USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1035 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 115 MET CE :methyl 168:sc= 0 (180deg=-0.237) USER MOD Set 1.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 19 TYR OH : rot -54:sc= 1.26 USER MOD Set 2.2: A 102 THR OG1 : rot 12:sc= 1.05 USER MOD Set 3.1: A 36 THR OG1 : rot 176:sc= 1.24 USER MOD Set 3.2: A 56 THR OG1 : rot -9:sc= 1.2 USER MOD Single : A 1 VAL N :NH3+ -113:sc= -0.0253 (180deg=-0.179) USER MOD Single : A 5 CYS SG : rot 12:sc= 0.45 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -62:sc= 1.29 USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 13 SER OG : rot 32:sc= 0.894 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= 0.596 K(o=0.6,f=-0.51) USER MOD Single : A 20 MET CE :methyl -173:sc= 0 (180deg=-0.076) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot -143:sc= 1.24 USER MOD Single : A 31 GLN : amide:sc= 0.0338 K(o=0.034,f=-0.6) USER MOD Single : A 34 ASN : amide:sc= 0.668 K(o=0.67,f=-1.1) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot -50:sc= 2.24 USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -43:sc= 1.36 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= 0.296 K(o=0.3,f=-2.8!) USER MOD Single : A 60 THR OG1 : rot -120:sc= 1.27 USER MOD Single : A 63 SER OG : rot 27:sc= 0.845 USER MOD Single : A 65 GLN : amide:sc= -0.648 K(o=-0.65,f=-4!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 140:sc= -0.25 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 CYS SG : rot -101:sc= 0.301 USER MOD Single : A 81 LYS NZ :NH3+ -173:sc= 0.717 (180deg=0.698) USER MOD Single : A 82 SER OG : rot 81:sc= 1.22 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 HIS : no HE2:sc= -0.22 K(o=-0.22,f=-1.4) USER MOD Single : A 95 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 96 LYS NZ :NH3+ -167:sc= 0.618 (180deg=0.524) USER MOD Single : A 100 LYS NZ :NH3+ -162:sc= 0.533 (180deg=0.386) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ -152:sc= 0.163 (180deg=0.0174) USER MOD Single : A 113 MET CE :methyl -120:sc= -0.106 (180deg=-3.75!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc=-0.000915 USER MOD Single : A 127 HIS : no HE2:sc= 0.205 K(o=0.21,f=-0.75) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 3.092 -1.165 -1.013 1.00 0.00 N ATOM 2 CA VAL A 1 1.897 -0.848 -1.847 1.00 0.00 C ATOM 3 C VAL A 1 1.048 0.323 -1.239 1.00 0.00 C ATOM 4 O VAL A 1 1.144 0.644 -0.049 1.00 0.00 O ATOM 5 CB VAL A 1 1.133 -2.176 -2.189 1.00 0.00 C ATOM 6 CG1 VAL A 1 0.192 -2.703 -1.081 1.00 0.00 C ATOM 7 CG2 VAL A 1 0.344 -2.089 -3.513 1.00 0.00 C ATOM 0 H1 VAL A 1 3.956 -0.917 -1.536 1.00 0.00 H new ATOM 0 H2 VAL A 1 3.053 -0.618 -0.129 1.00 0.00 H new ATOM 0 H3 VAL A 1 3.101 -2.181 -0.791 1.00 0.00 H new ATOM 0 HA VAL A 1 2.196 -0.435 -2.810 1.00 0.00 H new ATOM 0 HB VAL A 1 1.945 -2.896 -2.287 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -0.286 -3.623 -1.417 1.00 0.00 H new ATOM 0 HG12 VAL A 1 0.769 -2.903 -0.178 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -0.571 -1.955 -0.866 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -0.163 -3.036 -3.697 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -0.394 -1.289 -3.445 1.00 0.00 H new ATOM 0 HG23 VAL A 1 1.031 -1.880 -4.333 1.00 0.00 H new ATOM 18 N GLU A 2 0.232 1.002 -2.073 1.00 0.00 N ATOM 19 CA GLU A 2 -0.634 2.154 -1.670 1.00 0.00 C ATOM 20 C GLU A 2 0.124 3.499 -1.413 1.00 0.00 C ATOM 21 O GLU A 2 -0.185 4.505 -2.054 1.00 0.00 O ATOM 22 CB GLU A 2 -1.693 1.763 -0.601 1.00 0.00 C ATOM 23 CG GLU A 2 -2.924 2.696 -0.570 1.00 0.00 C ATOM 24 CD GLU A 2 -3.963 2.299 0.474 1.00 0.00 C ATOM 25 OE1 GLU A 2 -4.053 2.816 1.583 1.00 0.00 O ATOM 26 OE2 GLU A 2 -4.781 1.302 0.037 1.00 0.00 O ATOM 0 H GLU A 2 0.148 0.769 -3.063 1.00 0.00 H new ATOM 0 HA GLU A 2 -1.216 2.401 -2.558 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -2.027 0.743 -0.791 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -1.222 1.767 0.382 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -2.592 3.715 -0.372 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -3.392 2.699 -1.554 1.00 0.00 H new ATOM 34 N ALA A 3 1.164 3.495 -0.559 1.00 0.00 N ATOM 35 CA ALA A 3 2.201 4.572 -0.533 1.00 0.00 C ATOM 36 C ALA A 3 2.939 4.893 -1.883 1.00 0.00 C ATOM 37 O ALA A 3 3.282 6.050 -2.135 1.00 0.00 O ATOM 38 CB ALA A 3 3.208 4.193 0.570 1.00 0.00 C ATOM 0 H ALA A 3 1.319 2.759 0.130 1.00 0.00 H new ATOM 0 HA ALA A 3 1.674 5.506 -0.336 1.00 0.00 H new ATOM 0 HB1 ALA A 3 3.988 4.953 0.627 1.00 0.00 H new ATOM 0 HB2 ALA A 3 2.692 4.130 1.528 1.00 0.00 H new ATOM 0 HB3 ALA A 3 3.658 3.228 0.336 1.00 0.00 H new ATOM 44 N PHE A 4 3.135 3.889 -2.757 1.00 0.00 N ATOM 45 CA PHE A 4 3.532 4.112 -4.177 1.00 0.00 C ATOM 46 C PHE A 4 2.429 4.694 -5.130 1.00 0.00 C ATOM 47 O PHE A 4 2.802 5.301 -6.135 1.00 0.00 O ATOM 48 CB PHE A 4 4.080 2.773 -4.760 1.00 0.00 C ATOM 49 CG PHE A 4 5.398 2.243 -4.165 1.00 0.00 C ATOM 50 CD1 PHE A 4 6.598 2.906 -4.437 1.00 0.00 C ATOM 51 CD2 PHE A 4 5.423 1.083 -3.383 1.00 0.00 C ATOM 52 CE1 PHE A 4 7.800 2.433 -3.924 1.00 0.00 C ATOM 53 CE2 PHE A 4 6.627 0.604 -2.872 1.00 0.00 C ATOM 54 CZ PHE A 4 7.813 1.284 -3.141 1.00 0.00 C ATOM 0 H PHE A 4 3.026 2.905 -2.511 1.00 0.00 H new ATOM 0 HA PHE A 4 4.290 4.894 -4.142 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.316 2.007 -4.628 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.220 2.902 -5.833 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.591 3.794 -5.052 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.504 0.556 -3.174 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.721 2.956 -4.133 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.641 -0.292 -2.269 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.746 0.917 -2.740 1.00 0.00 H new ATOM 64 N CYS A 5 1.116 4.500 -4.880 1.00 0.00 N ATOM 65 CA CYS A 5 0.035 4.904 -5.819 1.00 0.00 C ATOM 66 C CYS A 5 -0.294 6.433 -5.762 1.00 0.00 C ATOM 67 O CYS A 5 -1.057 6.897 -4.910 1.00 0.00 O ATOM 68 CB CYS A 5 -1.173 3.995 -5.503 1.00 0.00 C ATOM 69 SG CYS A 5 -2.516 4.262 -6.710 1.00 0.00 S ATOM 0 H CYS A 5 0.772 4.061 -4.026 1.00 0.00 H new ATOM 0 HA CYS A 5 0.350 4.765 -6.853 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -0.863 2.950 -5.522 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -1.536 4.201 -4.496 1.00 0.00 H new ATOM 0 HG CYS A 5 -2.067 4.959 -7.712 1.00 0.00 H new ATOM 75 N ALA A 6 0.316 7.211 -6.675 1.00 0.00 N ATOM 76 CA ALA A 6 0.215 8.696 -6.711 1.00 0.00 C ATOM 77 C ALA A 6 0.805 9.292 -8.039 1.00 0.00 C ATOM 78 O ALA A 6 1.440 8.610 -8.854 1.00 0.00 O ATOM 79 CB ALA A 6 0.918 9.295 -5.463 1.00 0.00 C ATOM 0 H ALA A 6 0.900 6.830 -7.419 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.840 8.969 -6.690 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.844 10.382 -5.490 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.437 8.921 -4.560 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.968 9.003 -5.462 1.00 0.00 H new ATOM 85 N THR A 7 0.615 10.609 -8.233 1.00 0.00 N ATOM 86 CA THR A 7 1.364 11.407 -9.250 1.00 0.00 C ATOM 87 C THR A 7 2.796 11.752 -8.716 1.00 0.00 C ATOM 88 O THR A 7 2.939 12.285 -7.611 1.00 0.00 O ATOM 89 CB THR A 7 0.515 12.669 -9.595 1.00 0.00 C ATOM 90 OG1 THR A 7 -0.716 12.284 -10.199 1.00 0.00 O ATOM 91 CG2 THR A 7 1.154 13.657 -10.583 1.00 0.00 C ATOM 0 H THR A 7 -0.057 11.159 -7.697 1.00 0.00 H new ATOM 0 HA THR A 7 1.515 10.839 -10.168 1.00 0.00 H new ATOM 0 HB THR A 7 0.406 13.166 -8.631 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.241 13.084 -10.410 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.477 14.495 -10.749 1.00 0.00 H new ATOM 0 HG22 THR A 7 2.094 14.026 -10.172 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.346 13.152 -11.530 1.00 0.00 H new ATOM 99 N TRP A 8 3.847 11.444 -9.497 1.00 0.00 N ATOM 100 CA TRP A 8 5.261 11.645 -9.063 1.00 0.00 C ATOM 101 C TRP A 8 6.021 12.531 -10.094 1.00 0.00 C ATOM 102 O TRP A 8 6.294 12.101 -11.218 1.00 0.00 O ATOM 103 CB TRP A 8 5.955 10.267 -8.880 1.00 0.00 C ATOM 104 CG TRP A 8 5.422 9.423 -7.720 1.00 0.00 C ATOM 105 CD1 TRP A 8 4.556 8.322 -7.868 1.00 0.00 C ATOM 106 CD2 TRP A 8 5.587 9.593 -6.355 1.00 0.00 C ATOM 107 NE1 TRP A 8 4.180 7.785 -6.627 1.00 0.00 N ATOM 108 CE2 TRP A 8 4.821 8.592 -5.706 1.00 0.00 C ATOM 109 CE3 TRP A 8 6.307 10.554 -5.592 1.00 0.00 C ATOM 110 CZ2 TRP A 8 4.762 8.542 -4.299 1.00 0.00 C ATOM 111 CZ3 TRP A 8 6.247 10.471 -4.199 1.00 0.00 C ATOM 112 CH2 TRP A 8 5.476 9.488 -3.564 1.00 0.00 C ATOM 0 H TRP A 8 3.754 11.054 -10.435 1.00 0.00 H new ATOM 0 HA TRP A 8 5.275 12.164 -8.105 1.00 0.00 H new ATOM 0 HB2 TRP A 8 5.847 9.698 -9.803 1.00 0.00 H new ATOM 0 HB3 TRP A 8 7.022 10.432 -8.729 1.00 0.00 H new ATOM 0 HD1 TRP A 8 4.222 7.938 -8.820 1.00 0.00 H new ATOM 0 HE1 TRP A 8 3.574 6.985 -6.447 1.00 0.00 H new ATOM 0 HE3 TRP A 8 6.885 11.327 -6.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 4.175 7.786 -3.799 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 6.804 11.177 -3.601 1.00 0.00 H new ATOM 0 HH2 TRP A 8 5.434 9.463 -2.485 1.00 0.00 H new ATOM 123 N LYS A 9 6.389 13.759 -9.704 1.00 0.00 N ATOM 124 CA LYS A 9 7.033 14.750 -10.613 1.00 0.00 C ATOM 125 C LYS A 9 8.559 14.864 -10.316 1.00 0.00 C ATOM 126 O LYS A 9 8.979 15.030 -9.163 1.00 0.00 O ATOM 127 CB LYS A 9 6.315 16.118 -10.467 1.00 0.00 C ATOM 128 CG LYS A 9 4.850 16.134 -10.974 1.00 0.00 C ATOM 129 CD LYS A 9 4.150 17.501 -10.884 1.00 0.00 C ATOM 130 CE LYS A 9 4.610 18.508 -11.953 1.00 0.00 C ATOM 131 NZ LYS A 9 3.890 19.783 -11.776 1.00 0.00 N ATOM 0 H LYS A 9 6.254 14.104 -8.754 1.00 0.00 H new ATOM 0 HA LYS A 9 6.936 14.415 -11.646 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.326 16.409 -9.417 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.883 16.872 -11.012 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.836 15.802 -12.012 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.274 15.408 -10.400 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.074 17.354 -10.976 1.00 0.00 H new ATOM 0 HD3 LYS A 9 4.330 17.926 -9.897 1.00 0.00 H new ATOM 0 HE2 LYS A 9 5.685 18.672 -11.874 1.00 0.00 H new ATOM 0 HE3 LYS A 9 4.421 18.108 -12.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 4.203 20.462 -12.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.867 19.620 -11.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 4.092 20.167 -10.831 1.00 0.00 H new ATOM 144 N LEU A 10 9.399 14.760 -11.365 1.00 0.00 N ATOM 145 CA LEU A 10 10.879 14.738 -11.203 1.00 0.00 C ATOM 146 C LEU A 10 11.496 16.110 -10.774 1.00 0.00 C ATOM 147 O LEU A 10 11.193 17.170 -11.328 1.00 0.00 O ATOM 148 CB LEU A 10 11.494 14.163 -12.512 1.00 0.00 C ATOM 149 CG LEU A 10 13.011 13.814 -12.567 1.00 0.00 C ATOM 150 CD1 LEU A 10 13.909 15.006 -12.941 1.00 0.00 C ATOM 151 CD2 LEU A 10 13.547 13.076 -11.332 1.00 0.00 C ATOM 0 H LEU A 10 9.086 14.690 -12.333 1.00 0.00 H new ATOM 0 HA LEU A 10 11.133 14.090 -10.364 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.943 13.256 -12.759 1.00 0.00 H new ATOM 0 HB3 LEU A 10 11.297 14.882 -13.307 1.00 0.00 H new ATOM 0 HG LEU A 10 13.068 13.100 -13.389 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.951 14.685 -12.959 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.627 15.379 -13.926 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.786 15.799 -12.204 1.00 0.00 H new ATOM 0 HD21 LEU A 10 14.611 12.876 -11.461 1.00 0.00 H new ATOM 0 HD22 LEU A 10 13.399 13.694 -10.446 1.00 0.00 H new ATOM 0 HD23 LEU A 10 13.012 12.134 -11.211 1.00 0.00 H new ATOM 163 N THR A 11 12.402 16.043 -9.790 1.00 0.00 N ATOM 164 CA THR A 11 13.195 17.211 -9.291 1.00 0.00 C ATOM 165 C THR A 11 14.703 17.201 -9.716 1.00 0.00 C ATOM 166 O THR A 11 15.251 18.265 -10.008 1.00 0.00 O ATOM 167 CB THR A 11 13.051 17.365 -7.743 1.00 0.00 C ATOM 168 OG1 THR A 11 13.615 16.258 -7.040 1.00 0.00 O ATOM 169 CG2 THR A 11 11.613 17.544 -7.233 1.00 0.00 C ATOM 0 H THR A 11 12.619 15.174 -9.302 1.00 0.00 H new ATOM 0 HA THR A 11 12.763 18.083 -9.781 1.00 0.00 H new ATOM 0 HB THR A 11 13.597 18.286 -7.541 1.00 0.00 H new ATOM 0 HG1 THR A 11 13.133 15.439 -7.279 1.00 0.00 H new ATOM 0 HG21 THR A 11 11.621 17.642 -6.147 1.00 0.00 H new ATOM 0 HG22 THR A 11 11.179 18.441 -7.675 1.00 0.00 H new ATOM 0 HG23 THR A 11 11.016 16.676 -7.514 1.00 0.00 H new ATOM 177 N ASN A 12 15.388 16.037 -9.712 1.00 0.00 N ATOM 178 CA ASN A 12 16.851 15.942 -9.977 1.00 0.00 C ATOM 179 C ASN A 12 17.190 14.527 -10.545 1.00 0.00 C ATOM 180 O ASN A 12 16.934 13.511 -9.887 1.00 0.00 O ATOM 181 CB ASN A 12 17.625 16.253 -8.661 1.00 0.00 C ATOM 182 CG ASN A 12 19.156 16.292 -8.782 1.00 0.00 C ATOM 183 OD1 ASN A 12 19.732 16.616 -9.814 1.00 0.00 O ATOM 184 ND2 ASN A 12 19.867 15.961 -7.732 1.00 0.00 N ATOM 0 H ASN A 12 14.949 15.135 -9.526 1.00 0.00 H new ATOM 0 HA ASN A 12 17.156 16.673 -10.726 1.00 0.00 H new ATOM 0 HB2 ASN A 12 17.284 17.216 -8.280 1.00 0.00 H new ATOM 0 HB3 ASN A 12 17.357 15.503 -7.917 1.00 0.00 H new ATOM 0 HD21 ASN A 12 20.886 15.975 -7.781 1.00 0.00 H new ATOM 0 HD22 ASN A 12 19.402 15.689 -6.866 1.00 0.00 H new ATOM 191 N SER A 13 17.806 14.466 -11.739 1.00 0.00 N ATOM 192 CA SER A 13 18.306 13.194 -12.327 1.00 0.00 C ATOM 193 C SER A 13 19.853 13.062 -12.185 1.00 0.00 C ATOM 194 O SER A 13 20.614 13.628 -12.980 1.00 0.00 O ATOM 195 CB SER A 13 17.836 13.091 -13.797 1.00 0.00 C ATOM 196 OG SER A 13 18.542 13.994 -14.650 1.00 0.00 O ATOM 0 H SER A 13 17.974 15.284 -12.325 1.00 0.00 H new ATOM 0 HA SER A 13 17.886 12.354 -11.773 1.00 0.00 H new ATOM 0 HB2 SER A 13 17.979 12.070 -14.152 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.768 13.301 -13.852 1.00 0.00 H new ATOM 0 HG SER A 13 19.453 14.120 -14.310 1.00 0.00 H new ATOM 202 N GLN A 14 20.305 12.287 -11.189 1.00 0.00 N ATOM 203 CA GLN A 14 21.748 12.055 -10.915 1.00 0.00 C ATOM 204 C GLN A 14 22.367 11.042 -11.934 1.00 0.00 C ATOM 205 O GLN A 14 21.918 9.897 -12.027 1.00 0.00 O ATOM 206 CB GLN A 14 21.810 11.544 -9.450 1.00 0.00 C ATOM 207 CG GLN A 14 23.222 11.343 -8.842 1.00 0.00 C ATOM 208 CD GLN A 14 23.207 10.542 -7.536 1.00 0.00 C ATOM 209 OE1 GLN A 14 23.395 9.331 -7.521 1.00 0.00 O ATOM 210 NE2 GLN A 14 22.969 11.165 -6.407 1.00 0.00 N ATOM 0 H GLN A 14 19.686 11.797 -10.543 1.00 0.00 H new ATOM 0 HA GLN A 14 22.340 12.963 -11.034 1.00 0.00 H new ATOM 0 HB2 GLN A 14 21.266 12.248 -8.821 1.00 0.00 H new ATOM 0 HB3 GLN A 14 21.279 10.594 -9.398 1.00 0.00 H new ATOM 0 HG2 GLN A 14 23.854 10.831 -9.568 1.00 0.00 H new ATOM 0 HG3 GLN A 14 23.674 12.318 -8.658 1.00 0.00 H new ATOM 0 HE21 GLN A 14 22.811 12.173 -6.404 1.00 0.00 H new ATOM 0 HE22 GLN A 14 22.942 10.642 -5.532 1.00 0.00 H new ATOM 219 N ASN A 15 23.397 11.469 -12.690 1.00 0.00 N ATOM 220 CA ASN A 15 24.118 10.608 -13.687 1.00 0.00 C ATOM 221 C ASN A 15 23.269 10.005 -14.873 1.00 0.00 C ATOM 222 O ASN A 15 23.515 8.886 -15.333 1.00 0.00 O ATOM 223 CB ASN A 15 25.025 9.593 -12.917 1.00 0.00 C ATOM 224 CG ASN A 15 26.184 8.975 -13.707 1.00 0.00 C ATOM 225 OD1 ASN A 15 26.176 7.805 -14.072 1.00 0.00 O ATOM 226 ND2 ASN A 15 27.218 9.733 -13.991 1.00 0.00 N ATOM 0 H ASN A 15 23.764 12.419 -12.637 1.00 0.00 H new ATOM 0 HA ASN A 15 24.753 11.272 -14.274 1.00 0.00 H new ATOM 0 HB2 ASN A 15 25.438 10.099 -12.044 1.00 0.00 H new ATOM 0 HB3 ASN A 15 24.394 8.784 -12.548 1.00 0.00 H new ATOM 0 HD21 ASN A 15 28.006 9.347 -14.511 1.00 0.00 H new ATOM 0 HD22 ASN A 15 27.233 10.708 -13.691 1.00 0.00 H new ATOM 233 N PHE A 16 22.307 10.772 -15.422 1.00 0.00 N ATOM 234 CA PHE A 16 21.435 10.293 -16.535 1.00 0.00 C ATOM 235 C PHE A 16 22.113 10.256 -17.952 1.00 0.00 C ATOM 236 O PHE A 16 21.922 9.277 -18.678 1.00 0.00 O ATOM 237 CB PHE A 16 20.088 11.074 -16.472 1.00 0.00 C ATOM 238 CG PHE A 16 18.860 10.556 -17.259 1.00 0.00 C ATOM 239 CD1 PHE A 16 18.794 9.294 -17.870 1.00 0.00 C ATOM 240 CD2 PHE A 16 17.727 11.377 -17.290 1.00 0.00 C ATOM 241 CE1 PHE A 16 17.625 8.863 -18.487 1.00 0.00 C ATOM 242 CE2 PHE A 16 16.557 10.947 -17.911 1.00 0.00 C ATOM 243 CZ PHE A 16 16.510 9.692 -18.512 1.00 0.00 C ATOM 0 H PHE A 16 22.107 11.726 -15.120 1.00 0.00 H new ATOM 0 HA PHE A 16 21.234 9.233 -16.381 1.00 0.00 H new ATOM 0 HB2 PHE A 16 19.798 11.138 -15.423 1.00 0.00 H new ATOM 0 HB3 PHE A 16 20.286 12.091 -16.811 1.00 0.00 H new ATOM 0 HD1 PHE A 16 19.661 8.650 -17.861 1.00 0.00 H new ATOM 0 HD2 PHE A 16 17.760 12.353 -16.828 1.00 0.00 H new ATOM 0 HE1 PHE A 16 17.584 7.886 -18.946 1.00 0.00 H new ATOM 0 HE2 PHE A 16 15.687 11.587 -17.926 1.00 0.00 H new ATOM 0 HZ PHE A 16 15.604 9.362 -18.999 1.00 0.00 H new ATOM 253 N ASP A 17 22.923 11.259 -18.343 1.00 0.00 N ATOM 254 CA ASP A 17 23.704 11.237 -19.621 1.00 0.00 C ATOM 255 C ASP A 17 24.667 10.012 -19.814 1.00 0.00 C ATOM 256 O ASP A 17 24.594 9.320 -20.834 1.00 0.00 O ATOM 257 CB ASP A 17 24.445 12.595 -19.725 1.00 0.00 C ATOM 258 CG ASP A 17 24.894 12.955 -21.141 1.00 0.00 C ATOM 259 OD1 ASP A 17 24.134 13.017 -22.103 1.00 0.00 O ATOM 260 OD2 ASP A 17 26.232 13.191 -21.216 1.00 0.00 O ATOM 0 H ASP A 17 23.062 12.108 -17.794 1.00 0.00 H new ATOM 0 HA ASP A 17 22.999 11.101 -20.441 1.00 0.00 H new ATOM 0 HB2 ASP A 17 23.791 13.383 -19.352 1.00 0.00 H new ATOM 0 HB3 ASP A 17 25.319 12.571 -19.074 1.00 0.00 H new ATOM 266 N GLU A 18 25.516 9.729 -18.808 1.00 0.00 N ATOM 267 CA GLU A 18 26.294 8.454 -18.727 1.00 0.00 C ATOM 268 C GLU A 18 25.441 7.141 -18.782 1.00 0.00 C ATOM 269 O GLU A 18 25.761 6.256 -19.576 1.00 0.00 O ATOM 270 CB GLU A 18 27.187 8.503 -17.459 1.00 0.00 C ATOM 271 CG GLU A 18 28.279 7.402 -17.378 1.00 0.00 C ATOM 272 CD GLU A 18 29.000 7.333 -16.031 1.00 0.00 C ATOM 273 OE1 GLU A 18 29.420 8.315 -15.423 1.00 0.00 O ATOM 274 OE2 GLU A 18 29.124 6.056 -15.574 1.00 0.00 O ATOM 0 H GLU A 18 25.689 10.364 -18.029 1.00 0.00 H new ATOM 0 HA GLU A 18 26.901 8.397 -19.631 1.00 0.00 H new ATOM 0 HB2 GLU A 18 27.672 9.478 -17.413 1.00 0.00 H new ATOM 0 HB3 GLU A 18 26.547 8.424 -16.580 1.00 0.00 H new ATOM 0 HG2 GLU A 18 27.820 6.435 -17.582 1.00 0.00 H new ATOM 0 HG3 GLU A 18 29.015 7.577 -18.163 1.00 0.00 H new ATOM 282 N TYR A 19 24.356 7.027 -17.990 1.00 0.00 N ATOM 283 CA TYR A 19 23.353 5.932 -18.127 1.00 0.00 C ATOM 284 C TYR A 19 22.758 5.717 -19.565 1.00 0.00 C ATOM 285 O TYR A 19 22.705 4.581 -20.041 1.00 0.00 O ATOM 286 CB TYR A 19 22.276 6.198 -17.038 1.00 0.00 C ATOM 287 CG TYR A 19 21.206 5.109 -16.900 1.00 0.00 C ATOM 288 CD1 TYR A 19 21.457 3.983 -16.114 1.00 0.00 C ATOM 289 CD2 TYR A 19 19.999 5.205 -17.605 1.00 0.00 C ATOM 290 CE1 TYR A 19 20.517 2.962 -16.041 1.00 0.00 C ATOM 291 CE2 TYR A 19 19.060 4.178 -17.527 1.00 0.00 C ATOM 292 CZ TYR A 19 19.324 3.059 -16.746 1.00 0.00 C ATOM 293 OH TYR A 19 18.384 2.081 -16.596 1.00 0.00 O ATOM 0 H TYR A 19 24.144 7.684 -17.239 1.00 0.00 H new ATOM 0 HA TYR A 19 23.850 4.974 -17.974 1.00 0.00 H new ATOM 0 HB2 TYR A 19 22.776 6.318 -16.077 1.00 0.00 H new ATOM 0 HB3 TYR A 19 21.782 7.144 -17.261 1.00 0.00 H new ATOM 0 HD1 TYR A 19 22.382 3.905 -15.562 1.00 0.00 H new ATOM 0 HD2 TYR A 19 19.796 6.076 -18.210 1.00 0.00 H new ATOM 0 HE1 TYR A 19 20.715 2.091 -15.434 1.00 0.00 H new ATOM 0 HE2 TYR A 19 18.130 4.251 -18.072 1.00 0.00 H new ATOM 0 HH TYR A 19 18.789 1.207 -16.777 1.00 0.00 H new ATOM 303 N MET A 20 22.334 6.792 -20.248 1.00 0.00 N ATOM 304 CA MET A 20 21.854 6.731 -21.660 1.00 0.00 C ATOM 305 C MET A 20 22.916 6.301 -22.726 1.00 0.00 C ATOM 306 O MET A 20 22.602 5.477 -23.593 1.00 0.00 O ATOM 307 CB MET A 20 21.161 8.085 -21.979 1.00 0.00 C ATOM 308 CG MET A 20 19.760 8.224 -21.339 1.00 0.00 C ATOM 309 SD MET A 20 18.893 9.722 -21.848 1.00 0.00 S ATOM 310 CE MET A 20 19.914 11.029 -21.146 1.00 0.00 C ATOM 0 H MET A 20 22.310 7.730 -19.849 1.00 0.00 H new ATOM 0 HA MET A 20 21.140 5.911 -21.737 1.00 0.00 H new ATOM 0 HB2 MET A 20 21.795 8.900 -21.629 1.00 0.00 H new ATOM 0 HB3 MET A 20 21.071 8.193 -23.060 1.00 0.00 H new ATOM 0 HG2 MET A 20 19.158 7.355 -21.605 1.00 0.00 H new ATOM 0 HG3 MET A 20 19.861 8.221 -20.254 1.00 0.00 H new ATOM 0 HE1 MET A 20 19.419 11.991 -21.284 1.00 0.00 H new ATOM 0 HE2 MET A 20 20.060 10.845 -20.082 1.00 0.00 H new ATOM 0 HE3 MET A 20 20.882 11.044 -21.647 1.00 0.00 H new ATOM 320 N LYS A 21 24.174 6.776 -22.633 1.00 0.00 N ATOM 321 CA LYS A 21 25.326 6.126 -23.323 1.00 0.00 C ATOM 322 C LYS A 21 25.580 4.623 -22.934 1.00 0.00 C ATOM 323 O LYS A 21 25.668 3.781 -23.832 1.00 0.00 O ATOM 324 CB LYS A 21 26.564 7.052 -23.141 1.00 0.00 C ATOM 325 CG LYS A 21 27.891 6.576 -23.784 1.00 0.00 C ATOM 326 CD LYS A 21 27.875 6.467 -25.324 1.00 0.00 C ATOM 327 CE LYS A 21 29.126 5.746 -25.845 1.00 0.00 C ATOM 328 NZ LYS A 21 29.142 5.706 -27.320 1.00 0.00 N ATOM 0 H LYS A 21 24.426 7.603 -22.092 1.00 0.00 H new ATOM 0 HA LYS A 21 25.089 6.030 -24.383 1.00 0.00 H new ATOM 0 HB2 LYS A 21 26.319 8.032 -23.552 1.00 0.00 H new ATOM 0 HB3 LYS A 21 26.733 7.188 -22.073 1.00 0.00 H new ATOM 0 HG2 LYS A 21 28.684 7.265 -23.493 1.00 0.00 H new ATOM 0 HG3 LYS A 21 28.147 5.601 -23.370 1.00 0.00 H new ATOM 0 HD2 LYS A 21 26.983 5.928 -25.643 1.00 0.00 H new ATOM 0 HD3 LYS A 21 27.819 7.464 -25.761 1.00 0.00 H new ATOM 0 HE2 LYS A 21 30.020 6.254 -25.482 1.00 0.00 H new ATOM 0 HE3 LYS A 21 29.155 4.730 -25.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 29.998 5.213 -27.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 28.300 5.200 -27.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 29.139 6.677 -27.694 1.00 0.00 H new ATOM 341 N ALA A 22 25.677 4.285 -21.633 1.00 0.00 N ATOM 342 CA ALA A 22 25.908 2.892 -21.155 1.00 0.00 C ATOM 343 C ALA A 22 24.836 1.820 -21.531 1.00 0.00 C ATOM 344 O ALA A 22 25.199 0.720 -21.952 1.00 0.00 O ATOM 345 CB ALA A 22 26.098 2.975 -19.629 1.00 0.00 C ATOM 0 H ALA A 22 25.598 4.965 -20.877 1.00 0.00 H new ATOM 0 HA ALA A 22 26.788 2.522 -21.681 1.00 0.00 H new ATOM 0 HB1 ALA A 22 26.271 1.976 -19.229 1.00 0.00 H new ATOM 0 HB2 ALA A 22 26.955 3.610 -19.403 1.00 0.00 H new ATOM 0 HB3 ALA A 22 25.203 3.398 -19.173 1.00 0.00 H new ATOM 351 N LEU A 23 23.536 2.141 -21.411 1.00 0.00 N ATOM 352 CA LEU A 23 22.430 1.270 -21.897 1.00 0.00 C ATOM 353 C LEU A 23 22.341 1.080 -23.454 1.00 0.00 C ATOM 354 O LEU A 23 21.887 0.023 -23.906 1.00 0.00 O ATOM 355 CB LEU A 23 21.141 1.842 -21.231 1.00 0.00 C ATOM 356 CG LEU A 23 19.843 1.007 -21.395 1.00 0.00 C ATOM 357 CD1 LEU A 23 18.905 1.176 -20.190 1.00 0.00 C ATOM 358 CD2 LEU A 23 19.050 1.380 -22.660 1.00 0.00 C ATOM 0 H LEU A 23 23.214 3.006 -20.977 1.00 0.00 H new ATOM 0 HA LEU A 23 22.605 0.236 -21.601 1.00 0.00 H new ATOM 0 HB2 LEU A 23 21.334 1.965 -20.165 1.00 0.00 H new ATOM 0 HB3 LEU A 23 20.960 2.836 -21.639 1.00 0.00 H new ATOM 0 HG LEU A 23 20.179 -0.027 -21.474 1.00 0.00 H new ATOM 0 HD11 LEU A 23 18.007 0.577 -20.341 1.00 0.00 H new ATOM 0 HD12 LEU A 23 19.413 0.846 -19.284 1.00 0.00 H new ATOM 0 HD13 LEU A 23 18.628 2.225 -20.089 1.00 0.00 H new ATOM 0 HD21 LEU A 23 18.153 0.764 -22.722 1.00 0.00 H new ATOM 0 HD22 LEU A 23 18.766 2.431 -22.614 1.00 0.00 H new ATOM 0 HD23 LEU A 23 19.669 1.209 -23.541 1.00 0.00 H new ATOM 370 N GLY A 24 22.724 2.091 -24.259 1.00 0.00 N ATOM 371 CA GLY A 24 22.538 2.070 -25.732 1.00 0.00 C ATOM 372 C GLY A 24 21.212 2.668 -26.245 1.00 0.00 C ATOM 373 O GLY A 24 20.503 2.008 -27.007 1.00 0.00 O ATOM 0 H GLY A 24 23.168 2.942 -23.914 1.00 0.00 H new ATOM 0 HA2 GLY A 24 23.363 2.614 -26.192 1.00 0.00 H new ATOM 0 HA3 GLY A 24 22.607 1.037 -26.074 1.00 0.00 H new ATOM 377 N VAL A 25 20.905 3.928 -25.889 1.00 0.00 N ATOM 378 CA VAL A 25 19.778 4.692 -26.521 1.00 0.00 C ATOM 379 C VAL A 25 20.263 5.447 -27.811 1.00 0.00 C ATOM 380 O VAL A 25 21.432 5.837 -27.926 1.00 0.00 O ATOM 381 CB VAL A 25 19.022 5.629 -25.508 1.00 0.00 C ATOM 382 CG1 VAL A 25 18.513 4.926 -24.231 1.00 0.00 C ATOM 383 CG2 VAL A 25 19.765 6.919 -25.125 1.00 0.00 C ATOM 0 H VAL A 25 21.410 4.450 -25.172 1.00 0.00 H new ATOM 0 HA VAL A 25 19.032 3.962 -26.835 1.00 0.00 H new ATOM 0 HB VAL A 25 18.154 5.919 -26.100 1.00 0.00 H new ATOM 0 HG11 VAL A 25 18.006 5.651 -23.594 1.00 0.00 H new ATOM 0 HG12 VAL A 25 17.817 4.134 -24.505 1.00 0.00 H new ATOM 0 HG13 VAL A 25 19.357 4.497 -23.691 1.00 0.00 H new ATOM 0 HG21 VAL A 25 19.159 7.493 -24.424 1.00 0.00 H new ATOM 0 HG22 VAL A 25 20.717 6.666 -24.659 1.00 0.00 H new ATOM 0 HG23 VAL A 25 19.946 7.514 -26.020 1.00 0.00 H new ATOM 393 N GLY A 26 19.355 5.726 -28.763 1.00 0.00 N ATOM 394 CA GLY A 26 19.687 6.541 -29.966 1.00 0.00 C ATOM 395 C GLY A 26 20.046 8.027 -29.721 1.00 0.00 C ATOM 396 O GLY A 26 19.844 8.580 -28.632 1.00 0.00 O ATOM 0 H GLY A 26 18.387 5.405 -28.732 1.00 0.00 H new ATOM 0 HA2 GLY A 26 20.526 6.068 -30.477 1.00 0.00 H new ATOM 0 HA3 GLY A 26 18.837 6.504 -30.647 1.00 0.00 H new ATOM 400 N PHE A 27 20.569 8.693 -30.764 1.00 0.00 N ATOM 401 CA PHE A 27 20.907 10.151 -30.698 1.00 0.00 C ATOM 402 C PHE A 27 19.663 11.080 -30.973 1.00 0.00 C ATOM 403 O PHE A 27 19.630 11.891 -31.901 1.00 0.00 O ATOM 404 CB PHE A 27 22.125 10.376 -31.645 1.00 0.00 C ATOM 405 CG PHE A 27 22.997 11.594 -31.297 1.00 0.00 C ATOM 406 CD1 PHE A 27 22.732 12.850 -31.855 1.00 0.00 C ATOM 407 CD2 PHE A 27 24.089 11.446 -30.433 1.00 0.00 C ATOM 408 CE1 PHE A 27 23.540 13.942 -31.546 1.00 0.00 C ATOM 409 CE2 PHE A 27 24.893 12.539 -30.121 1.00 0.00 C ATOM 410 CZ PHE A 27 24.619 13.786 -30.679 1.00 0.00 C ATOM 0 H PHE A 27 20.771 8.260 -31.665 1.00 0.00 H new ATOM 0 HA PHE A 27 21.192 10.444 -29.688 1.00 0.00 H new ATOM 0 HB2 PHE A 27 22.750 9.483 -31.628 1.00 0.00 H new ATOM 0 HB3 PHE A 27 21.758 10.489 -32.665 1.00 0.00 H new ATOM 0 HD1 PHE A 27 21.897 12.973 -32.529 1.00 0.00 H new ATOM 0 HD2 PHE A 27 24.309 10.479 -30.006 1.00 0.00 H new ATOM 0 HE1 PHE A 27 23.330 14.909 -31.978 1.00 0.00 H new ATOM 0 HE2 PHE A 27 25.728 12.420 -29.447 1.00 0.00 H new ATOM 0 HZ PHE A 27 25.244 14.633 -30.439 1.00 0.00 H new ATOM 420 N ALA A 28 18.634 10.924 -30.127 1.00 0.00 N ATOM 421 CA ALA A 28 17.360 11.694 -30.178 1.00 0.00 C ATOM 422 C ALA A 28 16.631 11.601 -28.799 1.00 0.00 C ATOM 423 O ALA A 28 16.431 12.624 -28.137 1.00 0.00 O ATOM 424 CB ALA A 28 16.480 11.234 -31.363 1.00 0.00 C ATOM 0 H ALA A 28 18.655 10.245 -29.366 1.00 0.00 H new ATOM 0 HA ALA A 28 17.577 12.747 -30.359 1.00 0.00 H new ATOM 0 HB1 ALA A 28 15.556 11.813 -31.376 1.00 0.00 H new ATOM 0 HB2 ALA A 28 17.019 11.389 -32.298 1.00 0.00 H new ATOM 0 HB3 ALA A 28 16.244 10.176 -31.251 1.00 0.00 H new ATOM 430 N THR A 29 16.302 10.379 -28.318 1.00 0.00 N ATOM 431 CA THR A 29 15.821 10.146 -26.924 1.00 0.00 C ATOM 432 C THR A 29 16.836 10.550 -25.789 1.00 0.00 C ATOM 433 O THR A 29 16.390 11.001 -24.731 1.00 0.00 O ATOM 434 CB THR A 29 15.306 8.679 -26.807 1.00 0.00 C ATOM 435 OG1 THR A 29 14.318 8.415 -27.804 1.00 0.00 O ATOM 436 CG2 THR A 29 14.636 8.349 -25.462 1.00 0.00 C ATOM 0 H THR A 29 16.360 9.528 -28.877 1.00 0.00 H new ATOM 0 HA THR A 29 14.994 10.833 -26.744 1.00 0.00 H new ATOM 0 HB THR A 29 16.203 8.070 -26.921 1.00 0.00 H new ATOM 0 HG1 THR A 29 13.629 7.825 -27.433 1.00 0.00 H new ATOM 0 HG21 THR A 29 14.307 7.310 -25.465 1.00 0.00 H new ATOM 0 HG22 THR A 29 15.350 8.502 -24.653 1.00 0.00 H new ATOM 0 HG23 THR A 29 13.775 9.002 -25.314 1.00 0.00 H new ATOM 444 N ARG A 30 18.169 10.456 -25.994 1.00 0.00 N ATOM 445 CA ARG A 30 19.172 11.132 -25.112 1.00 0.00 C ATOM 446 C ARG A 30 19.053 12.689 -24.956 1.00 0.00 C ATOM 447 O ARG A 30 19.140 13.196 -23.835 1.00 0.00 O ATOM 448 CB ARG A 30 20.608 10.648 -25.447 1.00 0.00 C ATOM 449 CG ARG A 30 21.249 11.124 -26.771 1.00 0.00 C ATOM 450 CD ARG A 30 22.688 10.618 -26.978 1.00 0.00 C ATOM 451 NE ARG A 30 22.748 9.155 -27.274 1.00 0.00 N ATOM 452 CZ ARG A 30 23.861 8.418 -27.257 1.00 0.00 C ATOM 453 NH1 ARG A 30 25.050 8.913 -27.013 1.00 0.00 N ATOM 454 NH2 ARG A 30 23.778 7.143 -27.495 1.00 0.00 N ATOM 0 H ARG A 30 18.583 9.922 -26.758 1.00 0.00 H new ATOM 0 HA ARG A 30 18.916 10.805 -24.104 1.00 0.00 H new ATOM 0 HB2 ARG A 30 21.262 10.956 -24.631 1.00 0.00 H new ATOM 0 HB3 ARG A 30 20.599 9.558 -25.454 1.00 0.00 H new ATOM 0 HG2 ARG A 30 20.632 10.789 -27.604 1.00 0.00 H new ATOM 0 HG3 ARG A 30 21.250 12.214 -26.793 1.00 0.00 H new ATOM 0 HD2 ARG A 30 23.148 11.169 -27.798 1.00 0.00 H new ATOM 0 HD3 ARG A 30 23.275 10.828 -26.084 1.00 0.00 H new ATOM 0 HE ARG A 30 21.874 8.684 -27.506 1.00 0.00 H new ATOM 0 HH11 ARG A 30 25.159 9.909 -26.823 1.00 0.00 H new ATOM 0 HH12 ARG A 30 25.867 8.302 -27.013 1.00 0.00 H new ATOM 0 HH21 ARG A 30 22.871 6.719 -27.691 1.00 0.00 H new ATOM 0 HH22 ARG A 30 24.619 6.567 -27.486 1.00 0.00 H new ATOM 468 N GLN A 31 18.804 13.441 -26.045 1.00 0.00 N ATOM 469 CA GLN A 31 18.400 14.878 -25.976 1.00 0.00 C ATOM 470 C GLN A 31 17.057 15.122 -25.204 1.00 0.00 C ATOM 471 O GLN A 31 17.044 15.948 -24.288 1.00 0.00 O ATOM 472 CB GLN A 31 18.379 15.485 -27.411 1.00 0.00 C ATOM 473 CG GLN A 31 19.753 15.791 -28.070 1.00 0.00 C ATOM 474 CD GLN A 31 20.624 14.593 -28.481 1.00 0.00 C ATOM 475 OE1 GLN A 31 20.162 13.518 -28.851 1.00 0.00 O ATOM 476 NE2 GLN A 31 21.925 14.739 -28.437 1.00 0.00 N ATOM 0 H GLN A 31 18.874 13.082 -26.997 1.00 0.00 H new ATOM 0 HA GLN A 31 19.150 15.399 -25.382 1.00 0.00 H new ATOM 0 HB2 GLN A 31 17.837 14.798 -28.061 1.00 0.00 H new ATOM 0 HB3 GLN A 31 17.806 16.411 -27.378 1.00 0.00 H new ATOM 0 HG2 GLN A 31 19.573 16.397 -28.958 1.00 0.00 H new ATOM 0 HG3 GLN A 31 20.329 16.404 -27.377 1.00 0.00 H new ATOM 0 HE21 GLN A 31 22.329 15.625 -28.132 1.00 0.00 H new ATOM 0 HE22 GLN A 31 22.534 13.967 -28.707 1.00 0.00 H new ATOM 485 N VAL A 32 15.978 14.364 -25.507 1.00 0.00 N ATOM 486 CA VAL A 32 14.730 14.301 -24.672 1.00 0.00 C ATOM 487 C VAL A 32 15.004 14.038 -23.147 1.00 0.00 C ATOM 488 O VAL A 32 14.672 14.899 -22.331 1.00 0.00 O ATOM 489 CB VAL A 32 13.706 13.301 -25.328 1.00 0.00 C ATOM 490 CG1 VAL A 32 12.463 12.973 -24.468 1.00 0.00 C ATOM 491 CG2 VAL A 32 13.191 13.770 -26.711 1.00 0.00 C ATOM 0 H VAL A 32 15.936 13.773 -26.337 1.00 0.00 H new ATOM 0 HA VAL A 32 14.270 15.289 -24.670 1.00 0.00 H new ATOM 0 HB VAL A 32 14.310 12.399 -25.427 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.821 12.277 -25.008 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.780 12.520 -23.528 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.911 13.890 -24.261 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.490 13.035 -27.106 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.688 14.731 -26.605 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.032 13.874 -27.396 1.00 0.00 H new ATOM 501 N GLY A 33 15.629 12.903 -22.769 1.00 0.00 N ATOM 502 CA GLY A 33 16.015 12.612 -21.356 1.00 0.00 C ATOM 503 C GLY A 33 16.851 13.651 -20.568 1.00 0.00 C ATOM 504 O GLY A 33 16.591 13.854 -19.381 1.00 0.00 O ATOM 0 H GLY A 33 15.882 12.162 -23.423 1.00 0.00 H new ATOM 0 HA2 GLY A 33 15.097 12.437 -20.795 1.00 0.00 H new ATOM 0 HA3 GLY A 33 16.572 11.675 -21.355 1.00 0.00 H new ATOM 508 N ASN A 34 17.820 14.320 -21.215 1.00 0.00 N ATOM 509 CA ASN A 34 18.505 15.506 -20.623 1.00 0.00 C ATOM 510 C ASN A 34 17.617 16.783 -20.424 1.00 0.00 C ATOM 511 O ASN A 34 17.745 17.425 -19.378 1.00 0.00 O ATOM 512 CB ASN A 34 19.786 15.833 -21.440 1.00 0.00 C ATOM 513 CG ASN A 34 20.973 14.875 -21.261 1.00 0.00 C ATOM 514 OD1 ASN A 34 21.561 14.756 -20.192 1.00 0.00 O ATOM 515 ND2 ASN A 34 21.402 14.201 -22.300 1.00 0.00 N ATOM 0 H ASN A 34 18.153 14.069 -22.146 1.00 0.00 H new ATOM 0 HA ASN A 34 18.762 15.212 -19.605 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.521 15.855 -22.497 1.00 0.00 H new ATOM 0 HB3 ASN A 34 20.114 16.838 -21.173 1.00 0.00 H new ATOM 0 HD21 ASN A 34 22.213 13.589 -22.211 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.924 14.288 -23.197 1.00 0.00 H new ATOM 522 N VAL A 35 16.748 17.171 -21.380 1.00 0.00 N ATOM 523 CA VAL A 35 15.837 18.352 -21.209 1.00 0.00 C ATOM 524 C VAL A 35 14.563 18.122 -20.319 1.00 0.00 C ATOM 525 O VAL A 35 14.124 19.071 -19.663 1.00 0.00 O ATOM 526 CB VAL A 35 15.473 19.058 -22.565 1.00 0.00 C ATOM 527 CG1 VAL A 35 16.703 19.568 -23.349 1.00 0.00 C ATOM 528 CG2 VAL A 35 14.567 18.255 -23.527 1.00 0.00 C ATOM 0 H VAL A 35 16.648 16.696 -22.277 1.00 0.00 H new ATOM 0 HA VAL A 35 16.454 19.037 -20.628 1.00 0.00 H new ATOM 0 HB VAL A 35 14.886 19.906 -22.211 1.00 0.00 H new ATOM 0 HG11 VAL A 35 16.374 20.043 -24.273 1.00 0.00 H new ATOM 0 HG12 VAL A 35 17.247 20.292 -22.742 1.00 0.00 H new ATOM 0 HG13 VAL A 35 17.357 18.729 -23.586 1.00 0.00 H new ATOM 0 HG21 VAL A 35 14.383 18.841 -24.428 1.00 0.00 H new ATOM 0 HG22 VAL A 35 15.060 17.321 -23.796 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.618 18.037 -23.036 1.00 0.00 H new ATOM 538 N THR A 36 13.928 16.932 -20.335 1.00 0.00 N ATOM 539 CA THR A 36 12.550 16.744 -19.782 1.00 0.00 C ATOM 540 C THR A 36 12.526 16.214 -18.311 1.00 0.00 C ATOM 541 O THR A 36 13.260 15.288 -17.949 1.00 0.00 O ATOM 542 CB THR A 36 11.677 15.904 -20.767 1.00 0.00 C ATOM 543 OG1 THR A 36 10.306 16.148 -20.478 1.00 0.00 O ATOM 544 CG2 THR A 36 11.854 14.377 -20.750 1.00 0.00 C ATOM 0 H THR A 36 14.338 16.082 -20.722 1.00 0.00 H new ATOM 0 HA THR A 36 12.095 17.731 -19.704 1.00 0.00 H new ATOM 0 HB THR A 36 12.014 16.234 -21.750 1.00 0.00 H new ATOM 0 HG1 THR A 36 9.745 15.673 -21.127 1.00 0.00 H new ATOM 0 HG21 THR A 36 11.186 13.925 -21.483 1.00 0.00 H new ATOM 0 HG22 THR A 36 12.886 14.128 -20.997 1.00 0.00 H new ATOM 0 HG23 THR A 36 11.616 13.994 -19.758 1.00 0.00 H new ATOM 552 N LYS A 37 11.622 16.769 -17.483 1.00 0.00 N ATOM 553 CA LYS A 37 11.375 16.274 -16.100 1.00 0.00 C ATOM 554 C LYS A 37 10.031 15.454 -16.072 1.00 0.00 C ATOM 555 O LYS A 37 8.967 16.085 -16.072 1.00 0.00 O ATOM 556 CB LYS A 37 11.382 17.456 -15.090 1.00 0.00 C ATOM 557 CG LYS A 37 12.711 18.252 -14.967 1.00 0.00 C ATOM 558 CD LYS A 37 12.924 18.941 -13.602 1.00 0.00 C ATOM 559 CE LYS A 37 11.901 20.042 -13.270 1.00 0.00 C ATOM 560 NZ LYS A 37 12.061 20.467 -11.867 1.00 0.00 N ATOM 0 H LYS A 37 11.042 17.567 -17.743 1.00 0.00 H new ATOM 0 HA LYS A 37 12.177 15.603 -15.793 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.592 18.152 -15.373 1.00 0.00 H new ATOM 0 HB3 LYS A 37 11.125 17.065 -14.105 1.00 0.00 H new ATOM 0 HG2 LYS A 37 13.544 17.573 -15.150 1.00 0.00 H new ATOM 0 HG3 LYS A 37 12.739 19.010 -15.750 1.00 0.00 H new ATOM 0 HD2 LYS A 37 12.889 18.184 -12.819 1.00 0.00 H new ATOM 0 HD3 LYS A 37 13.924 19.375 -13.582 1.00 0.00 H new ATOM 0 HE2 LYS A 37 12.041 20.894 -13.936 1.00 0.00 H new ATOM 0 HE3 LYS A 37 10.889 19.672 -13.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 11.368 21.211 -11.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 11.906 19.653 -11.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 13.022 20.837 -11.724 1.00 0.00 H new ATOM 573 N PRO A 38 9.992 14.083 -16.073 1.00 0.00 N ATOM 574 CA PRO A 38 8.723 13.323 -16.262 1.00 0.00 C ATOM 575 C PRO A 38 7.719 13.304 -15.063 1.00 0.00 C ATOM 576 O PRO A 38 8.092 13.366 -13.886 1.00 0.00 O ATOM 577 CB PRO A 38 9.235 11.918 -16.648 1.00 0.00 C ATOM 578 CG PRO A 38 10.626 11.813 -16.024 1.00 0.00 C ATOM 579 CD PRO A 38 11.191 13.225 -16.167 1.00 0.00 C ATOM 0 HA PRO A 38 8.094 13.803 -17.011 1.00 0.00 H new ATOM 0 HB2 PRO A 38 8.573 11.140 -16.268 1.00 0.00 H new ATOM 0 HB3 PRO A 38 9.279 11.799 -17.731 1.00 0.00 H new ATOM 0 HG2 PRO A 38 10.575 11.506 -14.980 1.00 0.00 H new ATOM 0 HG3 PRO A 38 11.244 11.080 -16.542 1.00 0.00 H new ATOM 0 HD2 PRO A 38 11.910 13.452 -15.380 1.00 0.00 H new ATOM 0 HD3 PRO A 38 11.707 13.357 -17.118 1.00 0.00 H new ATOM 587 N THR A 39 6.425 13.184 -15.412 1.00 0.00 N ATOM 588 CA THR A 39 5.318 12.996 -14.434 1.00 0.00 C ATOM 589 C THR A 39 4.897 11.491 -14.460 1.00 0.00 C ATOM 590 O THR A 39 4.240 11.017 -15.392 1.00 0.00 O ATOM 591 CB THR A 39 4.172 13.992 -14.782 1.00 0.00 C ATOM 592 OG1 THR A 39 4.658 15.328 -14.701 1.00 0.00 O ATOM 593 CG2 THR A 39 2.958 13.930 -13.844 1.00 0.00 C ATOM 0 H THR A 39 6.108 13.214 -16.381 1.00 0.00 H new ATOM 0 HA THR A 39 5.617 13.221 -13.410 1.00 0.00 H new ATOM 0 HB THR A 39 3.851 13.702 -15.782 1.00 0.00 H new ATOM 0 HG1 THR A 39 3.936 15.953 -14.922 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.213 14.658 -14.165 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.525 12.930 -13.875 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.273 14.158 -12.826 1.00 0.00 H new ATOM 601 N VAL A 40 5.312 10.733 -13.437 1.00 0.00 N ATOM 602 CA VAL A 40 5.091 9.259 -13.362 1.00 0.00 C ATOM 603 C VAL A 40 3.814 9.005 -12.497 1.00 0.00 C ATOM 604 O VAL A 40 3.856 9.086 -11.266 1.00 0.00 O ATOM 605 CB VAL A 40 6.406 8.568 -12.851 1.00 0.00 C ATOM 606 CG1 VAL A 40 6.258 7.055 -12.584 1.00 0.00 C ATOM 607 CG2 VAL A 40 7.592 8.710 -13.836 1.00 0.00 C ATOM 0 H VAL A 40 5.811 11.111 -12.632 1.00 0.00 H new ATOM 0 HA VAL A 40 4.894 8.807 -14.334 1.00 0.00 H new ATOM 0 HB VAL A 40 6.603 9.098 -11.919 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.209 6.653 -12.234 1.00 0.00 H new ATOM 0 HG12 VAL A 40 5.494 6.893 -11.824 1.00 0.00 H new ATOM 0 HG13 VAL A 40 5.967 6.550 -13.505 1.00 0.00 H new ATOM 0 HG21 VAL A 40 8.469 8.211 -13.424 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.329 8.253 -14.790 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.814 9.766 -13.989 1.00 0.00 H new ATOM 617 N ILE A 41 2.672 8.704 -13.143 1.00 0.00 N ATOM 618 CA ILE A 41 1.372 8.499 -12.433 1.00 0.00 C ATOM 619 C ILE A 41 1.216 6.970 -12.159 1.00 0.00 C ATOM 620 O ILE A 41 0.865 6.196 -13.056 1.00 0.00 O ATOM 621 CB ILE A 41 0.157 9.147 -13.195 1.00 0.00 C ATOM 622 CG1 ILE A 41 0.342 10.671 -13.476 1.00 0.00 C ATOM 623 CG2 ILE A 41 -1.175 8.931 -12.423 1.00 0.00 C ATOM 624 CD1 ILE A 41 -0.693 11.318 -14.414 1.00 0.00 C ATOM 0 H ILE A 41 2.612 8.595 -14.155 1.00 0.00 H new ATOM 0 HA ILE A 41 1.375 9.024 -11.478 1.00 0.00 H new ATOM 0 HB ILE A 41 0.116 8.636 -14.157 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.320 11.200 -12.524 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.334 10.823 -13.902 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -1.994 9.390 -12.976 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.364 7.863 -12.315 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -1.102 9.388 -11.436 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.463 12.377 -14.535 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.660 10.826 -15.386 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.690 11.210 -13.986 1.00 0.00 H new ATOM 636 N ILE A 42 1.465 6.548 -10.907 1.00 0.00 N ATOM 637 CA ILE A 42 1.310 5.126 -10.476 1.00 0.00 C ATOM 638 C ILE A 42 -0.173 4.938 -10.020 1.00 0.00 C ATOM 639 O ILE A 42 -0.605 5.531 -9.028 1.00 0.00 O ATOM 640 CB ILE A 42 2.369 4.741 -9.378 1.00 0.00 C ATOM 641 CG1 ILE A 42 3.841 4.954 -9.854 1.00 0.00 C ATOM 642 CG2 ILE A 42 2.176 3.293 -8.840 1.00 0.00 C ATOM 643 CD1 ILE A 42 4.948 4.687 -8.825 1.00 0.00 C ATOM 0 H ILE A 42 1.778 7.170 -10.161 1.00 0.00 H new ATOM 0 HA ILE A 42 1.512 4.438 -11.297 1.00 0.00 H new ATOM 0 HB ILE A 42 2.186 5.430 -8.553 1.00 0.00 H new ATOM 0 HG12 ILE A 42 4.016 4.310 -10.716 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.940 5.983 -10.200 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.934 3.081 -8.085 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.185 3.199 -8.396 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.274 2.583 -9.662 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.921 4.871 -9.281 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.817 5.349 -7.969 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.894 3.650 -8.493 1.00 0.00 H new ATOM 655 N SER A 43 -0.947 4.129 -10.759 1.00 0.00 N ATOM 656 CA SER A 43 -2.418 4.017 -10.561 1.00 0.00 C ATOM 657 C SER A 43 -2.876 2.534 -10.434 1.00 0.00 C ATOM 658 O SER A 43 -2.695 1.739 -11.359 1.00 0.00 O ATOM 659 CB SER A 43 -3.127 4.761 -11.721 1.00 0.00 C ATOM 660 OG SER A 43 -2.850 4.210 -13.016 1.00 0.00 O ATOM 0 H SER A 43 -0.585 3.536 -11.506 1.00 0.00 H new ATOM 0 HA SER A 43 -2.697 4.485 -9.617 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.203 4.740 -11.550 1.00 0.00 H new ATOM 0 HB3 SER A 43 -2.823 5.808 -11.709 1.00 0.00 H new ATOM 0 HG SER A 43 -1.882 4.103 -13.126 1.00 0.00 H new ATOM 666 N GLN A 44 -3.498 2.154 -9.306 1.00 0.00 N ATOM 667 CA GLN A 44 -4.055 0.780 -9.114 1.00 0.00 C ATOM 668 C GLN A 44 -5.499 0.697 -9.706 1.00 0.00 C ATOM 669 O GLN A 44 -6.457 1.219 -9.127 1.00 0.00 O ATOM 670 CB GLN A 44 -3.996 0.405 -7.606 1.00 0.00 C ATOM 671 CG GLN A 44 -2.565 0.160 -7.052 1.00 0.00 C ATOM 672 CD GLN A 44 -2.456 -0.176 -5.560 1.00 0.00 C ATOM 673 OE1 GLN A 44 -1.978 0.607 -4.745 1.00 0.00 O ATOM 674 NE2 GLN A 44 -2.842 -1.362 -5.152 1.00 0.00 N ATOM 0 H GLN A 44 -3.634 2.771 -8.505 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.454 0.049 -9.655 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -4.462 1.203 -7.029 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -4.591 -0.494 -7.446 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.115 -0.655 -7.619 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -1.967 1.051 -7.245 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -3.241 -2.025 -5.816 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.743 -1.621 -4.170 1.00 0.00 H new ATOM 683 N GLU A 45 -5.636 0.073 -10.889 1.00 0.00 N ATOM 684 CA GLU A 45 -6.889 0.130 -11.694 1.00 0.00 C ATOM 685 C GLU A 45 -7.636 -1.236 -11.606 1.00 0.00 C ATOM 686 O GLU A 45 -7.416 -2.144 -12.418 1.00 0.00 O ATOM 687 CB GLU A 45 -6.552 0.552 -13.157 1.00 0.00 C ATOM 688 CG GLU A 45 -5.837 1.915 -13.380 1.00 0.00 C ATOM 689 CD GLU A 45 -6.637 3.187 -13.094 1.00 0.00 C ATOM 690 OE1 GLU A 45 -6.940 4.008 -13.958 1.00 0.00 O ATOM 691 OE2 GLU A 45 -6.927 3.339 -11.773 1.00 0.00 O ATOM 0 H GLU A 45 -4.896 -0.482 -11.319 1.00 0.00 H new ATOM 0 HA GLU A 45 -7.566 0.884 -11.294 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -5.927 -0.227 -13.593 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -7.484 0.568 -13.722 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.943 1.932 -12.756 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.503 1.954 -14.417 1.00 0.00 H new ATOM 699 N GLY A 46 -8.502 -1.394 -10.585 1.00 0.00 N ATOM 700 CA GLY A 46 -9.224 -2.675 -10.341 1.00 0.00 C ATOM 701 C GLY A 46 -8.401 -3.765 -9.625 1.00 0.00 C ATOM 702 O GLY A 46 -8.587 -4.024 -8.435 1.00 0.00 O ATOM 0 H GLY A 46 -8.723 -0.658 -9.914 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -10.114 -2.465 -9.747 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -9.565 -3.069 -11.298 1.00 0.00 H new ATOM 706 N ASP A 47 -7.502 -4.401 -10.385 1.00 0.00 N ATOM 707 CA ASP A 47 -6.551 -5.423 -9.856 1.00 0.00 C ATOM 708 C ASP A 47 -5.057 -5.067 -10.154 1.00 0.00 C ATOM 709 O ASP A 47 -4.232 -5.127 -9.239 1.00 0.00 O ATOM 710 CB ASP A 47 -6.917 -6.841 -10.383 1.00 0.00 C ATOM 711 CG ASP A 47 -8.292 -7.394 -10.000 1.00 0.00 C ATOM 712 OD1 ASP A 47 -9.170 -7.636 -10.823 1.00 0.00 O ATOM 713 OD2 ASP A 47 -8.420 -7.596 -8.655 1.00 0.00 O ATOM 0 H ASP A 47 -7.402 -4.232 -11.386 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.653 -5.424 -8.771 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -6.850 -6.825 -11.471 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.160 -7.540 -10.027 1.00 0.00 H new ATOM 719 N LYS A 48 -4.689 -4.739 -11.410 1.00 0.00 N ATOM 720 CA LYS A 48 -3.286 -4.450 -11.802 1.00 0.00 C ATOM 721 C LYS A 48 -2.792 -3.001 -11.474 1.00 0.00 C ATOM 722 O LYS A 48 -3.567 -2.043 -11.360 1.00 0.00 O ATOM 723 CB LYS A 48 -3.181 -4.817 -13.310 1.00 0.00 C ATOM 724 CG LYS A 48 -3.913 -3.868 -14.293 1.00 0.00 C ATOM 725 CD LYS A 48 -4.081 -4.430 -15.713 1.00 0.00 C ATOM 726 CE LYS A 48 -5.175 -5.503 -15.842 1.00 0.00 C ATOM 727 NZ LYS A 48 -5.292 -5.932 -17.249 1.00 0.00 N ATOM 0 H LYS A 48 -5.351 -4.666 -12.182 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.604 -5.051 -11.200 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.126 -4.848 -13.583 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -3.575 -5.824 -13.447 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.898 -3.636 -13.889 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.362 -2.929 -14.350 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.312 -3.609 -16.392 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.131 -4.855 -16.038 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.934 -6.358 -15.210 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.129 -5.107 -15.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.033 -6.657 -17.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.541 -5.115 -17.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.384 -6.327 -17.568 1.00 0.00 H new ATOM 740 N VAL A 49 -1.463 -2.852 -11.379 1.00 0.00 N ATOM 741 CA VAL A 49 -0.799 -1.529 -11.203 1.00 0.00 C ATOM 742 C VAL A 49 -0.481 -0.964 -12.629 1.00 0.00 C ATOM 743 O VAL A 49 0.313 -1.537 -13.386 1.00 0.00 O ATOM 744 CB VAL A 49 0.481 -1.623 -10.302 1.00 0.00 C ATOM 745 CG1 VAL A 49 1.054 -0.227 -9.958 1.00 0.00 C ATOM 746 CG2 VAL A 49 0.322 -2.388 -8.965 1.00 0.00 C ATOM 0 H VAL A 49 -0.810 -3.635 -11.420 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.466 -0.847 -10.676 1.00 0.00 H new ATOM 0 HB VAL A 49 1.158 -2.200 -10.932 1.00 0.00 H new ATOM 0 HG11 VAL A 49 1.939 -0.341 -9.333 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.324 0.292 -10.878 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.303 0.352 -9.421 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.272 -2.386 -8.430 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.439 -1.901 -8.355 1.00 0.00 H new ATOM 0 HG23 VAL A 49 0.021 -3.416 -9.168 1.00 0.00 H new ATOM 756 N VAL A 50 -1.118 0.161 -12.982 1.00 0.00 N ATOM 757 CA VAL A 50 -0.936 0.839 -14.296 1.00 0.00 C ATOM 758 C VAL A 50 -0.075 2.115 -14.031 1.00 0.00 C ATOM 759 O VAL A 50 -0.571 3.118 -13.498 1.00 0.00 O ATOM 760 CB VAL A 50 -2.316 1.147 -14.978 1.00 0.00 C ATOM 761 CG1 VAL A 50 -2.156 1.803 -16.371 1.00 0.00 C ATOM 762 CG2 VAL A 50 -3.221 -0.095 -15.157 1.00 0.00 C ATOM 0 H VAL A 50 -1.780 0.637 -12.369 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.417 0.196 -15.007 1.00 0.00 H new ATOM 0 HB VAL A 50 -2.793 1.837 -14.281 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -3.140 1.995 -16.798 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.615 2.744 -16.270 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.600 1.133 -17.027 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.155 0.201 -15.635 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.711 -0.830 -15.780 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.435 -0.533 -14.182 1.00 0.00 H new ATOM 772 N ILE A 51 1.213 2.074 -14.410 1.00 0.00 N ATOM 773 CA ILE A 51 2.133 3.243 -14.299 1.00 0.00 C ATOM 774 C ILE A 51 2.123 3.994 -15.666 1.00 0.00 C ATOM 775 O ILE A 51 2.518 3.450 -16.701 1.00 0.00 O ATOM 776 CB ILE A 51 3.575 2.857 -13.800 1.00 0.00 C ATOM 777 CG1 ILE A 51 3.544 2.096 -12.441 1.00 0.00 C ATOM 778 CG2 ILE A 51 4.489 4.111 -13.717 1.00 0.00 C ATOM 779 CD1 ILE A 51 4.893 1.705 -11.805 1.00 0.00 C ATOM 0 H ILE A 51 1.654 1.241 -14.801 1.00 0.00 H new ATOM 0 HA ILE A 51 1.773 3.915 -13.520 1.00 0.00 H new ATOM 0 HB ILE A 51 3.996 2.174 -14.538 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.002 2.713 -11.724 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.963 1.184 -12.581 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.479 3.817 -13.370 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.571 4.567 -14.703 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.058 4.829 -13.019 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.714 1.183 -10.865 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.440 1.052 -12.485 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.480 2.604 -11.615 1.00 0.00 H new ATOM 791 N ARG A 52 1.697 5.263 -15.650 1.00 0.00 N ATOM 792 CA ARG A 52 1.745 6.143 -16.849 1.00 0.00 C ATOM 793 C ARG A 52 2.965 7.106 -16.730 1.00 0.00 C ATOM 794 O ARG A 52 2.931 8.096 -15.991 1.00 0.00 O ATOM 795 CB ARG A 52 0.365 6.841 -16.990 1.00 0.00 C ATOM 796 CG ARG A 52 -0.723 5.912 -17.593 1.00 0.00 C ATOM 797 CD ARG A 52 -2.165 6.446 -17.501 1.00 0.00 C ATOM 798 NE ARG A 52 -2.802 6.020 -16.220 1.00 0.00 N ATOM 799 CZ ARG A 52 -4.115 5.895 -16.016 1.00 0.00 C ATOM 800 NH1 ARG A 52 -5.026 6.281 -16.874 1.00 0.00 N ATOM 801 NH2 ARG A 52 -4.522 5.360 -14.904 1.00 0.00 N ATOM 0 H ARG A 52 1.312 5.715 -14.821 1.00 0.00 H new ATOM 0 HA ARG A 52 1.906 5.587 -17.773 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.037 7.188 -16.010 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.473 7.723 -17.621 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.485 5.733 -18.642 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -0.676 4.948 -17.087 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -2.161 7.534 -17.567 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.749 6.078 -18.344 1.00 0.00 H new ATOM 0 HE ARG A 52 -2.184 5.807 -15.437 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -4.746 6.705 -17.758 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -6.015 6.157 -16.658 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -3.843 5.047 -14.210 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -5.520 5.254 -14.725 1.00 0.00 H new ATOM 815 N THR A 53 4.053 6.789 -17.457 1.00 0.00 N ATOM 816 CA THR A 53 5.300 7.607 -17.472 1.00 0.00 C ATOM 817 C THR A 53 5.150 8.744 -18.529 1.00 0.00 C ATOM 818 O THR A 53 5.388 8.541 -19.725 1.00 0.00 O ATOM 819 CB THR A 53 6.522 6.666 -17.716 1.00 0.00 C ATOM 820 OG1 THR A 53 6.677 5.771 -16.619 1.00 0.00 O ATOM 821 CG2 THR A 53 7.884 7.369 -17.860 1.00 0.00 C ATOM 0 H THR A 53 4.101 5.962 -18.052 1.00 0.00 H new ATOM 0 HA THR A 53 5.474 8.098 -16.514 1.00 0.00 H new ATOM 0 HB THR A 53 6.283 6.177 -18.661 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.445 5.184 -16.782 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.662 6.624 -18.026 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.852 8.055 -18.707 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.104 7.927 -16.950 1.00 0.00 H new ATOM 829 N LEU A 54 4.743 9.941 -18.075 1.00 0.00 N ATOM 830 CA LEU A 54 4.419 11.073 -18.978 1.00 0.00 C ATOM 831 C LEU A 54 5.638 12.040 -19.042 1.00 0.00 C ATOM 832 O LEU A 54 5.780 12.950 -18.218 1.00 0.00 O ATOM 833 CB LEU A 54 3.106 11.768 -18.506 1.00 0.00 C ATOM 834 CG LEU A 54 1.806 10.920 -18.407 1.00 0.00 C ATOM 835 CD1 LEU A 54 0.651 11.791 -17.887 1.00 0.00 C ATOM 836 CD2 LEU A 54 1.395 10.286 -19.745 1.00 0.00 C ATOM 0 H LEU A 54 4.628 10.156 -17.085 1.00 0.00 H new ATOM 0 HA LEU A 54 4.234 10.719 -19.992 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.295 12.199 -17.523 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.909 12.598 -19.185 1.00 0.00 H new ATOM 0 HG LEU A 54 2.019 10.107 -17.713 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.256 11.190 -17.820 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.903 12.178 -16.900 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.486 12.623 -18.572 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.481 9.708 -19.608 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.221 11.071 -20.481 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.191 9.629 -20.096 1.00 0.00 H new ATOM 848 N SER A 55 6.530 11.838 -20.029 1.00 0.00 N ATOM 849 CA SER A 55 7.695 12.747 -20.255 1.00 0.00 C ATOM 850 C SER A 55 7.464 14.024 -21.135 1.00 0.00 C ATOM 851 O SER A 55 8.435 14.692 -21.511 1.00 0.00 O ATOM 852 CB SER A 55 8.872 11.866 -20.746 1.00 0.00 C ATOM 853 OG SER A 55 8.754 11.507 -22.124 1.00 0.00 O ATOM 0 H SER A 55 6.477 11.060 -20.686 1.00 0.00 H new ATOM 0 HA SER A 55 7.915 13.223 -19.299 1.00 0.00 H new ATOM 0 HB2 SER A 55 9.809 12.401 -20.593 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.919 10.960 -20.141 1.00 0.00 H new ATOM 0 HG SER A 55 7.826 11.259 -22.319 1.00 0.00 H new ATOM 859 N THR A 56 6.203 14.378 -21.459 1.00 0.00 N ATOM 860 CA THR A 56 5.832 15.408 -22.484 1.00 0.00 C ATOM 861 C THR A 56 6.035 14.924 -23.958 1.00 0.00 C ATOM 862 O THR A 56 5.076 14.877 -24.731 1.00 0.00 O ATOM 863 CB THR A 56 6.297 16.879 -22.229 1.00 0.00 C ATOM 864 OG1 THR A 56 7.709 16.993 -22.324 1.00 0.00 O ATOM 865 CG2 THR A 56 5.883 17.460 -20.868 1.00 0.00 C ATOM 0 H THR A 56 5.389 13.954 -21.013 1.00 0.00 H new ATOM 0 HA THR A 56 4.756 15.496 -22.332 1.00 0.00 H new ATOM 0 HB THR A 56 5.790 17.451 -23.006 1.00 0.00 H new ATOM 0 HG1 THR A 56 8.106 16.099 -22.380 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.250 18.483 -20.782 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.796 17.456 -20.786 1.00 0.00 H new ATOM 0 HG23 THR A 56 6.309 16.854 -20.069 1.00 0.00 H new ATOM 873 N PHE A 57 7.265 14.528 -24.319 1.00 0.00 N ATOM 874 CA PHE A 57 7.613 13.968 -25.655 1.00 0.00 C ATOM 875 C PHE A 57 7.153 12.474 -25.813 1.00 0.00 C ATOM 876 O PHE A 57 6.327 12.175 -26.677 1.00 0.00 O ATOM 877 CB PHE A 57 9.148 14.134 -25.901 1.00 0.00 C ATOM 878 CG PHE A 57 9.779 15.538 -25.788 1.00 0.00 C ATOM 879 CD1 PHE A 57 10.174 16.025 -24.534 1.00 0.00 C ATOM 880 CD2 PHE A 57 10.040 16.303 -26.929 1.00 0.00 C ATOM 881 CE1 PHE A 57 10.815 17.254 -24.425 1.00 0.00 C ATOM 882 CE2 PHE A 57 10.695 17.529 -26.819 1.00 0.00 C ATOM 883 CZ PHE A 57 11.085 18.000 -25.566 1.00 0.00 C ATOM 0 H PHE A 57 8.065 14.584 -23.689 1.00 0.00 H new ATOM 0 HA PHE A 57 7.070 14.527 -26.417 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.666 13.483 -25.196 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.363 13.757 -26.901 1.00 0.00 H new ATOM 0 HD1 PHE A 57 9.979 15.441 -23.646 1.00 0.00 H new ATOM 0 HD2 PHE A 57 9.733 15.943 -27.900 1.00 0.00 H new ATOM 0 HE1 PHE A 57 11.103 17.629 -23.454 1.00 0.00 H new ATOM 0 HE2 PHE A 57 10.900 18.113 -27.704 1.00 0.00 H new ATOM 0 HZ PHE A 57 11.598 18.947 -25.482 1.00 0.00 H new ATOM 893 N LYS A 58 7.682 11.548 -24.985 1.00 0.00 N ATOM 894 CA LYS A 58 7.306 10.106 -25.001 1.00 0.00 C ATOM 895 C LYS A 58 6.415 9.784 -23.761 1.00 0.00 C ATOM 896 O LYS A 58 6.820 9.993 -22.609 1.00 0.00 O ATOM 897 CB LYS A 58 8.597 9.238 -25.029 1.00 0.00 C ATOM 898 CG LYS A 58 9.417 9.278 -26.347 1.00 0.00 C ATOM 899 CD LYS A 58 8.779 8.541 -27.550 1.00 0.00 C ATOM 900 CE LYS A 58 8.114 9.486 -28.567 1.00 0.00 C ATOM 901 NZ LYS A 58 7.537 8.718 -29.687 1.00 0.00 N ATOM 0 H LYS A 58 8.385 11.774 -24.282 1.00 0.00 H new ATOM 0 HA LYS A 58 6.726 9.875 -25.895 1.00 0.00 H new ATOM 0 HB2 LYS A 58 9.244 9.558 -24.212 1.00 0.00 H new ATOM 0 HB3 LYS A 58 8.319 8.203 -24.829 1.00 0.00 H new ATOM 0 HG2 LYS A 58 9.576 10.320 -26.624 1.00 0.00 H new ATOM 0 HG3 LYS A 58 10.399 8.845 -26.157 1.00 0.00 H new ATOM 0 HD2 LYS A 58 9.547 7.957 -28.057 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.034 7.836 -27.181 1.00 0.00 H new ATOM 0 HE2 LYS A 58 7.333 10.066 -28.076 1.00 0.00 H new ATOM 0 HE3 LYS A 58 8.848 10.197 -28.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 7.093 9.371 -30.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 8.290 8.183 -30.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 6.821 8.057 -29.323 1.00 0.00 H new ATOM 914 N ASN A 59 5.188 9.297 -24.005 1.00 0.00 N ATOM 915 CA ASN A 59 4.150 9.148 -22.943 1.00 0.00 C ATOM 916 C ASN A 59 3.671 7.661 -22.894 1.00 0.00 C ATOM 917 O ASN A 59 2.684 7.294 -23.540 1.00 0.00 O ATOM 918 CB ASN A 59 3.017 10.181 -23.218 1.00 0.00 C ATOM 919 CG ASN A 59 3.430 11.663 -23.121 1.00 0.00 C ATOM 920 OD1 ASN A 59 3.786 12.177 -22.065 1.00 0.00 O ATOM 921 ND2 ASN A 59 3.431 12.379 -24.221 1.00 0.00 N ATOM 0 H ASN A 59 4.878 8.995 -24.929 1.00 0.00 H new ATOM 0 HA ASN A 59 4.542 9.366 -21.950 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.617 9.998 -24.215 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.206 10.001 -22.512 1.00 0.00 H new ATOM 0 HD21 ASN A 59 3.726 13.355 -24.194 1.00 0.00 H new ATOM 0 HD22 ASN A 59 3.137 11.959 -25.103 1.00 0.00 H new ATOM 928 N THR A 60 4.406 6.796 -22.166 1.00 0.00 N ATOM 929 CA THR A 60 4.254 5.308 -22.265 1.00 0.00 C ATOM 930 C THR A 60 3.584 4.644 -21.014 1.00 0.00 C ATOM 931 O THR A 60 3.738 5.088 -19.870 1.00 0.00 O ATOM 932 CB THR A 60 5.613 4.666 -22.681 1.00 0.00 C ATOM 933 OG1 THR A 60 5.399 3.321 -23.093 1.00 0.00 O ATOM 934 CG2 THR A 60 6.755 4.665 -21.651 1.00 0.00 C ATOM 0 H THR A 60 5.117 7.092 -21.497 1.00 0.00 H new ATOM 0 HA THR A 60 3.533 5.100 -23.056 1.00 0.00 H new ATOM 0 HB THR A 60 5.957 5.325 -23.478 1.00 0.00 H new ATOM 0 HG1 THR A 60 5.911 2.717 -22.516 1.00 0.00 H new ATOM 0 HG21 THR A 60 7.634 4.186 -22.083 1.00 0.00 H new ATOM 0 HG22 THR A 60 6.999 5.691 -21.377 1.00 0.00 H new ATOM 0 HG23 THR A 60 6.443 4.117 -20.762 1.00 0.00 H new ATOM 942 N GLU A 61 2.834 3.555 -21.261 1.00 0.00 N ATOM 943 CA GLU A 61 2.026 2.847 -20.232 1.00 0.00 C ATOM 944 C GLU A 61 2.660 1.490 -19.779 1.00 0.00 C ATOM 945 O GLU A 61 3.106 0.677 -20.596 1.00 0.00 O ATOM 946 CB GLU A 61 0.555 2.694 -20.731 1.00 0.00 C ATOM 947 CG GLU A 61 0.250 1.759 -21.938 1.00 0.00 C ATOM 948 CD GLU A 61 0.675 2.288 -23.309 1.00 0.00 C ATOM 949 OE1 GLU A 61 1.822 2.223 -23.742 1.00 0.00 O ATOM 950 OE2 GLU A 61 -0.357 2.857 -23.992 1.00 0.00 O ATOM 0 H GLU A 61 2.766 3.132 -22.187 1.00 0.00 H new ATOM 0 HA GLU A 61 2.019 3.459 -19.330 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -0.042 2.345 -19.888 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.192 3.689 -20.988 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.745 0.803 -21.768 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.822 1.563 -21.961 1.00 0.00 H new ATOM 958 N ILE A 62 2.672 1.253 -18.459 1.00 0.00 N ATOM 959 CA ILE A 62 3.328 0.072 -17.818 1.00 0.00 C ATOM 960 C ILE A 62 2.238 -0.653 -16.960 1.00 0.00 C ATOM 961 O ILE A 62 1.900 -0.221 -15.855 1.00 0.00 O ATOM 962 CB ILE A 62 4.607 0.591 -17.055 1.00 0.00 C ATOM 963 CG1 ILE A 62 5.815 0.784 -18.016 1.00 0.00 C ATOM 964 CG2 ILE A 62 5.027 -0.221 -15.809 1.00 0.00 C ATOM 965 CD1 ILE A 62 6.885 1.777 -17.535 1.00 0.00 C ATOM 0 H ILE A 62 2.225 1.876 -17.786 1.00 0.00 H new ATOM 0 HA ILE A 62 3.701 -0.682 -18.512 1.00 0.00 H new ATOM 0 HB ILE A 62 4.293 1.559 -16.664 1.00 0.00 H new ATOM 0 HG12 ILE A 62 6.288 -0.185 -18.177 1.00 0.00 H new ATOM 0 HG13 ILE A 62 5.439 1.120 -18.982 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.917 0.227 -15.366 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.216 -0.215 -15.080 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.245 -1.248 -16.101 1.00 0.00 H new ATOM 0 HD11 ILE A 62 7.683 1.839 -18.275 1.00 0.00 H new ATOM 0 HD12 ILE A 62 6.435 2.761 -17.403 1.00 0.00 H new ATOM 0 HD13 ILE A 62 7.297 1.436 -16.585 1.00 0.00 H new ATOM 977 N SER A 63 1.686 -1.755 -17.485 1.00 0.00 N ATOM 978 CA SER A 63 0.543 -2.485 -16.863 1.00 0.00 C ATOM 979 C SER A 63 0.979 -3.870 -16.297 1.00 0.00 C ATOM 980 O SER A 63 1.309 -4.772 -17.078 1.00 0.00 O ATOM 981 CB SER A 63 -0.565 -2.645 -17.934 1.00 0.00 C ATOM 982 OG SER A 63 -0.155 -3.520 -18.989 1.00 0.00 O ATOM 0 H SER A 63 2.011 -2.177 -18.355 1.00 0.00 H new ATOM 0 HA SER A 63 0.167 -1.913 -16.015 1.00 0.00 H new ATOM 0 HB2 SER A 63 -1.469 -3.036 -17.467 1.00 0.00 H new ATOM 0 HB3 SER A 63 -0.816 -1.668 -18.347 1.00 0.00 H new ATOM 0 HG SER A 63 0.511 -4.154 -18.648 1.00 0.00 H new ATOM 988 N PHE A 64 0.953 -4.052 -14.965 1.00 0.00 N ATOM 989 CA PHE A 64 1.477 -5.289 -14.311 1.00 0.00 C ATOM 990 C PHE A 64 0.608 -5.770 -13.107 1.00 0.00 C ATOM 991 O PHE A 64 0.189 -4.988 -12.249 1.00 0.00 O ATOM 992 CB PHE A 64 2.976 -5.122 -13.918 1.00 0.00 C ATOM 993 CG PHE A 64 3.339 -4.002 -12.924 1.00 0.00 C ATOM 994 CD1 PHE A 64 3.612 -2.718 -13.401 1.00 0.00 C ATOM 995 CD2 PHE A 64 3.412 -4.252 -11.549 1.00 0.00 C ATOM 996 CE1 PHE A 64 3.961 -1.703 -12.517 1.00 0.00 C ATOM 997 CE2 PHE A 64 3.764 -3.234 -10.667 1.00 0.00 C ATOM 998 CZ PHE A 64 4.038 -1.959 -11.152 1.00 0.00 C ATOM 0 H PHE A 64 0.577 -3.365 -14.311 1.00 0.00 H new ATOM 0 HA PHE A 64 1.408 -6.084 -15.054 1.00 0.00 H new ATOM 0 HB2 PHE A 64 3.319 -6.067 -13.497 1.00 0.00 H new ATOM 0 HB3 PHE A 64 3.545 -4.955 -14.833 1.00 0.00 H new ATOM 0 HD1 PHE A 64 3.552 -2.513 -14.460 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.194 -5.240 -11.170 1.00 0.00 H new ATOM 0 HE1 PHE A 64 4.173 -0.712 -12.892 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.824 -3.434 -9.607 1.00 0.00 H new ATOM 0 HZ PHE A 64 4.310 -1.168 -10.469 1.00 0.00 H new ATOM 1008 N GLN A 65 0.413 -7.093 -13.002 1.00 0.00 N ATOM 1009 CA GLN A 65 -0.273 -7.737 -11.835 1.00 0.00 C ATOM 1010 C GLN A 65 0.669 -8.123 -10.624 1.00 0.00 C ATOM 1011 O GLN A 65 0.333 -9.031 -9.861 1.00 0.00 O ATOM 1012 CB GLN A 65 -1.017 -8.987 -12.403 1.00 0.00 C ATOM 1013 CG GLN A 65 -2.130 -8.746 -13.462 1.00 0.00 C ATOM 1014 CD GLN A 65 -2.471 -9.998 -14.275 1.00 0.00 C ATOM 1015 OE1 GLN A 65 -1.687 -10.464 -15.098 1.00 0.00 O ATOM 1016 NE2 GLN A 65 -3.627 -10.585 -14.083 1.00 0.00 N ATOM 0 H GLN A 65 0.719 -7.758 -13.712 1.00 0.00 H new ATOM 0 HA GLN A 65 -0.954 -7.011 -11.390 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.272 -9.649 -12.844 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.462 -9.522 -11.564 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -3.030 -8.391 -12.960 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -1.811 -7.955 -14.141 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -4.285 -10.206 -13.402 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -3.869 -11.421 -14.615 1.00 0.00 H new ATOM 1025 N LEU A 66 1.821 -7.437 -10.430 1.00 0.00 N ATOM 1026 CA LEU A 66 2.882 -7.787 -9.427 1.00 0.00 C ATOM 1027 C LEU A 66 3.555 -9.176 -9.703 1.00 0.00 C ATOM 1028 O LEU A 66 2.980 -10.229 -9.417 1.00 0.00 O ATOM 1029 CB LEU A 66 2.415 -7.602 -7.952 1.00 0.00 C ATOM 1030 CG LEU A 66 2.145 -6.143 -7.495 1.00 0.00 C ATOM 1031 CD1 LEU A 66 1.379 -6.131 -6.162 1.00 0.00 C ATOM 1032 CD2 LEU A 66 3.453 -5.353 -7.318 1.00 0.00 C ATOM 0 H LEU A 66 2.053 -6.605 -10.973 1.00 0.00 H new ATOM 0 HA LEU A 66 3.675 -7.053 -9.568 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.503 -8.181 -7.807 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.173 -8.031 -7.297 1.00 0.00 H new ATOM 0 HG LEU A 66 1.549 -5.669 -8.275 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.198 -5.101 -5.856 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.426 -6.646 -6.285 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.969 -6.638 -5.399 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.224 -4.337 -6.998 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.073 -5.840 -6.565 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.991 -5.322 -8.266 1.00 0.00 H new ATOM 1044 N GLY A 67 4.756 -9.176 -10.309 1.00 0.00 N ATOM 1045 CA GLY A 67 5.365 -10.417 -10.877 1.00 0.00 C ATOM 1046 C GLY A 67 4.974 -10.862 -12.316 1.00 0.00 C ATOM 1047 O GLY A 67 5.463 -11.897 -12.769 1.00 0.00 O ATOM 0 H GLY A 67 5.330 -8.341 -10.423 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.448 -10.292 -10.855 1.00 0.00 H new ATOM 0 HA3 GLY A 67 5.125 -11.239 -10.202 1.00 0.00 H new ATOM 1051 N GLU A 68 4.136 -10.101 -13.040 1.00 0.00 N ATOM 1052 CA GLU A 68 3.725 -10.412 -14.433 1.00 0.00 C ATOM 1053 C GLU A 68 4.710 -9.780 -15.467 1.00 0.00 C ATOM 1054 O GLU A 68 5.005 -8.580 -15.419 1.00 0.00 O ATOM 1055 CB GLU A 68 2.267 -9.896 -14.595 1.00 0.00 C ATOM 1056 CG GLU A 68 1.559 -10.179 -15.947 1.00 0.00 C ATOM 1057 CD GLU A 68 1.338 -11.659 -16.265 1.00 0.00 C ATOM 1058 OE1 GLU A 68 2.225 -12.379 -16.717 1.00 0.00 O ATOM 1059 OE2 GLU A 68 0.066 -12.081 -15.987 1.00 0.00 O ATOM 0 H GLU A 68 3.718 -9.244 -12.678 1.00 0.00 H new ATOM 0 HA GLU A 68 3.759 -11.484 -14.627 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.664 -10.334 -13.800 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.271 -8.818 -14.435 1.00 0.00 H new ATOM 0 HG2 GLU A 68 0.592 -9.675 -15.946 1.00 0.00 H new ATOM 0 HG3 GLU A 68 2.149 -9.735 -16.749 1.00 0.00 H new ATOM 1067 N GLU A 69 5.189 -10.604 -16.414 1.00 0.00 N ATOM 1068 CA GLU A 69 6.101 -10.145 -17.496 1.00 0.00 C ATOM 1069 C GLU A 69 5.301 -9.661 -18.748 1.00 0.00 C ATOM 1070 O GLU A 69 4.668 -10.455 -19.451 1.00 0.00 O ATOM 1071 CB GLU A 69 7.122 -11.268 -17.809 1.00 0.00 C ATOM 1072 CG GLU A 69 8.334 -10.791 -18.652 1.00 0.00 C ATOM 1073 CD GLU A 69 9.447 -11.826 -18.773 1.00 0.00 C ATOM 1074 OE1 GLU A 69 10.406 -11.881 -18.008 1.00 0.00 O ATOM 1075 OE2 GLU A 69 9.248 -12.672 -19.826 1.00 0.00 O ATOM 0 H GLU A 69 4.963 -11.598 -16.459 1.00 0.00 H new ATOM 0 HA GLU A 69 6.663 -9.272 -17.163 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.486 -11.688 -16.871 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.613 -12.071 -18.342 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.988 -10.526 -19.651 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.741 -9.884 -18.205 1.00 0.00 H new ATOM 1083 N PHE A 70 5.347 -8.349 -19.017 1.00 0.00 N ATOM 1084 CA PHE A 70 4.628 -7.699 -20.148 1.00 0.00 C ATOM 1085 C PHE A 70 5.644 -7.134 -21.194 1.00 0.00 C ATOM 1086 O PHE A 70 6.751 -6.717 -20.846 1.00 0.00 O ATOM 1087 CB PHE A 70 3.642 -6.623 -19.579 1.00 0.00 C ATOM 1088 CG PHE A 70 4.255 -5.384 -18.889 1.00 0.00 C ATOM 1089 CD1 PHE A 70 4.646 -5.450 -17.547 1.00 0.00 C ATOM 1090 CD2 PHE A 70 4.526 -4.224 -19.623 1.00 0.00 C ATOM 1091 CE1 PHE A 70 5.364 -4.404 -16.972 1.00 0.00 C ATOM 1092 CE2 PHE A 70 5.226 -3.174 -19.036 1.00 0.00 C ATOM 1093 CZ PHE A 70 5.673 -3.276 -17.726 1.00 0.00 C ATOM 0 H PHE A 70 5.888 -7.692 -18.455 1.00 0.00 H new ATOM 0 HA PHE A 70 4.027 -8.430 -20.690 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.015 -6.275 -20.400 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.984 -7.115 -18.863 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.390 -6.316 -16.954 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.191 -4.143 -20.647 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.681 -4.468 -15.941 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.422 -2.276 -19.602 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.260 -2.480 -17.292 1.00 0.00 H new ATOM 1103 N ASP A 71 5.273 -7.075 -22.484 1.00 0.00 N ATOM 1104 CA ASP A 71 6.114 -6.366 -23.500 1.00 0.00 C ATOM 1105 C ASP A 71 5.830 -4.828 -23.510 1.00 0.00 C ATOM 1106 O ASP A 71 4.680 -4.383 -23.553 1.00 0.00 O ATOM 1107 CB ASP A 71 5.953 -6.986 -24.908 1.00 0.00 C ATOM 1108 CG ASP A 71 6.599 -8.358 -25.138 1.00 0.00 C ATOM 1109 OD1 ASP A 71 7.233 -8.639 -26.150 1.00 0.00 O ATOM 1110 OD2 ASP A 71 6.387 -9.217 -24.099 1.00 0.00 O ATOM 0 H ASP A 71 4.420 -7.494 -22.855 1.00 0.00 H new ATOM 0 HA ASP A 71 7.155 -6.500 -23.207 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.888 -7.072 -25.121 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.368 -6.289 -25.636 1.00 0.00 H new ATOM 1116 N GLU A 72 6.911 -4.036 -23.468 1.00 0.00 N ATOM 1117 CA GLU A 72 6.843 -2.558 -23.315 1.00 0.00 C ATOM 1118 C GLU A 72 7.560 -1.874 -24.509 1.00 0.00 C ATOM 1119 O GLU A 72 8.793 -1.884 -24.576 1.00 0.00 O ATOM 1120 CB GLU A 72 7.487 -2.200 -21.943 1.00 0.00 C ATOM 1121 CG GLU A 72 7.506 -0.703 -21.520 1.00 0.00 C ATOM 1122 CD GLU A 72 6.209 0.118 -21.519 1.00 0.00 C ATOM 1123 OE1 GLU A 72 6.192 1.342 -21.624 1.00 0.00 O ATOM 1124 OE2 GLU A 72 5.092 -0.640 -21.328 1.00 0.00 O ATOM 0 H GLU A 72 7.864 -4.394 -23.539 1.00 0.00 H new ATOM 0 HA GLU A 72 5.814 -2.197 -23.325 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.961 -2.760 -21.170 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.516 -2.559 -21.952 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.917 -0.658 -20.512 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.211 -0.191 -22.175 1.00 0.00 H new ATOM 1132 N THR A 73 6.804 -1.246 -25.428 1.00 0.00 N ATOM 1133 CA THR A 73 7.388 -0.424 -26.532 1.00 0.00 C ATOM 1134 C THR A 73 7.820 0.970 -25.965 1.00 0.00 C ATOM 1135 O THR A 73 7.003 1.858 -25.710 1.00 0.00 O ATOM 1136 CB THR A 73 6.390 -0.345 -27.726 1.00 0.00 C ATOM 1137 OG1 THR A 73 6.079 -1.654 -28.195 1.00 0.00 O ATOM 1138 CG2 THR A 73 6.927 0.406 -28.956 1.00 0.00 C ATOM 0 H THR A 73 5.785 -1.285 -25.438 1.00 0.00 H new ATOM 0 HA THR A 73 8.289 -0.891 -26.931 1.00 0.00 H new ATOM 0 HB THR A 73 5.531 0.191 -27.322 1.00 0.00 H new ATOM 0 HG1 THR A 73 5.450 -1.592 -28.944 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.168 0.413 -29.738 1.00 0.00 H new ATOM 0 HG22 THR A 73 7.171 1.431 -28.678 1.00 0.00 H new ATOM 0 HG23 THR A 73 7.823 -0.093 -29.324 1.00 0.00 H new ATOM 1146 N THR A 74 9.129 1.107 -25.721 1.00 0.00 N ATOM 1147 CA THR A 74 9.698 2.212 -24.888 1.00 0.00 C ATOM 1148 C THR A 74 9.836 3.596 -25.619 1.00 0.00 C ATOM 1149 O THR A 74 9.574 3.741 -26.817 1.00 0.00 O ATOM 1150 CB THR A 74 11.085 1.729 -24.334 1.00 0.00 C ATOM 1151 OG1 THR A 74 11.958 1.402 -25.406 1.00 0.00 O ATOM 1152 CG2 THR A 74 11.055 0.537 -23.367 1.00 0.00 C ATOM 0 H THR A 74 9.834 0.466 -26.086 1.00 0.00 H new ATOM 0 HA THR A 74 8.988 2.411 -24.085 1.00 0.00 H new ATOM 0 HB THR A 74 11.437 2.581 -23.752 1.00 0.00 H new ATOM 0 HG1 THR A 74 12.863 1.716 -25.198 1.00 0.00 H new ATOM 0 HG21 THR A 74 12.071 0.297 -23.054 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.457 0.793 -22.493 1.00 0.00 H new ATOM 0 HG23 THR A 74 10.616 -0.326 -23.867 1.00 0.00 H new ATOM 1160 N ALA A 75 10.371 4.607 -24.905 1.00 0.00 N ATOM 1161 CA ALA A 75 10.914 5.854 -25.516 1.00 0.00 C ATOM 1162 C ALA A 75 12.051 5.763 -26.606 1.00 0.00 C ATOM 1163 O ALA A 75 12.370 6.781 -27.227 1.00 0.00 O ATOM 1164 CB ALA A 75 11.361 6.703 -24.309 1.00 0.00 C ATOM 0 H ALA A 75 10.442 4.589 -23.888 1.00 0.00 H new ATOM 0 HA ALA A 75 10.120 6.276 -26.132 1.00 0.00 H new ATOM 0 HB1 ALA A 75 11.777 7.647 -24.662 1.00 0.00 H new ATOM 0 HB2 ALA A 75 10.503 6.902 -23.667 1.00 0.00 H new ATOM 0 HB3 ALA A 75 12.119 6.161 -23.744 1.00 0.00 H new ATOM 1170 N ASP A 76 12.652 4.583 -26.859 1.00 0.00 N ATOM 1171 CA ASP A 76 13.374 4.297 -28.144 1.00 0.00 C ATOM 1172 C ASP A 76 12.659 3.265 -29.099 1.00 0.00 C ATOM 1173 O ASP A 76 13.323 2.693 -29.966 1.00 0.00 O ATOM 1174 CB ASP A 76 14.807 3.809 -27.785 1.00 0.00 C ATOM 1175 CG ASP A 76 15.754 4.870 -27.247 1.00 0.00 C ATOM 1176 OD1 ASP A 76 16.639 5.388 -27.920 1.00 0.00 O ATOM 1177 OD2 ASP A 76 15.510 5.150 -25.937 1.00 0.00 O ATOM 0 H ASP A 76 12.659 3.805 -26.200 1.00 0.00 H new ATOM 0 HA ASP A 76 13.390 5.224 -28.718 1.00 0.00 H new ATOM 0 HB2 ASP A 76 14.724 3.014 -27.044 1.00 0.00 H new ATOM 0 HB3 ASP A 76 15.254 3.369 -28.676 1.00 0.00 H new ATOM 1183 N ASP A 77 11.341 2.990 -28.959 1.00 0.00 N ATOM 1184 CA ASP A 77 10.618 1.898 -29.694 1.00 0.00 C ATOM 1185 C ASP A 77 11.127 0.409 -29.584 1.00 0.00 C ATOM 1186 O ASP A 77 10.620 -0.473 -30.281 1.00 0.00 O ATOM 1187 CB ASP A 77 10.156 2.356 -31.109 1.00 0.00 C ATOM 1188 CG ASP A 77 11.230 2.545 -32.180 1.00 0.00 C ATOM 1189 OD1 ASP A 77 11.625 3.642 -32.562 1.00 0.00 O ATOM 1190 OD2 ASP A 77 11.695 1.363 -32.668 1.00 0.00 O ATOM 0 H ASP A 77 10.735 3.518 -28.331 1.00 0.00 H new ATOM 0 HA ASP A 77 9.727 1.762 -29.081 1.00 0.00 H new ATOM 0 HB2 ASP A 77 9.437 1.625 -31.480 1.00 0.00 H new ATOM 0 HB3 ASP A 77 9.623 3.300 -30.998 1.00 0.00 H new ATOM 1196 N ARG A 78 12.042 0.106 -28.642 1.00 0.00 N ATOM 1197 CA ARG A 78 12.445 -1.281 -28.291 1.00 0.00 C ATOM 1198 C ARG A 78 11.349 -1.948 -27.401 1.00 0.00 C ATOM 1199 O ARG A 78 10.952 -1.383 -26.374 1.00 0.00 O ATOM 1200 CB ARG A 78 13.869 -1.314 -27.645 1.00 0.00 C ATOM 1201 CG ARG A 78 14.123 -0.439 -26.388 1.00 0.00 C ATOM 1202 CD ARG A 78 15.457 -0.695 -25.668 1.00 0.00 C ATOM 1203 NE ARG A 78 15.733 0.347 -24.634 1.00 0.00 N ATOM 1204 CZ ARG A 78 15.344 0.317 -23.356 1.00 0.00 C ATOM 1205 NH1 ARG A 78 14.781 -0.713 -22.786 1.00 0.00 N ATOM 1206 NH2 ARG A 78 15.540 1.375 -22.624 1.00 0.00 N ATOM 0 H ARG A 78 12.529 0.818 -28.097 1.00 0.00 H new ATOM 0 HA ARG A 78 12.521 -1.873 -29.203 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.092 -2.348 -27.382 1.00 0.00 H new ATOM 0 HB3 ARG A 78 14.588 -1.017 -28.408 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.083 0.610 -26.682 1.00 0.00 H new ATOM 0 HG3 ARG A 78 13.310 -0.603 -25.681 1.00 0.00 H new ATOM 0 HD2 ARG A 78 15.434 -1.678 -25.198 1.00 0.00 H new ATOM 0 HD3 ARG A 78 16.268 -0.709 -26.397 1.00 0.00 H new ATOM 0 HE ARG A 78 16.271 1.161 -24.933 1.00 0.00 H new ATOM 0 HH11 ARG A 78 14.613 -1.564 -23.322 1.00 0.00 H new ATOM 0 HH12 ARG A 78 14.509 -0.667 -21.804 1.00 0.00 H new ATOM 0 HH21 ARG A 78 15.981 2.201 -23.029 1.00 0.00 H new ATOM 0 HH22 ARG A 78 15.252 1.379 -21.645 1.00 0.00 H new ATOM 1220 N ASN A 79 10.866 -3.130 -27.822 1.00 0.00 N ATOM 1221 CA ASN A 79 9.845 -3.914 -27.073 1.00 0.00 C ATOM 1222 C ASN A 79 10.506 -4.792 -25.961 1.00 0.00 C ATOM 1223 O ASN A 79 11.105 -5.835 -26.238 1.00 0.00 O ATOM 1224 CB ASN A 79 8.909 -4.682 -28.051 1.00 0.00 C ATOM 1225 CG ASN A 79 9.513 -5.770 -28.954 1.00 0.00 C ATOM 1226 OD1 ASN A 79 9.625 -6.934 -28.589 1.00 0.00 O ATOM 1227 ND2 ASN A 79 9.898 -5.440 -30.164 1.00 0.00 N ATOM 0 H ASN A 79 11.166 -3.576 -28.689 1.00 0.00 H new ATOM 0 HA ASN A 79 9.191 -3.232 -26.531 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.121 -5.146 -27.458 1.00 0.00 H new ATOM 0 HB3 ASN A 79 8.431 -3.946 -28.697 1.00 0.00 H new ATOM 0 HD21 ASN A 79 10.285 -6.149 -30.787 1.00 0.00 H new ATOM 0 HD22 ASN A 79 9.811 -4.475 -30.481 1.00 0.00 H new ATOM 1234 N CYS A 80 10.436 -4.334 -24.701 1.00 0.00 N ATOM 1235 CA CYS A 80 11.173 -4.972 -23.581 1.00 0.00 C ATOM 1236 C CYS A 80 10.265 -5.887 -22.718 1.00 0.00 C ATOM 1237 O CYS A 80 9.225 -5.460 -22.202 1.00 0.00 O ATOM 1238 CB CYS A 80 11.821 -3.862 -22.740 1.00 0.00 C ATOM 1239 SG CYS A 80 13.060 -2.986 -23.742 1.00 0.00 S ATOM 0 H CYS A 80 9.879 -3.525 -24.425 1.00 0.00 H new ATOM 0 HA CYS A 80 11.942 -5.628 -23.989 1.00 0.00 H new ATOM 0 HB2 CYS A 80 11.060 -3.164 -22.392 1.00 0.00 H new ATOM 0 HB3 CYS A 80 12.291 -4.290 -21.854 1.00 0.00 H new ATOM 0 HG CYS A 80 14.249 -3.410 -23.430 1.00 0.00 H new ATOM 1245 N LYS A 81 10.714 -7.133 -22.513 1.00 0.00 N ATOM 1246 CA LYS A 81 10.031 -8.138 -21.655 1.00 0.00 C ATOM 1247 C LYS A 81 10.210 -7.745 -20.153 1.00 0.00 C ATOM 1248 O LYS A 81 11.276 -7.902 -19.554 1.00 0.00 O ATOM 1249 CB LYS A 81 10.621 -9.537 -22.011 1.00 0.00 C ATOM 1250 CG LYS A 81 10.047 -10.258 -23.259 1.00 0.00 C ATOM 1251 CD LYS A 81 10.200 -9.567 -24.636 1.00 0.00 C ATOM 1252 CE LYS A 81 11.644 -9.502 -25.163 1.00 0.00 C ATOM 1253 NZ LYS A 81 11.702 -8.729 -26.421 1.00 0.00 N ATOM 0 H LYS A 81 11.571 -7.485 -22.939 1.00 0.00 H new ATOM 0 HA LYS A 81 8.956 -8.172 -21.831 1.00 0.00 H new ATOM 0 HB2 LYS A 81 11.696 -9.423 -22.153 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.480 -10.191 -21.150 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.519 -11.238 -23.324 1.00 0.00 H new ATOM 0 HG3 LYS A 81 8.984 -10.427 -23.087 1.00 0.00 H new ATOM 0 HD2 LYS A 81 9.585 -10.096 -25.364 1.00 0.00 H new ATOM 0 HD3 LYS A 81 9.807 -8.553 -24.564 1.00 0.00 H new ATOM 0 HE2 LYS A 81 12.290 -9.041 -24.416 1.00 0.00 H new ATOM 0 HE3 LYS A 81 12.022 -10.511 -25.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 12.658 -8.794 -26.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 11.013 -9.115 -27.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 11.476 -7.733 -26.227 1.00 0.00 H new ATOM 1266 N SER A 82 9.169 -7.119 -19.596 1.00 0.00 N ATOM 1267 CA SER A 82 9.293 -6.234 -18.416 1.00 0.00 C ATOM 1268 C SER A 82 8.516 -6.836 -17.222 1.00 0.00 C ATOM 1269 O SER A 82 7.296 -7.003 -17.285 1.00 0.00 O ATOM 1270 CB SER A 82 8.737 -4.844 -18.799 1.00 0.00 C ATOM 1271 OG SER A 82 9.464 -4.241 -19.871 1.00 0.00 O ATOM 0 H SER A 82 8.214 -7.206 -19.944 1.00 0.00 H new ATOM 0 HA SER A 82 10.336 -6.137 -18.115 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.689 -4.941 -19.084 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.771 -4.190 -17.928 1.00 0.00 H new ATOM 0 HG SER A 82 9.153 -4.609 -20.725 1.00 0.00 H new ATOM 1277 N VAL A 83 9.231 -7.172 -16.143 1.00 0.00 N ATOM 1278 CA VAL A 83 8.642 -7.830 -14.940 1.00 0.00 C ATOM 1279 C VAL A 83 8.907 -6.957 -13.674 1.00 0.00 C ATOM 1280 O VAL A 83 10.039 -6.530 -13.419 1.00 0.00 O ATOM 1281 CB VAL A 83 9.132 -9.318 -14.841 1.00 0.00 C ATOM 1282 CG1 VAL A 83 10.645 -9.520 -14.594 1.00 0.00 C ATOM 1283 CG2 VAL A 83 8.345 -10.134 -13.795 1.00 0.00 C ATOM 0 H VAL A 83 10.234 -7.002 -16.065 1.00 0.00 H new ATOM 0 HA VAL A 83 7.557 -7.895 -15.024 1.00 0.00 H new ATOM 0 HB VAL A 83 8.930 -9.692 -15.845 1.00 0.00 H new ATOM 0 HG11 VAL A 83 10.866 -10.586 -14.544 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.210 -9.070 -15.410 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.927 -9.047 -13.653 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.726 -11.155 -13.769 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.464 -9.677 -12.813 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.289 -10.147 -14.064 1.00 0.00 H new ATOM 1293 N VAL A 84 7.851 -6.675 -12.888 1.00 0.00 N ATOM 1294 CA VAL A 84 7.935 -5.709 -11.752 1.00 0.00 C ATOM 1295 C VAL A 84 7.535 -6.434 -10.430 1.00 0.00 C ATOM 1296 O VAL A 84 6.368 -6.799 -10.235 1.00 0.00 O ATOM 1297 CB VAL A 84 7.090 -4.414 -11.993 1.00 0.00 C ATOM 1298 CG1 VAL A 84 7.386 -3.339 -10.922 1.00 0.00 C ATOM 1299 CG2 VAL A 84 7.257 -3.754 -13.378 1.00 0.00 C ATOM 0 H VAL A 84 6.929 -7.095 -13.010 1.00 0.00 H new ATOM 0 HA VAL A 84 8.966 -5.365 -11.671 1.00 0.00 H new ATOM 0 HB VAL A 84 6.063 -4.775 -11.931 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.783 -2.453 -11.119 1.00 0.00 H new ATOM 0 HG12 VAL A 84 7.142 -3.732 -9.935 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.443 -3.073 -10.956 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.627 -2.866 -13.436 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.299 -3.470 -13.522 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.963 -4.459 -14.155 1.00 0.00 H new ATOM 1309 N SER A 85 8.503 -6.594 -9.514 1.00 0.00 N ATOM 1310 CA SER A 85 8.284 -7.252 -8.197 1.00 0.00 C ATOM 1311 C SER A 85 8.420 -6.224 -7.031 1.00 0.00 C ATOM 1312 O SER A 85 9.401 -5.476 -6.950 1.00 0.00 O ATOM 1313 CB SER A 85 9.295 -8.413 -8.050 1.00 0.00 C ATOM 1314 OG SER A 85 9.008 -9.463 -8.978 1.00 0.00 O ATOM 0 H SER A 85 9.461 -6.275 -9.656 1.00 0.00 H new ATOM 0 HA SER A 85 7.271 -7.651 -8.148 1.00 0.00 H new ATOM 0 HB2 SER A 85 10.307 -8.042 -8.216 1.00 0.00 H new ATOM 0 HB3 SER A 85 9.261 -8.803 -7.033 1.00 0.00 H new ATOM 0 HG SER A 85 9.661 -10.185 -8.867 1.00 0.00 H new ATOM 1320 N LEU A 86 7.441 -6.210 -6.107 1.00 0.00 N ATOM 1321 CA LEU A 86 7.490 -5.360 -4.886 1.00 0.00 C ATOM 1322 C LEU A 86 8.147 -6.146 -3.706 1.00 0.00 C ATOM 1323 O LEU A 86 7.526 -7.011 -3.080 1.00 0.00 O ATOM 1324 CB LEU A 86 6.046 -4.854 -4.620 1.00 0.00 C ATOM 1325 CG LEU A 86 5.899 -3.619 -3.697 1.00 0.00 C ATOM 1326 CD1 LEU A 86 4.545 -2.931 -3.940 1.00 0.00 C ATOM 1327 CD2 LEU A 86 6.003 -3.975 -2.207 1.00 0.00 C ATOM 0 H LEU A 86 6.598 -6.780 -6.177 1.00 0.00 H new ATOM 0 HA LEU A 86 8.125 -4.483 -5.010 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.586 -4.618 -5.580 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.473 -5.673 -4.185 1.00 0.00 H new ATOM 0 HG LEU A 86 6.723 -2.951 -3.946 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.454 -2.065 -3.285 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.482 -2.608 -4.979 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.738 -3.632 -3.728 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.893 -3.071 -1.608 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.215 -4.681 -1.946 1.00 0.00 H new ATOM 0 HD23 LEU A 86 6.975 -4.426 -2.008 1.00 0.00 H new ATOM 1339 N ASP A 87 9.418 -5.831 -3.404 1.00 0.00 N ATOM 1340 CA ASP A 87 10.206 -6.523 -2.349 1.00 0.00 C ATOM 1341 C ASP A 87 9.981 -5.865 -0.943 1.00 0.00 C ATOM 1342 O ASP A 87 10.787 -5.053 -0.478 1.00 0.00 O ATOM 1343 CB ASP A 87 11.672 -6.513 -2.866 1.00 0.00 C ATOM 1344 CG ASP A 87 12.659 -7.322 -2.027 1.00 0.00 C ATOM 1345 OD1 ASP A 87 12.507 -8.507 -1.749 1.00 0.00 O ATOM 1346 OD2 ASP A 87 13.734 -6.584 -1.633 1.00 0.00 O ATOM 0 H ASP A 87 9.935 -5.091 -3.879 1.00 0.00 H new ATOM 0 HA ASP A 87 9.894 -7.554 -2.181 1.00 0.00 H new ATOM 0 HB2 ASP A 87 11.684 -6.898 -3.886 1.00 0.00 H new ATOM 0 HB3 ASP A 87 12.018 -5.480 -2.911 1.00 0.00 H new ATOM 1352 N GLY A 88 8.857 -6.202 -0.280 1.00 0.00 N ATOM 1353 CA GLY A 88 8.485 -5.592 1.031 1.00 0.00 C ATOM 1354 C GLY A 88 7.841 -4.194 0.922 1.00 0.00 C ATOM 1355 O GLY A 88 6.616 -4.064 0.942 1.00 0.00 O ATOM 0 H GLY A 88 8.187 -6.890 -0.622 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.793 -6.259 1.545 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.378 -5.520 1.651 1.00 0.00 H new ATOM 1359 N ASP A 89 8.680 -3.162 0.765 1.00 0.00 N ATOM 1360 CA ASP A 89 8.234 -1.819 0.284 1.00 0.00 C ATOM 1361 C ASP A 89 9.208 -1.236 -0.800 1.00 0.00 C ATOM 1362 O ASP A 89 9.738 -0.130 -0.657 1.00 0.00 O ATOM 1363 CB ASP A 89 7.906 -0.887 1.489 1.00 0.00 C ATOM 1364 CG ASP A 89 9.059 -0.470 2.410 1.00 0.00 C ATOM 1365 OD1 ASP A 89 9.761 -1.257 3.036 1.00 0.00 O ATOM 1366 OD2 ASP A 89 9.207 0.882 2.475 1.00 0.00 O ATOM 0 H ASP A 89 9.679 -3.218 0.961 1.00 0.00 H new ATOM 0 HA ASP A 89 7.291 -1.913 -0.254 1.00 0.00 H new ATOM 0 HB2 ASP A 89 7.448 0.020 1.095 1.00 0.00 H new ATOM 0 HB3 ASP A 89 7.153 -1.384 2.101 1.00 0.00 H new ATOM 1372 N LYS A 90 9.439 -1.987 -1.901 1.00 0.00 N ATOM 1373 CA LYS A 90 10.488 -1.658 -2.903 1.00 0.00 C ATOM 1374 C LYS A 90 10.099 -2.234 -4.304 1.00 0.00 C ATOM 1375 O LYS A 90 10.298 -3.423 -4.571 1.00 0.00 O ATOM 1376 CB LYS A 90 11.840 -2.184 -2.341 1.00 0.00 C ATOM 1377 CG LYS A 90 13.072 -1.906 -3.224 1.00 0.00 C ATOM 1378 CD LYS A 90 14.407 -2.280 -2.545 1.00 0.00 C ATOM 1379 CE LYS A 90 14.900 -1.216 -1.548 1.00 0.00 C ATOM 1380 NZ LYS A 90 16.175 -1.646 -0.942 1.00 0.00 N ATOM 0 H LYS A 90 8.911 -2.831 -2.122 1.00 0.00 H new ATOM 0 HA LYS A 90 10.586 -0.584 -3.064 1.00 0.00 H new ATOM 0 HB2 LYS A 90 12.007 -1.736 -1.362 1.00 0.00 H new ATOM 0 HB3 LYS A 90 11.758 -3.260 -2.189 1.00 0.00 H new ATOM 0 HG2 LYS A 90 12.977 -2.465 -4.155 1.00 0.00 H new ATOM 0 HG3 LYS A 90 13.090 -0.849 -3.488 1.00 0.00 H new ATOM 0 HD2 LYS A 90 14.288 -3.230 -2.023 1.00 0.00 H new ATOM 0 HD3 LYS A 90 15.167 -2.430 -3.311 1.00 0.00 H new ATOM 0 HE2 LYS A 90 15.033 -0.262 -2.058 1.00 0.00 H new ATOM 0 HE3 LYS A 90 14.152 -1.060 -0.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.501 -0.922 -0.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 16.035 -2.546 -0.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 16.889 -1.773 -1.688 1.00 0.00 H new ATOM 1393 N LEU A 91 9.569 -1.396 -5.215 1.00 0.00 N ATOM 1394 CA LEU A 91 9.221 -1.822 -6.606 1.00 0.00 C ATOM 1395 C LEU A 91 10.488 -1.922 -7.518 1.00 0.00 C ATOM 1396 O LEU A 91 11.126 -0.909 -7.817 1.00 0.00 O ATOM 1397 CB LEU A 91 8.180 -0.832 -7.212 1.00 0.00 C ATOM 1398 CG LEU A 91 6.692 -1.029 -6.823 1.00 0.00 C ATOM 1399 CD1 LEU A 91 5.873 0.217 -7.202 1.00 0.00 C ATOM 1400 CD2 LEU A 91 6.067 -2.247 -7.528 1.00 0.00 C ATOM 0 H LEU A 91 9.368 -0.415 -5.023 1.00 0.00 H new ATOM 0 HA LEU A 91 8.784 -2.819 -6.557 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.471 0.179 -6.926 1.00 0.00 H new ATOM 0 HB3 LEU A 91 8.254 -0.890 -8.298 1.00 0.00 H new ATOM 0 HG LEU A 91 6.668 -1.194 -5.746 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.830 0.065 -6.924 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.267 1.086 -6.674 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.941 0.384 -8.277 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.024 -2.347 -7.226 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.121 -2.109 -8.608 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.613 -3.148 -7.250 1.00 0.00 H new ATOM 1412 N VAL A 92 10.832 -3.139 -7.973 1.00 0.00 N ATOM 1413 CA VAL A 92 12.029 -3.380 -8.839 1.00 0.00 C ATOM 1414 C VAL A 92 11.513 -3.725 -10.274 1.00 0.00 C ATOM 1415 O VAL A 92 11.070 -4.849 -10.531 1.00 0.00 O ATOM 1416 CB VAL A 92 12.971 -4.469 -8.213 1.00 0.00 C ATOM 1417 CG1 VAL A 92 14.254 -4.689 -9.050 1.00 0.00 C ATOM 1418 CG2 VAL A 92 13.434 -4.160 -6.766 1.00 0.00 C ATOM 0 H VAL A 92 10.302 -3.985 -7.761 1.00 0.00 H new ATOM 0 HA VAL A 92 12.655 -2.490 -8.909 1.00 0.00 H new ATOM 0 HB VAL A 92 12.344 -5.361 -8.206 1.00 0.00 H new ATOM 0 HG11 VAL A 92 14.872 -5.451 -8.575 1.00 0.00 H new ATOM 0 HG12 VAL A 92 13.982 -5.016 -10.054 1.00 0.00 H new ATOM 0 HG13 VAL A 92 14.813 -3.755 -9.111 1.00 0.00 H new ATOM 0 HG21 VAL A 92 14.080 -4.963 -6.412 1.00 0.00 H new ATOM 0 HG22 VAL A 92 13.984 -3.219 -6.753 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.564 -4.081 -6.115 1.00 0.00 H new ATOM 1428 N HIS A 93 11.575 -2.750 -11.204 1.00 0.00 N ATOM 1429 CA HIS A 93 11.153 -2.949 -12.622 1.00 0.00 C ATOM 1430 C HIS A 93 12.337 -3.495 -13.475 1.00 0.00 C ATOM 1431 O HIS A 93 13.294 -2.767 -13.748 1.00 0.00 O ATOM 1432 CB HIS A 93 10.607 -1.587 -13.141 1.00 0.00 C ATOM 1433 CG HIS A 93 9.954 -1.539 -14.529 1.00 0.00 C ATOM 1434 ND1 HIS A 93 10.488 -2.081 -15.692 1.00 0.00 N ATOM 1435 CD2 HIS A 93 8.770 -0.844 -14.821 1.00 0.00 C ATOM 1436 CE1 HIS A 93 9.535 -1.682 -16.589 1.00 0.00 C ATOM 1437 NE2 HIS A 93 8.472 -0.944 -16.165 1.00 0.00 N ATOM 0 H HIS A 93 11.914 -1.809 -11.005 1.00 0.00 H new ATOM 0 HA HIS A 93 10.365 -3.698 -12.701 1.00 0.00 H new ATOM 0 HB2 HIS A 93 9.875 -1.226 -12.418 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.434 -0.876 -13.139 1.00 0.00 H new ATOM 0 HD1 HIS A 93 11.342 -2.620 -15.835 1.00 0.00 H new ATOM 0 HD2 HIS A 93 8.176 -0.307 -14.096 1.00 0.00 H new ATOM 0 HE1 HIS A 93 9.626 -1.952 -17.631 1.00 0.00 H new ATOM 1445 N ILE A 94 12.254 -4.762 -13.902 1.00 0.00 N ATOM 1446 CA ILE A 94 13.331 -5.441 -14.679 1.00 0.00 C ATOM 1447 C ILE A 94 12.909 -5.467 -16.185 1.00 0.00 C ATOM 1448 O ILE A 94 12.013 -6.235 -16.548 1.00 0.00 O ATOM 1449 CB ILE A 94 13.590 -6.872 -14.076 1.00 0.00 C ATOM 1450 CG1 ILE A 94 14.111 -6.848 -12.606 1.00 0.00 C ATOM 1451 CG2 ILE A 94 14.567 -7.699 -14.951 1.00 0.00 C ATOM 1452 CD1 ILE A 94 13.967 -8.173 -11.835 1.00 0.00 C ATOM 0 H ILE A 94 11.444 -5.356 -13.725 1.00 0.00 H new ATOM 0 HA ILE A 94 14.277 -4.903 -14.612 1.00 0.00 H new ATOM 0 HB ILE A 94 12.611 -7.351 -14.070 1.00 0.00 H new ATOM 0 HG12 ILE A 94 15.164 -6.565 -12.616 1.00 0.00 H new ATOM 0 HG13 ILE A 94 13.577 -6.070 -12.061 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.719 -8.680 -14.500 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.147 -7.820 -15.950 1.00 0.00 H new ATOM 0 HG23 ILE A 94 15.523 -7.179 -15.020 1.00 0.00 H new ATOM 0 HD11 ILE A 94 14.358 -8.051 -10.825 1.00 0.00 H new ATOM 0 HD12 ILE A 94 12.915 -8.453 -11.785 1.00 0.00 H new ATOM 0 HD13 ILE A 94 14.526 -8.955 -12.348 1.00 0.00 H new ATOM 1464 N GLN A 95 13.587 -4.700 -17.059 1.00 0.00 N ATOM 1465 CA GLN A 95 13.372 -4.767 -18.535 1.00 0.00 C ATOM 1466 C GLN A 95 14.408 -5.710 -19.222 1.00 0.00 C ATOM 1467 O GLN A 95 15.617 -5.490 -19.111 1.00 0.00 O ATOM 1468 CB GLN A 95 13.478 -3.348 -19.154 1.00 0.00 C ATOM 1469 CG GLN A 95 12.310 -2.389 -18.827 1.00 0.00 C ATOM 1470 CD GLN A 95 12.171 -1.177 -19.751 1.00 0.00 C ATOM 1471 OE1 GLN A 95 11.257 -1.070 -20.559 1.00 0.00 O ATOM 1472 NE2 GLN A 95 13.043 -0.205 -19.654 1.00 0.00 N ATOM 0 H GLN A 95 14.294 -4.021 -16.777 1.00 0.00 H new ATOM 0 HA GLN A 95 12.374 -5.171 -18.705 1.00 0.00 H new ATOM 0 HB2 GLN A 95 14.407 -2.891 -18.813 1.00 0.00 H new ATOM 0 HB3 GLN A 95 13.551 -3.448 -20.237 1.00 0.00 H new ATOM 0 HG2 GLN A 95 11.379 -2.955 -18.858 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.432 -2.032 -17.805 1.00 0.00 H new ATOM 0 HE21 GLN A 95 13.812 -0.274 -18.987 1.00 0.00 H new ATOM 0 HE22 GLN A 95 12.953 0.621 -20.245 1.00 0.00 H new ATOM 1481 N LYS A 96 13.924 -6.712 -19.973 1.00 0.00 N ATOM 1482 CA LYS A 96 14.778 -7.693 -20.706 1.00 0.00 C ATOM 1483 C LYS A 96 14.652 -7.476 -22.249 1.00 0.00 C ATOM 1484 O LYS A 96 13.545 -7.520 -22.799 1.00 0.00 O ATOM 1485 CB LYS A 96 14.289 -9.120 -20.324 1.00 0.00 C ATOM 1486 CG LYS A 96 14.592 -9.574 -18.876 1.00 0.00 C ATOM 1487 CD LYS A 96 13.789 -10.832 -18.495 1.00 0.00 C ATOM 1488 CE LYS A 96 13.909 -11.188 -17.007 1.00 0.00 C ATOM 1489 NZ LYS A 96 13.077 -12.374 -16.723 1.00 0.00 N ATOM 0 H LYS A 96 12.925 -6.875 -20.097 1.00 0.00 H new ATOM 0 HA LYS A 96 15.825 -7.562 -20.435 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.211 -9.168 -20.481 1.00 0.00 H new ATOM 0 HB3 LYS A 96 14.743 -9.834 -21.011 1.00 0.00 H new ATOM 0 HG2 LYS A 96 15.658 -9.778 -18.774 1.00 0.00 H new ATOM 0 HG3 LYS A 96 14.354 -8.766 -18.184 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.739 -10.676 -18.743 1.00 0.00 H new ATOM 0 HD3 LYS A 96 14.136 -11.674 -19.094 1.00 0.00 H new ATOM 0 HE2 LYS A 96 14.949 -11.389 -16.752 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.587 -10.347 -16.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.976 -12.489 -15.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.137 -12.249 -17.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.530 -13.220 -17.123 1.00 0.00 H new ATOM 1502 N TRP A 97 15.770 -7.253 -22.966 1.00 0.00 N ATOM 1503 CA TRP A 97 15.752 -7.058 -24.446 1.00 0.00 C ATOM 1504 C TRP A 97 17.126 -7.457 -25.069 1.00 0.00 C ATOM 1505 O TRP A 97 18.167 -6.936 -24.660 1.00 0.00 O ATOM 1506 CB TRP A 97 15.291 -5.615 -24.840 1.00 0.00 C ATOM 1507 CG TRP A 97 16.305 -4.463 -24.702 1.00 0.00 C ATOM 1508 CD1 TRP A 97 17.044 -3.915 -25.773 1.00 0.00 C ATOM 1509 CD2 TRP A 97 16.803 -3.855 -23.560 1.00 0.00 C ATOM 1510 NE1 TRP A 97 17.971 -2.951 -25.331 1.00 0.00 N ATOM 1511 CE2 TRP A 97 17.832 -2.962 -23.954 1.00 0.00 C ATOM 1512 CE3 TRP A 97 16.531 -4.068 -22.187 1.00 0.00 C ATOM 1513 CZ2 TRP A 97 18.612 -2.302 -22.977 1.00 0.00 C ATOM 1514 CZ3 TRP A 97 17.307 -3.402 -21.241 1.00 0.00 C ATOM 1515 CH2 TRP A 97 18.336 -2.534 -21.628 1.00 0.00 C ATOM 0 H TRP A 97 16.701 -7.202 -22.553 1.00 0.00 H new ATOM 0 HA TRP A 97 15.004 -7.728 -24.872 1.00 0.00 H new ATOM 0 HB2 TRP A 97 14.959 -5.643 -25.878 1.00 0.00 H new ATOM 0 HB3 TRP A 97 14.420 -5.366 -24.233 1.00 0.00 H new ATOM 0 HD1 TRP A 97 16.914 -4.201 -26.806 1.00 0.00 H new ATOM 0 HE1 TRP A 97 18.599 -2.378 -25.895 1.00 0.00 H new ATOM 0 HE3 TRP A 97 15.738 -4.733 -21.879 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 19.406 -1.631 -23.269 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 17.112 -3.558 -20.190 1.00 0.00 H new ATOM 0 HH2 TRP A 97 18.925 -2.037 -20.872 1.00 0.00 H new ATOM 1526 N ASP A 98 17.150 -8.341 -26.088 1.00 0.00 N ATOM 1527 CA ASP A 98 18.388 -8.625 -26.902 1.00 0.00 C ATOM 1528 C ASP A 98 19.660 -9.150 -26.125 1.00 0.00 C ATOM 1529 O ASP A 98 20.795 -8.847 -26.505 1.00 0.00 O ATOM 1530 CB ASP A 98 18.714 -7.390 -27.806 1.00 0.00 C ATOM 1531 CG ASP A 98 17.656 -7.018 -28.844 1.00 0.00 C ATOM 1532 OD1 ASP A 98 16.859 -6.095 -28.708 1.00 0.00 O ATOM 1533 OD2 ASP A 98 17.691 -7.835 -29.932 1.00 0.00 O ATOM 0 H ASP A 98 16.334 -8.879 -26.380 1.00 0.00 H new ATOM 0 HA ASP A 98 18.129 -9.491 -27.511 1.00 0.00 H new ATOM 0 HB2 ASP A 98 18.880 -6.527 -27.161 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.652 -7.584 -28.326 1.00 0.00 H new ATOM 1539 N GLY A 99 19.488 -9.914 -25.027 1.00 0.00 N ATOM 1540 CA GLY A 99 20.593 -10.151 -24.048 1.00 0.00 C ATOM 1541 C GLY A 99 20.881 -9.076 -22.960 1.00 0.00 C ATOM 1542 O GLY A 99 21.524 -9.403 -21.962 1.00 0.00 O ATOM 0 H GLY A 99 18.610 -10.376 -24.789 1.00 0.00 H new ATOM 0 HA2 GLY A 99 20.383 -11.090 -23.535 1.00 0.00 H new ATOM 0 HA3 GLY A 99 21.511 -10.297 -24.617 1.00 0.00 H new ATOM 1546 N LYS A 100 20.449 -7.816 -23.139 1.00 0.00 N ATOM 1547 CA LYS A 100 20.679 -6.712 -22.170 1.00 0.00 C ATOM 1548 C LYS A 100 19.510 -6.596 -21.140 1.00 0.00 C ATOM 1549 O LYS A 100 18.330 -6.790 -21.462 1.00 0.00 O ATOM 1550 CB LYS A 100 20.861 -5.380 -22.952 1.00 0.00 C ATOM 1551 CG LYS A 100 22.141 -5.284 -23.823 1.00 0.00 C ATOM 1552 CD LYS A 100 22.414 -3.876 -24.396 1.00 0.00 C ATOM 1553 CE LYS A 100 21.547 -3.532 -25.615 1.00 0.00 C ATOM 1554 NZ LYS A 100 21.745 -2.124 -26.011 1.00 0.00 N ATOM 0 H LYS A 100 19.925 -7.525 -23.965 1.00 0.00 H new ATOM 0 HA LYS A 100 21.583 -6.928 -21.600 1.00 0.00 H new ATOM 0 HB2 LYS A 100 19.993 -5.236 -23.596 1.00 0.00 H new ATOM 0 HB3 LYS A 100 20.867 -4.557 -22.237 1.00 0.00 H new ATOM 0 HG2 LYS A 100 22.998 -5.593 -23.224 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.058 -5.990 -24.649 1.00 0.00 H new ATOM 0 HD2 LYS A 100 22.240 -3.135 -23.616 1.00 0.00 H new ATOM 0 HD3 LYS A 100 23.465 -3.804 -24.676 1.00 0.00 H new ATOM 0 HE2 LYS A 100 21.802 -4.189 -26.447 1.00 0.00 H new ATOM 0 HE3 LYS A 100 20.497 -3.706 -25.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 20.957 -1.820 -26.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 21.779 -1.526 -25.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 22.639 -2.033 -26.535 1.00 0.00 H new ATOM 1567 N GLU A 101 19.860 -6.261 -19.886 1.00 0.00 N ATOM 1568 CA GLU A 101 18.881 -6.141 -18.772 1.00 0.00 C ATOM 1569 C GLU A 101 19.114 -4.827 -17.960 1.00 0.00 C ATOM 1570 O GLU A 101 20.247 -4.502 -17.588 1.00 0.00 O ATOM 1571 CB GLU A 101 18.963 -7.423 -17.898 1.00 0.00 C ATOM 1572 CG GLU A 101 17.794 -7.580 -16.895 1.00 0.00 C ATOM 1573 CD GLU A 101 17.874 -8.843 -16.043 1.00 0.00 C ATOM 1574 OE1 GLU A 101 18.256 -8.855 -14.877 1.00 0.00 O ATOM 1575 OE2 GLU A 101 17.459 -9.952 -16.715 1.00 0.00 O ATOM 0 H GLU A 101 20.822 -6.065 -19.609 1.00 0.00 H new ATOM 0 HA GLU A 101 17.867 -6.065 -19.165 1.00 0.00 H new ATOM 0 HB2 GLU A 101 18.986 -8.295 -18.552 1.00 0.00 H new ATOM 0 HB3 GLU A 101 19.903 -7.414 -17.346 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.774 -6.711 -16.237 1.00 0.00 H new ATOM 0 HG3 GLU A 101 16.854 -7.585 -17.446 1.00 0.00 H new ATOM 1583 N THR A 102 18.027 -4.092 -17.658 1.00 0.00 N ATOM 1584 CA THR A 102 18.075 -2.893 -16.767 1.00 0.00 C ATOM 1585 C THR A 102 17.036 -3.014 -15.606 1.00 0.00 C ATOM 1586 O THR A 102 15.881 -3.387 -15.839 1.00 0.00 O ATOM 1587 CB THR A 102 17.961 -1.572 -17.587 1.00 0.00 C ATOM 1588 OG1 THR A 102 18.375 -0.500 -16.758 1.00 0.00 O ATOM 1589 CG2 THR A 102 16.594 -1.186 -18.172 1.00 0.00 C ATOM 0 H THR A 102 17.095 -4.301 -18.015 1.00 0.00 H new ATOM 0 HA THR A 102 19.052 -2.852 -16.286 1.00 0.00 H new ATOM 0 HB THR A 102 18.587 -1.764 -18.458 1.00 0.00 H new ATOM 0 HG1 THR A 102 18.810 -0.856 -15.955 1.00 0.00 H new ATOM 0 HG21 THR A 102 16.683 -0.244 -18.713 1.00 0.00 H new ATOM 0 HG22 THR A 102 16.257 -1.966 -18.855 1.00 0.00 H new ATOM 0 HG23 THR A 102 15.871 -1.074 -17.364 1.00 0.00 H new ATOM 1597 N ASN A 103 17.447 -2.697 -14.363 1.00 0.00 N ATOM 1598 CA ASN A 103 16.568 -2.795 -13.160 1.00 0.00 C ATOM 1599 C ASN A 103 16.311 -1.396 -12.506 1.00 0.00 C ATOM 1600 O ASN A 103 17.252 -0.633 -12.259 1.00 0.00 O ATOM 1601 CB ASN A 103 17.096 -3.886 -12.188 1.00 0.00 C ATOM 1602 CG ASN A 103 18.439 -3.644 -11.486 1.00 0.00 C ATOM 1603 OD1 ASN A 103 18.515 -3.033 -10.427 1.00 0.00 O ATOM 1604 ND2 ASN A 103 19.527 -4.137 -12.025 1.00 0.00 N ATOM 0 H ASN A 103 18.389 -2.367 -14.155 1.00 0.00 H new ATOM 0 HA ASN A 103 15.577 -3.128 -13.468 1.00 0.00 H new ATOM 0 HB2 ASN A 103 16.340 -4.039 -11.417 1.00 0.00 H new ATOM 0 HB3 ASN A 103 17.176 -4.819 -12.746 1.00 0.00 H new ATOM 0 HD21 ASN A 103 20.427 -4.011 -11.563 1.00 0.00 H new ATOM 0 HD22 ASN A 103 19.473 -4.647 -12.907 1.00 0.00 H new ATOM 1611 N PHE A 104 15.036 -1.043 -12.241 1.00 0.00 N ATOM 1612 CA PHE A 104 14.667 0.298 -11.697 1.00 0.00 C ATOM 1613 C PHE A 104 14.158 0.119 -10.234 1.00 0.00 C ATOM 1614 O PHE A 104 13.019 -0.308 -10.017 1.00 0.00 O ATOM 1615 CB PHE A 104 13.617 1.047 -12.575 1.00 0.00 C ATOM 1616 CG PHE A 104 13.748 1.146 -14.114 1.00 0.00 C ATOM 1617 CD1 PHE A 104 14.977 1.072 -14.783 1.00 0.00 C ATOM 1618 CD2 PHE A 104 12.591 1.421 -14.855 1.00 0.00 C ATOM 1619 CE1 PHE A 104 15.049 1.302 -16.152 1.00 0.00 C ATOM 1620 CE2 PHE A 104 12.663 1.638 -16.229 1.00 0.00 C ATOM 1621 CZ PHE A 104 13.897 1.594 -16.873 1.00 0.00 C ATOM 0 H PHE A 104 14.239 -1.662 -12.392 1.00 0.00 H new ATOM 0 HA PHE A 104 15.557 0.928 -11.710 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.651 0.584 -12.372 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.566 2.069 -12.199 1.00 0.00 H new ATOM 0 HD1 PHE A 104 15.875 0.835 -14.231 1.00 0.00 H new ATOM 0 HD2 PHE A 104 11.634 1.465 -14.356 1.00 0.00 H new ATOM 0 HE1 PHE A 104 16.003 1.254 -16.657 1.00 0.00 H new ATOM 0 HE2 PHE A 104 11.765 1.840 -16.793 1.00 0.00 H new ATOM 0 HZ PHE A 104 13.959 1.787 -17.934 1.00 0.00 H new ATOM 1631 N VAL A 105 15.005 0.434 -9.242 1.00 0.00 N ATOM 1632 CA VAL A 105 14.730 0.149 -7.802 1.00 0.00 C ATOM 1633 C VAL A 105 14.024 1.394 -7.164 1.00 0.00 C ATOM 1634 O VAL A 105 14.628 2.460 -7.005 1.00 0.00 O ATOM 1635 CB VAL A 105 16.058 -0.270 -7.074 1.00 0.00 C ATOM 1636 CG1 VAL A 105 15.854 -0.553 -5.568 1.00 0.00 C ATOM 1637 CG2 VAL A 105 16.752 -1.521 -7.670 1.00 0.00 C ATOM 0 H VAL A 105 15.902 0.893 -9.402 1.00 0.00 H new ATOM 0 HA VAL A 105 14.050 -0.696 -7.692 1.00 0.00 H new ATOM 0 HB VAL A 105 16.695 0.601 -7.226 1.00 0.00 H new ATOM 0 HG11 VAL A 105 16.806 -0.838 -5.119 1.00 0.00 H new ATOM 0 HG12 VAL A 105 15.475 0.344 -5.077 1.00 0.00 H new ATOM 0 HG13 VAL A 105 15.137 -1.365 -5.444 1.00 0.00 H new ATOM 0 HG21 VAL A 105 17.659 -1.737 -7.106 1.00 0.00 H new ATOM 0 HG22 VAL A 105 16.076 -2.374 -7.611 1.00 0.00 H new ATOM 0 HG23 VAL A 105 17.009 -1.333 -8.712 1.00 0.00 H new ATOM 1647 N ARG A 106 12.737 1.246 -6.812 1.00 0.00 N ATOM 1648 CA ARG A 106 11.871 2.376 -6.376 1.00 0.00 C ATOM 1649 C ARG A 106 11.533 2.273 -4.861 1.00 0.00 C ATOM 1650 O ARG A 106 10.883 1.310 -4.442 1.00 0.00 O ATOM 1651 CB ARG A 106 10.580 2.342 -7.253 1.00 0.00 C ATOM 1652 CG ARG A 106 10.120 3.716 -7.789 1.00 0.00 C ATOM 1653 CD ARG A 106 9.031 3.662 -8.882 1.00 0.00 C ATOM 1654 NE ARG A 106 9.527 2.963 -10.103 1.00 0.00 N ATOM 1655 CZ ARG A 106 8.969 3.007 -11.309 1.00 0.00 C ATOM 1656 NH1 ARG A 106 7.955 3.775 -11.611 1.00 0.00 N ATOM 1657 NH2 ARG A 106 9.467 2.250 -12.243 1.00 0.00 N ATOM 0 H ARG A 106 12.259 0.345 -6.818 1.00 0.00 H new ATOM 0 HA ARG A 106 12.390 3.325 -6.510 1.00 0.00 H new ATOM 0 HB2 ARG A 106 10.751 1.677 -8.100 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.771 1.908 -6.665 1.00 0.00 H new ATOM 0 HG2 ARG A 106 9.745 4.307 -6.954 1.00 0.00 H new ATOM 0 HG3 ARG A 106 10.987 4.242 -8.188 1.00 0.00 H new ATOM 0 HD2 ARG A 106 8.151 3.147 -8.497 1.00 0.00 H new ATOM 0 HD3 ARG A 106 8.720 4.674 -9.140 1.00 0.00 H new ATOM 0 HE ARG A 106 10.372 2.400 -10.004 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.548 4.385 -10.902 1.00 0.00 H new ATOM 0 HH12 ARG A 106 7.570 3.764 -12.556 1.00 0.00 H new ATOM 0 HH21 ARG A 106 10.263 1.646 -12.039 1.00 0.00 H new ATOM 0 HH22 ARG A 106 9.061 2.261 -13.179 1.00 0.00 H new ATOM 1671 N GLU A 107 11.920 3.275 -4.054 1.00 0.00 N ATOM 1672 CA GLU A 107 11.584 3.324 -2.600 1.00 0.00 C ATOM 1673 C GLU A 107 10.959 4.697 -2.188 1.00 0.00 C ATOM 1674 O GLU A 107 11.363 5.757 -2.680 1.00 0.00 O ATOM 1675 CB GLU A 107 12.826 2.933 -1.747 1.00 0.00 C ATOM 1676 CG GLU A 107 14.038 3.903 -1.774 1.00 0.00 C ATOM 1677 CD GLU A 107 15.173 3.500 -0.840 1.00 0.00 C ATOM 1678 OE1 GLU A 107 15.353 3.995 0.268 1.00 0.00 O ATOM 1679 OE2 GLU A 107 15.969 2.533 -1.374 1.00 0.00 O ATOM 0 H GLU A 107 12.470 4.072 -4.376 1.00 0.00 H new ATOM 0 HA GLU A 107 10.809 2.585 -2.398 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.504 2.823 -0.711 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.170 1.953 -2.079 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.422 3.961 -2.793 1.00 0.00 H new ATOM 0 HG3 GLU A 107 13.697 4.903 -1.505 1.00 0.00 H new ATOM 1687 N ILE A 108 10.002 4.681 -1.239 1.00 0.00 N ATOM 1688 CA ILE A 108 9.448 5.932 -0.631 1.00 0.00 C ATOM 1689 C ILE A 108 10.343 6.318 0.596 1.00 0.00 C ATOM 1690 O ILE A 108 10.285 5.680 1.652 1.00 0.00 O ATOM 1691 CB ILE A 108 7.918 5.799 -0.289 1.00 0.00 C ATOM 1692 CG1 ILE A 108 6.996 5.351 -1.465 1.00 0.00 C ATOM 1693 CG2 ILE A 108 7.329 7.096 0.329 1.00 0.00 C ATOM 1694 CD1 ILE A 108 7.108 6.163 -2.769 1.00 0.00 C ATOM 0 H ILE A 108 9.590 3.824 -0.870 1.00 0.00 H new ATOM 0 HA ILE A 108 9.486 6.749 -1.352 1.00 0.00 H new ATOM 0 HB ILE A 108 7.915 4.991 0.443 1.00 0.00 H new ATOM 0 HG12 ILE A 108 7.214 4.308 -1.692 1.00 0.00 H new ATOM 0 HG13 ILE A 108 5.962 5.393 -1.124 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.271 6.948 0.545 1.00 0.00 H new ATOM 0 HG22 ILE A 108 7.858 7.332 1.252 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.444 7.919 -0.376 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.420 5.757 -3.511 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.856 7.205 -2.572 1.00 0.00 H new ATOM 0 HD13 ILE A 108 8.128 6.102 -3.149 1.00 0.00 H new ATOM 1706 N LYS A 109 11.172 7.364 0.440 1.00 0.00 N ATOM 1707 CA LYS A 109 12.095 7.844 1.500 1.00 0.00 C ATOM 1708 C LYS A 109 11.508 9.138 2.145 1.00 0.00 C ATOM 1709 O LYS A 109 11.578 10.228 1.568 1.00 0.00 O ATOM 1710 CB LYS A 109 13.490 8.040 0.845 1.00 0.00 C ATOM 1711 CG LYS A 109 14.655 8.324 1.821 1.00 0.00 C ATOM 1712 CD LYS A 109 15.095 7.096 2.646 1.00 0.00 C ATOM 1713 CE LYS A 109 16.205 7.447 3.646 1.00 0.00 C ATOM 1714 NZ LYS A 109 16.635 6.237 4.370 1.00 0.00 N ATOM 0 H LYS A 109 11.226 7.906 -0.423 1.00 0.00 H new ATOM 0 HA LYS A 109 12.208 7.130 2.316 1.00 0.00 H new ATOM 0 HB2 LYS A 109 13.731 7.145 0.272 1.00 0.00 H new ATOM 0 HB3 LYS A 109 13.425 8.865 0.136 1.00 0.00 H new ATOM 0 HG2 LYS A 109 15.509 8.693 1.253 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.358 9.120 2.504 1.00 0.00 H new ATOM 0 HD2 LYS A 109 14.236 6.693 3.183 1.00 0.00 H new ATOM 0 HD3 LYS A 109 15.446 6.314 1.973 1.00 0.00 H new ATOM 0 HE2 LYS A 109 17.053 7.887 3.121 1.00 0.00 H new ATOM 0 HE3 LYS A 109 15.845 8.195 4.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 17.387 6.485 5.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 15.826 5.835 4.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 16.996 5.536 3.691 1.00 0.00 H new ATOM 1727 N ASP A 110 10.888 8.998 3.336 1.00 0.00 N ATOM 1728 CA ASP A 110 10.191 10.113 4.058 1.00 0.00 C ATOM 1729 C ASP A 110 9.151 10.936 3.204 1.00 0.00 C ATOM 1730 O ASP A 110 9.254 12.165 3.112 1.00 0.00 O ATOM 1731 CB ASP A 110 11.273 10.965 4.791 1.00 0.00 C ATOM 1732 CG ASP A 110 10.775 11.884 5.908 1.00 0.00 C ATOM 1733 OD1 ASP A 110 11.032 11.700 7.093 1.00 0.00 O ATOM 1734 OD2 ASP A 110 10.032 12.928 5.432 1.00 0.00 O ATOM 0 H ASP A 110 10.850 8.110 3.836 1.00 0.00 H new ATOM 0 HA ASP A 110 9.522 9.677 4.800 1.00 0.00 H new ATOM 0 HB2 ASP A 110 12.014 10.286 5.212 1.00 0.00 H new ATOM 0 HB3 ASP A 110 11.786 11.577 4.049 1.00 0.00 H new ATOM 1740 N GLY A 111 8.175 10.260 2.569 1.00 0.00 N ATOM 1741 CA GLY A 111 7.266 10.914 1.581 1.00 0.00 C ATOM 1742 C GLY A 111 7.698 10.962 0.090 1.00 0.00 C ATOM 1743 O GLY A 111 6.828 10.908 -0.781 1.00 0.00 O ATOM 0 H GLY A 111 7.988 9.268 2.714 1.00 0.00 H new ATOM 0 HA2 GLY A 111 6.303 10.405 1.630 1.00 0.00 H new ATOM 0 HA3 GLY A 111 7.102 11.940 1.911 1.00 0.00 H new ATOM 1747 N LYS A 112 8.998 11.111 -0.215 1.00 0.00 N ATOM 1748 CA LYS A 112 9.497 11.321 -1.605 1.00 0.00 C ATOM 1749 C LYS A 112 9.953 9.984 -2.273 1.00 0.00 C ATOM 1750 O LYS A 112 10.503 9.093 -1.621 1.00 0.00 O ATOM 1751 CB LYS A 112 10.665 12.348 -1.594 1.00 0.00 C ATOM 1752 CG LYS A 112 10.332 13.756 -1.044 1.00 0.00 C ATOM 1753 CD LYS A 112 11.497 14.750 -1.203 1.00 0.00 C ATOM 1754 CE LYS A 112 11.191 16.103 -0.540 1.00 0.00 C ATOM 1755 NZ LYS A 112 12.281 17.058 -0.813 1.00 0.00 N ATOM 0 H LYS A 112 9.739 11.091 0.486 1.00 0.00 H new ATOM 0 HA LYS A 112 8.672 11.712 -2.201 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.481 11.933 -1.002 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.035 12.457 -2.614 1.00 0.00 H new ATOM 0 HG2 LYS A 112 9.455 14.145 -1.562 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.070 13.676 0.011 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.399 14.326 -0.762 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.702 14.903 -2.263 1.00 0.00 H new ATOM 0 HE2 LYS A 112 10.248 16.497 -0.918 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.073 15.972 0.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.337 17.751 -0.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.183 16.545 -0.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.093 17.553 -1.708 1.00 0.00 H new ATOM 1768 N MET A 113 9.766 9.854 -3.595 1.00 0.00 N ATOM 1769 CA MET A 113 10.207 8.652 -4.353 1.00 0.00 C ATOM 1770 C MET A 113 11.701 8.772 -4.806 1.00 0.00 C ATOM 1771 O MET A 113 12.065 9.604 -5.645 1.00 0.00 O ATOM 1772 CB MET A 113 9.175 8.411 -5.485 1.00 0.00 C ATOM 1773 CG MET A 113 9.601 7.422 -6.590 1.00 0.00 C ATOM 1774 SD MET A 113 8.188 6.984 -7.615 1.00 0.00 S ATOM 1775 CE MET A 113 7.362 5.831 -6.506 1.00 0.00 C ATOM 0 H MET A 113 9.312 10.563 -4.171 1.00 0.00 H new ATOM 0 HA MET A 113 10.217 7.759 -3.728 1.00 0.00 H new ATOM 0 HB2 MET A 113 8.251 8.047 -5.036 1.00 0.00 H new ATOM 0 HB3 MET A 113 8.947 9.369 -5.951 1.00 0.00 H new ATOM 0 HG2 MET A 113 10.381 7.869 -7.206 1.00 0.00 H new ATOM 0 HG3 MET A 113 10.025 6.524 -6.140 1.00 0.00 H new ATOM 0 HE1 MET A 113 7.290 4.854 -6.984 1.00 0.00 H new ATOM 0 HE2 MET A 113 7.934 5.741 -5.582 1.00 0.00 H new ATOM 0 HE3 MET A 113 6.361 6.198 -6.279 1.00 0.00 H new ATOM 1785 N VAL A 114 12.545 7.872 -4.279 1.00 0.00 N ATOM 1786 CA VAL A 114 13.945 7.678 -4.757 1.00 0.00 C ATOM 1787 C VAL A 114 13.904 6.507 -5.797 1.00 0.00 C ATOM 1788 O VAL A 114 13.695 5.342 -5.435 1.00 0.00 O ATOM 1789 CB VAL A 114 14.900 7.433 -3.537 1.00 0.00 C ATOM 1790 CG1 VAL A 114 16.352 7.086 -3.937 1.00 0.00 C ATOM 1791 CG2 VAL A 114 14.986 8.641 -2.572 1.00 0.00 C ATOM 0 H VAL A 114 12.288 7.253 -3.510 1.00 0.00 H new ATOM 0 HA VAL A 114 14.351 8.560 -5.252 1.00 0.00 H new ATOM 0 HB VAL A 114 14.437 6.580 -3.041 1.00 0.00 H new ATOM 0 HG11 VAL A 114 16.950 6.931 -3.039 1.00 0.00 H new ATOM 0 HG12 VAL A 114 16.357 6.176 -4.537 1.00 0.00 H new ATOM 0 HG13 VAL A 114 16.775 7.906 -4.518 1.00 0.00 H new ATOM 0 HG21 VAL A 114 15.663 8.404 -1.751 1.00 0.00 H new ATOM 0 HG22 VAL A 114 15.360 9.511 -3.111 1.00 0.00 H new ATOM 0 HG23 VAL A 114 13.995 8.860 -2.173 1.00 0.00 H new ATOM 1801 N MET A 115 14.074 6.838 -7.089 1.00 0.00 N ATOM 1802 CA MET A 115 13.992 5.852 -8.201 1.00 0.00 C ATOM 1803 C MET A 115 15.412 5.631 -8.811 1.00 0.00 C ATOM 1804 O MET A 115 15.920 6.455 -9.583 1.00 0.00 O ATOM 1805 CB MET A 115 12.923 6.392 -9.187 1.00 0.00 C ATOM 1806 CG MET A 115 12.498 5.434 -10.313 1.00 0.00 C ATOM 1807 SD MET A 115 11.007 6.075 -11.104 1.00 0.00 S ATOM 1808 CE MET A 115 11.234 5.499 -12.795 1.00 0.00 C ATOM 0 H MET A 115 14.271 7.789 -7.399 1.00 0.00 H new ATOM 0 HA MET A 115 13.677 4.859 -7.882 1.00 0.00 H new ATOM 0 HB2 MET A 115 12.036 6.665 -8.616 1.00 0.00 H new ATOM 0 HB3 MET A 115 13.305 7.307 -9.640 1.00 0.00 H new ATOM 0 HG2 MET A 115 13.299 5.336 -11.045 1.00 0.00 H new ATOM 0 HG3 MET A 115 12.311 4.439 -9.909 1.00 0.00 H new ATOM 0 HE1 MET A 115 10.306 5.629 -13.351 1.00 0.00 H new ATOM 0 HE2 MET A 115 12.027 6.075 -13.272 1.00 0.00 H new ATOM 0 HE3 MET A 115 11.507 4.444 -12.786 1.00 0.00 H new ATOM 1818 N THR A 116 16.053 4.511 -8.439 1.00 0.00 N ATOM 1819 CA THR A 116 17.458 4.199 -8.827 1.00 0.00 C ATOM 1820 C THR A 116 17.455 3.308 -10.105 1.00 0.00 C ATOM 1821 O THR A 116 17.124 2.119 -10.053 1.00 0.00 O ATOM 1822 CB THR A 116 18.195 3.543 -7.620 1.00 0.00 C ATOM 1823 OG1 THR A 116 18.158 4.398 -6.481 1.00 0.00 O ATOM 1824 CG2 THR A 116 19.679 3.254 -7.866 1.00 0.00 C ATOM 0 H THR A 116 15.621 3.790 -7.861 1.00 0.00 H new ATOM 0 HA THR A 116 18.005 5.108 -9.076 1.00 0.00 H new ATOM 0 HB THR A 116 17.664 2.603 -7.467 1.00 0.00 H new ATOM 0 HG1 THR A 116 18.624 3.968 -5.734 1.00 0.00 H new ATOM 0 HG21 THR A 116 20.113 2.799 -6.976 1.00 0.00 H new ATOM 0 HG22 THR A 116 19.782 2.572 -8.710 1.00 0.00 H new ATOM 0 HG23 THR A 116 20.199 4.186 -8.087 1.00 0.00 H new ATOM 1832 N LEU A 117 17.824 3.888 -11.255 1.00 0.00 N ATOM 1833 CA LEU A 117 17.870 3.162 -12.548 1.00 0.00 C ATOM 1834 C LEU A 117 19.303 2.575 -12.739 1.00 0.00 C ATOM 1835 O LEU A 117 20.283 3.319 -12.868 1.00 0.00 O ATOM 1836 CB LEU A 117 17.443 4.118 -13.698 1.00 0.00 C ATOM 1837 CG LEU A 117 15.927 4.416 -13.870 1.00 0.00 C ATOM 1838 CD1 LEU A 117 15.336 5.346 -12.807 1.00 0.00 C ATOM 1839 CD2 LEU A 117 15.629 4.980 -15.270 1.00 0.00 C ATOM 0 H LEU A 117 18.099 4.868 -11.324 1.00 0.00 H new ATOM 0 HA LEU A 117 17.168 2.328 -12.559 1.00 0.00 H new ATOM 0 HB2 LEU A 117 17.956 5.068 -13.551 1.00 0.00 H new ATOM 0 HB3 LEU A 117 17.810 3.699 -14.635 1.00 0.00 H new ATOM 0 HG LEU A 117 15.439 3.450 -13.740 1.00 0.00 H new ATOM 0 HD11 LEU A 117 14.275 5.498 -13.006 1.00 0.00 H new ATOM 0 HD12 LEU A 117 15.460 4.897 -11.821 1.00 0.00 H new ATOM 0 HD13 LEU A 117 15.852 6.306 -12.836 1.00 0.00 H new ATOM 0 HD21 LEU A 117 14.561 5.179 -15.362 1.00 0.00 H new ATOM 0 HD22 LEU A 117 16.185 5.906 -15.415 1.00 0.00 H new ATOM 0 HD23 LEU A 117 15.929 4.255 -16.026 1.00 0.00 H new ATOM 1851 N THR A 118 19.411 1.237 -12.733 1.00 0.00 N ATOM 1852 CA THR A 118 20.717 0.523 -12.640 1.00 0.00 C ATOM 1853 C THR A 118 20.912 -0.390 -13.889 1.00 0.00 C ATOM 1854 O THR A 118 20.143 -1.329 -14.131 1.00 0.00 O ATOM 1855 CB THR A 118 20.769 -0.228 -11.273 1.00 0.00 C ATOM 1856 OG1 THR A 118 20.888 0.717 -10.222 1.00 0.00 O ATOM 1857 CG2 THR A 118 21.932 -1.210 -11.070 1.00 0.00 C ATOM 0 H THR A 118 18.607 0.613 -12.792 1.00 0.00 H new ATOM 0 HA THR A 118 21.560 1.214 -12.655 1.00 0.00 H new ATOM 0 HB THR A 118 19.846 -0.808 -11.270 1.00 0.00 H new ATOM 0 HG1 THR A 118 20.919 0.248 -9.362 1.00 0.00 H new ATOM 0 HG21 THR A 118 21.855 -1.666 -10.083 1.00 0.00 H new ATOM 0 HG22 THR A 118 21.889 -1.987 -11.833 1.00 0.00 H new ATOM 0 HG23 THR A 118 22.878 -0.675 -11.150 1.00 0.00 H new ATOM 1865 N PHE A 119 21.986 -0.122 -14.652 1.00 0.00 N ATOM 1866 CA PHE A 119 22.437 -1.006 -15.762 1.00 0.00 C ATOM 1867 C PHE A 119 23.747 -1.746 -15.336 1.00 0.00 C ATOM 1868 O PHE A 119 24.859 -1.355 -15.712 1.00 0.00 O ATOM 1869 CB PHE A 119 22.562 -0.140 -17.052 1.00 0.00 C ATOM 1870 CG PHE A 119 22.775 -0.955 -18.341 1.00 0.00 C ATOM 1871 CD1 PHE A 119 21.731 -1.733 -18.849 1.00 0.00 C ATOM 1872 CD2 PHE A 119 24.014 -0.966 -18.989 1.00 0.00 C ATOM 1873 CE1 PHE A 119 21.920 -2.516 -19.984 1.00 0.00 C ATOM 1874 CE2 PHE A 119 24.204 -1.750 -20.126 1.00 0.00 C ATOM 1875 CZ PHE A 119 23.155 -2.521 -20.623 1.00 0.00 C ATOM 0 H PHE A 119 22.568 0.706 -14.525 1.00 0.00 H new ATOM 0 HA PHE A 119 21.719 -1.795 -15.984 1.00 0.00 H new ATOM 0 HB2 PHE A 119 21.660 0.462 -17.161 1.00 0.00 H new ATOM 0 HB3 PHE A 119 23.395 0.553 -16.932 1.00 0.00 H new ATOM 0 HD1 PHE A 119 20.770 -1.727 -18.357 1.00 0.00 H new ATOM 0 HD2 PHE A 119 24.826 -0.365 -18.607 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.110 -3.118 -20.367 1.00 0.00 H new ATOM 0 HE2 PHE A 119 25.164 -1.760 -20.621 1.00 0.00 H new ATOM 0 HZ PHE A 119 23.302 -3.124 -21.507 1.00 0.00 H new ATOM 1885 N GLY A 120 23.602 -2.798 -14.504 1.00 0.00 N ATOM 1886 CA GLY A 120 24.754 -3.535 -13.914 1.00 0.00 C ATOM 1887 C GLY A 120 25.645 -2.711 -12.956 1.00 0.00 C ATOM 1888 O GLY A 120 25.341 -2.571 -11.771 1.00 0.00 O ATOM 0 H GLY A 120 22.693 -3.163 -14.220 1.00 0.00 H new ATOM 0 HA2 GLY A 120 24.372 -4.401 -13.373 1.00 0.00 H new ATOM 0 HA3 GLY A 120 25.375 -3.914 -14.725 1.00 0.00 H new ATOM 1892 N ASP A 121 26.729 -2.152 -13.510 1.00 0.00 N ATOM 1893 CA ASP A 121 27.595 -1.168 -12.798 1.00 0.00 C ATOM 1894 C ASP A 121 27.107 0.325 -12.832 1.00 0.00 C ATOM 1895 O ASP A 121 27.383 1.057 -11.877 1.00 0.00 O ATOM 1896 CB ASP A 121 29.024 -1.357 -13.378 1.00 0.00 C ATOM 1897 CG ASP A 121 30.136 -0.661 -12.595 1.00 0.00 C ATOM 1898 OD1 ASP A 121 30.668 -1.135 -11.598 1.00 0.00 O ATOM 1899 OD2 ASP A 121 30.470 0.546 -13.129 1.00 0.00 O ATOM 0 H ASP A 121 27.040 -2.359 -14.459 1.00 0.00 H new ATOM 0 HA ASP A 121 27.560 -1.375 -11.728 1.00 0.00 H new ATOM 0 HB2 ASP A 121 29.244 -2.424 -13.422 1.00 0.00 H new ATOM 0 HB3 ASP A 121 29.036 -0.987 -14.403 1.00 0.00 H new ATOM 1905 N VAL A 122 26.443 0.803 -13.905 1.00 0.00 N ATOM 1906 CA VAL A 122 26.116 2.254 -14.076 1.00 0.00 C ATOM 1907 C VAL A 122 24.753 2.568 -13.367 1.00 0.00 C ATOM 1908 O VAL A 122 23.679 2.133 -13.799 1.00 0.00 O ATOM 1909 CB VAL A 122 26.200 2.699 -15.578 1.00 0.00 C ATOM 1910 CG1 VAL A 122 25.868 4.197 -15.790 1.00 0.00 C ATOM 1911 CG2 VAL A 122 27.607 2.477 -16.189 1.00 0.00 C ATOM 0 H VAL A 122 26.118 0.214 -14.672 1.00 0.00 H new ATOM 0 HA VAL A 122 26.870 2.867 -13.582 1.00 0.00 H new ATOM 0 HB VAL A 122 25.458 2.072 -16.073 1.00 0.00 H new ATOM 0 HG11 VAL A 122 25.944 4.440 -16.850 1.00 0.00 H new ATOM 0 HG12 VAL A 122 24.854 4.398 -15.444 1.00 0.00 H new ATOM 0 HG13 VAL A 122 26.572 4.809 -15.226 1.00 0.00 H new ATOM 0 HG21 VAL A 122 27.607 2.802 -17.229 1.00 0.00 H new ATOM 0 HG22 VAL A 122 28.342 3.054 -15.628 1.00 0.00 H new ATOM 0 HG23 VAL A 122 27.862 1.418 -16.140 1.00 0.00 H new ATOM 1921 N VAL A 123 24.841 3.319 -12.257 1.00 0.00 N ATOM 1922 CA VAL A 123 23.710 3.550 -11.312 1.00 0.00 C ATOM 1923 C VAL A 123 23.324 5.066 -11.361 1.00 0.00 C ATOM 1924 O VAL A 123 24.128 5.936 -11.008 1.00 0.00 O ATOM 1925 CB VAL A 123 24.131 3.043 -9.884 1.00 0.00 C ATOM 1926 CG1 VAL A 123 23.109 3.374 -8.776 1.00 0.00 C ATOM 1927 CG2 VAL A 123 24.348 1.511 -9.817 1.00 0.00 C ATOM 0 H VAL A 123 25.701 3.791 -11.978 1.00 0.00 H new ATOM 0 HA VAL A 123 22.819 2.988 -11.590 1.00 0.00 H new ATOM 0 HB VAL A 123 25.065 3.578 -9.710 1.00 0.00 H new ATOM 0 HG11 VAL A 123 23.471 2.992 -7.821 1.00 0.00 H new ATOM 0 HG12 VAL A 123 22.982 4.454 -8.710 1.00 0.00 H new ATOM 0 HG13 VAL A 123 22.152 2.910 -9.013 1.00 0.00 H new ATOM 0 HG21 VAL A 123 24.636 1.228 -8.805 1.00 0.00 H new ATOM 0 HG22 VAL A 123 23.424 1.000 -10.087 1.00 0.00 H new ATOM 0 HG23 VAL A 123 25.137 1.225 -10.512 1.00 0.00 H new ATOM 1937 N ALA A 124 22.080 5.369 -11.769 1.00 0.00 N ATOM 1938 CA ALA A 124 21.575 6.762 -11.879 1.00 0.00 C ATOM 1939 C ALA A 124 20.288 6.983 -11.025 1.00 0.00 C ATOM 1940 O ALA A 124 19.298 6.265 -11.195 1.00 0.00 O ATOM 1941 CB ALA A 124 21.312 6.996 -13.378 1.00 0.00 C ATOM 0 H ALA A 124 21.393 4.663 -12.033 1.00 0.00 H new ATOM 0 HA ALA A 124 22.301 7.475 -11.489 1.00 0.00 H new ATOM 0 HB1 ALA A 124 20.937 8.008 -13.528 1.00 0.00 H new ATOM 0 HB2 ALA A 124 22.240 6.867 -13.935 1.00 0.00 H new ATOM 0 HB3 ALA A 124 20.573 6.278 -13.734 1.00 0.00 H new ATOM 1947 N VAL A 125 20.257 8.010 -10.157 1.00 0.00 N ATOM 1948 CA VAL A 125 19.141 8.223 -9.177 1.00 0.00 C ATOM 1949 C VAL A 125 18.231 9.413 -9.639 1.00 0.00 C ATOM 1950 O VAL A 125 18.661 10.570 -9.661 1.00 0.00 O ATOM 1951 CB VAL A 125 19.677 8.425 -7.714 1.00 0.00 C ATOM 1952 CG1 VAL A 125 18.531 8.508 -6.679 1.00 0.00 C ATOM 1953 CG2 VAL A 125 20.642 7.326 -7.207 1.00 0.00 C ATOM 0 H VAL A 125 20.990 8.717 -10.103 1.00 0.00 H new ATOM 0 HA VAL A 125 18.530 7.320 -9.157 1.00 0.00 H new ATOM 0 HB VAL A 125 20.226 9.364 -7.793 1.00 0.00 H new ATOM 0 HG11 VAL A 125 18.950 8.648 -5.683 1.00 0.00 H new ATOM 0 HG12 VAL A 125 17.882 9.350 -6.921 1.00 0.00 H new ATOM 0 HG13 VAL A 125 17.952 7.585 -6.703 1.00 0.00 H new ATOM 0 HG21 VAL A 125 20.954 7.558 -6.189 1.00 0.00 H new ATOM 0 HG22 VAL A 125 20.134 6.362 -7.220 1.00 0.00 H new ATOM 0 HG23 VAL A 125 21.518 7.284 -7.854 1.00 0.00 H new ATOM 1963 N ARG A 126 16.954 9.141 -9.963 1.00 0.00 N ATOM 1964 CA ARG A 126 15.932 10.197 -10.205 1.00 0.00 C ATOM 1965 C ARG A 126 15.066 10.467 -8.931 1.00 0.00 C ATOM 1966 O ARG A 126 14.446 9.564 -8.360 1.00 0.00 O ATOM 1967 CB ARG A 126 15.110 9.781 -11.454 1.00 0.00 C ATOM 1968 CG ARG A 126 15.749 10.241 -12.792 1.00 0.00 C ATOM 1969 CD ARG A 126 15.457 9.320 -13.997 1.00 0.00 C ATOM 1970 NE ARG A 126 16.677 8.938 -14.770 1.00 0.00 N ATOM 1971 CZ ARG A 126 17.662 8.158 -14.315 1.00 0.00 C ATOM 1972 NH1 ARG A 126 17.832 7.897 -13.049 1.00 0.00 N ATOM 1973 NH2 ARG A 126 18.491 7.638 -15.163 1.00 0.00 N ATOM 0 H ARG A 126 16.595 8.192 -10.066 1.00 0.00 H new ATOM 0 HA ARG A 126 16.406 11.157 -10.411 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.003 8.696 -11.465 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.107 10.200 -11.376 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.391 11.244 -13.024 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.829 10.310 -12.658 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.965 8.415 -13.641 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.757 9.821 -14.665 1.00 0.00 H new ATOM 0 HE ARG A 126 16.765 9.301 -15.719 1.00 0.00 H new ATOM 0 HH11 ARG A 126 17.197 8.295 -12.357 1.00 0.00 H new ATOM 0 HH12 ARG A 126 18.600 7.295 -12.751 1.00 0.00 H new ATOM 0 HH21 ARG A 126 18.386 7.826 -16.160 1.00 0.00 H new ATOM 0 HH22 ARG A 126 19.249 7.040 -14.834 1.00 0.00 H new ATOM 1987 N HIS A 127 15.048 11.739 -8.502 1.00 0.00 N ATOM 1988 CA HIS A 127 14.467 12.164 -7.197 1.00 0.00 C ATOM 1989 C HIS A 127 13.059 12.801 -7.429 1.00 0.00 C ATOM 1990 O HIS A 127 12.945 13.926 -7.931 1.00 0.00 O ATOM 1991 CB HIS A 127 15.442 13.176 -6.522 1.00 0.00 C ATOM 1992 CG HIS A 127 16.852 12.673 -6.194 1.00 0.00 C ATOM 1993 ND1 HIS A 127 17.906 12.729 -7.085 1.00 0.00 N ATOM 1994 CD2 HIS A 127 17.278 12.090 -4.990 1.00 0.00 C ATOM 1995 CE1 HIS A 127 18.888 12.142 -6.335 1.00 0.00 C ATOM 1996 NE2 HIS A 127 18.619 11.735 -5.053 1.00 0.00 N ATOM 0 H HIS A 127 15.434 12.512 -9.044 1.00 0.00 H new ATOM 0 HA HIS A 127 14.340 11.305 -6.539 1.00 0.00 H new ATOM 0 HB2 HIS A 127 15.536 14.043 -7.176 1.00 0.00 H new ATOM 0 HB3 HIS A 127 14.982 13.523 -5.596 1.00 0.00 H new ATOM 0 HD1 HIS A 127 17.942 13.102 -8.034 1.00 0.00 H new ATOM 0 HD2 HIS A 127 16.646 11.938 -4.128 1.00 0.00 H new ATOM 0 HE1 HIS A 127 19.874 11.999 -6.752 1.00 0.00 H new ATOM 2004 N TYR A 128 11.984 12.080 -7.086 1.00 0.00 N ATOM 2005 CA TYR A 128 10.592 12.460 -7.449 1.00 0.00 C ATOM 2006 C TYR A 128 9.790 12.973 -6.209 1.00 0.00 C ATOM 2007 O TYR A 128 9.702 12.295 -5.178 1.00 0.00 O ATOM 2008 CB TYR A 128 9.896 11.211 -8.055 1.00 0.00 C ATOM 2009 CG TYR A 128 10.263 10.794 -9.489 1.00 0.00 C ATOM 2010 CD1 TYR A 128 9.542 11.301 -10.571 1.00 0.00 C ATOM 2011 CD2 TYR A 128 11.251 9.830 -9.718 1.00 0.00 C ATOM 2012 CE1 TYR A 128 9.805 10.862 -11.866 1.00 0.00 C ATOM 2013 CE2 TYR A 128 11.509 9.386 -11.014 1.00 0.00 C ATOM 2014 CZ TYR A 128 10.792 9.906 -12.086 1.00 0.00 C ATOM 2015 OH TYR A 128 11.044 9.466 -13.357 1.00 0.00 O ATOM 0 H TYR A 128 12.043 11.215 -6.549 1.00 0.00 H new ATOM 0 HA TYR A 128 10.621 13.276 -8.171 1.00 0.00 H new ATOM 0 HB2 TYR A 128 10.103 10.365 -7.400 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.820 11.383 -8.024 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.773 12.040 -10.402 1.00 0.00 H new ATOM 0 HD2 TYR A 128 11.815 9.429 -8.889 1.00 0.00 H new ATOM 0 HE1 TYR A 128 9.244 11.262 -12.698 1.00 0.00 H new ATOM 0 HE2 TYR A 128 12.267 8.637 -11.186 1.00 0.00 H new ATOM 0 HH TYR A 128 11.763 8.800 -13.336 1.00 0.00 H new ATOM 2025 N GLU A 129 9.146 14.143 -6.347 1.00 0.00 N ATOM 2026 CA GLU A 129 8.175 14.660 -5.335 1.00 0.00 C ATOM 2027 C GLU A 129 6.689 14.371 -5.729 1.00 0.00 C ATOM 2028 O GLU A 129 6.350 14.113 -6.888 1.00 0.00 O ATOM 2029 CB GLU A 129 8.446 16.173 -5.089 1.00 0.00 C ATOM 2030 CG GLU A 129 9.661 16.459 -4.170 1.00 0.00 C ATOM 2031 CD GLU A 129 9.885 17.932 -3.814 1.00 0.00 C ATOM 2032 OE1 GLU A 129 8.996 18.773 -3.729 1.00 0.00 O ATOM 2033 OE2 GLU A 129 11.198 18.207 -3.578 1.00 0.00 O ATOM 0 H GLU A 129 9.273 14.760 -7.149 1.00 0.00 H new ATOM 0 HA GLU A 129 8.328 14.124 -4.398 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.608 16.663 -6.049 1.00 0.00 H new ATOM 0 HB3 GLU A 129 7.557 16.623 -4.648 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.536 15.895 -3.246 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.560 16.080 -4.656 1.00 0.00 H new ATOM 2041 N LYS A 130 5.798 14.373 -4.723 1.00 0.00 N ATOM 2042 CA LYS A 130 4.398 13.909 -4.872 1.00 0.00 C ATOM 2043 C LYS A 130 3.423 15.055 -5.296 1.00 0.00 C ATOM 2044 O LYS A 130 3.379 16.115 -4.664 1.00 0.00 O ATOM 2045 CB LYS A 130 4.036 13.295 -3.495 1.00 0.00 C ATOM 2046 CG LYS A 130 2.930 12.226 -3.522 1.00 0.00 C ATOM 2047 CD LYS A 130 2.752 11.590 -2.128 1.00 0.00 C ATOM 2048 CE LYS A 130 1.931 10.295 -2.165 1.00 0.00 C ATOM 2049 NZ LYS A 130 1.770 9.752 -0.803 1.00 0.00 N ATOM 0 H LYS A 130 6.023 14.695 -3.782 1.00 0.00 H new ATOM 0 HA LYS A 130 4.300 13.180 -5.676 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.935 12.853 -3.065 1.00 0.00 H new ATOM 0 HB3 LYS A 130 3.725 14.099 -2.828 1.00 0.00 H new ATOM 0 HG2 LYS A 130 1.991 12.675 -3.845 1.00 0.00 H new ATOM 0 HG3 LYS A 130 3.181 11.454 -4.250 1.00 0.00 H new ATOM 0 HD2 LYS A 130 3.733 11.381 -1.701 1.00 0.00 H new ATOM 0 HD3 LYS A 130 2.263 12.306 -1.467 1.00 0.00 H new ATOM 0 HE2 LYS A 130 0.953 10.489 -2.604 1.00 0.00 H new ATOM 0 HE3 LYS A 130 2.426 9.561 -2.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 1.212 8.875 -0.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 2.706 9.549 -0.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 1.278 10.449 -0.207 1.00 0.00 H new ATOM 2062 N ALA A 131 2.620 14.775 -6.335 1.00 0.00 N ATOM 2063 CA ALA A 131 1.615 15.703 -6.927 1.00 0.00 C ATOM 2064 C ALA A 131 2.146 16.846 -7.830 1.00 0.00 C ATOM 2065 O ALA A 131 3.119 17.552 -7.476 1.00 0.00 O ATOM 2066 CB ALA A 131 0.552 16.162 -5.911 1.00 0.00 C ATOM 2067 OXT ALA A 131 1.558 17.042 -8.920 1.00 0.00 O ATOM 0 H ALA A 131 2.645 13.872 -6.808 1.00 0.00 H new ATOM 0 HA ALA A 131 1.112 15.068 -7.657 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -0.152 16.836 -6.400 1.00 0.00 H new ATOM 0 HB2 ALA A 131 0.016 15.294 -5.527 1.00 0.00 H new ATOM 0 HB3 ALA A 131 1.038 16.682 -5.086 1.00 0.00 H new TER 2073 ALA A 131