USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 0 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 74 SER OG : rot -55:sc= 0.04 USER MOD Set 1.2: A 86 SER OG : rot 52:sc= 0.0349 USER MOD Set 1.3: A 87 LYS NZ :NH3+ 154:sc= -0.0269 (180deg=-0.8) USER MOD Set 2.1: A 80 THR OG1 : rot 64:sc= 0.599 USER MOD Set 2.2: A 107 SER OG : rot 78:sc= 0.709 USER MOD Set 3.1: A 7 SER OG : rot -144:sc= 0.0221 USER MOD Set 3.2: A 75 TYR OH : rot 151:sc= 0.0232 USER MOD Set 4.1: A 8 MET CE :methyl -147:sc= -3.93 (180deg=-7.95!) USER MOD Set 4.2: A 73 TYR OH : rot -69:sc= -0.715 USER MOD Set 5.1: A 1 ALA N :NH3+ -132:sc= -0.478 (180deg=-3.12!) USER MOD Set 5.2: A 72 SER OG : rot 51:sc= 0.632 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 HIS :FLIP no HD1:sc= 0.265 F(o=-2.6!,f=0.27) USER MOD Single : A 20 MET CE :methyl 132:sc= -0.0512 (180deg=-2.06!) USER MOD Single : A 23 ASN : amide:sc= -0.209 K(o=-0.21,f=-1.5) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 25 TYR OH : rot -124:sc= 0.895 USER MOD Single : A 28 TYR OH : rot 162:sc= -0.479 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HD1:sc= -1.8 X(o=-1.8,f=-2!) USER MOD Single : A 50 ASN : amide:sc= -0.0016 K(o=-0.0016,f=-1.6) USER MOD Single : A 52 TYR OH : rot 59:sc= 0.168 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= 0.00222 X(o=0.0022,f=-0.045) USER MOD Single : A 60 SER OG : rot 130:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 TYR OH : rot 173:sc= -0.448 USER MOD Single : A 70 THR OG1 : rot 140:sc= 0.333 USER MOD Single : A 76 SER OG : rot 31:sc= -0.147 USER MOD Single : A 78 SER OG : rot 180:sc= 0.0592 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.217 K(o=-0.22,f=-1.4) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0.05) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot -41:sc= 1.32 USER MOD Single : A 112 ASN : amide:sc= -0.059 X(o=-0.059,f=-0.074) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 HIS : no HD1:sc= -2.14 K(o=-2.1,f=-5.1!) USER MOD Single : A 116 LYS NZ :NH3+ -125:sc= 0 (180deg=-1.13) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 THR OG1 : rot 46:sc= 0.743 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -8.066 1.364 3.676 1.00 0.00 N ATOM 2 CA ALA A 1 -7.580 2.509 4.463 1.00 0.00 C ATOM 3 C ALA A 1 -6.063 2.452 4.661 1.00 0.00 C ATOM 4 O ALA A 1 -5.443 1.394 4.769 1.00 0.00 O ATOM 5 CB ALA A 1 -8.255 2.615 5.830 1.00 0.00 C ATOM 0 H1 ALA A 1 -8.699 1.703 2.924 1.00 0.00 H new ATOM 0 H2 ALA A 1 -7.258 0.868 3.250 1.00 0.00 H new ATOM 0 H3 ALA A 1 -8.585 0.711 4.297 1.00 0.00 H new ATOM 0 HA ALA A 1 -7.840 3.394 3.882 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -7.858 3.477 6.366 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -9.330 2.735 5.697 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -8.059 1.709 6.404 1.00 0.00 H new ATOM 6 N LEU A 2 -5.497 3.650 4.711 1.00 0.00 N ATOM 7 CA LEU A 2 -4.047 3.878 4.719 1.00 0.00 C ATOM 8 C LEU A 2 -3.446 4.024 6.110 1.00 0.00 C ATOM 9 O LEU A 2 -2.534 3.263 6.394 1.00 0.00 O ATOM 10 CB LEU A 2 -3.884 5.095 3.814 1.00 0.00 C ATOM 11 CG LEU A 2 -2.524 5.427 3.228 1.00 0.00 C ATOM 12 CD1 LEU A 2 -1.617 6.299 4.077 1.00 0.00 C ATOM 13 CD2 LEU A 2 -1.785 4.200 2.738 1.00 0.00 C ATOM 0 H LEU A 2 -6.039 4.513 4.748 1.00 0.00 H new ATOM 0 HA LEU A 2 -3.482 3.020 4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.576 4.974 2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.215 5.966 4.379 1.00 0.00 H new ATOM 0 HG LEU A 2 -2.784 6.052 2.374 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -0.677 6.466 3.552 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -2.103 7.257 4.263 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -1.419 5.802 5.027 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -0.819 4.496 2.329 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.632 3.512 3.569 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -2.372 3.707 1.962 1.00 0.00 H new ATOM 14 N TRP A 3 -3.905 4.959 6.972 1.00 0.00 N ATOM 15 CA TRP A 3 -3.550 4.942 8.426 1.00 0.00 C ATOM 16 C TRP A 3 -3.929 3.619 9.170 1.00 0.00 C ATOM 17 O TRP A 3 -3.214 3.189 10.077 1.00 0.00 O ATOM 18 CB TRP A 3 -4.164 6.156 9.187 1.00 0.00 C ATOM 19 CG TRP A 3 -5.725 6.145 9.379 1.00 0.00 C ATOM 20 CD1 TRP A 3 -6.439 5.447 10.395 1.00 0.00 C ATOM 21 CD2 TRP A 3 -6.702 6.485 8.453 1.00 0.00 C ATOM 22 NE1 TRP A 3 -7.810 5.358 10.134 1.00 0.00 N ATOM 23 CE2 TRP A 3 -7.950 5.967 8.911 1.00 0.00 C ATOM 24 CE3 TRP A 3 -6.593 7.002 7.134 1.00 0.00 C ATOM 25 CZ2 TRP A 3 -9.060 5.940 8.036 1.00 0.00 C ATOM 26 CZ3 TRP A 3 -7.719 7.034 6.327 1.00 0.00 C ATOM 27 CH2 TRP A 3 -8.939 6.510 6.776 1.00 0.00 C ATOM 0 H TRP A 3 -4.515 5.730 6.699 1.00 0.00 H new ATOM 0 HA TRP A 3 -2.462 5.011 8.436 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -3.699 6.212 10.171 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -3.892 7.067 8.653 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -5.971 5.030 11.274 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -8.536 4.939 10.716 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -5.645 7.365 6.765 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -9.989 5.483 8.343 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -7.656 7.468 5.340 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -9.802 6.551 6.129 1.00 0.00 H new ATOM 28 N GLN A 4 -5.075 3.043 8.775 1.00 0.00 N ATOM 29 CA GLN A 4 -5.639 1.825 9.365 1.00 0.00 C ATOM 30 C GLN A 4 -4.963 0.534 8.863 1.00 0.00 C ATOM 31 O GLN A 4 -4.866 -0.398 9.667 1.00 0.00 O ATOM 32 CB GLN A 4 -7.167 1.831 9.157 1.00 0.00 C ATOM 33 CG GLN A 4 -7.960 1.607 10.457 1.00 0.00 C ATOM 34 CD GLN A 4 -9.475 1.774 10.301 1.00 0.00 C ATOM 35 OE1 GLN A 4 -9.975 2.572 9.508 1.00 0.00 O ATOM 36 NE2 GLN A 4 -10.246 1.041 11.085 1.00 0.00 N ATOM 0 H GLN A 4 -5.646 3.422 8.019 1.00 0.00 H new ATOM 0 HA GLN A 4 -5.431 1.829 10.435 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -7.463 2.784 8.719 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -7.432 1.054 8.440 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.752 0.604 10.829 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.604 2.307 11.213 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -9.827 0.381 11.740 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -11.260 1.135 11.035 1.00 0.00 H new ATOM 37 N PHE A 5 -4.487 0.463 7.578 1.00 0.00 N ATOM 38 CA PHE A 5 -3.484 -0.574 7.207 1.00 0.00 C ATOM 39 C PHE A 5 -2.065 -0.206 7.731 1.00 0.00 C ATOM 40 O PHE A 5 -1.276 -1.123 7.909 1.00 0.00 O ATOM 41 CB PHE A 5 -3.628 -1.084 5.765 1.00 0.00 C ATOM 42 CG PHE A 5 -2.567 -0.851 4.707 1.00 0.00 C ATOM 43 CD1 PHE A 5 -2.249 0.449 4.376 1.00 0.00 C ATOM 44 CD2 PHE A 5 -1.944 -1.896 3.999 1.00 0.00 C ATOM 45 CE1 PHE A 5 -1.337 0.723 3.365 1.00 0.00 C ATOM 46 CE2 PHE A 5 -1.042 -1.616 2.966 1.00 0.00 C ATOM 47 CZ PHE A 5 -0.736 -0.303 2.656 1.00 0.00 C ATOM 0 H PHE A 5 -4.770 1.083 6.819 1.00 0.00 H new ATOM 0 HA PHE A 5 -3.705 -1.494 7.748 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -3.773 -2.162 5.829 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -4.554 -0.661 5.376 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -2.715 1.264 4.909 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -2.164 -2.922 4.255 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -1.094 1.748 3.129 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -0.586 -2.423 2.412 1.00 0.00 H new ATOM 0 HZ PHE A 5 -0.033 -0.080 1.867 1.00 0.00 H new ATOM 48 N ARG A 6 -1.753 1.076 8.027 1.00 0.00 N ATOM 49 CA ARG A 6 -0.545 1.483 8.764 1.00 0.00 C ATOM 50 C ARG A 6 -0.597 1.447 10.306 1.00 0.00 C ATOM 51 O ARG A 6 -0.198 2.379 11.004 1.00 0.00 O ATOM 52 CB ARG A 6 -0.045 2.827 8.173 1.00 0.00 C ATOM 53 CG ARG A 6 0.855 2.589 6.968 1.00 0.00 C ATOM 54 CD ARG A 6 0.394 2.602 5.528 1.00 0.00 C ATOM 55 NE ARG A 6 1.442 1.884 4.745 1.00 0.00 N ATOM 56 CZ ARG A 6 1.764 2.036 3.454 1.00 0.00 C ATOM 57 NH1 ARG A 6 1.215 2.926 2.640 1.00 0.00 N ATOM 58 NH2 ARG A 6 2.709 1.258 2.964 1.00 0.00 N ATOM 0 H ARG A 6 -2.343 1.863 7.756 1.00 0.00 H new ATOM 0 HA ARG A 6 0.192 0.697 8.601 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -0.898 3.440 7.880 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.500 3.384 8.935 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.649 3.333 7.035 1.00 0.00 H new ATOM 0 HG3 ARG A 6 1.317 1.614 7.126 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -0.573 2.110 5.425 1.00 0.00 H new ATOM 0 HD3 ARG A 6 0.272 3.624 5.168 1.00 0.00 H new ATOM 0 HE ARG A 6 1.982 1.188 5.259 1.00 0.00 H new ATOM 0 HH11 ARG A 6 0.492 3.557 2.987 1.00 0.00 H new ATOM 0 HH12 ARG A 6 1.515 2.980 1.667 1.00 0.00 H new ATOM 0 HH21 ARG A 6 3.166 0.571 3.564 1.00 0.00 H new ATOM 0 HH22 ARG A 6 2.983 1.343 1.985 1.00 0.00 H new ATOM 59 N SER A 7 -1.147 0.347 10.812 1.00 0.00 N ATOM 60 CA SER A 7 -0.840 -0.150 12.208 1.00 0.00 C ATOM 61 C SER A 7 -0.048 -1.497 12.148 1.00 0.00 C ATOM 62 O SER A 7 1.056 -1.722 12.635 1.00 0.00 O ATOM 63 CB SER A 7 -2.091 -0.108 13.092 1.00 0.00 C ATOM 64 OG SER A 7 -1.793 -0.509 14.425 1.00 0.00 O ATOM 0 H SER A 7 -1.810 -0.236 10.301 1.00 0.00 H new ATOM 0 HA SER A 7 -0.155 0.525 12.721 1.00 0.00 H new ATOM 0 HB2 SER A 7 -2.503 0.901 13.096 1.00 0.00 H new ATOM 0 HB3 SER A 7 -2.856 -0.763 12.675 1.00 0.00 H new ATOM 0 HG SER A 7 -2.547 -1.018 14.790 1.00 0.00 H new ATOM 65 N MET A 8 -0.794 -2.363 11.527 1.00 0.00 N ATOM 66 CA MET A 8 -0.468 -3.621 10.891 1.00 0.00 C ATOM 67 C MET A 8 0.610 -3.611 9.769 1.00 0.00 C ATOM 68 O MET A 8 1.165 -4.680 9.554 1.00 0.00 O ATOM 69 CB MET A 8 -1.856 -4.157 10.406 1.00 0.00 C ATOM 70 CG MET A 8 -2.940 -3.115 10.034 1.00 0.00 C ATOM 71 SD MET A 8 -4.297 -3.799 9.132 1.00 0.00 S ATOM 72 CE MET A 8 -3.388 -4.096 7.644 1.00 0.00 C ATOM 0 H MET A 8 -1.794 -2.181 11.439 1.00 0.00 H new ATOM 0 HA MET A 8 0.040 -4.267 11.607 1.00 0.00 H new ATOM 0 HB2 MET A 8 -1.686 -4.789 9.535 1.00 0.00 H new ATOM 0 HB3 MET A 8 -2.261 -4.797 11.190 1.00 0.00 H new ATOM 0 HG2 MET A 8 -3.317 -2.653 10.947 1.00 0.00 H new ATOM 0 HG3 MET A 8 -2.483 -2.323 9.441 1.00 0.00 H new ATOM 0 HE1 MET A 8 -4.045 -3.967 6.784 1.00 0.00 H new ATOM 0 HE2 MET A 8 -2.560 -3.391 7.577 1.00 0.00 H new ATOM 0 HE3 MET A 8 -2.998 -5.114 7.653 1.00 0.00 H new ATOM 73 N ILE A 9 0.952 -2.503 9.066 1.00 0.00 N ATOM 74 CA ILE A 9 2.206 -2.432 8.199 1.00 0.00 C ATOM 75 C ILE A 9 3.521 -2.353 9.059 1.00 0.00 C ATOM 76 O ILE A 9 4.576 -2.731 8.566 1.00 0.00 O ATOM 77 CB ILE A 9 2.041 -1.367 7.076 1.00 0.00 C ATOM 78 CG1 ILE A 9 0.915 -1.817 6.089 1.00 0.00 C ATOM 79 CG2 ILE A 9 3.265 -0.914 6.226 1.00 0.00 C ATOM 80 CD1 ILE A 9 1.421 -2.535 4.864 1.00 0.00 C ATOM 0 H ILE A 9 0.400 -1.645 9.066 1.00 0.00 H new ATOM 0 HA ILE A 9 2.331 -3.372 7.662 1.00 0.00 H new ATOM 0 HB ILE A 9 1.817 -0.480 7.669 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.222 -2.470 6.619 1.00 0.00 H new ATOM 0 HG13 ILE A 9 0.350 -0.939 5.775 1.00 0.00 H new ATOM 0 HG21 ILE A 9 2.946 -0.168 5.498 1.00 0.00 H new ATOM 0 HG22 ILE A 9 4.022 -0.482 6.880 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.684 -1.774 5.704 1.00 0.00 H new ATOM 0 HD11 ILE A 9 0.578 -2.813 4.231 1.00 0.00 H new ATOM 0 HD12 ILE A 9 2.091 -1.879 4.308 1.00 0.00 H new ATOM 0 HD13 ILE A 9 1.960 -3.433 5.165 1.00 0.00 H new ATOM 81 N LYS A 10 3.433 -1.911 10.321 1.00 0.00 N ATOM 82 CA LYS A 10 4.496 -2.069 11.363 1.00 0.00 C ATOM 83 C LYS A 10 4.509 -3.444 12.131 1.00 0.00 C ATOM 84 O LYS A 10 5.487 -3.786 12.797 1.00 0.00 O ATOM 85 CB LYS A 10 4.328 -1.045 12.516 1.00 0.00 C ATOM 86 CG LYS A 10 4.370 0.389 12.026 1.00 0.00 C ATOM 87 CD LYS A 10 2.979 0.967 11.798 1.00 0.00 C ATOM 88 CE LYS A 10 2.718 2.299 12.507 1.00 0.00 C ATOM 89 NZ LYS A 10 2.349 2.115 13.923 1.00 0.00 N ATOM 0 H LYS A 10 2.609 -1.421 10.669 1.00 0.00 H new ATOM 0 HA LYS A 10 5.400 -1.949 10.766 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.380 -1.225 13.023 1.00 0.00 H new ATOM 0 HB3 LYS A 10 5.117 -1.198 13.252 1.00 0.00 H new ATOM 0 HG2 LYS A 10 4.901 1.003 12.754 1.00 0.00 H new ATOM 0 HG3 LYS A 10 4.937 0.436 11.096 1.00 0.00 H new ATOM 0 HD2 LYS A 10 2.828 1.105 10.727 1.00 0.00 H new ATOM 0 HD3 LYS A 10 2.239 0.241 12.133 1.00 0.00 H new ATOM 0 HE2 LYS A 10 3.610 2.923 12.444 1.00 0.00 H new ATOM 0 HE3 LYS A 10 1.919 2.832 11.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 2.182 3.043 14.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 1.483 1.542 13.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 3.121 1.630 14.423 1.00 0.00 H new ATOM 90 N CYS A 11 3.381 -4.154 12.120 1.00 0.00 N ATOM 91 CA CYS A 11 3.371 -5.617 12.411 1.00 0.00 C ATOM 92 C CYS A 11 4.011 -6.409 11.225 1.00 0.00 C ATOM 93 O CYS A 11 4.897 -7.229 11.466 1.00 0.00 O ATOM 94 CB CYS A 11 1.955 -6.094 12.719 1.00 0.00 C ATOM 95 SG CYS A 11 1.865 -7.877 12.880 1.00 0.00 S ATOM 0 H CYS A 11 2.463 -3.759 11.917 1.00 0.00 H new ATOM 0 HA CYS A 11 3.975 -5.807 13.298 1.00 0.00 H new ATOM 0 HB2 CYS A 11 1.609 -5.629 13.642 1.00 0.00 H new ATOM 0 HB3 CYS A 11 1.282 -5.767 11.926 1.00 0.00 H new ATOM 96 N ALA A 12 3.591 -6.082 9.985 1.00 0.00 N ATOM 97 CA ALA A 12 4.197 -6.560 8.720 1.00 0.00 C ATOM 98 C ALA A 12 5.723 -6.364 8.579 1.00 0.00 C ATOM 99 O ALA A 12 6.402 -7.231 8.030 1.00 0.00 O ATOM 100 CB ALA A 12 3.431 -5.839 7.601 1.00 0.00 C ATOM 0 H ALA A 12 2.798 -5.460 9.829 1.00 0.00 H new ATOM 0 HA ALA A 12 4.103 -7.645 8.680 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.827 -6.145 6.633 1.00 0.00 H new ATOM 0 HB2 ALA A 12 2.374 -6.098 7.659 1.00 0.00 H new ATOM 0 HB3 ALA A 12 3.548 -4.761 7.716 1.00 0.00 H new ATOM 101 N ILE A 13 6.270 -5.253 9.069 1.00 0.00 N ATOM 102 CA ILE A 13 7.702 -4.953 9.074 1.00 0.00 C ATOM 103 C ILE A 13 7.797 -4.919 10.622 1.00 0.00 C ATOM 104 O ILE A 13 7.432 -3.874 11.168 1.00 0.00 O ATOM 105 CB ILE A 13 7.807 -3.613 8.296 1.00 0.00 C ATOM 106 CG1 ILE A 13 7.806 -3.868 6.761 1.00 0.00 C ATOM 107 CG2 ILE A 13 8.898 -2.648 8.718 1.00 0.00 C ATOM 108 CD1 ILE A 13 6.436 -3.532 6.184 1.00 0.00 C ATOM 0 H ILE A 13 5.710 -4.511 9.488 1.00 0.00 H new ATOM 0 HA ILE A 13 8.477 -5.573 8.624 1.00 0.00 H new ATOM 0 HB ILE A 13 6.905 -3.072 8.583 1.00 0.00 H new ATOM 0 HG12 ILE A 13 8.572 -3.259 6.281 1.00 0.00 H new ATOM 0 HG13 ILE A 13 8.052 -4.910 6.556 1.00 0.00 H new ATOM 0 HG21 ILE A 13 8.857 -1.756 8.093 1.00 0.00 H new ATOM 0 HG22 ILE A 13 8.752 -2.367 9.761 1.00 0.00 H new ATOM 0 HG23 ILE A 13 9.871 -3.126 8.604 1.00 0.00 H new ATOM 0 HD11 ILE A 13 6.440 -3.712 5.109 1.00 0.00 H new ATOM 0 HD12 ILE A 13 5.679 -4.160 6.654 1.00 0.00 H new ATOM 0 HD13 ILE A 13 6.208 -2.484 6.375 1.00 0.00 H new ATOM 109 N PRO A 14 8.233 -5.984 11.373 1.00 0.00 N ATOM 110 CA PRO A 14 8.473 -5.933 12.880 1.00 0.00 C ATOM 111 C PRO A 14 9.189 -4.631 13.289 1.00 0.00 C ATOM 112 O PRO A 14 8.631 -3.817 14.028 1.00 0.00 O ATOM 113 CB PRO A 14 9.195 -7.265 13.171 1.00 0.00 C ATOM 114 CG PRO A 14 8.762 -8.191 11.999 1.00 0.00 C ATOM 115 CD PRO A 14 8.718 -7.239 10.795 1.00 0.00 C ATOM 0 HA PRO A 14 7.576 -5.873 13.497 1.00 0.00 H new ATOM 0 HB2 PRO A 14 10.277 -7.135 13.198 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.899 -7.677 14.136 1.00 0.00 H new ATOM 0 HG2 PRO A 14 9.473 -9.003 11.844 1.00 0.00 H new ATOM 0 HG3 PRO A 14 7.791 -8.649 12.186 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.702 -7.119 10.341 1.00 0.00 H new ATOM 0 HD3 PRO A 14 8.051 -7.607 10.016 1.00 0.00 H new ATOM 116 N GLY A 15 10.348 -4.386 12.642 1.00 0.00 N ATOM 117 CA GLY A 15 10.438 -3.160 11.819 1.00 0.00 C ATOM 118 C GLY A 15 10.353 -1.786 12.466 1.00 0.00 C ATOM 119 O GLY A 15 10.822 -1.628 13.598 1.00 0.00 O ATOM 0 H GLY A 15 11.181 -4.974 12.666 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.384 -3.203 11.280 1.00 0.00 H new ATOM 0 HA3 GLY A 15 9.644 -3.214 11.074 1.00 0.00 H new ATOM 120 N SER A 16 9.803 -0.776 11.738 1.00 0.00 N ATOM 121 CA SER A 16 9.797 0.629 12.279 1.00 0.00 C ATOM 122 C SER A 16 8.661 1.473 11.648 1.00 0.00 C ATOM 123 O SER A 16 7.496 1.215 11.959 1.00 0.00 O ATOM 124 CB SER A 16 11.225 1.241 12.224 1.00 0.00 C ATOM 125 OG SER A 16 11.274 2.497 12.895 1.00 0.00 O ATOM 0 H SER A 16 9.375 -0.888 10.819 1.00 0.00 H new ATOM 0 HA SER A 16 9.546 0.622 13.340 1.00 0.00 H new ATOM 0 HB2 SER A 16 11.936 0.553 12.682 1.00 0.00 H new ATOM 0 HB3 SER A 16 11.529 1.369 11.185 1.00 0.00 H new ATOM 0 HG SER A 16 12.184 2.858 12.847 1.00 0.00 H new ATOM 126 N HIS A 17 8.978 2.461 10.781 1.00 0.00 N ATOM 127 CA HIS A 17 7.974 3.265 10.025 1.00 0.00 C ATOM 128 C HIS A 17 7.261 2.315 9.000 1.00 0.00 C ATOM 129 O HIS A 17 7.957 1.549 8.321 1.00 0.00 O ATOM 130 CB HIS A 17 8.492 4.546 9.254 1.00 0.00 C ATOM 131 CG HIS A 17 9.961 4.571 8.925 1.00 0.00 C ATOM 132 ND1 HIS A 17 10.447 3.588 8.092 1.00 0.00 N flip ATOM 133 CD2 HIS A 17 10.982 5.236 9.592 1.00 0.00 C flip ATOM 134 CE1 HIS A 17 11.812 3.548 8.137 1.00 0.00 C flip ATOM 135 NE2 HIS A 17 12.041 4.557 9.036 1.00 0.00 N flip ATOM 0 H HIS A 17 9.941 2.729 10.581 1.00 0.00 H new ATOM 0 HA HIS A 17 7.314 3.670 10.792 1.00 0.00 H new ATOM 0 HB2 HIS A 17 7.930 4.638 8.324 1.00 0.00 H new ATOM 0 HB3 HIS A 17 8.260 5.425 9.855 1.00 0.00 H new ATOM 0 HD2 HIS A 17 10.953 6.035 10.318 1.00 0.00 H new ATOM 0 HE1 HIS A 17 12.508 2.908 7.616 1.00 0.00 H new ATOM 0 HE2 HIS A 17 12.997 4.804 9.293 1.00 0.00 H new ATOM 136 N PRO A 18 5.920 2.319 8.849 1.00 0.00 N ATOM 137 CA PRO A 18 5.241 1.476 7.835 1.00 0.00 C ATOM 138 C PRO A 18 5.551 1.896 6.382 1.00 0.00 C ATOM 139 O PRO A 18 6.056 1.062 5.633 1.00 0.00 O ATOM 140 CB PRO A 18 3.749 1.617 8.148 1.00 0.00 C ATOM 141 CG PRO A 18 3.624 2.925 8.956 1.00 0.00 C ATOM 142 CD PRO A 18 4.982 3.140 9.635 1.00 0.00 C ATOM 0 HA PRO A 18 5.590 0.445 7.894 1.00 0.00 H new ATOM 0 HB2 PRO A 18 3.158 1.662 7.233 1.00 0.00 H new ATOM 0 HB3 PRO A 18 3.385 0.764 8.721 1.00 0.00 H new ATOM 0 HG2 PRO A 18 3.378 3.763 8.304 1.00 0.00 H new ATOM 0 HG3 PRO A 18 2.826 2.851 9.695 1.00 0.00 H new ATOM 0 HD2 PRO A 18 5.269 4.191 9.624 1.00 0.00 H new ATOM 0 HD3 PRO A 18 4.958 2.827 10.679 1.00 0.00 H new ATOM 143 N LEU A 19 5.283 3.176 6.027 1.00 0.00 N ATOM 144 CA LEU A 19 5.773 3.812 4.800 1.00 0.00 C ATOM 145 C LEU A 19 7.276 3.997 4.866 1.00 0.00 C ATOM 146 O LEU A 19 7.914 2.971 5.017 1.00 0.00 O ATOM 147 CB LEU A 19 4.911 5.084 4.590 1.00 0.00 C ATOM 148 CG LEU A 19 3.846 4.888 3.539 1.00 0.00 C ATOM 149 CD1 LEU A 19 2.843 6.043 3.695 1.00 0.00 C ATOM 150 CD2 LEU A 19 4.398 5.022 2.125 1.00 0.00 C ATOM 0 H LEU A 19 4.711 3.797 6.600 1.00 0.00 H new ATOM 0 HA LEU A 19 5.651 3.201 3.905 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.440 5.361 5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.556 5.913 4.300 1.00 0.00 H new ATOM 0 HG LEU A 19 3.419 3.894 3.672 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.052 5.941 2.952 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.408 6.015 4.694 1.00 0.00 H new ATOM 0 HD13 LEU A 19 3.357 6.993 3.550 1.00 0.00 H new ATOM 0 HD21 LEU A 19 3.594 4.873 1.405 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.823 6.017 1.993 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.173 4.272 1.964 1.00 0.00 H new ATOM 151 N MET A 20 7.694 5.253 4.876 1.00 0.00 N ATOM 152 CA MET A 20 9.022 5.920 4.819 1.00 0.00 C ATOM 153 C MET A 20 10.339 5.151 4.608 1.00 0.00 C ATOM 154 O MET A 20 11.251 5.604 3.914 1.00 0.00 O ATOM 155 CB MET A 20 8.875 6.791 6.093 1.00 0.00 C ATOM 156 CG MET A 20 7.787 7.893 6.022 1.00 0.00 C ATOM 157 SD MET A 20 7.123 8.143 7.684 1.00 0.00 S ATOM 158 CE MET A 20 6.023 6.702 7.795 1.00 0.00 C ATOM 0 H MET A 20 6.979 5.978 4.936 1.00 0.00 H new ATOM 0 HA MET A 20 9.196 6.427 3.870 1.00 0.00 H new ATOM 0 HB2 MET A 20 8.652 6.137 6.936 1.00 0.00 H new ATOM 0 HB3 MET A 20 9.834 7.264 6.302 1.00 0.00 H new ATOM 0 HG2 MET A 20 8.211 8.821 5.639 1.00 0.00 H new ATOM 0 HG3 MET A 20 6.993 7.599 5.336 1.00 0.00 H new ATOM 0 HE1 MET A 20 6.190 6.189 8.742 1.00 0.00 H new ATOM 0 HE2 MET A 20 4.985 7.031 7.738 1.00 0.00 H new ATOM 0 HE3 MET A 20 6.233 6.020 6.971 1.00 0.00 H new ATOM 159 N ASP A 21 10.290 3.917 5.080 1.00 0.00 N ATOM 160 CA ASP A 21 10.768 2.723 4.308 1.00 0.00 C ATOM 161 C ASP A 21 10.152 2.508 2.883 1.00 0.00 C ATOM 162 O ASP A 21 10.620 1.615 2.174 1.00 0.00 O ATOM 163 CB ASP A 21 10.699 1.460 5.202 1.00 0.00 C ATOM 164 CG ASP A 21 11.399 0.207 4.669 1.00 0.00 C ATOM 165 OD1 ASP A 21 12.766 0.327 4.682 1.00 0.00 O ATOM 166 OD2 ASP A 21 10.793 -0.785 4.266 1.00 0.00 O ATOM 0 H ASP A 21 9.923 3.687 6.004 1.00 0.00 H new ATOM 0 HA ASP A 21 11.807 2.938 4.057 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.130 1.705 6.173 1.00 0.00 H new ATOM 0 HB3 ASP A 21 9.650 1.219 5.371 1.00 0.00 H new ATOM 167 N PHE A 22 9.158 3.300 2.451 1.00 0.00 N ATOM 168 CA PHE A 22 8.500 3.133 1.156 1.00 0.00 C ATOM 169 C PHE A 22 8.211 4.532 0.534 1.00 0.00 C ATOM 170 O PHE A 22 8.451 4.654 -0.665 1.00 0.00 O ATOM 171 CB PHE A 22 7.236 2.283 1.368 1.00 0.00 C ATOM 172 CG PHE A 22 7.462 0.809 1.725 1.00 0.00 C ATOM 173 CD1 PHE A 22 7.551 0.377 3.067 1.00 0.00 C ATOM 174 CD2 PHE A 22 7.441 -0.155 0.712 1.00 0.00 C ATOM 175 CE1 PHE A 22 7.408 -0.967 3.381 1.00 0.00 C ATOM 176 CE2 PHE A 22 7.441 -1.506 1.026 1.00 0.00 C ATOM 177 CZ PHE A 22 7.394 -1.901 2.357 1.00 0.00 C ATOM 0 H PHE A 22 8.790 4.078 2.998 1.00 0.00 H new ATOM 0 HA PHE A 22 9.136 2.608 0.443 1.00 0.00 H new ATOM 0 HB2 PHE A 22 6.645 2.741 2.161 1.00 0.00 H new ATOM 0 HB3 PHE A 22 6.637 2.327 0.458 1.00 0.00 H new ATOM 0 HD1 PHE A 22 7.731 1.096 3.852 1.00 0.00 H new ATOM 0 HD2 PHE A 22 7.425 0.155 -0.322 1.00 0.00 H new ATOM 0 HE1 PHE A 22 7.309 -1.281 4.410 1.00 0.00 H new ATOM 0 HE2 PHE A 22 7.477 -2.246 0.241 1.00 0.00 H new ATOM 0 HZ PHE A 22 7.346 -2.953 2.598 1.00 0.00 H new ATOM 178 N ASN A 23 7.703 5.551 1.282 1.00 0.00 N ATOM 179 CA ASN A 23 7.334 6.919 0.746 1.00 0.00 C ATOM 180 C ASN A 23 8.176 7.498 -0.419 1.00 0.00 C ATOM 181 O ASN A 23 7.669 7.867 -1.479 1.00 0.00 O ATOM 182 CB ASN A 23 7.301 7.875 1.977 1.00 0.00 C ATOM 183 CG ASN A 23 6.986 9.361 1.784 1.00 0.00 C ATOM 184 OD1 ASN A 23 6.709 9.860 0.695 1.00 0.00 O ATOM 185 ND2 ASN A 23 7.069 10.128 2.858 1.00 0.00 N ATOM 0 H ASN A 23 7.532 5.459 2.283 1.00 0.00 H new ATOM 0 HA ASN A 23 6.368 6.813 0.252 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.567 7.476 2.677 1.00 0.00 H new ATOM 0 HB3 ASN A 23 8.274 7.810 2.464 1.00 0.00 H new ATOM 0 HD21 ASN A 23 6.903 11.132 2.782 1.00 0.00 H new ATOM 0 HD22 ASN A 23 7.299 9.716 3.762 1.00 0.00 H new ATOM 186 N ASN A 24 9.466 7.530 -0.130 1.00 0.00 N ATOM 187 CA ASN A 24 10.514 7.956 -1.064 1.00 0.00 C ATOM 188 C ASN A 24 10.890 6.705 -1.892 1.00 0.00 C ATOM 189 O ASN A 24 10.323 6.542 -2.972 1.00 0.00 O ATOM 190 CB ASN A 24 11.676 8.611 -0.283 1.00 0.00 C ATOM 191 CG ASN A 24 11.439 10.041 0.212 1.00 0.00 C ATOM 192 OD1 ASN A 24 10.324 10.562 0.253 1.00 0.00 O ATOM 193 ND2 ASN A 24 12.503 10.704 0.628 1.00 0.00 N ATOM 0 H ASN A 24 9.831 7.255 0.782 1.00 0.00 H new ATOM 0 HA ASN A 24 10.192 8.731 -1.760 1.00 0.00 H new ATOM 0 HB2 ASN A 24 11.905 7.984 0.579 1.00 0.00 H new ATOM 0 HB3 ASN A 24 12.560 8.612 -0.921 1.00 0.00 H new ATOM 0 HD21 ASN A 24 12.404 11.654 0.986 1.00 0.00 H new ATOM 0 HD22 ASN A 24 13.423 10.266 0.591 1.00 0.00 H new ATOM 194 N TYR A 25 11.779 5.837 -1.360 1.00 0.00 N ATOM 195 CA TYR A 25 12.205 4.541 -1.989 1.00 0.00 C ATOM 196 C TYR A 25 12.498 4.593 -3.517 1.00 0.00 C ATOM 197 O TYR A 25 12.673 5.696 -4.044 1.00 0.00 O ATOM 198 CB TYR A 25 11.247 3.451 -1.462 1.00 0.00 C ATOM 199 CG TYR A 25 11.855 2.089 -1.116 1.00 0.00 C ATOM 200 CD1 TYR A 25 12.681 1.916 0.010 1.00 0.00 C ATOM 201 CD2 TYR A 25 11.483 0.959 -1.840 1.00 0.00 C ATOM 202 CE1 TYR A 25 13.132 0.651 0.390 1.00 0.00 C ATOM 203 CE2 TYR A 25 11.917 -0.306 -1.452 1.00 0.00 C ATOM 204 CZ TYR A 25 12.703 -0.467 -0.312 1.00 0.00 C ATOM 205 OH TYR A 25 12.949 -1.717 0.167 1.00 0.00 O ATOM 0 H TYR A 25 12.236 6.010 -0.465 1.00 0.00 H new ATOM 0 HA TYR A 25 13.214 4.273 -1.677 1.00 0.00 H new ATOM 0 HB2 TYR A 25 10.755 3.837 -0.569 1.00 0.00 H new ATOM 0 HB3 TYR A 25 10.471 3.293 -2.211 1.00 0.00 H new ATOM 0 HD1 TYR A 25 12.972 2.779 0.591 1.00 0.00 H new ATOM 0 HD2 TYR A 25 10.852 1.065 -2.710 1.00 0.00 H new ATOM 0 HE1 TYR A 25 13.810 0.543 1.224 1.00 0.00 H new ATOM 0 HE2 TYR A 25 11.642 -1.170 -2.039 1.00 0.00 H new ATOM 0 HH TYR A 25 13.427 -2.239 -0.511 1.00 0.00 H new ATOM 206 N GLY A 26 12.589 3.442 -4.220 1.00 0.00 N ATOM 207 CA GLY A 26 12.907 3.376 -5.695 1.00 0.00 C ATOM 208 C GLY A 26 12.450 4.501 -6.662 1.00 0.00 C ATOM 209 O GLY A 26 13.190 5.039 -7.484 1.00 0.00 O ATOM 0 H GLY A 26 12.447 2.525 -3.797 1.00 0.00 H new ATOM 0 HA2 GLY A 26 13.990 3.298 -5.785 1.00 0.00 H new ATOM 0 HA3 GLY A 26 12.488 2.442 -6.071 1.00 0.00 H new ATOM 210 N CYS A 27 11.166 4.739 -6.517 1.00 0.00 N ATOM 211 CA CYS A 27 10.481 5.931 -7.044 1.00 0.00 C ATOM 212 C CYS A 27 9.501 6.608 -6.059 1.00 0.00 C ATOM 213 O CYS A 27 9.525 7.837 -5.942 1.00 0.00 O ATOM 214 CB CYS A 27 9.788 5.746 -8.414 1.00 0.00 C ATOM 215 SG CYS A 27 10.782 4.729 -9.505 1.00 0.00 S ATOM 0 H CYS A 27 10.542 4.104 -6.020 1.00 0.00 H new ATOM 0 HA CYS A 27 11.326 6.604 -7.194 1.00 0.00 H new ATOM 0 HB2 CYS A 27 8.811 5.285 -8.272 1.00 0.00 H new ATOM 0 HB3 CYS A 27 9.617 6.720 -8.874 1.00 0.00 H new ATOM 216 N TYR A 28 8.615 5.831 -5.407 1.00 0.00 N ATOM 217 CA TYR A 28 7.375 6.390 -4.804 1.00 0.00 C ATOM 218 C TYR A 28 6.547 5.594 -3.737 1.00 0.00 C ATOM 219 O TYR A 28 5.444 5.994 -3.356 1.00 0.00 O ATOM 220 CB TYR A 28 6.399 6.613 -5.992 1.00 0.00 C ATOM 221 CG TYR A 28 6.071 5.509 -7.025 1.00 0.00 C ATOM 222 CD1 TYR A 28 5.978 4.106 -6.797 1.00 0.00 C ATOM 223 CD2 TYR A 28 5.792 5.976 -8.303 1.00 0.00 C ATOM 224 CE1 TYR A 28 5.538 3.252 -7.809 1.00 0.00 C ATOM 225 CE2 TYR A 28 5.376 5.117 -9.310 1.00 0.00 C ATOM 226 CZ TYR A 28 5.216 3.766 -9.055 1.00 0.00 C ATOM 227 OH TYR A 28 4.758 2.951 -10.034 1.00 0.00 O ATOM 0 H TYR A 28 8.726 4.825 -5.281 1.00 0.00 H new ATOM 0 HA TYR A 28 7.748 7.244 -4.239 1.00 0.00 H new ATOM 0 HB2 TYR A 28 5.449 6.925 -5.559 1.00 0.00 H new ATOM 0 HB3 TYR A 28 6.786 7.461 -6.557 1.00 0.00 H new ATOM 0 HD1 TYR A 28 6.250 3.700 -5.834 1.00 0.00 H new ATOM 0 HD2 TYR A 28 5.901 7.029 -8.517 1.00 0.00 H new ATOM 0 HE1 TYR A 28 5.449 2.192 -7.622 1.00 0.00 H new ATOM 0 HE2 TYR A 28 5.176 5.505 -10.298 1.00 0.00 H new ATOM 0 HH TYR A 28 4.312 3.486 -10.723 1.00 0.00 H new ATOM 228 N CYS A 29 7.116 4.487 -3.314 1.00 0.00 N ATOM 229 CA CYS A 29 6.413 3.310 -2.786 1.00 0.00 C ATOM 230 C CYS A 29 5.366 3.595 -1.710 1.00 0.00 C ATOM 231 O CYS A 29 5.686 4.113 -0.647 1.00 0.00 O ATOM 232 CB CYS A 29 7.445 2.223 -2.441 1.00 0.00 C ATOM 233 SG CYS A 29 6.830 0.585 -2.850 1.00 0.00 S ATOM 0 H CYS A 29 8.129 4.364 -3.324 1.00 0.00 H new ATOM 0 HA CYS A 29 5.769 2.921 -3.575 1.00 0.00 H new ATOM 0 HB2 CYS A 29 8.371 2.412 -2.984 1.00 0.00 H new ATOM 0 HB3 CYS A 29 7.684 2.269 -1.378 1.00 0.00 H new ATOM 234 N GLY A 30 4.085 3.393 -2.025 1.00 0.00 N ATOM 235 CA GLY A 30 3.003 3.707 -1.089 1.00 0.00 C ATOM 236 C GLY A 30 2.572 5.168 -1.133 1.00 0.00 C ATOM 237 O GLY A 30 1.435 5.422 -1.543 1.00 0.00 O ATOM 0 H GLY A 30 3.772 3.014 -2.919 1.00 0.00 H new ATOM 0 HA2 GLY A 30 2.144 3.075 -1.313 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.325 3.461 -0.077 1.00 0.00 H new ATOM 238 N LEU A 31 3.431 6.129 -0.708 1.00 0.00 N ATOM 239 CA LEU A 31 3.019 7.525 -0.581 1.00 0.00 C ATOM 240 C LEU A 31 3.401 8.329 -1.789 1.00 0.00 C ATOM 241 O LEU A 31 2.571 8.760 -2.596 1.00 0.00 O ATOM 242 CB LEU A 31 3.183 8.054 0.858 1.00 0.00 C ATOM 243 CG LEU A 31 3.331 9.555 1.096 1.00 0.00 C ATOM 244 CD1 LEU A 31 2.212 10.458 0.582 1.00 0.00 C ATOM 245 CD2 LEU A 31 3.549 9.838 2.598 1.00 0.00 C ATOM 0 H LEU A 31 4.402 5.952 -0.453 1.00 0.00 H new ATOM 0 HA LEU A 31 1.939 7.654 -0.650 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.319 7.716 1.430 1.00 0.00 H new ATOM 0 HB3 LEU A 31 4.059 7.568 1.287 1.00 0.00 H new ATOM 0 HG LEU A 31 4.199 9.818 0.491 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.445 11.496 0.818 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.119 10.343 -0.498 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.272 10.180 1.059 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.653 10.912 2.755 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.694 9.470 3.165 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.454 9.333 2.936 1.00 0.00 H new ATOM 246 N GLY A 32 4.698 8.579 -1.776 1.00 0.00 N ATOM 247 CA GLY A 32 5.182 9.834 -2.342 1.00 0.00 C ATOM 248 C GLY A 32 5.011 10.136 -3.843 1.00 0.00 C ATOM 249 O GLY A 32 3.963 10.653 -4.236 1.00 0.00 O ATOM 0 H GLY A 32 5.414 7.960 -1.397 1.00 0.00 H new ATOM 0 HA2 GLY A 32 4.696 10.642 -1.795 1.00 0.00 H new ATOM 0 HA3 GLY A 32 6.248 9.896 -2.121 1.00 0.00 H new ATOM 250 N GLY A 33 6.032 9.829 -4.662 1.00 0.00 N ATOM 251 CA GLY A 33 6.104 10.256 -6.080 1.00 0.00 C ATOM 252 C GLY A 33 5.108 9.679 -7.104 1.00 0.00 C ATOM 253 O GLY A 33 3.998 9.271 -6.754 1.00 0.00 O ATOM 0 H GLY A 33 6.835 9.276 -4.363 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.998 11.341 -6.099 1.00 0.00 H new ATOM 0 HA3 GLY A 33 7.108 10.027 -6.438 1.00 0.00 H new ATOM 254 N SER A 34 5.507 9.700 -8.396 1.00 0.00 N ATOM 255 CA SER A 34 4.615 9.296 -9.522 1.00 0.00 C ATOM 256 C SER A 34 5.413 8.906 -10.805 1.00 0.00 C ATOM 257 O SER A 34 6.464 9.481 -11.106 1.00 0.00 O ATOM 258 CB SER A 34 3.635 10.461 -9.825 1.00 0.00 C ATOM 259 OG SER A 34 2.654 10.091 -10.788 1.00 0.00 O ATOM 0 H SER A 34 6.439 9.991 -8.691 1.00 0.00 H new ATOM 0 HA SER A 34 4.064 8.406 -9.219 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.141 10.769 -8.903 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.196 11.322 -10.190 1.00 0.00 H new ATOM 0 HG SER A 34 2.054 10.849 -10.952 1.00 0.00 H new ATOM 260 N GLY A 35 4.856 7.938 -11.556 1.00 0.00 N ATOM 261 CA GLY A 35 5.431 7.447 -12.826 1.00 0.00 C ATOM 262 C GLY A 35 5.286 5.916 -12.924 1.00 0.00 C ATOM 263 O GLY A 35 4.171 5.399 -13.031 1.00 0.00 O ATOM 0 H GLY A 35 3.987 7.470 -11.298 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.927 7.921 -13.668 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.483 7.724 -12.887 1.00 0.00 H new ATOM 264 N THR A 36 6.428 5.220 -12.870 1.00 0.00 N ATOM 265 CA THR A 36 6.514 3.744 -12.769 1.00 0.00 C ATOM 266 C THR A 36 7.604 3.377 -11.668 1.00 0.00 C ATOM 267 O THR A 36 8.362 4.257 -11.248 1.00 0.00 O ATOM 268 CB THR A 36 6.749 3.010 -14.132 1.00 0.00 C ATOM 269 OG1 THR A 36 6.884 3.882 -15.258 1.00 0.00 O ATOM 270 CG2 THR A 36 5.604 2.028 -14.428 1.00 0.00 C ATOM 0 H THR A 36 7.343 5.670 -12.895 1.00 0.00 H new ATOM 0 HA THR A 36 5.538 3.371 -12.458 1.00 0.00 H new ATOM 0 HB THR A 36 7.698 2.489 -14.003 1.00 0.00 H new ATOM 0 HG1 THR A 36 7.029 3.350 -16.068 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.789 1.530 -15.380 1.00 0.00 H new ATOM 0 HG22 THR A 36 5.548 1.284 -13.634 1.00 0.00 H new ATOM 0 HG23 THR A 36 4.662 2.573 -14.481 1.00 0.00 H new ATOM 271 N PRO A 37 7.709 2.128 -11.149 1.00 0.00 N ATOM 272 CA PRO A 37 8.604 1.786 -9.992 1.00 0.00 C ATOM 273 C PRO A 37 10.047 1.403 -10.421 1.00 0.00 C ATOM 274 O PRO A 37 10.542 1.840 -11.465 1.00 0.00 O ATOM 275 CB PRO A 37 7.776 0.583 -9.434 1.00 0.00 C ATOM 276 CG PRO A 37 7.386 -0.177 -10.706 1.00 0.00 C ATOM 277 CD PRO A 37 6.915 0.964 -11.594 1.00 0.00 C ATOM 0 HA PRO A 37 8.805 2.592 -9.287 1.00 0.00 H new ATOM 0 HB2 PRO A 37 8.366 -0.036 -8.758 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.900 0.918 -8.878 1.00 0.00 H new ATOM 0 HG2 PRO A 37 8.229 -0.716 -11.139 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.599 -0.909 -10.524 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.088 0.745 -12.648 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.846 1.144 -11.477 1.00 0.00 H new ATOM 278 N VAL A 38 10.687 0.559 -9.598 1.00 0.00 N ATOM 279 CA VAL A 38 12.012 -0.021 -9.863 1.00 0.00 C ATOM 280 C VAL A 38 11.997 -1.582 -9.602 1.00 0.00 C ATOM 281 O VAL A 38 12.305 -2.388 -10.481 1.00 0.00 O ATOM 282 CB VAL A 38 13.157 0.717 -9.090 1.00 0.00 C ATOM 283 CG1 VAL A 38 12.960 2.226 -8.845 1.00 0.00 C ATOM 284 CG2 VAL A 38 13.484 0.233 -7.655 1.00 0.00 C ATOM 0 H VAL A 38 10.289 0.254 -8.710 1.00 0.00 H new ATOM 0 HA VAL A 38 12.238 0.131 -10.918 1.00 0.00 H new ATOM 0 HB VAL A 38 13.943 0.480 -9.807 1.00 0.00 H new ATOM 0 HG11 VAL A 38 13.818 2.622 -8.302 1.00 0.00 H new ATOM 0 HG12 VAL A 38 12.867 2.741 -9.801 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.055 2.384 -8.258 1.00 0.00 H new ATOM 0 HG21 VAL A 38 14.295 0.834 -7.244 1.00 0.00 H new ATOM 0 HG22 VAL A 38 12.600 0.337 -7.026 1.00 0.00 H new ATOM 0 HG23 VAL A 38 13.787 -0.814 -7.684 1.00 0.00 H new ATOM 285 N ASP A 39 11.649 -1.901 -8.351 1.00 0.00 N ATOM 286 CA ASP A 39 11.707 -3.249 -7.749 1.00 0.00 C ATOM 287 C ASP A 39 10.442 -4.044 -8.001 1.00 0.00 C ATOM 288 O ASP A 39 9.396 -3.460 -8.294 1.00 0.00 O ATOM 289 CB ASP A 39 12.084 -3.109 -6.245 1.00 0.00 C ATOM 290 CG ASP A 39 12.912 -4.280 -5.705 1.00 0.00 C ATOM 291 OD1 ASP A 39 14.189 -4.276 -6.208 1.00 0.00 O ATOM 292 OD2 ASP A 39 12.479 -5.126 -4.927 1.00 0.00 O ATOM 0 H ASP A 39 11.303 -1.200 -7.696 1.00 0.00 H new ATOM 0 HA ASP A 39 12.486 -3.838 -8.233 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.644 -2.185 -6.105 1.00 0.00 H new ATOM 0 HB3 ASP A 39 11.170 -3.020 -5.657 1.00 0.00 H new ATOM 293 N GLU A 40 10.522 -5.392 -7.820 1.00 0.00 N ATOM 294 CA GLU A 40 9.299 -6.175 -7.554 1.00 0.00 C ATOM 295 C GLU A 40 8.468 -5.559 -6.381 1.00 0.00 C ATOM 296 O GLU A 40 7.250 -5.403 -6.479 1.00 0.00 O ATOM 297 CB GLU A 40 9.480 -7.647 -7.134 1.00 0.00 C ATOM 298 CG GLU A 40 8.251 -8.445 -7.588 1.00 0.00 C ATOM 299 CD GLU A 40 8.288 -8.948 -9.016 1.00 0.00 C ATOM 300 OE1 GLU A 40 8.979 -9.899 -9.380 1.00 0.00 O ATOM 301 OE2 GLU A 40 7.466 -8.227 -9.844 1.00 0.00 O ATOM 0 H GLU A 40 11.386 -5.934 -7.853 1.00 0.00 H new ATOM 0 HA GLU A 40 8.818 -6.139 -8.531 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.384 -8.059 -7.582 1.00 0.00 H new ATOM 0 HB3 GLU A 40 9.599 -7.719 -6.053 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.130 -9.300 -6.923 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.368 -7.818 -7.465 1.00 0.00 H new ATOM 302 N LEU A 41 9.182 -5.206 -5.303 1.00 0.00 N ATOM 303 CA LEU A 41 8.616 -4.496 -4.186 1.00 0.00 C ATOM 304 C LEU A 41 7.960 -3.146 -4.492 1.00 0.00 C ATOM 305 O LEU A 41 6.836 -2.899 -4.045 1.00 0.00 O ATOM 306 CB LEU A 41 9.723 -4.601 -3.139 1.00 0.00 C ATOM 307 CG LEU A 41 9.412 -4.277 -1.690 1.00 0.00 C ATOM 308 CD1 LEU A 41 9.957 -2.974 -1.177 1.00 0.00 C ATOM 309 CD2 LEU A 41 7.970 -4.613 -1.391 1.00 0.00 C ATOM 0 H LEU A 41 10.175 -5.415 -5.197 1.00 0.00 H new ATOM 0 HA LEU A 41 7.692 -4.924 -3.797 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.107 -5.620 -3.171 1.00 0.00 H new ATOM 0 HB3 LEU A 41 10.534 -3.945 -3.454 1.00 0.00 H new ATOM 0 HG LEU A 41 10.003 -4.936 -1.054 1.00 0.00 H new ATOM 0 HD11 LEU A 41 9.674 -2.847 -0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 41 11.044 -2.976 -1.261 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.549 -2.152 -1.766 1.00 0.00 H new ATOM 0 HD21 LEU A 41 7.750 -4.379 -0.349 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.318 -4.028 -2.040 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.800 -5.675 -1.568 1.00 0.00 H new ATOM 310 N ASP A 42 8.609 -2.317 -5.324 1.00 0.00 N ATOM 311 CA ASP A 42 7.994 -1.096 -5.877 1.00 0.00 C ATOM 312 C ASP A 42 6.796 -1.310 -6.871 1.00 0.00 C ATOM 313 O ASP A 42 5.988 -0.392 -7.002 1.00 0.00 O ATOM 314 CB ASP A 42 9.058 -0.126 -6.407 1.00 0.00 C ATOM 315 CG ASP A 42 9.989 0.521 -5.386 1.00 0.00 C ATOM 316 OD1 ASP A 42 10.964 -0.335 -4.945 1.00 0.00 O ATOM 317 OD2 ASP A 42 9.880 1.693 -5.027 1.00 0.00 O ATOM 0 H ASP A 42 9.569 -2.471 -5.632 1.00 0.00 H new ATOM 0 HA ASP A 42 7.502 -0.627 -5.025 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.672 -0.662 -7.131 1.00 0.00 H new ATOM 0 HB3 ASP A 42 8.548 0.670 -6.950 1.00 0.00 H new ATOM 318 N ARG A 43 6.643 -2.479 -7.521 1.00 0.00 N ATOM 319 CA ARG A 43 5.460 -2.806 -8.362 1.00 0.00 C ATOM 320 C ARG A 43 4.109 -2.879 -7.577 1.00 0.00 C ATOM 321 O ARG A 43 3.104 -2.404 -8.109 1.00 0.00 O ATOM 322 CB ARG A 43 5.535 -4.247 -8.935 1.00 0.00 C ATOM 323 CG ARG A 43 6.742 -4.667 -9.719 1.00 0.00 C ATOM 324 CD ARG A 43 7.222 -3.788 -10.840 1.00 0.00 C ATOM 325 NE ARG A 43 6.118 -3.334 -11.689 1.00 0.00 N ATOM 326 CZ ARG A 43 6.265 -2.739 -12.887 1.00 0.00 C ATOM 327 NH1 ARG A 43 7.441 -2.503 -13.464 1.00 0.00 N ATOM 328 NH2 ARG A 43 5.175 -2.360 -13.526 1.00 0.00 N ATOM 0 H ARG A 43 7.333 -3.229 -7.482 1.00 0.00 H new ATOM 0 HA ARG A 43 5.481 -2.006 -9.102 1.00 0.00 H new ATOM 0 HB2 ARG A 43 5.433 -4.937 -8.098 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.664 -4.390 -9.574 1.00 0.00 H new ATOM 0 HG2 ARG A 43 7.567 -4.785 -9.016 1.00 0.00 H new ATOM 0 HG3 ARG A 43 6.537 -5.652 -10.138 1.00 0.00 H new ATOM 0 HD2 ARG A 43 7.741 -2.923 -10.427 1.00 0.00 H new ATOM 0 HD3 ARG A 43 7.945 -4.334 -11.446 1.00 0.00 H new ATOM 0 HE ARG A 43 5.168 -3.480 -11.347 1.00 0.00 H new ATOM 0 HH11 ARG A 43 8.304 -2.778 -12.995 1.00 0.00 H new ATOM 0 HH12 ARG A 43 7.479 -2.047 -14.376 1.00 0.00 H new ATOM 0 HH21 ARG A 43 4.258 -2.521 -13.110 1.00 0.00 H new ATOM 0 HH22 ARG A 43 5.249 -1.906 -14.436 1.00 0.00 H new ATOM 329 N CYS A 44 4.073 -3.507 -6.369 1.00 0.00 N ATOM 330 CA CYS A 44 2.881 -3.440 -5.506 1.00 0.00 C ATOM 331 C CYS A 44 2.553 -2.013 -4.964 1.00 0.00 C ATOM 332 O CYS A 44 1.502 -1.883 -4.360 1.00 0.00 O ATOM 333 CB CYS A 44 3.017 -4.400 -4.328 1.00 0.00 C ATOM 334 SG CYS A 44 3.422 -6.079 -4.809 1.00 0.00 S ATOM 0 H CYS A 44 4.844 -4.053 -5.985 1.00 0.00 H new ATOM 0 HA CYS A 44 2.050 -3.729 -6.150 1.00 0.00 H new ATOM 0 HB2 CYS A 44 3.790 -4.028 -3.655 1.00 0.00 H new ATOM 0 HB3 CYS A 44 2.082 -4.408 -3.767 1.00 0.00 H new ATOM 335 N CYS A 45 3.423 -1.010 -5.163 1.00 0.00 N ATOM 336 CA CYS A 45 3.105 0.412 -5.055 1.00 0.00 C ATOM 337 C CYS A 45 2.630 1.049 -6.391 1.00 0.00 C ATOM 338 O CYS A 45 1.864 2.009 -6.280 1.00 0.00 O ATOM 339 CB CYS A 45 4.336 1.161 -4.571 1.00 0.00 C ATOM 340 SG CYS A 45 4.843 0.570 -2.954 1.00 0.00 S ATOM 0 H CYS A 45 4.398 -1.178 -5.411 1.00 0.00 H new ATOM 0 HA CYS A 45 2.278 0.493 -4.350 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.151 1.030 -5.283 1.00 0.00 H new ATOM 0 HB3 CYS A 45 4.123 2.229 -4.523 1.00 0.00 H new ATOM 341 N GLU A 46 3.020 0.590 -7.627 1.00 0.00 N ATOM 342 CA GLU A 46 2.268 0.993 -8.857 1.00 0.00 C ATOM 343 C GLU A 46 0.763 0.566 -8.782 1.00 0.00 C ATOM 344 O GLU A 46 -0.095 1.326 -9.217 1.00 0.00 O ATOM 345 CB GLU A 46 2.956 0.391 -10.105 1.00 0.00 C ATOM 346 CG GLU A 46 2.376 0.769 -11.478 1.00 0.00 C ATOM 347 CD GLU A 46 2.376 2.245 -11.856 1.00 0.00 C ATOM 348 OE1 GLU A 46 1.485 2.986 -11.123 1.00 0.00 O ATOM 349 OE2 GLU A 46 3.084 2.711 -12.743 1.00 0.00 O ATOM 0 H GLU A 46 3.813 -0.030 -7.791 1.00 0.00 H new ATOM 0 HA GLU A 46 2.284 2.080 -8.930 1.00 0.00 H new ATOM 0 HB2 GLU A 46 4.005 0.687 -10.088 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.930 -0.695 -10.014 1.00 0.00 H new ATOM 0 HG2 GLU A 46 2.934 0.226 -12.241 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.347 0.410 -11.520 1.00 0.00 H new ATOM 350 N THR A 47 0.502 -0.619 -8.216 1.00 0.00 N ATOM 351 CA THR A 47 -0.842 -1.139 -7.915 1.00 0.00 C ATOM 352 C THR A 47 -1.369 -0.783 -6.490 1.00 0.00 C ATOM 353 O THR A 47 -2.583 -0.875 -6.323 1.00 0.00 O ATOM 354 CB THR A 47 -0.710 -2.670 -8.171 1.00 0.00 C ATOM 355 OG1 THR A 47 -0.513 -2.905 -9.568 1.00 0.00 O ATOM 356 CG2 THR A 47 -1.892 -3.531 -7.752 1.00 0.00 C ATOM 0 H THR A 47 1.243 -1.265 -7.945 1.00 0.00 H new ATOM 0 HA THR A 47 -1.603 -0.676 -8.543 1.00 0.00 H new ATOM 0 HB THR A 47 0.133 -2.964 -7.546 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.428 -3.868 -9.729 1.00 0.00 H new ATOM 0 HG21 THR A 47 -1.681 -4.575 -7.981 1.00 0.00 H new ATOM 0 HG22 THR A 47 -2.060 -3.421 -6.681 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.783 -3.214 -8.294 1.00 0.00 H new ATOM 357 N HIS A 48 -0.573 -0.369 -5.478 1.00 0.00 N ATOM 358 CA HIS A 48 -1.148 0.320 -4.267 1.00 0.00 C ATOM 359 C HIS A 48 -1.163 1.859 -4.584 1.00 0.00 C ATOM 360 O HIS A 48 -0.391 2.673 -4.075 1.00 0.00 O ATOM 361 CB HIS A 48 -0.463 -0.060 -2.937 1.00 0.00 C ATOM 362 CG HIS A 48 -1.479 -0.070 -1.776 1.00 0.00 C ATOM 363 ND1 HIS A 48 -1.506 0.882 -0.763 1.00 0.00 N ATOM 364 CD2 HIS A 48 -2.553 -0.976 -1.626 1.00 0.00 C ATOM 365 CE1 HIS A 48 -2.625 0.457 -0.115 1.00 0.00 C ATOM 366 NE2 HIS A 48 -3.386 -0.531 -0.643 1.00 0.00 N ATOM 0 H HIS A 48 0.440 -0.488 -5.459 1.00 0.00 H new ATOM 0 HA HIS A 48 -2.166 -0.025 -4.088 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -0.001 -1.043 -3.029 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.336 0.649 -2.720 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.692 -1.880 -2.200 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -2.907 0.910 0.824 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -4.318 -0.851 -0.380 1.00 0.00 H new ATOM 367 N ASP A 49 -2.091 2.130 -5.503 1.00 0.00 N ATOM 368 CA ASP A 49 -2.232 3.315 -6.347 1.00 0.00 C ATOM 369 C ASP A 49 -3.274 2.781 -7.422 1.00 0.00 C ATOM 370 O ASP A 49 -4.373 3.318 -7.430 1.00 0.00 O ATOM 371 CB ASP A 49 -0.961 3.713 -7.109 1.00 0.00 C ATOM 372 CG ASP A 49 -0.009 4.693 -6.458 1.00 0.00 C ATOM 373 OD1 ASP A 49 -0.270 5.356 -5.453 1.00 0.00 O ATOM 374 OD2 ASP A 49 1.184 4.757 -7.131 1.00 0.00 O ATOM 0 H ASP A 49 -2.835 1.458 -5.692 1.00 0.00 H new ATOM 0 HA ASP A 49 -2.498 4.193 -5.758 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -0.403 2.801 -7.324 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -1.266 4.133 -8.067 1.00 0.00 H new ATOM 375 N ASN A 50 -2.936 1.761 -8.275 1.00 0.00 N ATOM 376 CA ASN A 50 -3.813 1.284 -9.373 1.00 0.00 C ATOM 377 C ASN A 50 -4.945 0.289 -9.028 1.00 0.00 C ATOM 378 O ASN A 50 -5.992 0.345 -9.678 1.00 0.00 O ATOM 379 CB ASN A 50 -3.067 0.888 -10.665 1.00 0.00 C ATOM 380 CG ASN A 50 -2.244 2.006 -11.326 1.00 0.00 C ATOM 381 OD1 ASN A 50 -2.518 3.198 -11.210 1.00 0.00 O ATOM 382 ND2 ASN A 50 -1.191 1.643 -12.028 1.00 0.00 N ATOM 0 H ASN A 50 -2.052 1.256 -8.213 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.358 2.206 -9.574 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -2.400 0.056 -10.438 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.797 0.523 -11.387 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.606 2.350 -12.473 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -0.960 0.654 -12.127 1.00 0.00 H new ATOM 383 N CYS A 51 -4.766 -0.606 -8.052 1.00 0.00 N ATOM 384 CA CYS A 51 -5.917 -1.184 -7.322 1.00 0.00 C ATOM 385 C CYS A 51 -6.322 -0.354 -6.063 1.00 0.00 C ATOM 386 O CYS A 51 -7.263 -0.794 -5.393 1.00 0.00 O ATOM 387 CB CYS A 51 -5.702 -2.671 -6.976 1.00 0.00 C ATOM 388 SG CYS A 51 -4.491 -3.045 -5.694 1.00 0.00 S ATOM 0 H CYS A 51 -3.854 -0.947 -7.747 1.00 0.00 H new ATOM 0 HA CYS A 51 -6.760 -1.130 -8.011 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -6.661 -3.090 -6.669 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -5.404 -3.191 -7.886 1.00 0.00 H new ATOM 389 N TYR A 52 -5.678 0.811 -5.723 1.00 0.00 N ATOM 390 CA TYR A 52 -6.032 1.528 -4.453 1.00 0.00 C ATOM 391 C TYR A 52 -7.170 2.536 -4.677 1.00 0.00 C ATOM 392 O TYR A 52 -8.143 2.567 -3.917 1.00 0.00 O ATOM 393 CB TYR A 52 -4.811 2.188 -3.778 1.00 0.00 C ATOM 394 CG TYR A 52 -4.867 2.536 -2.290 1.00 0.00 C ATOM 395 CD1 TYR A 52 -5.917 2.082 -1.493 1.00 0.00 C ATOM 396 CD2 TYR A 52 -3.818 3.259 -1.675 1.00 0.00 C ATOM 397 CE1 TYR A 52 -5.874 2.230 -0.125 1.00 0.00 C ATOM 398 CE2 TYR A 52 -3.819 3.468 -0.289 1.00 0.00 C ATOM 399 CZ TYR A 52 -4.839 2.911 0.483 1.00 0.00 C ATOM 400 OH TYR A 52 -4.795 2.915 1.833 1.00 0.00 O ATOM 0 H TYR A 52 -4.947 1.254 -6.280 1.00 0.00 H new ATOM 0 HA TYR A 52 -6.391 0.769 -3.758 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -3.959 1.525 -3.926 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.597 3.109 -4.320 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -6.772 1.610 -1.953 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -3.012 3.652 -2.277 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -6.662 1.807 0.481 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -3.039 4.053 0.176 1.00 0.00 H new ATOM 0 HH TYR A 52 -4.733 1.994 2.161 1.00 0.00 H new ATOM 401 N ARG A 53 -7.018 3.337 -5.732 1.00 0.00 N ATOM 402 CA ARG A 53 -8.052 4.165 -6.308 1.00 0.00 C ATOM 403 C ARG A 53 -9.458 3.573 -6.450 1.00 0.00 C ATOM 404 O ARG A 53 -10.409 4.242 -6.059 1.00 0.00 O ATOM 405 CB ARG A 53 -7.358 4.746 -7.554 1.00 0.00 C ATOM 406 CG ARG A 53 -7.891 4.244 -8.861 1.00 0.00 C ATOM 407 CD ARG A 53 -7.122 3.107 -9.433 1.00 0.00 C ATOM 408 NE ARG A 53 -6.500 3.473 -10.716 1.00 0.00 N ATOM 409 CZ ARG A 53 -5.510 4.361 -10.929 1.00 0.00 C ATOM 410 NH1 ARG A 53 -4.894 5.045 -9.972 1.00 0.00 N ATOM 411 NH2 ARG A 53 -5.136 4.572 -12.175 1.00 0.00 N ATOM 0 H ARG A 53 -6.128 3.423 -6.222 1.00 0.00 H new ATOM 0 HA ARG A 53 -8.387 4.950 -5.630 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -7.452 5.832 -7.532 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -6.294 4.517 -7.500 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.927 3.936 -8.724 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -7.895 5.064 -9.579 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.351 2.796 -8.728 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.784 2.254 -9.578 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.862 2.997 -11.542 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -5.164 4.914 -8.997 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -4.151 5.702 -10.212 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -5.593 4.070 -12.937 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -4.390 5.237 -12.378 1.00 0.00 H new ATOM 412 N ASP A 54 -9.553 2.371 -7.045 1.00 0.00 N ATOM 413 CA ASP A 54 -10.758 1.954 -7.835 1.00 0.00 C ATOM 414 C ASP A 54 -12.106 1.710 -7.119 1.00 0.00 C ATOM 415 O ASP A 54 -13.116 1.410 -7.745 1.00 0.00 O ATOM 416 CB ASP A 54 -10.339 0.738 -8.667 1.00 0.00 C ATOM 417 CG ASP A 54 -11.069 0.534 -9.987 1.00 0.00 C ATOM 418 OD1 ASP A 54 -10.739 1.095 -11.031 1.00 0.00 O ATOM 419 OD2 ASP A 54 -12.126 -0.333 -9.877 1.00 0.00 O ATOM 0 H ASP A 54 -8.820 1.663 -7.003 1.00 0.00 H new ATOM 0 HA ASP A 54 -11.026 2.835 -8.419 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -9.272 0.819 -8.876 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -10.478 -0.156 -8.059 1.00 0.00 H new ATOM 420 N ALA A 55 -12.049 1.900 -5.808 1.00 0.00 N ATOM 421 CA ALA A 55 -13.170 2.333 -4.956 1.00 0.00 C ATOM 422 C ALA A 55 -13.977 3.548 -5.536 1.00 0.00 C ATOM 423 O ALA A 55 -15.209 3.535 -5.523 1.00 0.00 O ATOM 424 CB ALA A 55 -12.494 2.846 -3.655 1.00 0.00 C ATOM 0 H ALA A 55 -11.190 1.753 -5.279 1.00 0.00 H new ATOM 0 HA ALA A 55 -13.868 1.504 -4.843 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -13.259 3.190 -2.959 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -11.925 2.037 -3.197 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -11.823 3.671 -3.894 1.00 0.00 H new ATOM 425 N LYS A 56 -13.244 4.554 -6.062 1.00 0.00 N ATOM 426 CA LYS A 56 -13.761 5.632 -6.909 1.00 0.00 C ATOM 427 C LYS A 56 -14.656 5.268 -8.101 1.00 0.00 C ATOM 428 O LYS A 56 -15.586 6.002 -8.438 1.00 0.00 O ATOM 429 CB LYS A 56 -12.607 6.601 -7.195 1.00 0.00 C ATOM 430 CG LYS A 56 -11.653 6.136 -8.273 1.00 0.00 C ATOM 431 CD LYS A 56 -10.314 6.818 -8.046 1.00 0.00 C ATOM 432 CE LYS A 56 -9.508 7.156 -9.299 1.00 0.00 C ATOM 433 NZ LYS A 56 -9.992 8.353 -10.011 1.00 0.00 N ATOM 0 H LYS A 56 -12.240 4.633 -5.898 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.537 6.139 -6.336 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -13.022 7.566 -7.486 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -12.046 6.760 -6.274 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -11.539 5.053 -8.238 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -12.044 6.384 -9.260 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -10.489 7.740 -7.492 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -9.705 6.175 -7.410 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -8.465 7.307 -9.020 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -9.535 6.304 -9.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -9.399 8.522 -10.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -10.978 8.205 -10.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -9.941 9.177 -9.379 1.00 0.00 H new ATOM 434 N ASN A 57 -14.324 4.124 -8.731 1.00 0.00 N ATOM 435 CA ASN A 57 -15.058 3.551 -9.889 1.00 0.00 C ATOM 436 C ASN A 57 -16.053 2.383 -9.553 1.00 0.00 C ATOM 437 O ASN A 57 -16.900 2.055 -10.385 1.00 0.00 O ATOM 438 CB ASN A 57 -13.908 2.999 -10.784 1.00 0.00 C ATOM 439 CG ASN A 57 -14.264 2.599 -12.210 1.00 0.00 C ATOM 440 OD1 ASN A 57 -15.157 3.155 -12.849 1.00 0.00 O ATOM 441 ND2 ASN A 57 -13.538 1.643 -12.759 1.00 0.00 N ATOM 0 H ASN A 57 -13.524 3.558 -8.448 1.00 0.00 H new ATOM 0 HA ASN A 57 -15.697 4.312 -10.336 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -13.125 3.755 -10.831 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -13.481 2.129 -10.286 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -13.714 1.358 -13.722 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -12.801 1.189 -12.220 1.00 0.00 H new ATOM 442 N LEU A 58 -15.888 1.795 -8.361 1.00 0.00 N ATOM 443 CA LEU A 58 -16.477 0.517 -7.901 1.00 0.00 C ATOM 444 C LEU A 58 -17.891 0.154 -8.311 1.00 0.00 C ATOM 445 O LEU A 58 -18.808 0.973 -8.382 1.00 0.00 O ATOM 446 CB LEU A 58 -16.088 0.394 -6.413 1.00 0.00 C ATOM 447 CG LEU A 58 -16.057 -0.903 -5.636 1.00 0.00 C ATOM 448 CD1 LEU A 58 -15.320 -1.960 -6.409 1.00 0.00 C ATOM 449 CD2 LEU A 58 -15.299 -0.731 -4.304 1.00 0.00 C ATOM 0 H LEU A 58 -15.304 2.221 -7.642 1.00 0.00 H new ATOM 0 HA LEU A 58 -16.051 -0.303 -8.479 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -15.089 0.820 -6.327 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -16.764 1.054 -5.870 1.00 0.00 H new ATOM 0 HG LEU A 58 -17.094 -1.190 -5.459 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -15.307 -2.887 -5.836 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -15.821 -2.130 -7.362 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -14.297 -1.631 -6.591 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -15.291 -1.678 -3.765 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -14.274 -0.420 -4.506 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -15.795 0.027 -3.698 1.00 0.00 H new ATOM 450 N ASP A 59 -17.991 -1.151 -8.588 1.00 0.00 N ATOM 451 CA ASP A 59 -19.267 -1.868 -8.783 1.00 0.00 C ATOM 452 C ASP A 59 -20.183 -1.802 -7.520 1.00 0.00 C ATOM 453 O ASP A 59 -21.410 -1.754 -7.628 1.00 0.00 O ATOM 454 CB ASP A 59 -18.835 -3.368 -8.910 1.00 0.00 C ATOM 455 CG ASP A 59 -18.375 -3.792 -10.295 1.00 0.00 C ATOM 456 OD1 ASP A 59 -19.427 -4.093 -11.121 1.00 0.00 O ATOM 457 OD2 ASP A 59 -17.191 -3.851 -10.626 1.00 0.00 O ATOM 0 H ASP A 59 -17.175 -1.754 -8.686 1.00 0.00 H new ATOM 0 HA ASP A 59 -19.811 -1.446 -9.628 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -18.028 -3.559 -8.202 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -19.674 -3.998 -8.614 1.00 0.00 H new ATOM 458 N SER A 60 -19.517 -1.861 -6.360 1.00 0.00 N ATOM 459 CA SER A 60 -20.141 -1.850 -5.043 1.00 0.00 C ATOM 460 C SER A 60 -20.165 -0.423 -4.474 1.00 0.00 C ATOM 461 O SER A 60 -21.073 -0.125 -3.694 1.00 0.00 O ATOM 462 CB SER A 60 -19.253 -2.816 -4.252 1.00 0.00 C ATOM 463 OG SER A 60 -19.942 -3.338 -3.128 1.00 0.00 O ATOM 0 H SER A 60 -18.500 -1.919 -6.317 1.00 0.00 H new ATOM 0 HA SER A 60 -21.187 -2.156 -5.025 1.00 0.00 H new ATOM 0 HB2 SER A 60 -18.933 -3.633 -4.898 1.00 0.00 H new ATOM 0 HB3 SER A 60 -18.352 -2.299 -3.922 1.00 0.00 H new ATOM 0 HG SER A 60 -19.857 -4.314 -3.117 1.00 0.00 H new ATOM 464 N CYS A 61 -19.192 0.445 -4.871 1.00 0.00 N ATOM 465 CA CYS A 61 -19.217 1.865 -4.486 1.00 0.00 C ATOM 466 C CYS A 61 -19.232 2.716 -5.774 1.00 0.00 C ATOM 467 O CYS A 61 -18.188 3.058 -6.338 1.00 0.00 O ATOM 468 CB CYS A 61 -18.062 2.135 -3.520 1.00 0.00 C ATOM 469 SG CYS A 61 -18.761 2.419 -1.875 1.00 0.00 S ATOM 0 H CYS A 61 -18.395 0.180 -5.450 1.00 0.00 H new ATOM 0 HA CYS A 61 -20.117 2.145 -3.938 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -17.376 1.288 -3.501 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -17.489 3.003 -3.845 1.00 0.00 H new ATOM 470 N LYS A 62 -20.456 3.054 -6.217 1.00 0.00 N ATOM 471 CA LYS A 62 -20.695 3.836 -7.458 1.00 0.00 C ATOM 472 C LYS A 62 -20.218 5.327 -7.407 1.00 0.00 C ATOM 473 O LYS A 62 -19.755 5.824 -8.436 1.00 0.00 O ATOM 474 CB LYS A 62 -22.203 3.824 -7.828 1.00 0.00 C ATOM 475 CG LYS A 62 -22.854 2.471 -8.156 1.00 0.00 C ATOM 476 CD LYS A 62 -22.807 2.011 -9.619 1.00 0.00 C ATOM 477 CE LYS A 62 -21.474 1.413 -10.076 1.00 0.00 C ATOM 478 NZ LYS A 62 -21.567 0.879 -11.446 1.00 0.00 N ATOM 0 H LYS A 62 -21.313 2.795 -5.729 1.00 0.00 H new ATOM 0 HA LYS A 62 -20.089 3.335 -8.212 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -22.754 4.267 -6.999 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -22.341 4.479 -8.689 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -22.373 1.707 -7.545 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -23.899 2.514 -7.848 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -23.591 1.270 -9.775 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -23.042 2.862 -10.258 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -20.697 2.176 -10.033 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -21.177 0.617 -9.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -20.648 0.481 -11.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -22.292 0.134 -11.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -21.827 1.645 -12.100 1.00 0.00 H new ATOM 479 N PHE A 63 -20.313 5.999 -6.243 1.00 0.00 N ATOM 480 CA PHE A 63 -19.900 7.400 -6.039 1.00 0.00 C ATOM 481 C PHE A 63 -18.485 7.790 -6.532 1.00 0.00 C ATOM 482 O PHE A 63 -17.541 6.996 -6.461 1.00 0.00 O ATOM 483 CB PHE A 63 -20.016 7.658 -4.494 1.00 0.00 C ATOM 484 CG PHE A 63 -20.733 8.967 -4.177 1.00 0.00 C ATOM 485 CD1 PHE A 63 -22.131 9.029 -4.262 1.00 0.00 C ATOM 486 CD2 PHE A 63 -20.020 10.125 -3.850 1.00 0.00 C ATOM 487 CE1 PHE A 63 -22.803 10.230 -4.044 1.00 0.00 C ATOM 488 CE2 PHE A 63 -20.692 11.327 -3.631 1.00 0.00 C ATOM 489 CZ PHE A 63 -22.084 11.381 -3.729 1.00 0.00 C ATOM 0 H PHE A 63 -20.689 5.571 -5.397 1.00 0.00 H new ATOM 0 HA PHE A 63 -20.552 8.022 -6.653 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -20.553 6.831 -4.029 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -19.018 7.677 -4.055 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -22.692 8.137 -4.499 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -18.944 10.088 -3.767 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -23.880 10.269 -4.119 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -20.134 12.219 -3.385 1.00 0.00 H new ATOM 0 HZ PHE A 63 -22.602 12.313 -3.561 1.00 0.00 H new ATOM 490 N LEU A 64 -18.381 9.042 -6.998 1.00 0.00 N ATOM 491 CA LEU A 64 -17.121 9.646 -7.479 1.00 0.00 C ATOM 492 C LEU A 64 -15.940 9.636 -6.479 1.00 0.00 C ATOM 493 O LEU A 64 -14.831 9.218 -6.818 1.00 0.00 O ATOM 494 CB LEU A 64 -17.127 11.105 -8.097 1.00 0.00 C ATOM 495 CG LEU A 64 -18.420 11.888 -8.302 1.00 0.00 C ATOM 496 CD1 LEU A 64 -19.417 11.284 -9.277 1.00 0.00 C ATOM 497 CD2 LEU A 64 -19.058 12.149 -6.936 1.00 0.00 C ATOM 0 H LEU A 64 -19.178 9.676 -7.054 1.00 0.00 H new ATOM 0 HA LEU A 64 -16.990 8.936 -8.296 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -16.485 11.718 -7.464 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.643 11.036 -9.071 1.00 0.00 H new ATOM 0 HG LEU A 64 -18.136 12.821 -8.788 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -20.296 11.925 -9.343 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.957 11.197 -10.261 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -19.714 10.295 -8.927 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -19.984 12.709 -7.068 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -19.275 11.199 -6.448 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -18.370 12.726 -6.318 1.00 0.00 H new ATOM 498 N VAL A 65 -16.215 10.203 -5.293 1.00 0.00 N ATOM 499 CA VAL A 65 -15.164 10.951 -4.534 1.00 0.00 C ATOM 500 C VAL A 65 -14.875 10.379 -3.144 1.00 0.00 C ATOM 501 O VAL A 65 -15.117 10.930 -2.068 1.00 0.00 O ATOM 502 CB VAL A 65 -15.568 12.433 -4.673 1.00 0.00 C ATOM 503 CG1 VAL A 65 -16.767 12.889 -3.857 1.00 0.00 C ATOM 504 CG2 VAL A 65 -14.397 13.408 -4.688 1.00 0.00 C ATOM 0 H VAL A 65 -17.127 10.168 -4.837 1.00 0.00 H new ATOM 0 HA VAL A 65 -14.158 10.838 -4.937 1.00 0.00 H new ATOM 0 HB VAL A 65 -15.965 12.468 -5.687 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -16.950 13.948 -4.040 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -17.645 12.313 -4.148 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -16.566 12.734 -2.797 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -14.773 14.426 -4.789 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -13.837 13.318 -3.757 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -13.743 13.178 -5.529 1.00 0.00 H new ATOM 505 N ASP A 66 -14.272 9.220 -3.322 1.00 0.00 N ATOM 506 CA ASP A 66 -13.722 8.353 -2.267 1.00 0.00 C ATOM 507 C ASP A 66 -12.341 8.842 -1.721 1.00 0.00 C ATOM 508 O ASP A 66 -12.141 8.764 -0.508 1.00 0.00 O ATOM 509 CB ASP A 66 -13.530 6.884 -2.752 1.00 0.00 C ATOM 510 CG ASP A 66 -14.818 6.094 -2.993 1.00 0.00 C ATOM 511 OD1 ASP A 66 -15.517 6.542 -4.086 1.00 0.00 O ATOM 512 OD2 ASP A 66 -15.172 5.150 -2.289 1.00 0.00 O ATOM 0 H ASP A 66 -14.139 8.825 -4.253 1.00 0.00 H new ATOM 0 HA ASP A 66 -14.465 8.401 -1.471 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -12.955 6.898 -3.678 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -12.931 6.352 -2.013 1.00 0.00 H new ATOM 513 N ASN A 67 -11.425 9.286 -2.613 1.00 0.00 N ATOM 514 CA ASN A 67 -10.021 9.636 -2.293 1.00 0.00 C ATOM 515 C ASN A 67 -9.181 8.319 -2.304 1.00 0.00 C ATOM 516 O ASN A 67 -9.512 7.440 -1.500 1.00 0.00 O ATOM 517 CB ASN A 67 -9.719 10.483 -1.031 1.00 0.00 C ATOM 518 CG ASN A 67 -10.373 11.868 -1.024 1.00 0.00 C ATOM 519 OD1 ASN A 67 -9.965 12.766 -1.759 1.00 0.00 O ATOM 520 ND2 ASN A 67 -11.389 12.076 -0.204 1.00 0.00 N ATOM 0 H ASN A 67 -11.647 9.414 -3.600 1.00 0.00 H new ATOM 0 HA ASN A 67 -9.737 10.340 -3.075 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -10.053 9.933 -0.151 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -8.640 10.604 -0.940 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -11.843 12.989 -0.176 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -11.719 11.324 0.401 1.00 0.00 H new ATOM 521 N PRO A 68 -8.117 8.127 -3.133 1.00 0.00 N ATOM 522 CA PRO A 68 -7.310 6.864 -3.147 1.00 0.00 C ATOM 523 C PRO A 68 -6.674 6.300 -1.855 1.00 0.00 C ATOM 524 O PRO A 68 -6.225 5.160 -1.909 1.00 0.00 O ATOM 525 CB PRO A 68 -6.204 7.167 -4.203 1.00 0.00 C ATOM 526 CG PRO A 68 -6.883 8.148 -5.178 1.00 0.00 C ATOM 527 CD PRO A 68 -7.762 9.018 -4.263 1.00 0.00 C ATOM 0 HA PRO A 68 -8.011 6.054 -3.349 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.321 7.609 -3.741 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -5.878 6.260 -4.711 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -6.150 8.748 -5.718 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -7.479 7.623 -5.925 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -7.224 9.901 -3.918 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -8.651 9.370 -4.785 1.00 0.00 H new ATOM 528 N TYR A 69 -6.632 7.052 -0.740 1.00 0.00 N ATOM 529 CA TYR A 69 -6.098 6.552 0.546 1.00 0.00 C ATOM 530 C TYR A 69 -7.300 6.754 1.527 1.00 0.00 C ATOM 531 O TYR A 69 -7.445 7.893 1.988 1.00 0.00 O ATOM 532 CB TYR A 69 -4.905 7.390 1.134 1.00 0.00 C ATOM 533 CG TYR A 69 -3.493 7.451 0.467 1.00 0.00 C ATOM 534 CD1 TYR A 69 -3.187 6.795 -0.736 1.00 0.00 C ATOM 535 CD2 TYR A 69 -2.466 8.253 1.025 1.00 0.00 C ATOM 536 CE1 TYR A 69 -2.023 7.073 -1.455 1.00 0.00 C ATOM 537 CE2 TYR A 69 -1.297 8.535 0.302 1.00 0.00 C ATOM 538 CZ TYR A 69 -1.105 7.982 -0.957 1.00 0.00 C ATOM 539 OH TYR A 69 -0.037 8.337 -1.719 1.00 0.00 O ATOM 0 H TYR A 69 -6.964 8.016 -0.702 1.00 0.00 H new ATOM 0 HA TYR A 69 -5.722 5.538 0.412 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -5.257 8.419 1.206 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -4.750 7.034 2.152 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -3.873 6.053 -1.117 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -2.585 8.653 2.021 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -1.839 6.580 -2.398 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -0.545 9.184 0.726 1.00 0.00 H new ATOM 0 HH TYR A 69 0.451 9.064 -1.279 1.00 0.00 H new ATOM 540 N THR A 70 -8.177 5.750 1.831 1.00 0.00 N ATOM 541 CA THR A 70 -9.194 5.962 2.883 1.00 0.00 C ATOM 542 C THR A 70 -10.102 4.793 3.386 1.00 0.00 C ATOM 543 O THR A 70 -10.322 4.738 4.596 1.00 0.00 O ATOM 544 CB THR A 70 -10.197 7.189 2.659 1.00 0.00 C ATOM 545 OG1 THR A 70 -10.155 7.757 1.350 1.00 0.00 O ATOM 546 CG2 THR A 70 -9.910 8.263 3.705 1.00 0.00 C ATOM 0 H THR A 70 -8.196 4.834 1.383 1.00 0.00 H new ATOM 0 HA THR A 70 -8.441 6.142 3.650 1.00 0.00 H new ATOM 0 HB THR A 70 -11.205 6.789 2.769 1.00 0.00 H new ATOM 0 HG1 THR A 70 -11.065 7.972 1.058 1.00 0.00 H new ATOM 0 HG21 THR A 70 -10.589 9.103 3.560 1.00 0.00 H new ATOM 0 HG22 THR A 70 -10.055 7.848 4.702 1.00 0.00 H new ATOM 0 HG23 THR A 70 -8.881 8.606 3.601 1.00 0.00 H new ATOM 547 N GLU A 71 -10.720 3.953 2.534 1.00 0.00 N ATOM 548 CA GLU A 71 -12.006 3.286 2.912 1.00 0.00 C ATOM 549 C GLU A 71 -12.126 2.316 4.126 1.00 0.00 C ATOM 550 O GLU A 71 -13.037 2.486 4.940 1.00 0.00 O ATOM 551 CB GLU A 71 -12.654 2.585 1.676 1.00 0.00 C ATOM 552 CG GLU A 71 -12.945 3.483 0.461 1.00 0.00 C ATOM 553 CD GLU A 71 -13.970 4.581 0.696 1.00 0.00 C ATOM 554 OE1 GLU A 71 -15.255 4.100 0.701 1.00 0.00 O ATOM 555 OE2 GLU A 71 -13.670 5.765 0.853 1.00 0.00 O ATOM 0 H GLU A 71 -10.373 3.717 1.604 1.00 0.00 H new ATOM 0 HA GLU A 71 -12.524 4.169 3.286 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -11.995 1.778 1.356 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -13.590 2.125 1.994 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.011 3.943 0.138 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.291 2.855 -0.360 1.00 0.00 H new ATOM 556 N SER A 72 -11.269 1.296 4.198 1.00 0.00 N ATOM 557 CA SER A 72 -11.573 0.052 4.958 1.00 0.00 C ATOM 558 C SER A 72 -10.969 -0.133 6.375 1.00 0.00 C ATOM 559 O SER A 72 -10.535 0.831 7.004 1.00 0.00 O ATOM 560 CB SER A 72 -11.147 -1.053 3.936 1.00 0.00 C ATOM 561 OG SER A 72 -9.737 -1.234 3.858 1.00 0.00 O ATOM 0 H SER A 72 -10.356 1.293 3.744 1.00 0.00 H new ATOM 0 HA SER A 72 -12.620 0.040 5.261 1.00 0.00 H new ATOM 0 HB2 SER A 72 -11.613 -1.997 4.217 1.00 0.00 H new ATOM 0 HB3 SER A 72 -11.528 -0.792 2.949 1.00 0.00 H new ATOM 0 HG SER A 72 -9.373 -1.357 4.759 1.00 0.00 H new ATOM 562 N TYR A 73 -11.039 -1.398 6.858 1.00 0.00 N ATOM 563 CA TYR A 73 -10.282 -1.991 7.970 1.00 0.00 C ATOM 564 C TYR A 73 -11.064 -2.293 9.262 1.00 0.00 C ATOM 565 O TYR A 73 -11.833 -1.477 9.776 1.00 0.00 O ATOM 566 CB TYR A 73 -8.945 -1.322 8.379 1.00 0.00 C ATOM 567 CG TYR A 73 -7.814 -1.821 7.530 1.00 0.00 C ATOM 568 CD1 TYR A 73 -7.598 -1.369 6.238 1.00 0.00 C ATOM 569 CD2 TYR A 73 -7.230 -3.018 7.946 1.00 0.00 C ATOM 570 CE1 TYR A 73 -6.868 -2.155 5.368 1.00 0.00 C ATOM 571 CE2 TYR A 73 -6.568 -3.839 7.053 1.00 0.00 C ATOM 572 CZ TYR A 73 -6.378 -3.397 5.748 1.00 0.00 C ATOM 573 OH TYR A 73 -5.574 -4.075 4.893 1.00 0.00 O ATOM 0 H TYR A 73 -11.678 -2.076 6.443 1.00 0.00 H new ATOM 0 HA TYR A 73 -10.048 -2.927 7.463 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -9.030 -0.240 8.279 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -8.736 -1.530 9.428 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -7.994 -0.417 5.916 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -7.297 -3.308 8.984 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -6.674 -1.795 4.369 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -6.204 -4.807 7.363 1.00 0.00 H new ATOM 0 HH TYR A 73 -6.096 -4.372 4.119 1.00 0.00 H new ATOM 574 N SER A 74 -10.714 -3.494 9.774 1.00 0.00 N ATOM 575 CA SER A 74 -11.238 -4.119 11.011 1.00 0.00 C ATOM 576 C SER A 74 -10.407 -5.430 11.240 1.00 0.00 C ATOM 577 O SER A 74 -10.920 -6.546 11.118 1.00 0.00 O ATOM 578 CB SER A 74 -12.732 -4.326 10.704 1.00 0.00 C ATOM 579 OG SER A 74 -13.434 -5.042 11.700 1.00 0.00 O ATOM 0 H SER A 74 -10.023 -4.085 9.312 1.00 0.00 H new ATOM 0 HA SER A 74 -11.147 -3.549 11.935 1.00 0.00 H new ATOM 0 HB2 SER A 74 -13.203 -3.352 10.573 1.00 0.00 H new ATOM 0 HB3 SER A 74 -12.827 -4.856 9.756 1.00 0.00 H new ATOM 0 HG SER A 74 -12.985 -5.897 11.866 1.00 0.00 H new ATOM 580 N TYR A 75 -9.122 -5.281 11.599 1.00 0.00 N ATOM 581 CA TYR A 75 -8.082 -6.295 11.426 1.00 0.00 C ATOM 582 C TYR A 75 -7.660 -7.070 12.686 1.00 0.00 C ATOM 583 O TYR A 75 -8.486 -7.589 13.441 1.00 0.00 O ATOM 584 CB TYR A 75 -6.986 -5.436 10.653 1.00 0.00 C ATOM 585 CG TYR A 75 -6.336 -4.248 11.420 1.00 0.00 C ATOM 586 CD1 TYR A 75 -6.970 -3.025 11.750 1.00 0.00 C ATOM 587 CD2 TYR A 75 -5.079 -4.488 11.946 1.00 0.00 C ATOM 588 CE1 TYR A 75 -6.422 -2.189 12.726 1.00 0.00 C ATOM 589 CE2 TYR A 75 -4.546 -3.679 12.945 1.00 0.00 C ATOM 590 CZ TYR A 75 -5.222 -2.533 13.350 1.00 0.00 C ATOM 591 OH TYR A 75 -4.705 -1.735 14.326 1.00 0.00 O ATOM 0 H TYR A 75 -8.773 -4.425 12.030 1.00 0.00 H new ATOM 0 HA TYR A 75 -8.389 -7.184 10.875 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -6.189 -6.110 10.339 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.445 -5.041 9.747 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -7.881 -2.738 11.245 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.500 -5.320 11.574 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -6.928 -1.275 12.998 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.606 -3.942 13.407 1.00 0.00 H new ATOM 0 HH TYR A 75 -4.177 -2.279 14.947 1.00 0.00 H new ATOM 592 N SER A 76 -6.336 -7.219 12.793 1.00 0.00 N ATOM 593 CA SER A 76 -5.641 -8.281 13.534 1.00 0.00 C ATOM 594 C SER A 76 -4.098 -7.975 13.618 1.00 0.00 C ATOM 595 O SER A 76 -3.625 -6.873 13.334 1.00 0.00 O ATOM 596 CB SER A 76 -5.822 -9.521 12.589 1.00 0.00 C ATOM 597 OG SER A 76 -6.984 -10.257 12.916 1.00 0.00 O ATOM 0 H SER A 76 -5.687 -6.572 12.344 1.00 0.00 H new ATOM 0 HA SER A 76 -6.018 -8.403 14.549 1.00 0.00 H new ATOM 0 HB2 SER A 76 -5.882 -9.185 11.554 1.00 0.00 H new ATOM 0 HB3 SER A 76 -4.948 -10.167 12.664 1.00 0.00 H new ATOM 0 HG SER A 76 -7.666 -9.650 13.273 1.00 0.00 H new ATOM 598 N CYS A 77 -3.374 -9.014 14.080 1.00 0.00 N ATOM 599 CA CYS A 77 -1.930 -9.229 13.844 1.00 0.00 C ATOM 600 C CYS A 77 -1.472 -10.462 14.637 1.00 0.00 C ATOM 601 O CYS A 77 -1.907 -10.726 15.765 1.00 0.00 O ATOM 602 CB CYS A 77 -1.033 -8.025 13.914 1.00 0.00 C ATOM 603 SG CYS A 77 0.665 -8.304 14.403 1.00 0.00 S ATOM 0 H CYS A 77 -3.791 -9.752 14.647 1.00 0.00 H new ATOM 0 HA CYS A 77 -1.810 -9.440 12.781 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -1.029 -7.548 12.934 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -1.474 -7.314 14.613 1.00 0.00 H new ATOM 604 N SER A 78 -0.529 -11.167 14.016 1.00 0.00 N ATOM 605 CA SER A 78 0.038 -12.426 14.580 1.00 0.00 C ATOM 606 C SER A 78 1.575 -12.283 14.682 1.00 0.00 C ATOM 607 O SER A 78 2.089 -11.261 15.150 1.00 0.00 O ATOM 608 CB SER A 78 -0.575 -13.598 13.766 1.00 0.00 C ATOM 609 OG SER A 78 -0.309 -14.855 14.381 1.00 0.00 O ATOM 0 H SER A 78 -0.129 -10.900 13.117 1.00 0.00 H new ATOM 0 HA SER A 78 -0.232 -12.650 15.612 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.652 -13.456 13.676 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.168 -13.593 12.755 1.00 0.00 H new ATOM 0 HG SER A 78 -0.709 -15.572 13.846 1.00 0.00 H new ATOM 610 N ASN A 79 2.283 -13.329 14.256 1.00 0.00 N ATOM 611 CA ASN A 79 3.743 -13.329 13.943 1.00 0.00 C ATOM 612 C ASN A 79 4.384 -12.051 13.247 1.00 0.00 C ATOM 613 O ASN A 79 5.555 -11.731 13.448 1.00 0.00 O ATOM 614 CB ASN A 79 3.929 -14.498 12.896 1.00 0.00 C ATOM 615 CG ASN A 79 3.943 -15.917 13.461 1.00 0.00 C ATOM 616 OD1 ASN A 79 4.192 -16.163 14.641 1.00 0.00 O ATOM 617 ND2 ASN A 79 3.699 -16.898 12.610 1.00 0.00 N ATOM 0 H ASN A 79 1.854 -14.243 14.108 1.00 0.00 H new ATOM 0 HA ASN A 79 4.240 -13.399 14.911 1.00 0.00 H new ATOM 0 HB2 ASN A 79 3.127 -14.430 12.161 1.00 0.00 H new ATOM 0 HB3 ASN A 79 4.865 -14.333 12.362 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.716 -17.866 12.930 1.00 0.00 H new ATOM 0 HD22 ASN A 79 3.493 -16.687 11.634 1.00 0.00 H new ATOM 618 N THR A 80 3.543 -11.466 12.406 1.00 0.00 N ATOM 619 CA THR A 80 3.771 -10.411 11.404 1.00 0.00 C ATOM 620 C THR A 80 2.497 -10.334 10.426 1.00 0.00 C ATOM 621 O THR A 80 2.425 -9.388 9.641 1.00 0.00 O ATOM 622 CB THR A 80 5.145 -10.428 10.681 1.00 0.00 C ATOM 623 OG1 THR A 80 5.248 -9.352 9.758 1.00 0.00 O ATOM 624 CG2 THR A 80 5.562 -11.673 9.921 1.00 0.00 C ATOM 0 H THR A 80 2.563 -11.748 12.403 1.00 0.00 H new ATOM 0 HA THR A 80 3.857 -9.471 11.949 1.00 0.00 H new ATOM 0 HB THR A 80 5.817 -10.362 11.537 1.00 0.00 H new ATOM 0 HG1 THR A 80 5.219 -8.501 10.243 1.00 0.00 H new ATOM 0 HG21 THR A 80 6.545 -11.516 9.477 1.00 0.00 H new ATOM 0 HG22 THR A 80 5.604 -12.520 10.606 1.00 0.00 H new ATOM 0 HG23 THR A 80 4.837 -11.878 9.133 1.00 0.00 H new ATOM 625 N GLU A 81 1.509 -11.270 10.514 1.00 0.00 N ATOM 626 CA GLU A 81 0.385 -11.405 9.568 1.00 0.00 C ATOM 627 C GLU A 81 -0.981 -11.176 10.219 1.00 0.00 C ATOM 628 O GLU A 81 -1.250 -11.592 11.344 1.00 0.00 O ATOM 629 CB GLU A 81 0.355 -12.871 9.039 1.00 0.00 C ATOM 630 CG GLU A 81 1.557 -13.086 8.123 1.00 0.00 C ATOM 631 CD GLU A 81 1.582 -14.408 7.396 1.00 0.00 C ATOM 632 OE1 GLU A 81 2.057 -15.436 7.876 1.00 0.00 O ATOM 633 OE2 GLU A 81 1.019 -14.323 6.147 1.00 0.00 O ATOM 0 H GLU A 81 1.480 -11.961 11.263 1.00 0.00 H new ATOM 0 HA GLU A 81 0.545 -10.658 8.791 1.00 0.00 H new ATOM 0 HB2 GLU A 81 0.384 -13.574 9.872 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -0.572 -13.058 8.496 1.00 0.00 H new ATOM 0 HG2 GLU A 81 1.580 -12.284 7.386 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.467 -12.999 8.717 1.00 0.00 H new ATOM 634 N ILE A 82 -1.882 -10.600 9.430 1.00 0.00 N ATOM 635 CA ILE A 82 -3.099 -9.949 9.978 1.00 0.00 C ATOM 636 C ILE A 82 -4.350 -10.726 9.483 1.00 0.00 C ATOM 637 O ILE A 82 -4.511 -11.900 9.826 1.00 0.00 O ATOM 638 CB ILE A 82 -2.853 -8.436 9.695 1.00 0.00 C ATOM 639 CG1 ILE A 82 -1.628 -7.841 10.464 1.00 0.00 C ATOM 640 CG2 ILE A 82 -3.996 -7.477 9.945 1.00 0.00 C ATOM 641 CD1 ILE A 82 -0.521 -7.349 9.556 1.00 0.00 C ATOM 0 H ILE A 82 -1.807 -10.563 8.413 1.00 0.00 H new ATOM 0 HA ILE A 82 -3.311 -9.988 11.047 1.00 0.00 H new ATOM 0 HB ILE A 82 -2.686 -8.492 8.619 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -1.968 -7.015 11.088 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -1.226 -8.602 11.133 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -3.679 -6.462 9.705 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.844 -7.750 9.317 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.290 -7.527 10.993 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.294 -6.950 10.160 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -0.153 -8.177 8.950 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.907 -6.565 8.904 1.00 0.00 H new ATOM 642 N THR A 83 -5.224 -10.043 8.744 1.00 0.00 N ATOM 643 CA THR A 83 -6.515 -10.554 8.204 1.00 0.00 C ATOM 644 C THR A 83 -7.023 -9.462 7.215 1.00 0.00 C ATOM 645 O THR A 83 -6.611 -9.583 6.068 1.00 0.00 O ATOM 646 CB THR A 83 -7.528 -11.112 9.226 1.00 0.00 C ATOM 647 OG1 THR A 83 -8.525 -11.860 8.529 1.00 0.00 O ATOM 648 CG2 THR A 83 -8.228 -10.089 10.105 1.00 0.00 C ATOM 0 H THR A 83 -5.057 -9.071 8.485 1.00 0.00 H new ATOM 0 HA THR A 83 -6.356 -11.490 7.669 1.00 0.00 H new ATOM 0 HB THR A 83 -6.931 -11.719 9.906 1.00 0.00 H new ATOM 0 HG1 THR A 83 -9.172 -12.220 9.171 1.00 0.00 H new ATOM 0 HG21 THR A 83 -8.914 -10.599 10.781 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.487 -9.541 10.686 1.00 0.00 H new ATOM 0 HG23 THR A 83 -8.786 -9.393 9.479 1.00 0.00 H new ATOM 649 N CYS A 84 -7.951 -8.531 7.565 1.00 0.00 N ATOM 650 CA CYS A 84 -8.251 -7.279 6.850 1.00 0.00 C ATOM 651 C CYS A 84 -9.463 -6.630 7.569 1.00 0.00 C ATOM 652 O CYS A 84 -9.317 -5.588 8.203 1.00 0.00 O ATOM 653 CB CYS A 84 -8.315 -7.207 5.334 1.00 0.00 C ATOM 654 SG CYS A 84 -9.911 -6.835 4.663 1.00 0.00 S ATOM 0 H CYS A 84 -8.533 -8.647 8.394 1.00 0.00 H new ATOM 0 HA CYS A 84 -7.327 -6.706 6.923 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -7.609 -6.450 4.992 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -7.981 -8.161 4.927 1.00 0.00 H new ATOM 655 N ASN A 85 -10.651 -7.262 7.414 1.00 0.00 N ATOM 656 CA ASN A 85 -11.933 -6.761 7.931 1.00 0.00 C ATOM 657 C ASN A 85 -12.830 -7.917 8.457 1.00 0.00 C ATOM 658 O ASN A 85 -12.444 -9.092 8.441 1.00 0.00 O ATOM 659 CB ASN A 85 -12.568 -5.841 6.857 1.00 0.00 C ATOM 660 CG ASN A 85 -13.383 -6.419 5.699 1.00 0.00 C ATOM 661 OD1 ASN A 85 -14.405 -5.850 5.320 1.00 0.00 O ATOM 662 ND2 ASN A 85 -12.975 -7.529 5.102 1.00 0.00 N ATOM 0 H ASN A 85 -10.739 -8.148 6.917 1.00 0.00 H new ATOM 0 HA ASN A 85 -11.789 -6.144 8.818 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -13.215 -5.139 7.382 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -11.758 -5.260 6.417 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -13.509 -7.916 4.324 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -12.126 -7.997 5.420 1.00 0.00 H new ATOM 663 N SER A 86 -14.037 -7.572 8.938 1.00 0.00 N ATOM 664 CA SER A 86 -15.055 -8.582 9.340 1.00 0.00 C ATOM 665 C SER A 86 -16.492 -8.059 9.063 1.00 0.00 C ATOM 666 O SER A 86 -17.325 -7.979 9.972 1.00 0.00 O ATOM 667 CB SER A 86 -14.826 -9.037 10.802 1.00 0.00 C ATOM 668 OG SER A 86 -14.929 -7.964 11.735 1.00 0.00 O ATOM 0 H SER A 86 -14.339 -6.606 9.061 1.00 0.00 H new ATOM 0 HA SER A 86 -14.940 -9.475 8.725 1.00 0.00 H new ATOM 0 HB2 SER A 86 -15.555 -9.806 11.057 1.00 0.00 H new ATOM 0 HB3 SER A 86 -13.839 -9.493 10.886 1.00 0.00 H new ATOM 0 HG SER A 86 -15.772 -7.486 11.592 1.00 0.00 H new ATOM 669 N LYS A 87 -16.775 -7.722 7.785 1.00 0.00 N ATOM 670 CA LYS A 87 -18.059 -7.106 7.376 1.00 0.00 C ATOM 671 C LYS A 87 -18.352 -7.302 5.860 1.00 0.00 C ATOM 672 O LYS A 87 -19.318 -7.989 5.518 1.00 0.00 O ATOM 673 CB LYS A 87 -18.262 -5.680 7.921 1.00 0.00 C ATOM 674 CG LYS A 87 -17.210 -4.622 7.634 1.00 0.00 C ATOM 675 CD LYS A 87 -16.100 -4.391 8.663 1.00 0.00 C ATOM 676 CE LYS A 87 -16.492 -3.662 9.958 1.00 0.00 C ATOM 677 NZ LYS A 87 -17.066 -4.542 10.994 1.00 0.00 N ATOM 0 H LYS A 87 -16.125 -7.868 7.012 1.00 0.00 H new ATOM 0 HA LYS A 87 -18.852 -7.663 7.875 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -19.212 -5.312 7.533 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -18.367 -5.754 9.003 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -16.735 -4.877 6.687 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -17.727 -3.674 7.487 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.681 -5.360 8.933 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.304 -3.823 8.182 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -15.610 -3.167 10.365 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -17.214 -2.881 9.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -16.901 -4.126 11.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -18.089 -4.644 10.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -16.614 -5.477 10.945 1.00 0.00 H new ATOM 678 N ASN A 88 -17.531 -6.711 4.980 1.00 0.00 N ATOM 679 CA ASN A 88 -17.603 -6.861 3.516 1.00 0.00 C ATOM 680 C ASN A 88 -18.850 -6.417 2.705 1.00 0.00 C ATOM 681 O ASN A 88 -19.705 -7.214 2.311 1.00 0.00 O ATOM 682 CB ASN A 88 -16.930 -8.125 2.914 1.00 0.00 C ATOM 683 CG ASN A 88 -17.533 -9.485 3.228 1.00 0.00 C ATOM 684 OD1 ASN A 88 -18.523 -9.900 2.627 1.00 0.00 O ATOM 685 ND2 ASN A 88 -16.956 -10.220 4.165 1.00 0.00 N ATOM 0 H ASN A 88 -16.773 -6.095 5.275 1.00 0.00 H new ATOM 0 HA ASN A 88 -16.955 -6.001 3.347 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -16.917 -8.010 1.830 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -15.892 -8.138 3.245 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -17.332 -11.140 4.395 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -16.136 -9.867 4.657 1.00 0.00 H new ATOM 686 N ASN A 89 -18.842 -5.121 2.395 1.00 0.00 N ATOM 687 CA ASN A 89 -19.357 -4.595 1.102 1.00 0.00 C ATOM 688 C ASN A 89 -18.035 -4.122 0.382 1.00 0.00 C ATOM 689 O ASN A 89 -17.135 -3.591 1.045 1.00 0.00 O ATOM 690 CB ASN A 89 -20.312 -3.396 1.233 1.00 0.00 C ATOM 691 CG ASN A 89 -21.637 -3.701 1.930 1.00 0.00 C ATOM 692 OD1 ASN A 89 -22.522 -4.340 1.362 1.00 0.00 O ATOM 693 ND2 ASN A 89 -21.807 -3.258 3.165 1.00 0.00 N ATOM 0 H ASN A 89 -18.484 -4.399 3.019 1.00 0.00 H new ATOM 0 HA ASN A 89 -19.945 -5.352 0.583 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -19.803 -2.604 1.782 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -20.523 -3.008 0.237 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -22.680 -3.445 3.658 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -21.065 -2.730 3.624 1.00 0.00 H new ATOM 694 N ALA A 90 -17.901 -4.290 -0.948 1.00 0.00 N ATOM 695 CA ALA A 90 -16.633 -3.947 -1.660 1.00 0.00 C ATOM 696 C ALA A 90 -16.131 -2.494 -1.455 1.00 0.00 C ATOM 697 O ALA A 90 -14.932 -2.302 -1.283 1.00 0.00 O ATOM 698 CB ALA A 90 -16.670 -4.453 -3.102 1.00 0.00 C ATOM 0 H ALA A 90 -18.637 -4.655 -1.552 1.00 0.00 H new ATOM 0 HA ALA A 90 -15.830 -4.498 -1.171 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -15.737 -4.193 -3.603 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -16.794 -5.536 -3.105 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -17.505 -3.991 -3.628 1.00 0.00 H new ATOM 699 N CYS A 91 -17.011 -1.483 -1.389 1.00 0.00 N ATOM 700 CA CYS A 91 -16.726 -0.170 -0.717 1.00 0.00 C ATOM 701 C CYS A 91 -15.551 -0.079 0.313 1.00 0.00 C ATOM 702 O CYS A 91 -14.679 0.760 0.124 1.00 0.00 O ATOM 703 CB CYS A 91 -18.034 0.105 0.056 1.00 0.00 C ATOM 704 SG CYS A 91 -19.329 0.661 -1.066 1.00 0.00 S ATOM 0 H CYS A 91 -17.945 -1.536 -1.795 1.00 0.00 H new ATOM 0 HA CYS A 91 -16.413 0.527 -1.494 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -18.356 -0.800 0.571 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -17.859 0.862 0.821 1.00 0.00 H new ATOM 705 N GLU A 92 -15.579 -0.930 1.356 1.00 0.00 N ATOM 706 CA GLU A 92 -14.443 -1.201 2.250 1.00 0.00 C ATOM 707 C GLU A 92 -13.664 -2.446 1.767 1.00 0.00 C ATOM 708 O GLU A 92 -12.519 -2.285 1.357 1.00 0.00 O ATOM 709 CB GLU A 92 -14.838 -1.314 3.741 1.00 0.00 C ATOM 710 CG GLU A 92 -15.967 -2.290 4.096 1.00 0.00 C ATOM 711 CD GLU A 92 -16.669 -1.952 5.401 1.00 0.00 C ATOM 712 OE1 GLU A 92 -15.801 -1.865 6.461 1.00 0.00 O ATOM 713 OE2 GLU A 92 -17.885 -1.780 5.485 1.00 0.00 O ATOM 0 H GLU A 92 -16.414 -1.460 1.604 1.00 0.00 H new ATOM 0 HA GLU A 92 -13.787 -0.332 2.195 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -13.951 -1.604 4.304 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -15.127 -0.323 4.090 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -16.700 -2.296 3.289 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -15.558 -3.298 4.162 1.00 0.00 H new ATOM 714 N ALA A 93 -14.266 -3.655 1.798 1.00 0.00 N ATOM 715 CA ALA A 93 -13.541 -4.913 1.556 1.00 0.00 C ATOM 716 C ALA A 93 -12.789 -5.114 0.238 1.00 0.00 C ATOM 717 O ALA A 93 -11.824 -5.885 0.237 1.00 0.00 O ATOM 718 CB ALA A 93 -14.423 -6.138 1.748 1.00 0.00 C ATOM 0 H ALA A 93 -15.260 -3.782 1.990 1.00 0.00 H new ATOM 0 HA ALA A 93 -12.767 -4.804 2.316 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -13.840 -7.039 1.558 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -14.799 -6.159 2.771 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -15.262 -6.095 1.053 1.00 0.00 H new ATOM 719 N PHE A 94 -13.212 -4.470 -0.871 1.00 0.00 N ATOM 720 CA PHE A 94 -12.357 -4.501 -2.115 1.00 0.00 C ATOM 721 C PHE A 94 -11.023 -3.744 -1.889 1.00 0.00 C ATOM 722 O PHE A 94 -9.973 -4.200 -2.348 1.00 0.00 O ATOM 723 CB PHE A 94 -13.192 -4.040 -3.320 1.00 0.00 C ATOM 724 CG PHE A 94 -12.526 -3.603 -4.624 1.00 0.00 C ATOM 725 CD1 PHE A 94 -11.684 -2.486 -4.638 1.00 0.00 C ATOM 726 CD2 PHE A 94 -12.987 -4.095 -5.849 1.00 0.00 C ATOM 727 CE1 PHE A 94 -11.273 -1.898 -5.825 1.00 0.00 C ATOM 728 CE2 PHE A 94 -12.574 -3.516 -7.052 1.00 0.00 C ATOM 729 CZ PHE A 94 -11.708 -2.419 -7.033 1.00 0.00 C ATOM 0 H PHE A 94 -14.084 -3.947 -0.950 1.00 0.00 H new ATOM 0 HA PHE A 94 -12.043 -5.518 -2.349 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.871 -4.856 -3.567 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -13.806 -3.206 -2.981 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -11.345 -2.071 -3.700 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -13.670 -4.932 -5.866 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -10.618 -1.039 -5.808 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -12.923 -3.915 -7.993 1.00 0.00 H new ATOM 0 HZ PHE A 94 -11.377 -1.977 -7.961 1.00 0.00 H new ATOM 730 N ILE A 95 -11.110 -2.575 -1.231 1.00 0.00 N ATOM 731 CA ILE A 95 -9.951 -1.704 -0.942 1.00 0.00 C ATOM 732 C ILE A 95 -9.007 -2.432 0.090 1.00 0.00 C ATOM 733 O ILE A 95 -7.803 -2.479 -0.125 1.00 0.00 O ATOM 734 CB ILE A 95 -10.367 -0.312 -0.375 1.00 0.00 C ATOM 735 CG1 ILE A 95 -11.691 0.341 -0.807 1.00 0.00 C ATOM 736 CG2 ILE A 95 -9.202 0.697 -0.497 1.00 0.00 C ATOM 737 CD1 ILE A 95 -12.404 0.028 -2.101 1.00 0.00 C ATOM 0 H ILE A 95 -11.993 -2.203 -0.881 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.433 -1.523 -1.884 1.00 0.00 H new ATOM 0 HB ILE A 95 -10.595 -0.576 0.658 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.405 0.138 -0.009 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.513 1.416 -0.810 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -9.513 1.662 -0.096 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.343 0.330 0.065 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.928 0.811 -1.546 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -13.315 0.622 -2.167 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.753 0.267 -2.942 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.659 -1.031 -2.129 1.00 0.00 H new ATOM 738 N CYS A 96 -9.615 -2.999 1.150 1.00 0.00 N ATOM 739 CA CYS A 96 -9.009 -3.936 2.117 1.00 0.00 C ATOM 740 C CYS A 96 -8.212 -5.119 1.502 1.00 0.00 C ATOM 741 O CYS A 96 -7.172 -5.469 2.061 1.00 0.00 O ATOM 742 CB CYS A 96 -10.235 -4.449 2.896 1.00 0.00 C ATOM 743 SG CYS A 96 -9.969 -4.860 4.590 1.00 0.00 S ATOM 0 H CYS A 96 -10.593 -2.806 1.366 1.00 0.00 H new ATOM 0 HA CYS A 96 -8.249 -3.432 2.714 1.00 0.00 H new ATOM 0 HB2 CYS A 96 -11.014 -3.688 2.847 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -10.619 -5.332 2.386 1.00 0.00 H new ATOM 744 N ASN A 97 -8.673 -5.707 0.367 1.00 0.00 N ATOM 745 CA ASN A 97 -7.868 -6.714 -0.397 1.00 0.00 C ATOM 746 C ASN A 97 -6.631 -6.123 -1.130 1.00 0.00 C ATOM 747 O ASN A 97 -5.571 -6.753 -1.095 1.00 0.00 O ATOM 748 CB ASN A 97 -8.806 -7.439 -1.386 1.00 0.00 C ATOM 749 CG ASN A 97 -8.321 -8.789 -1.920 1.00 0.00 C ATOM 750 OD1 ASN A 97 -7.389 -9.415 -1.413 1.00 0.00 O ATOM 751 ND2 ASN A 97 -8.966 -9.282 -2.962 1.00 0.00 N ATOM 0 H ASN A 97 -9.587 -5.508 -0.041 1.00 0.00 H new ATOM 0 HA ASN A 97 -7.449 -7.414 0.326 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -9.767 -7.591 -0.896 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -8.982 -6.779 -2.235 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -8.693 -10.185 -3.350 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -9.737 -8.760 -3.378 1.00 0.00 H new ATOM 752 N CYS A 98 -6.758 -4.939 -1.757 1.00 0.00 N ATOM 753 CA CYS A 98 -5.585 -4.164 -2.249 1.00 0.00 C ATOM 754 C CYS A 98 -4.573 -3.824 -1.104 1.00 0.00 C ATOM 755 O CYS A 98 -3.385 -4.091 -1.282 1.00 0.00 O ATOM 756 CB CYS A 98 -6.101 -2.925 -2.997 1.00 0.00 C ATOM 757 SG CYS A 98 -4.824 -2.097 -3.954 1.00 0.00 S ATOM 0 H CYS A 98 -7.656 -4.492 -1.939 1.00 0.00 H new ATOM 0 HA CYS A 98 -5.008 -4.773 -2.945 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -6.911 -3.221 -3.663 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -6.521 -2.222 -2.277 1.00 0.00 H new ATOM 758 N ASP A 99 -5.052 -3.334 0.064 1.00 0.00 N ATOM 759 CA ASP A 99 -4.232 -3.049 1.264 1.00 0.00 C ATOM 760 C ASP A 99 -3.471 -4.267 1.812 1.00 0.00 C ATOM 761 O ASP A 99 -2.248 -4.207 1.809 1.00 0.00 O ATOM 762 CB ASP A 99 -5.048 -2.364 2.371 1.00 0.00 C ATOM 763 CG ASP A 99 -5.590 -0.972 2.084 1.00 0.00 C ATOM 764 OD1 ASP A 99 -4.665 0.003 2.328 1.00 0.00 O ATOM 765 OD2 ASP A 99 -6.742 -0.751 1.724 1.00 0.00 O ATOM 0 H ASP A 99 -6.040 -3.122 0.200 1.00 0.00 H new ATOM 0 HA ASP A 99 -3.469 -2.352 0.919 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -5.891 -3.010 2.616 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -4.423 -2.305 3.262 1.00 0.00 H new ATOM 766 N ARG A 100 -4.132 -5.347 2.236 1.00 0.00 N ATOM 767 CA ARG A 100 -3.431 -6.558 2.709 1.00 0.00 C ATOM 768 C ARG A 100 -2.536 -7.273 1.685 1.00 0.00 C ATOM 769 O ARG A 100 -1.480 -7.719 2.121 1.00 0.00 O ATOM 770 CB ARG A 100 -4.416 -7.626 3.188 1.00 0.00 C ATOM 771 CG ARG A 100 -5.177 -7.283 4.443 1.00 0.00 C ATOM 772 CD ARG A 100 -4.497 -7.113 5.794 1.00 0.00 C ATOM 773 NE ARG A 100 -3.153 -7.642 6.000 1.00 0.00 N ATOM 774 CZ ARG A 100 -2.777 -8.931 6.007 1.00 0.00 C ATOM 775 NH1 ARG A 100 -3.587 -9.955 5.773 1.00 0.00 N ATOM 776 NH2 ARG A 100 -1.513 -9.193 6.271 1.00 0.00 N ATOM 0 H ARG A 100 -5.149 -5.414 2.264 1.00 0.00 H new ATOM 0 HA ARG A 100 -2.801 -6.154 3.501 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -5.132 -7.820 2.390 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -3.868 -8.553 3.357 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -5.706 -6.352 4.241 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -5.933 -8.058 4.570 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -4.463 -6.045 6.009 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -5.144 -7.568 6.544 1.00 0.00 H new ATOM 0 HE ARG A 100 -2.416 -6.955 6.156 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -4.573 -9.789 5.570 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -3.224 -10.908 5.796 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -0.863 -8.430 6.460 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -1.185 -10.159 6.287 1.00 0.00 H new ATOM 777 N ASN A 101 -2.897 -7.431 0.391 1.00 0.00 N ATOM 778 CA ASN A 101 -1.904 -8.026 -0.566 1.00 0.00 C ATOM 779 C ASN A 101 -0.699 -7.056 -0.879 1.00 0.00 C ATOM 780 O ASN A 101 0.352 -7.526 -1.315 1.00 0.00 O ATOM 781 CB ASN A 101 -2.648 -8.505 -1.824 1.00 0.00 C ATOM 782 CG ASN A 101 -1.845 -9.448 -2.724 1.00 0.00 C ATOM 783 OD1 ASN A 101 -1.640 -10.616 -2.398 1.00 0.00 O ATOM 784 ND2 ASN A 101 -1.378 -8.974 -3.867 1.00 0.00 N ATOM 0 H ASN A 101 -3.802 -7.178 -0.007 1.00 0.00 H new ATOM 0 HA ASN A 101 -1.433 -8.890 -0.098 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -3.564 -9.010 -1.517 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -2.945 -7.634 -2.408 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -0.841 -9.579 -4.489 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -1.554 -8.004 -4.127 1.00 0.00 H new ATOM 785 N ALA A 102 -0.852 -5.745 -0.611 1.00 0.00 N ATOM 786 CA ALA A 102 0.275 -4.826 -0.415 1.00 0.00 C ATOM 787 C ALA A 102 0.940 -5.000 0.987 1.00 0.00 C ATOM 788 O ALA A 102 2.148 -4.881 0.977 1.00 0.00 O ATOM 789 CB ALA A 102 -0.188 -3.396 -0.678 1.00 0.00 C ATOM 0 H ALA A 102 -1.764 -5.297 -0.525 1.00 0.00 H new ATOM 0 HA ALA A 102 1.058 -5.068 -1.133 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.647 -2.711 -0.533 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -0.551 -3.314 -1.702 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.991 -3.141 0.013 1.00 0.00 H new ATOM 790 N ALA A 103 0.285 -5.324 2.139 1.00 0.00 N ATOM 791 CA ALA A 103 1.013 -5.718 3.409 1.00 0.00 C ATOM 792 C ALA A 103 1.961 -6.997 3.346 1.00 0.00 C ATOM 793 O ALA A 103 2.811 -7.200 4.201 1.00 0.00 O ATOM 794 CB ALA A 103 -0.025 -5.939 4.529 1.00 0.00 C ATOM 0 H ALA A 103 -0.731 -5.324 2.227 1.00 0.00 H new ATOM 0 HA ALA A 103 1.691 -4.884 3.593 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.487 -6.223 5.448 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -0.584 -5.018 4.694 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -0.713 -6.733 4.236 1.00 0.00 H new ATOM 795 N ILE A 104 1.692 -7.792 2.328 1.00 0.00 N ATOM 796 CA ILE A 104 2.341 -9.060 1.851 1.00 0.00 C ATOM 797 C ILE A 104 3.484 -8.871 0.848 1.00 0.00 C ATOM 798 O ILE A 104 4.459 -9.613 0.784 1.00 0.00 O ATOM 799 CB ILE A 104 1.106 -9.761 1.155 1.00 0.00 C ATOM 800 CG1 ILE A 104 0.199 -10.569 2.089 1.00 0.00 C ATOM 801 CG2 ILE A 104 1.309 -10.528 -0.164 1.00 0.00 C ATOM 802 CD1 ILE A 104 0.077 -10.057 3.510 1.00 0.00 C ATOM 0 H ILE A 104 0.912 -7.556 1.715 1.00 0.00 H new ATOM 0 HA ILE A 104 2.827 -9.606 2.660 1.00 0.00 H new ATOM 0 HB ILE A 104 0.601 -8.844 0.852 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -0.798 -10.605 1.651 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.569 -11.594 2.124 1.00 0.00 H new ATOM 0 HG21 ILE A 104 0.356 -10.942 -0.495 1.00 0.00 H new ATOM 0 HG22 ILE A 104 1.693 -9.848 -0.925 1.00 0.00 H new ATOM 0 HG23 ILE A 104 2.022 -11.338 -0.008 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.589 -10.708 4.075 1.00 0.00 H new ATOM 0 HD12 ILE A 104 1.061 -10.049 3.979 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -0.328 -9.045 3.499 1.00 0.00 H new ATOM 803 N CYS A 105 3.263 -7.943 -0.066 1.00 0.00 N ATOM 804 CA CYS A 105 4.376 -7.368 -0.832 1.00 0.00 C ATOM 805 C CYS A 105 5.338 -6.582 0.127 1.00 0.00 C ATOM 806 O CYS A 105 6.551 -6.764 0.108 1.00 0.00 O ATOM 807 CB CYS A 105 3.809 -6.413 -1.870 1.00 0.00 C ATOM 808 SG CYS A 105 2.961 -7.200 -3.228 1.00 0.00 S ATOM 0 H CYS A 105 2.343 -7.570 -0.300 1.00 0.00 H new ATOM 0 HA CYS A 105 4.937 -8.166 -1.319 1.00 0.00 H new ATOM 0 HB2 CYS A 105 3.118 -5.730 -1.376 1.00 0.00 H new ATOM 0 HB3 CYS A 105 4.623 -5.809 -2.270 1.00 0.00 H new ATOM 809 N PHE A 106 4.748 -5.783 1.012 1.00 0.00 N ATOM 810 CA PHE A 106 5.480 -4.870 1.899 1.00 0.00 C ATOM 811 C PHE A 106 6.170 -5.532 3.073 1.00 0.00 C ATOM 812 O PHE A 106 7.315 -5.171 3.364 1.00 0.00 O ATOM 813 CB PHE A 106 4.561 -3.713 2.256 1.00 0.00 C ATOM 814 CG PHE A 106 4.157 -2.814 1.035 1.00 0.00 C ATOM 815 CD1 PHE A 106 4.663 -2.876 -0.309 1.00 0.00 C ATOM 816 CD2 PHE A 106 3.083 -1.976 1.288 1.00 0.00 C ATOM 817 CE1 PHE A 106 4.125 -2.056 -1.296 1.00 0.00 C ATOM 818 CE2 PHE A 106 2.568 -1.139 0.309 1.00 0.00 C ATOM 819 CZ PHE A 106 3.086 -1.183 -0.981 1.00 0.00 C ATOM 0 H PHE A 106 3.736 -5.747 1.138 1.00 0.00 H new ATOM 0 HA PHE A 106 6.340 -4.474 1.359 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.656 -4.111 2.716 1.00 0.00 H new ATOM 0 HB3 PHE A 106 5.052 -3.091 3.004 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.462 -3.560 -0.553 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.636 -1.974 2.271 1.00 0.00 H new ATOM 0 HE1 PHE A 106 4.512 -2.096 -2.304 1.00 0.00 H new ATOM 0 HE2 PHE A 106 1.767 -0.455 0.548 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.680 -0.536 -1.744 1.00 0.00 H new ATOM 820 N SER A 107 5.550 -6.535 3.712 1.00 0.00 N ATOM 821 CA SER A 107 6.329 -7.370 4.663 1.00 0.00 C ATOM 822 C SER A 107 7.469 -8.217 4.021 1.00 0.00 C ATOM 823 O SER A 107 8.490 -8.454 4.672 1.00 0.00 O ATOM 824 CB SER A 107 5.369 -8.313 5.421 1.00 0.00 C ATOM 825 OG SER A 107 6.024 -9.305 6.216 1.00 0.00 O ATOM 0 H SER A 107 4.567 -6.786 3.604 1.00 0.00 H new ATOM 0 HA SER A 107 6.823 -6.665 5.331 1.00 0.00 H new ATOM 0 HB2 SER A 107 4.725 -7.715 6.066 1.00 0.00 H new ATOM 0 HB3 SER A 107 4.723 -8.812 4.699 1.00 0.00 H new ATOM 0 HG SER A 107 6.341 -8.899 7.050 1.00 0.00 H new ATOM 826 N LYS A 108 7.242 -8.675 2.782 1.00 0.00 N ATOM 827 CA LYS A 108 7.948 -9.819 2.223 1.00 0.00 C ATOM 828 C LYS A 108 8.365 -9.593 0.757 1.00 0.00 C ATOM 829 O LYS A 108 9.576 -9.464 0.585 1.00 0.00 O ATOM 830 CB LYS A 108 7.211 -11.159 2.497 1.00 0.00 C ATOM 831 CG LYS A 108 5.755 -11.162 3.034 1.00 0.00 C ATOM 832 CD LYS A 108 5.051 -12.463 2.624 1.00 0.00 C ATOM 833 CE LYS A 108 3.541 -12.297 2.522 1.00 0.00 C ATOM 834 NZ LYS A 108 2.829 -13.585 2.467 1.00 0.00 N ATOM 0 H LYS A 108 6.563 -8.258 2.146 1.00 0.00 H new ATOM 0 HA LYS A 108 8.892 -9.915 2.759 1.00 0.00 H new ATOM 0 HB2 LYS A 108 7.211 -11.723 1.564 1.00 0.00 H new ATOM 0 HB3 LYS A 108 7.817 -11.720 3.208 1.00 0.00 H new ATOM 0 HG2 LYS A 108 5.758 -11.066 4.120 1.00 0.00 H new ATOM 0 HG3 LYS A 108 5.211 -10.304 2.640 1.00 0.00 H new ATOM 0 HD2 LYS A 108 5.443 -12.798 1.664 1.00 0.00 H new ATOM 0 HD3 LYS A 108 5.280 -13.242 3.351 1.00 0.00 H new ATOM 0 HE2 LYS A 108 3.184 -11.726 3.379 1.00 0.00 H new ATOM 0 HE3 LYS A 108 3.303 -11.717 1.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 1.806 -13.413 2.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 3.147 -14.122 1.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 3.031 -14.131 3.329 1.00 0.00 H new ATOM 835 N ALA A 109 7.462 -9.588 -0.264 1.00 0.00 N ATOM 836 CA ALA A 109 7.834 -9.573 -1.713 1.00 0.00 C ATOM 837 C ALA A 109 9.169 -10.312 -2.147 1.00 0.00 C ATOM 838 O ALA A 109 9.807 -11.056 -1.398 1.00 0.00 O ATOM 839 CB ALA A 109 7.813 -8.123 -2.284 1.00 0.00 C ATOM 0 H ALA A 109 6.454 -9.594 -0.108 1.00 0.00 H new ATOM 0 HA ALA A 109 7.051 -10.187 -2.157 1.00 0.00 H new ATOM 0 HB1 ALA A 109 8.087 -8.143 -3.339 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.812 -7.704 -2.177 1.00 0.00 H new ATOM 0 HB3 ALA A 109 8.525 -7.506 -1.736 1.00 0.00 H new ATOM 840 N PRO A 110 9.588 -10.102 -3.397 1.00 0.00 N ATOM 841 CA PRO A 110 11.045 -10.211 -3.831 1.00 0.00 C ATOM 842 C PRO A 110 11.765 -8.870 -3.563 1.00 0.00 C ATOM 843 O PRO A 110 12.172 -8.099 -4.438 1.00 0.00 O ATOM 844 CB PRO A 110 10.865 -10.495 -5.334 1.00 0.00 C ATOM 845 CG PRO A 110 9.581 -11.331 -5.304 1.00 0.00 C ATOM 846 CD PRO A 110 8.664 -10.412 -4.501 1.00 0.00 C ATOM 0 HA PRO A 110 11.647 -10.960 -3.317 1.00 0.00 H new ATOM 0 HB2 PRO A 110 10.752 -9.582 -5.919 1.00 0.00 H new ATOM 0 HB3 PRO A 110 11.707 -11.043 -5.757 1.00 0.00 H new ATOM 0 HG2 PRO A 110 9.194 -11.531 -6.303 1.00 0.00 H new ATOM 0 HG3 PRO A 110 9.727 -12.296 -4.819 1.00 0.00 H new ATOM 0 HD2 PRO A 110 8.357 -9.527 -5.058 1.00 0.00 H new ATOM 0 HD3 PRO A 110 7.754 -10.909 -4.165 1.00 0.00 H new ATOM 847 N TYR A 111 11.866 -8.687 -2.255 1.00 0.00 N ATOM 848 CA TYR A 111 12.255 -7.393 -1.644 1.00 0.00 C ATOM 849 C TYR A 111 13.695 -6.886 -1.997 1.00 0.00 C ATOM 850 O TYR A 111 14.574 -7.730 -2.206 1.00 0.00 O ATOM 851 CB TYR A 111 12.387 -7.673 -0.082 1.00 0.00 C ATOM 852 CG TYR A 111 11.850 -6.534 0.754 1.00 0.00 C ATOM 853 CD1 TYR A 111 10.482 -6.530 0.845 1.00 0.00 C ATOM 854 CD2 TYR A 111 12.581 -5.449 1.300 1.00 0.00 C ATOM 855 CE1 TYR A 111 9.810 -5.476 1.435 1.00 0.00 C ATOM 856 CE2 TYR A 111 11.901 -4.426 1.968 1.00 0.00 C ATOM 857 CZ TYR A 111 10.508 -4.445 2.046 1.00 0.00 C ATOM 858 OH TYR A 111 9.878 -3.388 2.616 1.00 0.00 O ATOM 0 H TYR A 111 11.683 -9.423 -1.573 1.00 0.00 H new ATOM 0 HA TYR A 111 11.516 -6.669 -1.987 1.00 0.00 H new ATOM 0 HB2 TYR A 111 11.850 -8.588 0.167 1.00 0.00 H new ATOM 0 HB3 TYR A 111 13.435 -7.841 0.167 1.00 0.00 H new ATOM 0 HD1 TYR A 111 9.921 -7.364 0.449 1.00 0.00 H new ATOM 0 HD2 TYR A 111 13.656 -5.413 1.201 1.00 0.00 H new ATOM 0 HE1 TYR A 111 8.730 -5.455 1.420 1.00 0.00 H new ATOM 0 HE2 TYR A 111 12.455 -3.619 2.425 1.00 0.00 H new ATOM 0 HH TYR A 111 9.133 -3.105 2.045 1.00 0.00 H new ATOM 859 N ASN A 112 13.971 -5.567 -1.972 1.00 0.00 N ATOM 860 CA ASN A 112 15.364 -5.069 -1.928 1.00 0.00 C ATOM 861 C ASN A 112 15.259 -3.660 -1.269 1.00 0.00 C ATOM 862 O ASN A 112 14.626 -2.727 -1.765 1.00 0.00 O ATOM 863 CB ASN A 112 16.065 -4.950 -3.296 1.00 0.00 C ATOM 864 CG ASN A 112 16.590 -6.249 -3.897 1.00 0.00 C ATOM 865 OD1 ASN A 112 17.529 -6.854 -3.378 1.00 0.00 O ATOM 866 ND2 ASN A 112 16.014 -6.711 -4.994 1.00 0.00 N ATOM 0 H ASN A 112 13.261 -4.835 -1.981 1.00 0.00 H new ATOM 0 HA ASN A 112 15.978 -5.784 -1.380 1.00 0.00 H new ATOM 0 HB2 ASN A 112 15.365 -4.504 -4.002 1.00 0.00 H new ATOM 0 HB3 ASN A 112 16.900 -4.257 -3.194 1.00 0.00 H new ATOM 0 HD21 ASN A 112 16.347 -7.577 -5.419 1.00 0.00 H new ATOM 0 HD22 ASN A 112 15.237 -6.202 -5.415 1.00 0.00 H new ATOM 867 N LYS A 113 15.959 -3.597 -0.145 1.00 0.00 N ATOM 868 CA LYS A 113 16.021 -2.494 0.821 1.00 0.00 C ATOM 869 C LYS A 113 17.404 -1.849 0.886 1.00 0.00 C ATOM 870 O LYS A 113 18.277 -2.085 1.726 1.00 0.00 O ATOM 871 CB LYS A 113 15.514 -3.098 2.123 1.00 0.00 C ATOM 872 CG LYS A 113 16.291 -4.266 2.774 1.00 0.00 C ATOM 873 CD LYS A 113 16.574 -5.571 2.017 1.00 0.00 C ATOM 874 CE LYS A 113 17.946 -5.673 1.314 1.00 0.00 C ATOM 875 NZ LYS A 113 19.064 -5.918 2.245 1.00 0.00 N ATOM 0 H LYS A 113 16.549 -4.377 0.144 1.00 0.00 H new ATOM 0 HA LYS A 113 15.400 -1.643 0.540 1.00 0.00 H new ATOM 0 HB2 LYS A 113 15.459 -2.294 2.856 1.00 0.00 H new ATOM 0 HB3 LYS A 113 14.494 -3.441 1.949 1.00 0.00 H new ATOM 0 HG2 LYS A 113 17.256 -3.867 3.087 1.00 0.00 H new ATOM 0 HG3 LYS A 113 15.750 -4.538 3.680 1.00 0.00 H new ATOM 0 HD2 LYS A 113 16.488 -6.399 2.720 1.00 0.00 H new ATOM 0 HD3 LYS A 113 15.795 -5.707 1.267 1.00 0.00 H new ATOM 0 HE2 LYS A 113 17.911 -6.478 0.580 1.00 0.00 H new ATOM 0 HE3 LYS A 113 18.135 -4.750 0.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 19.954 -5.976 1.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 19.122 -5.138 2.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 18.905 -6.813 2.751 1.00 0.00 H new ATOM 876 N GLU A 114 17.562 -1.074 -0.181 1.00 0.00 N ATOM 877 CA GLU A 114 18.823 -0.997 -0.924 1.00 0.00 C ATOM 878 C GLU A 114 18.726 0.321 -1.708 1.00 0.00 C ATOM 879 O GLU A 114 19.551 1.212 -1.494 1.00 0.00 O ATOM 880 CB GLU A 114 18.819 -2.409 -1.579 1.00 0.00 C ATOM 881 CG GLU A 114 19.385 -2.472 -2.948 1.00 0.00 C ATOM 882 CD GLU A 114 20.876 -2.365 -3.117 1.00 0.00 C ATOM 883 OE1 GLU A 114 21.648 -3.305 -2.935 1.00 0.00 O ATOM 884 OE2 GLU A 114 21.265 -1.105 -3.496 1.00 0.00 O ATOM 0 H GLU A 114 16.823 -0.481 -0.558 1.00 0.00 H new ATOM 0 HA GLU A 114 19.809 -0.888 -0.472 1.00 0.00 H new ATOM 0 HB2 GLU A 114 19.380 -3.090 -0.939 1.00 0.00 H new ATOM 0 HB3 GLU A 114 17.793 -2.774 -1.610 1.00 0.00 H new ATOM 0 HG2 GLU A 114 19.068 -3.415 -3.394 1.00 0.00 H new ATOM 0 HG3 GLU A 114 18.928 -1.674 -3.532 1.00 0.00 H new ATOM 885 N HIS A 115 17.693 0.461 -2.570 1.00 0.00 N ATOM 886 CA HIS A 115 17.243 1.732 -3.121 1.00 0.00 C ATOM 887 C HIS A 115 16.124 2.254 -2.152 1.00 0.00 C ATOM 888 O HIS A 115 14.935 2.319 -2.459 1.00 0.00 O ATOM 889 CB HIS A 115 16.863 1.600 -4.626 1.00 0.00 C ATOM 890 CG HIS A 115 15.846 0.545 -5.013 1.00 0.00 C ATOM 891 ND1 HIS A 115 14.525 0.730 -4.693 1.00 0.00 N ATOM 892 CD2 HIS A 115 16.181 -0.813 -4.967 1.00 0.00 C ATOM 893 CE1 HIS A 115 14.239 -0.528 -4.267 1.00 0.00 C ATOM 894 NE2 HIS A 115 15.120 -1.549 -4.497 1.00 0.00 N ATOM 0 H HIS A 115 17.145 -0.333 -2.901 1.00 0.00 H new ATOM 0 HA HIS A 115 18.027 2.488 -3.157 1.00 0.00 H new ATOM 0 HB2 HIS A 115 16.486 2.566 -4.961 1.00 0.00 H new ATOM 0 HB3 HIS A 115 17.778 1.403 -5.185 1.00 0.00 H new ATOM 0 HD2 HIS A 115 17.136 -1.224 -5.259 1.00 0.00 H new ATOM 0 HE1 HIS A 115 13.314 -0.723 -3.745 1.00 0.00 H new ATOM 0 HE2 HIS A 115 15.019 -2.555 -4.361 1.00 0.00 H new ATOM 895 N LYS A 116 16.530 2.734 -0.991 1.00 0.00 N ATOM 896 CA LYS A 116 15.786 3.575 -0.097 1.00 0.00 C ATOM 897 C LYS A 116 16.339 4.979 -0.342 1.00 0.00 C ATOM 898 O LYS A 116 17.511 5.193 -0.695 1.00 0.00 O ATOM 899 CB LYS A 116 16.213 2.920 1.240 1.00 0.00 C ATOM 900 CG LYS A 116 16.017 3.845 2.414 1.00 0.00 C ATOM 901 CD LYS A 116 14.837 3.450 3.254 1.00 0.00 C ATOM 902 CE LYS A 116 14.593 4.564 4.279 1.00 0.00 C ATOM 903 NZ LYS A 116 13.842 4.137 5.466 1.00 0.00 N ATOM 0 H LYS A 116 17.461 2.525 -0.629 1.00 0.00 H new ATOM 0 HA LYS A 116 14.702 3.660 -0.172 1.00 0.00 H new ATOM 0 HB2 LYS A 116 15.636 2.009 1.397 1.00 0.00 H new ATOM 0 HB3 LYS A 116 17.261 2.627 1.181 1.00 0.00 H new ATOM 0 HG2 LYS A 116 16.916 3.844 3.030 1.00 0.00 H new ATOM 0 HG3 LYS A 116 15.879 4.864 2.053 1.00 0.00 H new ATOM 0 HD2 LYS A 116 13.955 3.307 2.629 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.028 2.503 3.758 1.00 0.00 H new ATOM 0 HE2 LYS A 116 15.555 4.966 4.597 1.00 0.00 H new ATOM 0 HE3 LYS A 116 14.052 5.376 3.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.007 4.745 5.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 13.537 3.150 5.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 14.449 4.213 6.307 1.00 0.00 H new ATOM 904 N ASN A 117 15.499 5.954 0.054 1.00 0.00 N ATOM 905 CA ASN A 117 16.019 7.296 0.484 1.00 0.00 C ATOM 906 C ASN A 117 16.105 8.303 -0.684 1.00 0.00 C ATOM 907 O ASN A 117 15.667 9.446 -0.548 1.00 0.00 O ATOM 908 CB ASN A 117 17.285 7.136 1.395 1.00 0.00 C ATOM 909 CG ASN A 117 17.375 8.118 2.546 1.00 0.00 C ATOM 910 OD1 ASN A 117 17.810 9.257 2.380 1.00 0.00 O ATOM 911 ND2 ASN A 117 16.967 7.711 3.736 1.00 0.00 N ATOM 0 H ASN A 117 14.484 5.858 0.090 1.00 0.00 H new ATOM 0 HA ASN A 117 15.290 7.780 1.134 1.00 0.00 H new ATOM 0 HB2 ASN A 117 17.297 6.124 1.799 1.00 0.00 H new ATOM 0 HB3 ASN A 117 18.175 7.243 0.776 1.00 0.00 H new ATOM 0 HD21 ASN A 117 17.010 8.345 4.534 1.00 0.00 H new ATOM 0 HD22 ASN A 117 16.609 6.763 3.856 1.00 0.00 H new ATOM 912 N LEU A 118 16.642 7.764 -1.800 1.00 0.00 N ATOM 913 CA LEU A 118 16.432 8.267 -3.183 1.00 0.00 C ATOM 914 C LEU A 118 15.979 9.749 -3.448 1.00 0.00 C ATOM 915 O LEU A 118 16.585 10.702 -2.954 1.00 0.00 O ATOM 916 CB LEU A 118 15.620 7.144 -3.851 1.00 0.00 C ATOM 917 CG LEU A 118 16.368 6.015 -4.525 1.00 0.00 C ATOM 918 CD1 LEU A 118 17.095 4.880 -3.908 1.00 0.00 C ATOM 919 CD2 LEU A 118 15.354 5.297 -5.402 1.00 0.00 C ATOM 0 H LEU A 118 17.250 6.946 -1.767 1.00 0.00 H new ATOM 0 HA LEU A 118 17.399 8.447 -3.653 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.973 6.706 -3.091 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.971 7.603 -4.596 1.00 0.00 H new ATOM 0 HG LEU A 118 17.200 6.624 -4.879 1.00 0.00 H new ATOM 0 HD11 LEU A 118 17.519 4.251 -4.691 1.00 0.00 H new ATOM 0 HD12 LEU A 118 17.896 5.262 -3.275 1.00 0.00 H new ATOM 0 HD13 LEU A 118 16.405 4.291 -3.304 1.00 0.00 H new ATOM 0 HD21 LEU A 118 15.840 4.468 -5.916 1.00 0.00 H new ATOM 0 HD22 LEU A 118 14.543 4.914 -4.782 1.00 0.00 H new ATOM 0 HD23 LEU A 118 14.951 5.994 -6.137 1.00 0.00 H new ATOM 920 N ASP A 119 14.998 9.874 -4.360 1.00 0.00 N ATOM 921 CA ASP A 119 15.014 10.760 -5.521 1.00 0.00 C ATOM 922 C ASP A 119 14.247 9.875 -6.649 1.00 0.00 C ATOM 923 O ASP A 119 13.756 8.752 -6.491 1.00 0.00 O ATOM 924 CB ASP A 119 16.447 11.095 -6.002 1.00 0.00 C ATOM 925 CG ASP A 119 16.756 12.576 -5.998 1.00 0.00 C ATOM 926 OD1 ASP A 119 16.272 13.374 -6.801 1.00 0.00 O ATOM 927 OD2 ASP A 119 17.631 12.919 -5.000 1.00 0.00 O ATOM 0 H ASP A 119 14.136 9.332 -4.298 1.00 0.00 H new ATOM 0 HA ASP A 119 14.556 11.725 -5.305 1.00 0.00 H new ATOM 0 HB2 ASP A 119 17.165 10.581 -5.363 1.00 0.00 H new ATOM 0 HB3 ASP A 119 16.583 10.707 -7.011 1.00 0.00 H new ATOM 928 N THR A 120 14.160 10.571 -7.763 1.00 0.00 N ATOM 929 CA THR A 120 13.472 10.191 -8.998 1.00 0.00 C ATOM 930 C THR A 120 14.315 10.787 -10.168 1.00 0.00 C ATOM 931 O THR A 120 13.908 11.780 -10.780 1.00 0.00 O ATOM 932 CB THR A 120 11.982 10.678 -8.964 1.00 0.00 C ATOM 933 OG1 THR A 120 11.852 12.097 -9.030 1.00 0.00 O ATOM 934 CG2 THR A 120 11.245 10.213 -7.703 1.00 0.00 C ATOM 0 H THR A 120 14.599 11.488 -7.844 1.00 0.00 H new ATOM 0 HA THR A 120 13.404 9.111 -9.129 1.00 0.00 H new ATOM 0 HB THR A 120 11.537 10.230 -9.852 1.00 0.00 H new ATOM 0 HG1 THR A 120 12.439 12.447 -9.733 1.00 0.00 H new ATOM 0 HG21 THR A 120 10.218 10.576 -7.727 1.00 0.00 H new ATOM 0 HG22 THR A 120 11.244 9.124 -7.663 1.00 0.00 H new ATOM 0 HG23 THR A 120 11.749 10.608 -6.821 1.00 0.00 H new ATOM 935 N LYS A 121 15.486 10.193 -10.504 1.00 0.00 N ATOM 936 CA LYS A 121 16.404 10.801 -11.551 1.00 0.00 C ATOM 937 C LYS A 121 17.192 9.625 -12.213 1.00 0.00 C ATOM 938 O LYS A 121 16.926 9.196 -13.337 1.00 0.00 O ATOM 939 CB LYS A 121 17.300 11.934 -10.939 1.00 0.00 C ATOM 940 CG LYS A 121 17.759 11.646 -9.494 1.00 0.00 C ATOM 941 CD LYS A 121 19.048 12.310 -9.024 1.00 0.00 C ATOM 942 CE LYS A 121 19.628 11.525 -7.826 1.00 0.00 C ATOM 943 NZ LYS A 121 20.820 12.174 -7.253 1.00 0.00 N ATOM 0 H LYS A 121 15.826 9.324 -10.093 1.00 0.00 H new ATOM 0 HA LYS A 121 15.843 11.314 -12.332 1.00 0.00 H new ATOM 0 HB2 LYS A 121 18.178 12.072 -11.570 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.746 12.872 -10.955 1.00 0.00 H new ATOM 0 HG2 LYS A 121 16.958 11.949 -8.819 1.00 0.00 H new ATOM 0 HG3 LYS A 121 17.876 10.568 -9.386 1.00 0.00 H new ATOM 0 HD2 LYS A 121 19.772 12.338 -9.838 1.00 0.00 H new ATOM 0 HD3 LYS A 121 18.853 13.343 -8.735 1.00 0.00 H new ATOM 0 HE2 LYS A 121 18.864 11.428 -7.054 1.00 0.00 H new ATOM 0 HE3 LYS A 121 19.886 10.516 -8.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 21.172 11.610 -6.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 21.561 12.243 -7.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 20.570 13.127 -6.921 1.00 0.00 H new ATOM 944 N LYS A 122 18.070 9.090 -11.382 1.00 0.00 N ATOM 945 CA LYS A 122 18.631 7.743 -11.411 1.00 0.00 C ATOM 946 C LYS A 122 17.525 6.579 -11.292 1.00 0.00 C ATOM 947 O LYS A 122 17.452 5.615 -12.051 1.00 0.00 O ATOM 948 CB LYS A 122 19.371 7.831 -9.978 1.00 0.00 C ATOM 949 CG LYS A 122 20.790 8.258 -10.063 1.00 0.00 C ATOM 950 CD LYS A 122 21.613 8.327 -8.785 1.00 0.00 C ATOM 951 CE LYS A 122 22.651 9.440 -8.968 1.00 0.00 C ATOM 952 NZ LYS A 122 23.627 9.515 -7.868 1.00 0.00 N ATOM 0 H LYS A 122 18.443 9.631 -10.601 1.00 0.00 H new ATOM 0 HA LYS A 122 19.195 7.509 -12.314 1.00 0.00 H new ATOM 0 HB2 LYS A 122 18.828 8.530 -9.341 1.00 0.00 H new ATOM 0 HB3 LYS A 122 19.323 6.856 -9.494 1.00 0.00 H new ATOM 0 HG2 LYS A 122 21.299 7.578 -10.747 1.00 0.00 H new ATOM 0 HG3 LYS A 122 20.810 9.246 -10.522 1.00 0.00 H new ATOM 0 HD2 LYS A 122 20.973 8.536 -7.927 1.00 0.00 H new ATOM 0 HD3 LYS A 122 22.103 7.373 -8.592 1.00 0.00 H new ATOM 0 HE2 LYS A 122 23.183 9.280 -9.906 1.00 0.00 H new ATOM 0 HE3 LYS A 122 22.136 10.397 -9.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 24.300 10.287 -8.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 23.129 9.697 -6.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 24.143 8.615 -7.800 1.00 0.00 H new ATOM 953 N TYR A 123 16.730 6.860 -10.280 1.00 0.00 N ATOM 954 CA TYR A 123 15.650 6.147 -9.607 1.00 0.00 C ATOM 955 C TYR A 123 14.322 6.244 -10.342 1.00 0.00 C ATOM 956 O TYR A 123 13.681 5.206 -10.514 1.00 0.00 O ATOM 957 CB TYR A 123 15.805 6.981 -8.287 1.00 0.00 C ATOM 958 CG TYR A 123 17.174 6.779 -7.538 1.00 0.00 C ATOM 959 CD1 TYR A 123 17.977 5.620 -7.634 1.00 0.00 C ATOM 960 CD2 TYR A 123 17.694 7.882 -6.895 1.00 0.00 C ATOM 961 CE1 TYR A 123 19.275 5.629 -7.144 1.00 0.00 C ATOM 962 CE2 TYR A 123 18.972 7.861 -6.356 1.00 0.00 C ATOM 963 CZ TYR A 123 19.767 6.728 -6.461 1.00 0.00 C ATOM 964 OH TYR A 123 21.056 6.743 -6.013 1.00 0.00 O ATOM 0 H TYR A 123 16.850 7.765 -9.825 1.00 0.00 H new ATOM 0 HA TYR A 123 15.684 5.062 -9.504 1.00 0.00 H new ATOM 0 HB2 TYR A 123 15.690 8.038 -8.526 1.00 0.00 H new ATOM 0 HB3 TYR A 123 14.993 6.717 -7.609 1.00 0.00 H new ATOM 0 HD1 TYR A 123 17.579 4.725 -8.090 1.00 0.00 H new ATOM 0 HD2 TYR A 123 17.096 8.777 -6.809 1.00 0.00 H new ATOM 0 HE1 TYR A 123 19.909 4.768 -7.297 1.00 0.00 H new ATOM 0 HE2 TYR A 123 19.353 8.736 -5.849 1.00 0.00 H new ATOM 0 HH TYR A 123 21.234 7.592 -5.556 1.00 0.00 H new ATOM 965 N CYS A 124 13.923 7.450 -10.817 1.00 0.00 N ATOM 966 CA CYS A 124 12.672 7.672 -11.574 1.00 0.00 C ATOM 967 C CYS A 124 12.699 8.972 -12.393 1.00 0.00 C ATOM 968 O CYS A 124 13.650 9.287 -13.111 1.00 0.00 O ATOM 969 CB CYS A 124 11.435 7.332 -10.755 1.00 0.00 C ATOM 970 SG CYS A 124 10.837 5.711 -11.215 1.00 0.00 S ATOM 971 OXT CYS A 124 11.555 9.723 -12.284 1.00 0.00 O ATOM 0 H CYS A 124 14.468 8.302 -10.682 1.00 0.00 H new ATOM 0 HA CYS A 124 12.593 6.939 -12.377 1.00 0.00 H new ATOM 0 HB2 CYS A 124 11.673 7.354 -9.692 1.00 0.00 H new ATOM 0 HB3 CYS A 124 10.659 8.078 -10.923 1.00 0.00 H new TER 972 CYS A 124 HETATM 973 CA CA A 125 2.699 6.901 -5.045 1.00 0.00 CA