USER MOD reduce.3.24.130724 H: found=0, std=0, add=1291, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1284 hydrogens (24 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 153 HIS : no HE2:sc= -6.21! C(o=-5.8!,f=-9.2!) USER MOD Set 1.2: A 155 TYR OH : rot 123:sc= 0.397 USER MOD Set 2.1: A 112 THR OG1 : rot -64:sc= 1.2 USER MOD Set 2.2: A 159 GLN : amide:sc= 0.267 K(o=1.5,f=-4.3!) USER MOD Single : A 1 THR N :NH3+ 150:sc= 0.157 (180deg=0.0623) USER MOD Single : A 1 THR OG1 : rot 155:sc= 1.28 USER MOD Single : A 7 GLN : amide:sc= -2.75 K(o=-2.8,f=-1.4) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -0.404 K(o=-0.4,f=-3.3!) USER MOD Single : A 22 HIS : no HD1:sc= -0.456 X(o=-0.46,f=-0.16) USER MOD Single : A 28 HIS : no HD1:sc= -0.168 X(o=-0.17,f=-0.23) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.12) USER MOD Single : A 34 THR OG1 : rot -78:sc= -0.0452 USER MOD Single : A 37 LYS NZ :NH3+ 159:sc= -0.0145 (180deg=-0.246) USER MOD Single : A 39 MET CE :methyl -107:sc= -2.16! (180deg=-6.02!) USER MOD Single : A 45 THR OG1 : rot -150:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.915 USER MOD Single : A 48 SER OG : rot 78:sc= 0.986 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -1.48! C(o=-1.5!,f=-4.7!) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -3.57! C(o=-3.6!,f=-1.7!) USER MOD Single : A 65 GLN : amide:sc= -0.499 K(o=-0.5,f=-3.8!) USER MOD Single : A 68 TYR OH : rot 30:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -3.79 X(o=-3.8,f=-4) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 159:sc= -0.0289 (180deg=-0.347) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 92 GLN : amide:sc= -1.08 K(o=-1.1,f=-2.6!) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.00197 USER MOD Single : A 107 LYS NZ :NH3+ -108:sc= -1.6 (180deg=-6.06!) USER MOD Single : A 116 THR OG1 : rot -98:sc= 0.0658 USER MOD Single : A 121 SER OG : rot 180:sc= 0.00259 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 178:sc= -1.53 (180deg=-1.58) USER MOD Single : A 132 ASN : amide:sc= -0.989 K(o=-0.99,f=-0.22) USER MOD Single : A 137 THR OG1 : rot 115:sc=-0.00933 USER MOD Single : A 138 LYS NZ :NH3+ 155:sc= 0.891 (180deg=-1.11) USER MOD Single : A 140 SER OG : rot 180:sc= -0.0445 USER MOD Single : A 141 SER OG : rot 10:sc= 0.984 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0457 USER MOD Single : A 148 ASN : amide:sc= -1.27 K(o=-1.3,f=-4.6!) USER MOD Single : A 152 THR OG1 : rot 112:sc= 1.15 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.0133 USER MOD Single : A 160 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0926) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -3.555 6.219 4.159 1.00 0.00 N ATOM 2 CA THR A 1 -3.513 5.056 3.228 1.00 0.00 C ATOM 3 C THR A 1 -2.124 4.415 3.277 1.00 0.00 C ATOM 4 O THR A 1 -1.142 5.065 3.582 1.00 0.00 O ATOM 5 CB THR A 1 -3.804 5.533 1.802 1.00 0.00 C ATOM 6 OG1 THR A 1 -4.925 6.405 1.817 1.00 0.00 O ATOM 7 CG2 THR A 1 -4.104 4.327 0.910 1.00 0.00 C ATOM 0 H1 THR A 1 -4.224 6.929 3.798 1.00 0.00 H new ATOM 0 H2 THR A 1 -3.863 5.900 5.100 1.00 0.00 H new ATOM 0 H3 THR A 1 -2.607 6.642 4.230 1.00 0.00 H new ATOM 0 HA THR A 1 -4.263 4.324 3.527 1.00 0.00 H new ATOM 0 HB THR A 1 -2.936 6.063 1.411 1.00 0.00 H new ATOM 0 HG1 THR A 1 -4.882 7.006 1.044 1.00 0.00 H new ATOM 0 HG21 THR A 1 -4.311 4.667 -0.105 1.00 0.00 H new ATOM 0 HG22 THR A 1 -3.243 3.659 0.900 1.00 0.00 H new ATOM 0 HG23 THR A 1 -4.972 3.794 1.298 1.00 0.00 H new ATOM 17 N ALA A 2 -2.038 3.143 2.977 1.00 0.00 N ATOM 18 CA ALA A 2 -0.718 2.449 3.003 1.00 0.00 C ATOM 19 C ALA A 2 -0.534 1.656 1.708 1.00 0.00 C ATOM 20 O ALA A 2 -1.236 0.696 1.455 1.00 0.00 O ATOM 21 CB ALA A 2 -0.667 1.495 4.197 1.00 0.00 C ATOM 0 H ALA A 2 -2.829 2.555 2.715 1.00 0.00 H new ATOM 0 HA ALA A 2 0.079 3.187 3.094 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.297 0.988 4.216 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.798 2.060 5.120 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.464 0.757 4.107 1.00 0.00 H new ATOM 27 N PHE A 3 0.407 2.053 0.888 1.00 0.00 N ATOM 28 CA PHE A 3 0.644 1.327 -0.394 1.00 0.00 C ATOM 29 C PHE A 3 1.611 0.165 -0.151 1.00 0.00 C ATOM 30 O PHE A 3 2.419 0.200 0.758 1.00 0.00 O ATOM 31 CB PHE A 3 1.251 2.288 -1.419 1.00 0.00 C ATOM 32 CG PHE A 3 0.151 3.078 -2.088 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.761 3.808 -1.314 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.043 3.081 -3.483 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.778 4.540 -1.937 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.975 3.813 -4.106 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.886 4.542 -3.333 1.00 0.00 C ATOM 0 H PHE A 3 1.022 2.850 1.053 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.302 0.940 -0.773 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.951 2.964 -0.928 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.817 1.730 -2.165 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -0.679 3.806 -0.237 1.00 0.00 H new ATOM 0 HD2 PHE A 3 0.746 2.518 -4.080 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.480 5.104 -1.341 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -1.057 3.815 -5.183 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.672 5.106 -3.813 1.00 0.00 H new ATOM 47 N LEU A 4 1.530 -0.861 -0.958 1.00 0.00 N ATOM 48 CA LEU A 4 2.439 -2.033 -0.785 1.00 0.00 C ATOM 49 C LEU A 4 2.431 -2.874 -2.063 1.00 0.00 C ATOM 50 O LEU A 4 1.450 -3.518 -2.384 1.00 0.00 O ATOM 51 CB LEU A 4 1.952 -2.886 0.391 1.00 0.00 C ATOM 52 CG LEU A 4 2.948 -4.015 0.655 1.00 0.00 C ATOM 53 CD1 LEU A 4 4.165 -3.462 1.399 1.00 0.00 C ATOM 54 CD2 LEU A 4 2.279 -5.095 1.507 1.00 0.00 C ATOM 0 H LEU A 4 0.871 -0.938 -1.732 1.00 0.00 H new ATOM 0 HA LEU A 4 3.452 -1.683 -0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.844 -2.267 1.282 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.968 -3.300 0.170 1.00 0.00 H new ATOM 0 HG LEU A 4 3.268 -4.445 -0.294 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.874 -4.268 1.586 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.643 -2.692 0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.846 -3.031 2.348 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.988 -5.901 1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.959 -4.664 2.455 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.412 -5.491 0.978 1.00 0.00 H new ATOM 66 N TRP A 5 3.517 -2.869 -2.795 1.00 0.00 N ATOM 67 CA TRP A 5 3.575 -3.664 -4.055 1.00 0.00 C ATOM 68 C TRP A 5 4.965 -4.297 -4.204 1.00 0.00 C ATOM 69 O TRP A 5 5.962 -3.721 -3.810 1.00 0.00 O ATOM 70 CB TRP A 5 3.283 -2.748 -5.253 1.00 0.00 C ATOM 71 CG TRP A 5 4.306 -1.655 -5.338 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.266 -1.568 -6.287 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.491 -0.503 -4.462 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.026 -0.438 -6.053 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.589 0.252 -4.941 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.821 -0.042 -3.314 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.008 1.420 -4.302 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.241 1.134 -2.669 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.332 1.862 -3.162 1.00 0.00 C ATOM 0 H TRP A 5 4.365 -2.348 -2.572 1.00 0.00 H new ATOM 0 HA TRP A 5 2.827 -4.456 -4.020 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.287 -3.331 -6.174 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.287 -2.316 -5.154 1.00 0.00 H new ATOM 0 HD1 TRP A 5 5.414 -2.268 -7.096 1.00 0.00 H new ATOM 0 HE1 TRP A 5 6.814 -0.149 -6.632 1.00 0.00 H new ATOM 0 HE3 TRP A 5 2.979 -0.595 -2.926 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.849 1.978 -4.686 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.720 1.479 -1.788 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.650 2.764 -2.661 1.00 0.00 H new ATOM 90 N ALA A 6 5.033 -5.474 -4.774 1.00 0.00 N ATOM 91 CA ALA A 6 6.351 -6.148 -4.956 1.00 0.00 C ATOM 92 C ALA A 6 6.875 -5.859 -6.364 1.00 0.00 C ATOM 93 O ALA A 6 6.309 -6.302 -7.347 1.00 0.00 O ATOM 94 CB ALA A 6 6.182 -7.658 -4.773 1.00 0.00 C ATOM 0 H ALA A 6 4.229 -5.997 -5.121 1.00 0.00 H new ATOM 0 HA ALA A 6 7.060 -5.772 -4.218 1.00 0.00 H new ATOM 0 HB1 ALA A 6 7.145 -8.151 -4.906 1.00 0.00 H new ATOM 0 HB2 ALA A 6 5.805 -7.863 -3.771 1.00 0.00 H new ATOM 0 HB3 ALA A 6 5.476 -8.037 -5.511 1.00 0.00 H new ATOM 100 N GLN A 7 7.950 -5.119 -6.468 1.00 0.00 N ATOM 101 CA GLN A 7 8.513 -4.794 -7.810 1.00 0.00 C ATOM 102 C GLN A 7 10.021 -5.056 -7.813 1.00 0.00 C ATOM 103 O GLN A 7 10.674 -4.980 -6.790 1.00 0.00 O ATOM 104 CB GLN A 7 8.249 -3.320 -8.133 1.00 0.00 C ATOM 105 CG GLN A 7 8.815 -2.435 -7.017 1.00 0.00 C ATOM 106 CD GLN A 7 10.192 -1.907 -7.429 1.00 0.00 C ATOM 107 OE1 GLN A 7 10.291 -0.984 -8.213 1.00 0.00 O ATOM 108 NE2 GLN A 7 11.264 -2.457 -6.929 1.00 0.00 N ATOM 0 H GLN A 7 8.462 -4.726 -5.678 1.00 0.00 H new ATOM 0 HA GLN A 7 8.036 -5.422 -8.563 1.00 0.00 H new ATOM 0 HB2 GLN A 7 8.710 -3.059 -9.086 1.00 0.00 H new ATOM 0 HB3 GLN A 7 7.178 -3.147 -8.239 1.00 0.00 H new ATOM 0 HG2 GLN A 7 8.139 -1.603 -6.821 1.00 0.00 H new ATOM 0 HG3 GLN A 7 8.895 -3.006 -6.092 1.00 0.00 H new ATOM 0 HE21 GLN A 7 11.180 -3.232 -6.271 1.00 0.00 H new ATOM 0 HE22 GLN A 7 12.186 -2.112 -7.196 1.00 0.00 H new ATOM 117 N ASP A 8 10.574 -5.363 -8.959 1.00 0.00 N ATOM 118 CA ASP A 8 12.040 -5.632 -9.042 1.00 0.00 C ATOM 119 C ASP A 8 12.748 -4.414 -9.640 1.00 0.00 C ATOM 120 O ASP A 8 12.114 -3.489 -10.113 1.00 0.00 O ATOM 121 CB ASP A 8 12.293 -6.858 -9.926 1.00 0.00 C ATOM 122 CG ASP A 8 11.541 -6.711 -11.253 1.00 0.00 C ATOM 123 OD1 ASP A 8 11.389 -5.589 -11.707 1.00 0.00 O ATOM 124 OD2 ASP A 8 11.129 -7.726 -11.792 1.00 0.00 O ATOM 0 H ASP A 8 10.071 -5.439 -9.843 1.00 0.00 H new ATOM 0 HA ASP A 8 12.429 -5.825 -8.042 1.00 0.00 H new ATOM 0 HB2 ASP A 8 13.361 -6.967 -10.114 1.00 0.00 H new ATOM 0 HB3 ASP A 8 11.966 -7.762 -9.411 1.00 0.00 H new ATOM 129 N ARG A 9 14.057 -4.409 -9.622 1.00 0.00 N ATOM 130 CA ARG A 9 14.819 -3.254 -10.187 1.00 0.00 C ATOM 131 C ARG A 9 14.499 -3.100 -11.676 1.00 0.00 C ATOM 132 O ARG A 9 14.711 -2.052 -12.257 1.00 0.00 O ATOM 133 CB ARG A 9 16.319 -3.498 -10.011 1.00 0.00 C ATOM 134 CG ARG A 9 16.692 -4.852 -10.618 1.00 0.00 C ATOM 135 CD ARG A 9 18.179 -5.124 -10.383 1.00 0.00 C ATOM 136 NE ARG A 9 18.986 -4.426 -11.431 1.00 0.00 N ATOM 137 CZ ARG A 9 19.432 -3.203 -11.240 1.00 0.00 C ATOM 138 NH1 ARG A 9 19.181 -2.562 -10.126 1.00 0.00 N ATOM 139 NH2 ARG A 9 20.133 -2.621 -12.174 1.00 0.00 N ATOM 0 H ARG A 9 14.633 -5.158 -9.239 1.00 0.00 H new ATOM 0 HA ARG A 9 14.532 -2.343 -9.662 1.00 0.00 H new ATOM 0 HB2 ARG A 9 16.886 -2.703 -10.494 1.00 0.00 H new ATOM 0 HB3 ARG A 9 16.580 -3.478 -8.953 1.00 0.00 H new ATOM 0 HG2 ARG A 9 16.091 -5.642 -10.168 1.00 0.00 H new ATOM 0 HG3 ARG A 9 16.475 -4.856 -11.686 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.471 -4.776 -9.392 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.373 -6.196 -10.414 1.00 0.00 H new ATOM 0 HE ARG A 9 19.194 -4.905 -12.307 1.00 0.00 H new ATOM 0 HH11 ARG A 9 18.633 -3.011 -9.392 1.00 0.00 H new ATOM 0 HH12 ARG A 9 19.534 -1.614 -9.992 1.00 0.00 H new ATOM 0 HH21 ARG A 9 20.332 -3.114 -13.045 1.00 0.00 H new ATOM 0 HH22 ARG A 9 20.482 -1.673 -12.034 1.00 0.00 H new ATOM 153 N ASP A 10 13.990 -4.135 -12.296 1.00 0.00 N ATOM 154 CA ASP A 10 13.654 -4.055 -13.749 1.00 0.00 C ATOM 155 C ASP A 10 12.341 -3.287 -13.935 1.00 0.00 C ATOM 156 O ASP A 10 11.738 -3.324 -14.991 1.00 0.00 O ATOM 157 CB ASP A 10 13.501 -5.468 -14.315 1.00 0.00 C ATOM 158 CG ASP A 10 14.884 -6.092 -14.510 1.00 0.00 C ATOM 159 OD1 ASP A 10 15.473 -5.866 -15.554 1.00 0.00 O ATOM 160 OD2 ASP A 10 15.332 -6.786 -13.611 1.00 0.00 O ATOM 0 H ASP A 10 13.792 -5.034 -11.856 1.00 0.00 H new ATOM 0 HA ASP A 10 14.454 -3.535 -14.275 1.00 0.00 H new ATOM 0 HB2 ASP A 10 12.906 -6.080 -13.637 1.00 0.00 H new ATOM 0 HB3 ASP A 10 12.968 -5.435 -15.265 1.00 0.00 H new ATOM 165 N GLY A 11 11.897 -2.590 -12.918 1.00 0.00 N ATOM 166 CA GLY A 11 10.623 -1.817 -13.029 1.00 0.00 C ATOM 167 C GLY A 11 9.460 -2.776 -13.291 1.00 0.00 C ATOM 168 O GLY A 11 8.546 -2.467 -14.030 1.00 0.00 O ATOM 0 H GLY A 11 12.364 -2.524 -12.014 1.00 0.00 H new ATOM 0 HA2 GLY A 11 10.445 -1.256 -12.111 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.697 -1.090 -13.838 1.00 0.00 H new ATOM 172 N LEU A 12 9.493 -3.939 -12.689 1.00 0.00 N ATOM 173 CA LEU A 12 8.393 -4.926 -12.897 1.00 0.00 C ATOM 174 C LEU A 12 7.523 -4.992 -11.641 1.00 0.00 C ATOM 175 O LEU A 12 7.890 -4.489 -10.596 1.00 0.00 O ATOM 176 CB LEU A 12 8.992 -6.306 -13.177 1.00 0.00 C ATOM 177 CG LEU A 12 8.055 -7.093 -14.095 1.00 0.00 C ATOM 178 CD1 LEU A 12 8.183 -6.568 -15.526 1.00 0.00 C ATOM 179 CD2 LEU A 12 8.437 -8.575 -14.060 1.00 0.00 C ATOM 0 H LEU A 12 10.236 -4.246 -12.062 1.00 0.00 H new ATOM 0 HA LEU A 12 7.783 -4.617 -13.745 1.00 0.00 H new ATOM 0 HB2 LEU A 12 9.972 -6.201 -13.643 1.00 0.00 H new ATOM 0 HB3 LEU A 12 9.140 -6.846 -12.242 1.00 0.00 H new ATOM 0 HG LEU A 12 7.026 -6.973 -13.755 1.00 0.00 H new ATOM 0 HD11 LEU A 12 7.515 -7.129 -16.180 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.914 -5.512 -15.552 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.211 -6.689 -15.867 1.00 0.00 H new ATOM 0 HD21 LEU A 12 7.771 -9.138 -14.713 1.00 0.00 H new ATOM 0 HD22 LEU A 12 9.465 -8.694 -14.401 1.00 0.00 H new ATOM 0 HD23 LEU A 12 8.347 -8.950 -13.040 1.00 0.00 H new ATOM 191 N ILE A 13 6.374 -5.611 -11.737 1.00 0.00 N ATOM 192 CA ILE A 13 5.472 -5.716 -10.552 1.00 0.00 C ATOM 193 C ILE A 13 4.790 -7.086 -10.549 1.00 0.00 C ATOM 194 O ILE A 13 4.465 -7.623 -9.505 1.00 0.00 O ATOM 195 CB ILE A 13 4.409 -4.618 -10.621 1.00 0.00 C ATOM 196 CG1 ILE A 13 3.691 -4.686 -11.972 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.075 -3.250 -10.468 1.00 0.00 C ATOM 198 CD1 ILE A 13 2.490 -3.738 -11.962 1.00 0.00 C ATOM 0 H ILE A 13 6.021 -6.049 -12.588 1.00 0.00 H new ATOM 0 HA ILE A 13 6.057 -5.599 -9.640 1.00 0.00 H new ATOM 0 HB ILE A 13 3.687 -4.763 -9.817 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.377 -4.412 -12.774 1.00 0.00 H new ATOM 0 HG13 ILE A 13 3.361 -5.706 -12.169 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.317 -2.469 -10.517 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.586 -3.200 -9.507 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.798 -3.105 -11.271 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.980 -3.787 -12.924 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.801 -4.032 -11.170 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.833 -2.719 -11.785 1.00 0.00 H new ATOM 210 N GLY A 14 4.571 -7.653 -11.709 1.00 0.00 N ATOM 211 CA GLY A 14 3.910 -8.990 -11.781 1.00 0.00 C ATOM 212 C GLY A 14 3.864 -9.459 -13.237 1.00 0.00 C ATOM 213 O GLY A 14 4.375 -8.804 -14.125 1.00 0.00 O ATOM 0 H GLY A 14 4.822 -7.246 -12.610 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.456 -9.711 -11.173 1.00 0.00 H new ATOM 0 HA3 GLY A 14 2.900 -8.931 -11.375 1.00 0.00 H new ATOM 217 N LYS A 15 3.251 -10.589 -13.484 1.00 0.00 N ATOM 218 CA LYS A 15 3.164 -11.112 -14.878 1.00 0.00 C ATOM 219 C LYS A 15 2.091 -12.200 -14.950 1.00 0.00 C ATOM 220 O LYS A 15 2.132 -13.173 -14.220 1.00 0.00 O ATOM 221 CB LYS A 15 4.516 -11.701 -15.287 1.00 0.00 C ATOM 222 CG LYS A 15 4.521 -11.972 -16.793 1.00 0.00 C ATOM 223 CD LYS A 15 5.639 -12.960 -17.132 1.00 0.00 C ATOM 224 CE LYS A 15 5.185 -14.380 -16.791 1.00 0.00 C ATOM 225 NZ LYS A 15 6.055 -15.362 -17.500 1.00 0.00 N ATOM 0 H LYS A 15 2.806 -11.173 -12.776 1.00 0.00 H new ATOM 0 HA LYS A 15 2.902 -10.299 -15.555 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.319 -11.010 -15.029 1.00 0.00 H new ATOM 0 HB3 LYS A 15 4.702 -12.625 -14.740 1.00 0.00 H new ATOM 0 HG2 LYS A 15 3.558 -12.377 -17.103 1.00 0.00 H new ATOM 0 HG3 LYS A 15 4.667 -11.041 -17.340 1.00 0.00 H new ATOM 0 HD2 LYS A 15 5.891 -12.892 -18.190 1.00 0.00 H new ATOM 0 HD3 LYS A 15 6.541 -12.711 -16.573 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.238 -14.542 -15.714 1.00 0.00 H new ATOM 0 HE3 LYS A 15 4.145 -14.521 -17.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 5.748 -16.328 -17.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 5.983 -15.212 -18.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 7.042 -15.232 -17.199 1.00 0.00 H new ATOM 239 N ASP A 16 1.127 -12.039 -15.824 1.00 0.00 N ATOM 240 CA ASP A 16 0.039 -13.057 -15.953 1.00 0.00 C ATOM 241 C ASP A 16 -0.704 -13.192 -14.621 1.00 0.00 C ATOM 242 O ASP A 16 -1.229 -14.241 -14.299 1.00 0.00 O ATOM 243 CB ASP A 16 0.644 -14.411 -16.341 1.00 0.00 C ATOM 244 CG ASP A 16 0.603 -14.573 -17.862 1.00 0.00 C ATOM 245 OD1 ASP A 16 -0.392 -14.186 -18.453 1.00 0.00 O ATOM 246 OD2 ASP A 16 1.568 -15.081 -18.411 1.00 0.00 O ATOM 0 H ASP A 16 1.047 -11.242 -16.456 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.661 -12.738 -16.725 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.672 -14.477 -15.986 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.089 -15.219 -15.864 1.00 0.00 H new ATOM 251 N GLY A 17 -0.749 -12.137 -13.849 1.00 0.00 N ATOM 252 CA GLY A 17 -1.454 -12.192 -12.535 1.00 0.00 C ATOM 253 C GLY A 17 -0.462 -12.575 -11.436 1.00 0.00 C ATOM 254 O GLY A 17 -0.217 -11.814 -10.518 1.00 0.00 O ATOM 0 H GLY A 17 -0.326 -11.237 -14.074 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -1.904 -11.225 -12.312 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -2.265 -12.919 -12.576 1.00 0.00 H new ATOM 258 N HIS A 18 0.110 -13.749 -11.525 1.00 0.00 N ATOM 259 CA HIS A 18 1.089 -14.191 -10.489 1.00 0.00 C ATOM 260 C HIS A 18 2.395 -13.410 -10.654 1.00 0.00 C ATOM 261 O HIS A 18 2.518 -12.571 -11.528 1.00 0.00 O ATOM 262 CB HIS A 18 1.365 -15.690 -10.649 1.00 0.00 C ATOM 263 CG HIS A 18 1.787 -15.980 -12.064 1.00 0.00 C ATOM 264 ND1 HIS A 18 3.120 -16.013 -12.445 1.00 0.00 N ATOM 265 CD2 HIS A 18 1.065 -16.253 -13.199 1.00 0.00 C ATOM 266 CE1 HIS A 18 3.157 -16.296 -13.761 1.00 0.00 C ATOM 267 NE2 HIS A 18 1.933 -16.452 -14.270 1.00 0.00 N ATOM 0 H HIS A 18 -0.060 -14.421 -12.273 1.00 0.00 H new ATOM 0 HA HIS A 18 0.676 -14.003 -9.498 1.00 0.00 H new ATOM 0 HB2 HIS A 18 2.146 -16.002 -9.955 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.471 -16.263 -10.401 1.00 0.00 H new ATOM 0 HD1 HIS A 18 3.925 -15.852 -11.839 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -0.012 -16.306 -13.253 1.00 0.00 H new ATOM 0 HE1 HIS A 18 4.067 -16.386 -14.335 1.00 0.00 H new ATOM 275 N LEU A 19 3.369 -13.680 -9.822 1.00 0.00 N ATOM 276 CA LEU A 19 4.670 -12.957 -9.923 1.00 0.00 C ATOM 277 C LEU A 19 5.622 -13.742 -10.837 1.00 0.00 C ATOM 278 O LEU A 19 5.450 -14.931 -11.020 1.00 0.00 O ATOM 279 CB LEU A 19 5.292 -12.828 -8.530 1.00 0.00 C ATOM 280 CG LEU A 19 4.642 -11.659 -7.787 1.00 0.00 C ATOM 281 CD1 LEU A 19 4.984 -11.748 -6.299 1.00 0.00 C ATOM 282 CD2 LEU A 19 5.172 -10.340 -8.354 1.00 0.00 C ATOM 0 H LEU A 19 3.317 -14.373 -9.075 1.00 0.00 H new ATOM 0 HA LEU A 19 4.502 -11.964 -10.340 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.151 -13.752 -7.970 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.367 -12.667 -8.614 1.00 0.00 H new ATOM 0 HG LEU A 19 3.560 -11.702 -7.914 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.521 -10.916 -5.769 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.609 -12.689 -5.895 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.066 -11.703 -6.171 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.710 -9.505 -7.826 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.254 -10.297 -8.225 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.930 -10.277 -9.415 1.00 0.00 H new ATOM 294 N PRO A 20 6.606 -13.060 -11.389 1.00 0.00 N ATOM 295 CA PRO A 20 7.644 -13.635 -12.310 1.00 0.00 C ATOM 296 C PRO A 20 8.729 -14.344 -11.495 1.00 0.00 C ATOM 297 O PRO A 20 9.333 -15.297 -11.950 1.00 0.00 O ATOM 298 CB PRO A 20 8.242 -12.458 -13.079 1.00 0.00 C ATOM 299 CG PRO A 20 7.805 -11.187 -12.377 1.00 0.00 C ATOM 300 CD PRO A 20 6.896 -11.590 -11.220 1.00 0.00 C ATOM 0 HA PRO A 20 7.210 -14.367 -12.991 1.00 0.00 H new ATOM 0 HB2 PRO A 20 9.329 -12.528 -13.103 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.899 -12.462 -14.114 1.00 0.00 H new ATOM 0 HG2 PRO A 20 8.670 -10.635 -12.010 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.277 -10.530 -13.068 1.00 0.00 H new ATOM 0 HD2 PRO A 20 7.380 -11.399 -10.262 1.00 0.00 H new ATOM 0 HD3 PRO A 20 5.973 -11.010 -11.232 1.00 0.00 H new ATOM 308 N TRP A 21 8.979 -13.883 -10.296 1.00 0.00 N ATOM 309 CA TRP A 21 10.025 -14.524 -9.443 1.00 0.00 C ATOM 310 C TRP A 21 9.353 -15.348 -8.342 1.00 0.00 C ATOM 311 O TRP A 21 8.145 -15.479 -8.304 1.00 0.00 O ATOM 312 CB TRP A 21 10.905 -13.441 -8.810 1.00 0.00 C ATOM 313 CG TRP A 21 10.046 -12.450 -8.089 1.00 0.00 C ATOM 314 CD1 TRP A 21 9.559 -12.609 -6.836 1.00 0.00 C ATOM 315 CD2 TRP A 21 9.566 -11.154 -8.552 1.00 0.00 C ATOM 316 NE1 TRP A 21 8.811 -11.495 -6.502 1.00 0.00 N ATOM 317 CE2 TRP A 21 8.786 -10.570 -7.527 1.00 0.00 C ATOM 318 CE3 TRP A 21 9.731 -10.438 -9.751 1.00 0.00 C ATOM 319 CZ2 TRP A 21 8.190 -9.318 -7.686 1.00 0.00 C ATOM 320 CZ3 TRP A 21 9.132 -9.177 -9.913 1.00 0.00 C ATOM 321 CH2 TRP A 21 8.364 -8.619 -8.883 1.00 0.00 C ATOM 0 H TRP A 21 8.502 -13.088 -9.870 1.00 0.00 H new ATOM 0 HA TRP A 21 10.643 -15.178 -10.058 1.00 0.00 H new ATOM 0 HB2 TRP A 21 11.614 -13.894 -8.117 1.00 0.00 H new ATOM 0 HB3 TRP A 21 11.489 -12.938 -9.580 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.727 -13.466 -6.201 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.336 -11.372 -5.608 1.00 0.00 H new ATOM 0 HE3 TRP A 21 10.321 -10.859 -10.551 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 7.598 -8.892 -6.889 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 9.265 -8.635 -10.838 1.00 0.00 H new ATOM 0 HH2 TRP A 21 7.907 -7.649 -9.014 1.00 0.00 H new ATOM 332 N HIS A 22 10.133 -15.903 -7.449 1.00 0.00 N ATOM 333 CA HIS A 22 9.551 -16.722 -6.345 1.00 0.00 C ATOM 334 C HIS A 22 10.206 -16.326 -5.020 1.00 0.00 C ATOM 335 O HIS A 22 11.324 -16.708 -4.732 1.00 0.00 O ATOM 336 CB HIS A 22 9.809 -18.205 -6.619 1.00 0.00 C ATOM 337 CG HIS A 22 8.922 -19.039 -5.737 1.00 0.00 C ATOM 338 ND1 HIS A 22 7.539 -18.990 -5.820 1.00 0.00 N ATOM 339 CD2 HIS A 22 9.205 -19.950 -4.749 1.00 0.00 C ATOM 340 CE1 HIS A 22 7.047 -19.846 -4.906 1.00 0.00 C ATOM 341 NE2 HIS A 22 8.019 -20.457 -4.226 1.00 0.00 N ATOM 0 H HIS A 22 11.150 -15.823 -7.438 1.00 0.00 H new ATOM 0 HA HIS A 22 8.477 -16.546 -6.288 1.00 0.00 H new ATOM 0 HB2 HIS A 22 9.614 -18.431 -7.667 1.00 0.00 H new ATOM 0 HB3 HIS A 22 10.856 -18.444 -6.431 1.00 0.00 H new ATOM 0 HD2 HIS A 22 10.197 -20.230 -4.427 1.00 0.00 H new ATOM 0 HE1 HIS A 22 5.993 -20.018 -4.743 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.915 -21.147 -3.482 1.00 0.00 H new ATOM 349 N LEU A 23 9.513 -15.561 -4.213 1.00 0.00 N ATOM 350 CA LEU A 23 10.086 -15.132 -2.904 1.00 0.00 C ATOM 351 C LEU A 23 9.128 -15.532 -1.769 1.00 0.00 C ATOM 352 O LEU A 23 8.347 -14.720 -1.314 1.00 0.00 O ATOM 353 CB LEU A 23 10.276 -13.613 -2.906 1.00 0.00 C ATOM 354 CG LEU A 23 11.226 -13.211 -1.775 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.619 -13.781 -2.047 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.308 -11.683 -1.697 1.00 0.00 C ATOM 0 H LEU A 23 8.573 -15.215 -4.407 1.00 0.00 H new ATOM 0 HA LEU A 23 11.050 -15.617 -2.750 1.00 0.00 H new ATOM 0 HB2 LEU A 23 10.679 -13.288 -3.865 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.314 -13.116 -2.780 1.00 0.00 H new ATOM 0 HG LEU A 23 10.851 -13.606 -0.831 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.294 -13.494 -1.241 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.563 -14.868 -2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 23 12.995 -13.388 -2.992 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.984 -11.396 -0.892 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.682 -11.290 -2.643 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.316 -11.275 -1.501 1.00 0.00 H new ATOM 368 N PRO A 24 9.212 -16.778 -1.343 1.00 0.00 N ATOM 369 CA PRO A 24 8.369 -17.377 -0.246 1.00 0.00 C ATOM 370 C PRO A 24 8.298 -16.420 0.950 1.00 0.00 C ATOM 371 O PRO A 24 7.267 -16.279 1.582 1.00 0.00 O ATOM 372 CB PRO A 24 9.041 -18.686 0.167 1.00 0.00 C ATOM 373 CG PRO A 24 10.147 -18.970 -0.826 1.00 0.00 C ATOM 374 CD PRO A 24 10.147 -17.844 -1.855 1.00 0.00 C ATOM 0 HA PRO A 24 7.350 -17.553 -0.591 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.445 -18.607 1.176 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.317 -19.501 0.176 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.111 -19.025 -0.320 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.987 -19.932 -1.312 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.152 -17.444 -1.988 1.00 0.00 H new ATOM 0 HD3 PRO A 24 9.818 -18.210 -2.827 1.00 0.00 H new ATOM 382 N ASP A 25 9.387 -15.764 1.263 1.00 0.00 N ATOM 383 CA ASP A 25 9.394 -14.816 2.416 1.00 0.00 C ATOM 384 C ASP A 25 8.412 -13.675 2.144 1.00 0.00 C ATOM 385 O ASP A 25 7.614 -13.319 2.992 1.00 0.00 O ATOM 386 CB ASP A 25 10.802 -14.246 2.597 1.00 0.00 C ATOM 387 CG ASP A 25 11.032 -13.917 4.073 1.00 0.00 C ATOM 388 OD1 ASP A 25 10.188 -13.249 4.649 1.00 0.00 O ATOM 389 OD2 ASP A 25 12.048 -14.337 4.603 1.00 0.00 O ATOM 0 H ASP A 25 10.274 -15.845 0.767 1.00 0.00 H new ATOM 0 HA ASP A 25 9.096 -15.343 3.322 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.545 -14.966 2.254 1.00 0.00 H new ATOM 0 HB3 ASP A 25 10.924 -13.349 1.990 1.00 0.00 H new ATOM 394 N ASP A 26 8.468 -13.100 0.970 1.00 0.00 N ATOM 395 CA ASP A 26 7.541 -11.980 0.634 1.00 0.00 C ATOM 396 C ASP A 26 6.100 -12.495 0.623 1.00 0.00 C ATOM 397 O ASP A 26 5.169 -11.761 0.893 1.00 0.00 O ATOM 398 CB ASP A 26 7.897 -11.422 -0.748 1.00 0.00 C ATOM 399 CG ASP A 26 7.032 -10.196 -1.047 1.00 0.00 C ATOM 400 OD1 ASP A 26 6.733 -9.466 -0.117 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.683 -10.009 -2.201 1.00 0.00 O ATOM 0 H ASP A 26 9.118 -13.359 0.228 1.00 0.00 H new ATOM 0 HA ASP A 26 7.637 -11.191 1.380 1.00 0.00 H new ATOM 0 HB2 ASP A 26 8.952 -11.151 -0.781 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.740 -12.185 -1.511 1.00 0.00 H new ATOM 406 N LEU A 27 5.913 -13.754 0.312 1.00 0.00 N ATOM 407 CA LEU A 27 4.536 -14.326 0.281 1.00 0.00 C ATOM 408 C LEU A 27 4.015 -14.487 1.711 1.00 0.00 C ATOM 409 O LEU A 27 2.822 -14.517 1.945 1.00 0.00 O ATOM 410 CB LEU A 27 4.569 -15.693 -0.407 1.00 0.00 C ATOM 411 CG LEU A 27 5.100 -15.535 -1.834 1.00 0.00 C ATOM 412 CD1 LEU A 27 5.264 -16.914 -2.473 1.00 0.00 C ATOM 413 CD2 LEU A 27 4.111 -14.708 -2.659 1.00 0.00 C ATOM 0 H LEU A 27 6.658 -14.410 0.078 1.00 0.00 H new ATOM 0 HA LEU A 27 3.877 -13.656 -0.271 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.203 -16.379 0.154 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.569 -16.127 -0.426 1.00 0.00 H new ATOM 0 HG LEU A 27 6.065 -15.029 -1.807 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.642 -16.802 -3.489 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.968 -17.505 -1.887 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.299 -17.420 -2.499 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.489 -14.596 -3.675 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.146 -15.214 -2.685 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.992 -13.724 -2.205 1.00 0.00 H new ATOM 425 N HIS A 28 4.905 -14.588 2.668 1.00 0.00 N ATOM 426 CA HIS A 28 4.471 -14.745 4.087 1.00 0.00 C ATOM 427 C HIS A 28 4.249 -13.365 4.708 1.00 0.00 C ATOM 428 O HIS A 28 3.457 -13.205 5.618 1.00 0.00 O ATOM 429 CB HIS A 28 5.553 -15.490 4.872 1.00 0.00 C ATOM 430 CG HIS A 28 5.548 -16.942 4.480 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.386 -17.698 4.459 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.554 -17.791 4.090 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.719 -18.942 4.069 1.00 0.00 C ATOM 434 NE2 HIS A 28 6.029 -19.052 3.830 1.00 0.00 N ATOM 0 H HIS A 28 5.915 -14.568 2.525 1.00 0.00 H new ATOM 0 HA HIS A 28 3.541 -15.313 4.122 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.530 -15.051 4.670 1.00 0.00 H new ATOM 0 HB3 HIS A 28 5.374 -15.391 5.943 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.596 -17.520 3.999 1.00 0.00 H new ATOM 0 HE1 HIS A 28 4.013 -19.753 3.962 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.535 -19.883 3.523 1.00 0.00 H new ATOM 442 N TYR A 29 4.945 -12.369 4.222 1.00 0.00 N ATOM 443 CA TYR A 29 4.783 -10.993 4.777 1.00 0.00 C ATOM 444 C TYR A 29 3.406 -10.447 4.393 1.00 0.00 C ATOM 445 O TYR A 29 2.836 -9.633 5.094 1.00 0.00 O ATOM 446 CB TYR A 29 5.871 -10.081 4.205 1.00 0.00 C ATOM 447 CG TYR A 29 5.920 -8.796 4.997 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.154 -8.833 6.377 1.00 0.00 C ATOM 449 CD2 TYR A 29 5.733 -7.569 4.351 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.201 -7.642 7.110 1.00 0.00 C ATOM 451 CE2 TYR A 29 5.779 -6.378 5.085 1.00 0.00 C ATOM 452 CZ TYR A 29 6.013 -6.414 6.465 1.00 0.00 C ATOM 453 OH TYR A 29 6.059 -5.240 7.188 1.00 0.00 O ATOM 0 H TYR A 29 5.621 -12.451 3.462 1.00 0.00 H new ATOM 0 HA TYR A 29 4.871 -11.026 5.863 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.838 -10.582 4.245 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.666 -9.866 3.156 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.298 -9.780 6.875 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.553 -7.541 3.286 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.382 -7.670 8.174 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.634 -5.431 4.587 1.00 0.00 H new ATOM 0 HH TYR A 29 5.910 -4.480 6.588 1.00 0.00 H new ATOM 463 N PHE A 30 2.872 -10.891 3.284 1.00 0.00 N ATOM 464 CA PHE A 30 1.531 -10.404 2.844 1.00 0.00 C ATOM 465 C PHE A 30 0.461 -10.907 3.816 1.00 0.00 C ATOM 466 O PHE A 30 -0.403 -10.164 4.238 1.00 0.00 O ATOM 467 CB PHE A 30 1.233 -10.933 1.439 1.00 0.00 C ATOM 468 CG PHE A 30 -0.016 -10.273 0.906 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.055 -8.994 0.340 1.00 0.00 C ATOM 470 CD2 PHE A 30 -1.245 -10.939 0.976 1.00 0.00 C ATOM 471 CE1 PHE A 30 -1.102 -8.382 -0.155 1.00 0.00 C ATOM 472 CE2 PHE A 30 -2.402 -10.327 0.481 1.00 0.00 C ATOM 473 CZ PHE A 30 -2.331 -9.049 -0.085 1.00 0.00 C ATOM 0 H PHE A 30 3.309 -11.572 2.663 1.00 0.00 H new ATOM 0 HA PHE A 30 1.526 -9.314 2.831 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.075 -10.731 0.777 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.102 -12.015 1.467 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.003 -8.480 0.286 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -1.300 -11.925 1.412 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.047 -7.395 -0.591 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -3.350 -10.841 0.536 1.00 0.00 H new ATOM 0 HZ PHE A 30 -3.224 -8.577 -0.468 1.00 0.00 H new ATOM 483 N ARG A 31 0.518 -12.166 4.171 1.00 0.00 N ATOM 484 CA ARG A 31 -0.492 -12.728 5.116 1.00 0.00 C ATOM 485 C ARG A 31 -0.307 -12.094 6.496 1.00 0.00 C ATOM 486 O ARG A 31 -1.236 -12.009 7.277 1.00 0.00 O ATOM 487 CB ARG A 31 -0.303 -14.244 5.221 1.00 0.00 C ATOM 488 CG ARG A 31 -1.601 -14.886 5.715 1.00 0.00 C ATOM 489 CD ARG A 31 -1.500 -16.407 5.583 1.00 0.00 C ATOM 490 NE ARG A 31 -1.515 -16.784 4.135 1.00 0.00 N ATOM 491 CZ ARG A 31 -1.769 -18.019 3.759 1.00 0.00 C ATOM 492 NH1 ARG A 31 -2.014 -18.954 4.642 1.00 0.00 N ATOM 493 NH2 ARG A 31 -1.774 -18.315 2.487 1.00 0.00 N ATOM 0 H ARG A 31 1.222 -12.829 3.846 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.495 -12.511 4.748 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.028 -14.655 4.250 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.513 -14.473 5.907 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.782 -14.612 6.754 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.446 -14.515 5.135 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.583 -16.763 6.053 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.331 -16.884 6.103 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.325 -16.073 3.429 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -2.010 -18.730 5.637 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.209 -19.907 4.335 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.582 -17.591 1.794 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -1.970 -19.270 2.186 1.00 0.00 H new ATOM 507 N ALA A 32 0.886 -11.650 6.800 1.00 0.00 N ATOM 508 CA ALA A 32 1.141 -11.019 8.128 1.00 0.00 C ATOM 509 C ALA A 32 0.646 -9.571 8.108 1.00 0.00 C ATOM 510 O ALA A 32 0.274 -9.021 9.128 1.00 0.00 O ATOM 511 CB ALA A 32 2.642 -11.041 8.422 1.00 0.00 C ATOM 0 H ALA A 32 1.697 -11.698 6.183 1.00 0.00 H new ATOM 0 HA ALA A 32 0.611 -11.573 8.902 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.830 -10.580 9.392 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.995 -12.072 8.436 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.173 -10.486 7.648 1.00 0.00 H new ATOM 517 N GLN A 33 0.640 -8.954 6.955 1.00 0.00 N ATOM 518 CA GLN A 33 0.170 -7.540 6.858 1.00 0.00 C ATOM 519 C GLN A 33 -1.226 -7.508 6.231 1.00 0.00 C ATOM 520 O GLN A 33 -1.559 -6.606 5.486 1.00 0.00 O ATOM 521 CB GLN A 33 1.139 -6.739 5.986 1.00 0.00 C ATOM 522 CG GLN A 33 2.478 -6.595 6.712 1.00 0.00 C ATOM 523 CD GLN A 33 2.324 -5.614 7.877 1.00 0.00 C ATOM 524 OE1 GLN A 33 2.588 -5.956 9.012 1.00 0.00 O ATOM 525 NE2 GLN A 33 1.905 -4.402 7.642 1.00 0.00 N ATOM 0 H GLN A 33 0.941 -9.370 6.074 1.00 0.00 H new ATOM 0 HA GLN A 33 0.131 -7.101 7.855 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.284 -7.241 5.029 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.723 -5.755 5.770 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.810 -7.565 7.081 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.242 -6.239 6.021 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.683 -4.115 6.689 1.00 0.00 H new ATOM 0 HE22 GLN A 33 1.799 -3.741 8.411 1.00 0.00 H new ATOM 534 N THR A 34 -2.042 -8.487 6.530 1.00 0.00 N ATOM 535 CA THR A 34 -3.419 -8.524 5.957 1.00 0.00 C ATOM 536 C THR A 34 -4.408 -8.977 7.033 1.00 0.00 C ATOM 537 O THR A 34 -5.576 -8.640 6.994 1.00 0.00 O ATOM 538 CB THR A 34 -3.458 -9.504 4.782 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.794 -10.706 5.149 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.759 -8.882 3.573 1.00 0.00 C ATOM 0 H THR A 34 -1.811 -9.264 7.149 1.00 0.00 H new ATOM 0 HA THR A 34 -3.693 -7.528 5.608 1.00 0.00 H new ATOM 0 HB THR A 34 -4.494 -9.724 4.526 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.824 -10.570 5.106 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.787 -9.581 2.737 1.00 0.00 H new ATOM 0 HG22 THR A 34 -3.268 -7.960 3.293 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.722 -8.661 3.826 1.00 0.00 H new ATOM 548 N VAL A 35 -3.944 -9.739 7.991 1.00 0.00 N ATOM 549 CA VAL A 35 -4.850 -10.221 9.075 1.00 0.00 C ATOM 550 C VAL A 35 -5.279 -9.038 9.946 1.00 0.00 C ATOM 551 O VAL A 35 -4.454 -8.320 10.481 1.00 0.00 O ATOM 552 CB VAL A 35 -4.112 -11.249 9.937 1.00 0.00 C ATOM 553 CG1 VAL A 35 -3.818 -12.496 9.103 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.796 -10.647 10.435 1.00 0.00 C ATOM 0 H VAL A 35 -2.975 -10.048 8.068 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.732 -10.684 8.632 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.733 -11.520 10.790 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.293 -13.228 9.716 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.755 -12.925 8.748 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.197 -12.225 8.250 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.270 -11.379 11.049 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.174 -10.375 9.582 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.005 -9.758 11.030 1.00 0.00 H new ATOM 564 N GLY A 36 -6.563 -8.832 10.090 1.00 0.00 N ATOM 565 CA GLY A 36 -7.057 -7.697 10.925 1.00 0.00 C ATOM 566 C GLY A 36 -6.791 -6.377 10.201 1.00 0.00 C ATOM 567 O GLY A 36 -6.449 -5.382 10.814 1.00 0.00 O ATOM 0 H GLY A 36 -7.293 -9.403 9.664 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.124 -7.810 11.117 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.557 -7.700 11.894 1.00 0.00 H new ATOM 571 N LYS A 37 -6.945 -6.361 8.901 1.00 0.00 N ATOM 572 CA LYS A 37 -6.704 -5.108 8.127 1.00 0.00 C ATOM 573 C LYS A 37 -7.655 -5.055 6.931 1.00 0.00 C ATOM 574 O LYS A 37 -8.247 -6.050 6.555 1.00 0.00 O ATOM 575 CB LYS A 37 -5.257 -5.087 7.630 1.00 0.00 C ATOM 576 CG LYS A 37 -4.320 -4.750 8.791 1.00 0.00 C ATOM 577 CD LYS A 37 -4.536 -3.296 9.217 1.00 0.00 C ATOM 578 CE LYS A 37 -3.365 -2.840 10.089 1.00 0.00 C ATOM 579 NZ LYS A 37 -2.171 -2.599 9.231 1.00 0.00 N ATOM 0 H LYS A 37 -7.228 -7.165 8.342 1.00 0.00 H new ATOM 0 HA LYS A 37 -6.881 -4.245 8.769 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.993 -6.056 7.206 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.146 -4.350 6.834 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -4.510 -5.418 9.631 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -3.283 -4.902 8.491 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -4.619 -2.657 8.338 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -5.472 -3.203 9.768 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.630 -1.929 10.625 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.140 -3.598 10.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.507 -1.971 9.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.703 -3.505 9.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.468 -2.153 8.340 1.00 0.00 H new ATOM 593 N ILE A 38 -7.807 -3.901 6.333 1.00 0.00 N ATOM 594 CA ILE A 38 -8.719 -3.774 5.159 1.00 0.00 C ATOM 595 C ILE A 38 -7.914 -3.944 3.868 1.00 0.00 C ATOM 596 O ILE A 38 -7.205 -3.050 3.448 1.00 0.00 O ATOM 597 CB ILE A 38 -9.377 -2.392 5.172 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.053 -2.162 6.525 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.425 -2.316 4.060 1.00 0.00 C ATOM 600 CD1 ILE A 38 -10.506 -0.704 6.628 1.00 0.00 C ATOM 0 H ILE A 38 -7.337 -3.039 6.609 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.489 -4.544 5.211 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.618 -1.627 5.010 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.909 -2.828 6.634 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.361 -2.397 7.334 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.894 -1.332 4.069 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.945 -2.481 3.095 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.184 -3.081 4.222 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -10.988 -0.540 7.592 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -9.641 -0.047 6.538 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -11.213 -0.485 5.827 1.00 0.00 H new ATOM 612 N MET A 39 -8.022 -5.087 3.240 1.00 0.00 N ATOM 613 CA MET A 39 -7.267 -5.326 1.976 1.00 0.00 C ATOM 614 C MET A 39 -8.080 -4.805 0.790 1.00 0.00 C ATOM 615 O MET A 39 -9.052 -5.410 0.378 1.00 0.00 O ATOM 616 CB MET A 39 -7.023 -6.828 1.805 1.00 0.00 C ATOM 617 CG MET A 39 -6.031 -7.057 0.662 1.00 0.00 C ATOM 618 SD MET A 39 -5.950 -8.824 0.279 1.00 0.00 S ATOM 619 CE MET A 39 -7.637 -8.997 -0.352 1.00 0.00 C ATOM 0 H MET A 39 -8.602 -5.866 3.550 1.00 0.00 H new ATOM 0 HA MET A 39 -6.311 -4.804 2.019 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.632 -7.251 2.730 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.963 -7.338 1.593 1.00 0.00 H new ATOM 0 HG2 MET A 39 -6.340 -6.497 -0.220 1.00 0.00 H new ATOM 0 HG3 MET A 39 -5.044 -6.689 0.943 1.00 0.00 H new ATOM 0 HE1 MET A 39 -8.244 -9.535 0.376 1.00 0.00 H new ATOM 0 HE2 MET A 39 -8.065 -8.009 -0.523 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.619 -9.552 -1.290 1.00 0.00 H new ATOM 629 N VAL A 40 -7.686 -3.684 0.238 1.00 0.00 N ATOM 630 CA VAL A 40 -8.430 -3.113 -0.923 1.00 0.00 C ATOM 631 C VAL A 40 -7.774 -3.577 -2.225 1.00 0.00 C ATOM 632 O VAL A 40 -6.592 -3.383 -2.436 1.00 0.00 O ATOM 633 CB VAL A 40 -8.394 -1.585 -0.850 1.00 0.00 C ATOM 634 CG1 VAL A 40 -9.280 -0.999 -1.952 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.913 -1.127 0.514 1.00 0.00 C ATOM 0 H VAL A 40 -6.879 -3.140 0.543 1.00 0.00 H new ATOM 0 HA VAL A 40 -9.465 -3.453 -0.895 1.00 0.00 H new ATOM 0 HB VAL A 40 -7.369 -1.241 -0.985 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -9.254 0.089 -1.899 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.913 -1.324 -2.925 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -10.305 -1.344 -1.817 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.887 -0.039 0.566 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.938 -1.473 0.648 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -8.284 -1.543 1.301 1.00 0.00 H new ATOM 645 N VAL A 41 -8.534 -4.191 -3.096 1.00 0.00 N ATOM 646 CA VAL A 41 -7.963 -4.674 -4.387 1.00 0.00 C ATOM 647 C VAL A 41 -8.979 -4.451 -5.510 1.00 0.00 C ATOM 648 O VAL A 41 -10.141 -4.187 -5.262 1.00 0.00 O ATOM 649 CB VAL A 41 -7.642 -6.166 -4.277 1.00 0.00 C ATOM 650 CG1 VAL A 41 -6.516 -6.371 -3.261 1.00 0.00 C ATOM 651 CG2 VAL A 41 -8.889 -6.924 -3.815 1.00 0.00 C ATOM 0 H VAL A 41 -9.528 -4.379 -2.967 1.00 0.00 H new ATOM 0 HA VAL A 41 -7.050 -4.122 -4.609 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.328 -6.543 -5.250 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.286 -7.434 -3.182 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -5.628 -5.831 -3.589 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.831 -5.994 -2.288 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.660 -7.987 -3.737 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -9.204 -6.548 -2.842 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -9.692 -6.778 -4.537 1.00 0.00 H new ATOM 661 N GLY A 42 -8.548 -4.559 -6.740 1.00 0.00 N ATOM 662 CA GLY A 42 -9.480 -4.355 -7.888 1.00 0.00 C ATOM 663 C GLY A 42 -10.152 -5.683 -8.243 1.00 0.00 C ATOM 664 O GLY A 42 -10.128 -6.624 -7.472 1.00 0.00 O ATOM 0 H GLY A 42 -7.587 -4.781 -6.999 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -10.234 -3.611 -7.630 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -8.934 -3.970 -8.749 1.00 0.00 H new ATOM 668 N ARG A 43 -10.749 -5.763 -9.405 1.00 0.00 N ATOM 669 CA ARG A 43 -11.427 -7.027 -9.820 1.00 0.00 C ATOM 670 C ARG A 43 -10.388 -8.003 -10.378 1.00 0.00 C ATOM 671 O ARG A 43 -10.469 -9.197 -10.162 1.00 0.00 O ATOM 672 CB ARG A 43 -12.467 -6.718 -10.898 1.00 0.00 C ATOM 673 CG ARG A 43 -13.476 -7.866 -10.977 1.00 0.00 C ATOM 674 CD ARG A 43 -14.357 -7.688 -12.215 1.00 0.00 C ATOM 675 NE ARG A 43 -13.530 -7.887 -13.446 1.00 0.00 N ATOM 676 CZ ARG A 43 -14.081 -7.879 -14.641 1.00 0.00 C ATOM 677 NH1 ARG A 43 -15.371 -7.697 -14.787 1.00 0.00 N ATOM 678 NH2 ARG A 43 -13.334 -8.056 -15.696 1.00 0.00 N ATOM 0 H ARG A 43 -10.796 -5.005 -10.086 1.00 0.00 H new ATOM 0 HA ARG A 43 -11.920 -7.475 -8.957 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -12.980 -5.784 -10.667 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -11.978 -6.583 -11.863 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -12.953 -8.821 -11.024 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -14.093 -7.884 -10.078 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -15.179 -8.404 -12.196 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -14.801 -6.693 -12.219 1.00 0.00 H new ATOM 0 HE ARG A 43 -12.524 -8.031 -13.358 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -15.963 -7.559 -13.968 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -15.783 -7.693 -15.720 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.330 -8.199 -15.591 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -13.754 -8.051 -16.625 1.00 0.00 H new ATOM 692 N ARG A 44 -9.414 -7.499 -11.092 1.00 0.00 N ATOM 693 CA ARG A 44 -8.364 -8.389 -11.670 1.00 0.00 C ATOM 694 C ARG A 44 -7.529 -8.995 -10.539 1.00 0.00 C ATOM 695 O ARG A 44 -7.203 -10.168 -10.558 1.00 0.00 O ATOM 696 CB ARG A 44 -7.456 -7.575 -12.593 1.00 0.00 C ATOM 697 CG ARG A 44 -6.663 -8.521 -13.496 1.00 0.00 C ATOM 698 CD ARG A 44 -5.626 -7.723 -14.288 1.00 0.00 C ATOM 699 NE ARG A 44 -4.561 -7.231 -13.359 1.00 0.00 N ATOM 700 CZ ARG A 44 -3.397 -6.825 -13.818 1.00 0.00 C ATOM 701 NH1 ARG A 44 -3.137 -6.840 -15.101 1.00 0.00 N ATOM 702 NH2 ARG A 44 -2.488 -6.402 -12.982 1.00 0.00 N ATOM 0 H ARG A 44 -9.301 -6.507 -11.300 1.00 0.00 H new ATOM 0 HA ARG A 44 -8.839 -9.188 -12.240 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -8.053 -6.893 -13.199 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -6.774 -6.963 -12.002 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.168 -9.284 -12.895 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -7.337 -9.039 -14.178 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -5.186 -8.348 -15.065 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.104 -6.881 -14.789 1.00 0.00 H new ATOM 0 HE ARG A 44 -4.740 -7.210 -12.355 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.842 -7.170 -15.760 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.230 -6.522 -15.441 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -2.683 -6.388 -11.981 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.583 -6.086 -13.330 1.00 0.00 H new ATOM 716 N THR A 45 -7.184 -8.203 -9.556 1.00 0.00 N ATOM 717 CA THR A 45 -6.370 -8.723 -8.419 1.00 0.00 C ATOM 718 C THR A 45 -7.237 -9.631 -7.545 1.00 0.00 C ATOM 719 O THR A 45 -6.741 -10.516 -6.871 1.00 0.00 O ATOM 720 CB THR A 45 -5.855 -7.550 -7.582 1.00 0.00 C ATOM 721 OG1 THR A 45 -5.260 -6.585 -8.439 1.00 0.00 O ATOM 722 CG2 THR A 45 -4.815 -8.053 -6.579 1.00 0.00 C ATOM 0 H THR A 45 -7.432 -7.216 -9.493 1.00 0.00 H new ATOM 0 HA THR A 45 -5.525 -9.291 -8.807 1.00 0.00 H new ATOM 0 HB THR A 45 -6.686 -7.096 -7.043 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.548 -6.114 -7.957 1.00 0.00 H new ATOM 0 HG21 THR A 45 -4.449 -7.216 -5.984 1.00 0.00 H new ATOM 0 HG22 THR A 45 -5.271 -8.794 -5.922 1.00 0.00 H new ATOM 0 HG23 THR A 45 -3.982 -8.508 -7.116 1.00 0.00 H new ATOM 730 N TYR A 46 -8.528 -9.417 -7.552 1.00 0.00 N ATOM 731 CA TYR A 46 -9.438 -10.262 -6.723 1.00 0.00 C ATOM 732 C TYR A 46 -9.389 -11.708 -7.225 1.00 0.00 C ATOM 733 O TYR A 46 -9.365 -12.642 -6.446 1.00 0.00 O ATOM 734 CB TYR A 46 -10.869 -9.731 -6.837 1.00 0.00 C ATOM 735 CG TYR A 46 -11.741 -10.407 -5.806 1.00 0.00 C ATOM 736 CD1 TYR A 46 -11.513 -10.186 -4.443 1.00 0.00 C ATOM 737 CD2 TYR A 46 -12.779 -11.254 -6.213 1.00 0.00 C ATOM 738 CE1 TYR A 46 -12.322 -10.812 -3.487 1.00 0.00 C ATOM 739 CE2 TYR A 46 -13.588 -11.880 -5.257 1.00 0.00 C ATOM 740 CZ TYR A 46 -13.360 -11.659 -3.894 1.00 0.00 C ATOM 741 OH TYR A 46 -14.157 -12.275 -2.952 1.00 0.00 O ATOM 0 H TYR A 46 -8.992 -8.691 -8.098 1.00 0.00 H new ATOM 0 HA TYR A 46 -9.119 -10.228 -5.681 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -10.881 -8.651 -6.687 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -11.259 -9.918 -7.838 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.713 -9.532 -4.129 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -12.956 -11.424 -7.265 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -12.145 -10.642 -2.435 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -14.388 -12.534 -5.571 1.00 0.00 H new ATOM 0 HH TYR A 46 -14.829 -12.827 -3.403 1.00 0.00 H new ATOM 751 N GLU A 47 -9.373 -11.894 -8.520 1.00 0.00 N ATOM 752 CA GLU A 47 -9.325 -13.276 -9.083 1.00 0.00 C ATOM 753 C GLU A 47 -7.871 -13.751 -9.158 1.00 0.00 C ATOM 754 O GLU A 47 -7.600 -14.936 -9.215 1.00 0.00 O ATOM 755 CB GLU A 47 -9.933 -13.275 -10.487 1.00 0.00 C ATOM 756 CG GLU A 47 -11.458 -13.218 -10.385 1.00 0.00 C ATOM 757 CD GLU A 47 -12.042 -12.722 -11.709 1.00 0.00 C ATOM 758 OE1 GLU A 47 -11.519 -11.756 -12.238 1.00 0.00 O ATOM 759 OE2 GLU A 47 -13.001 -13.319 -12.171 1.00 0.00 O ATOM 0 H GLU A 47 -9.391 -11.146 -9.213 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.892 -13.948 -8.440 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.564 -12.420 -11.054 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.628 -14.171 -11.027 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -11.854 -14.206 -10.148 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.754 -12.553 -9.574 1.00 0.00 H new ATOM 766 N SER A 48 -6.936 -12.834 -9.160 1.00 0.00 N ATOM 767 CA SER A 48 -5.496 -13.224 -9.232 1.00 0.00 C ATOM 768 C SER A 48 -5.124 -14.044 -7.996 1.00 0.00 C ATOM 769 O SER A 48 -4.188 -14.821 -8.017 1.00 0.00 O ATOM 770 CB SER A 48 -4.631 -11.964 -9.289 1.00 0.00 C ATOM 771 OG SER A 48 -4.680 -11.419 -10.600 1.00 0.00 O ATOM 0 H SER A 48 -7.109 -11.830 -9.115 1.00 0.00 H new ATOM 0 HA SER A 48 -5.326 -13.823 -10.127 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.987 -11.231 -8.565 1.00 0.00 H new ATOM 0 HB3 SER A 48 -3.602 -12.203 -9.021 1.00 0.00 H new ATOM 0 HG SER A 48 -5.521 -10.931 -10.720 1.00 0.00 H new ATOM 777 N PHE A 49 -5.850 -13.875 -6.919 1.00 0.00 N ATOM 778 CA PHE A 49 -5.545 -14.643 -5.676 1.00 0.00 C ATOM 779 C PHE A 49 -5.728 -16.145 -5.942 1.00 0.00 C ATOM 780 O PHE A 49 -6.385 -16.519 -6.894 1.00 0.00 O ATOM 781 CB PHE A 49 -6.495 -14.204 -4.559 1.00 0.00 C ATOM 782 CG PHE A 49 -6.197 -12.775 -4.175 1.00 0.00 C ATOM 783 CD1 PHE A 49 -4.904 -12.410 -3.781 1.00 0.00 C ATOM 784 CD2 PHE A 49 -7.214 -11.813 -4.214 1.00 0.00 C ATOM 785 CE1 PHE A 49 -4.628 -11.084 -3.424 1.00 0.00 C ATOM 786 CE2 PHE A 49 -6.937 -10.487 -3.858 1.00 0.00 C ATOM 787 CZ PHE A 49 -5.645 -10.123 -3.463 1.00 0.00 C ATOM 0 H PHE A 49 -6.642 -13.236 -6.848 1.00 0.00 H new ATOM 0 HA PHE A 49 -4.515 -14.451 -5.375 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.529 -14.294 -4.891 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -6.380 -14.856 -3.693 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.119 -13.151 -3.752 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -8.212 -12.093 -4.518 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.631 -10.803 -3.119 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -7.721 -9.745 -3.888 1.00 0.00 H new ATOM 0 HZ PHE A 49 -5.432 -9.100 -3.188 1.00 0.00 H new ATOM 797 N PRO A 50 -5.143 -16.968 -5.097 1.00 0.00 N ATOM 798 CA PRO A 50 -5.194 -18.467 -5.173 1.00 0.00 C ATOM 799 C PRO A 50 -6.520 -18.974 -4.599 1.00 0.00 C ATOM 800 O PRO A 50 -7.391 -19.416 -5.325 1.00 0.00 O ATOM 801 CB PRO A 50 -4.022 -18.985 -4.342 1.00 0.00 C ATOM 802 CG PRO A 50 -3.486 -17.820 -3.534 1.00 0.00 C ATOM 803 CD PRO A 50 -4.314 -16.591 -3.895 1.00 0.00 C ATOM 0 HA PRO A 50 -5.125 -18.815 -6.204 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -4.346 -19.791 -3.684 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -3.245 -19.393 -4.988 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.556 -18.029 -2.467 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -2.432 -17.651 -3.757 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -4.952 -16.295 -3.062 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -3.669 -15.742 -4.120 1.00 0.00 H new ATOM 811 N LYS A 51 -6.676 -18.914 -3.301 1.00 0.00 N ATOM 812 CA LYS A 51 -7.942 -19.391 -2.670 1.00 0.00 C ATOM 813 C LYS A 51 -8.757 -18.190 -2.189 1.00 0.00 C ATOM 814 O LYS A 51 -8.559 -17.693 -1.097 1.00 0.00 O ATOM 815 CB LYS A 51 -7.610 -20.293 -1.480 1.00 0.00 C ATOM 816 CG LYS A 51 -8.871 -21.038 -1.037 1.00 0.00 C ATOM 817 CD LYS A 51 -8.540 -21.941 0.153 1.00 0.00 C ATOM 818 CE LYS A 51 -9.631 -23.003 0.308 1.00 0.00 C ATOM 819 NZ LYS A 51 -9.074 -24.187 1.020 1.00 0.00 N ATOM 0 H LYS A 51 -5.978 -18.554 -2.650 1.00 0.00 H new ATOM 0 HA LYS A 51 -8.523 -19.953 -3.401 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.832 -21.005 -1.756 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.219 -19.696 -0.656 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -9.649 -20.326 -0.761 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -9.262 -21.634 -1.861 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -7.572 -22.419 0.002 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -8.464 -21.347 1.064 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -10.475 -22.594 0.864 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -10.008 -23.298 -0.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -9.815 -24.909 1.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -8.282 -24.581 0.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -8.735 -23.899 1.960 1.00 0.00 H new ATOM 833 N ARG A 52 -9.674 -17.722 -2.998 1.00 0.00 N ATOM 834 CA ARG A 52 -10.511 -16.554 -2.598 1.00 0.00 C ATOM 835 C ARG A 52 -11.869 -17.051 -2.082 1.00 0.00 C ATOM 836 O ARG A 52 -12.286 -18.142 -2.414 1.00 0.00 O ATOM 837 CB ARG A 52 -10.727 -15.644 -3.809 1.00 0.00 C ATOM 838 CG ARG A 52 -11.301 -16.461 -4.968 1.00 0.00 C ATOM 839 CD ARG A 52 -11.799 -15.516 -6.062 1.00 0.00 C ATOM 840 NE ARG A 52 -12.007 -16.284 -7.328 1.00 0.00 N ATOM 841 CZ ARG A 52 -13.054 -17.067 -7.482 1.00 0.00 C ATOM 842 NH1 ARG A 52 -13.945 -17.195 -6.530 1.00 0.00 N ATOM 843 NH2 ARG A 52 -13.207 -17.724 -8.599 1.00 0.00 N ATOM 0 H ARG A 52 -9.878 -18.102 -3.922 1.00 0.00 H new ATOM 0 HA ARG A 52 -10.005 -15.996 -1.810 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -11.408 -14.833 -3.550 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.783 -15.186 -4.106 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -10.538 -17.128 -5.369 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -12.119 -17.088 -4.614 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -12.732 -15.044 -5.753 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -11.076 -14.717 -6.224 1.00 0.00 H new ATOM 0 HE ARG A 52 -11.327 -16.200 -8.084 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -13.833 -16.684 -5.654 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -14.751 -17.806 -6.664 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.518 -17.629 -9.345 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -14.016 -18.333 -8.726 1.00 0.00 H new ATOM 857 N PRO A 53 -12.526 -16.237 -1.280 1.00 0.00 N ATOM 858 CA PRO A 53 -12.086 -14.871 -0.817 1.00 0.00 C ATOM 859 C PRO A 53 -11.096 -15.006 0.344 1.00 0.00 C ATOM 860 O PRO A 53 -11.114 -15.978 1.075 1.00 0.00 O ATOM 861 CB PRO A 53 -13.349 -14.146 -0.356 1.00 0.00 C ATOM 862 CG PRO A 53 -14.452 -15.178 -0.251 1.00 0.00 C ATOM 863 CD PRO A 53 -13.866 -16.524 -0.667 1.00 0.00 C ATOM 0 HA PRO A 53 -11.586 -14.321 -1.614 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -13.184 -13.662 0.607 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.622 -13.363 -1.064 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -14.836 -15.226 0.768 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -15.290 -14.910 -0.895 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -13.765 -17.185 0.194 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.519 -17.027 -1.380 1.00 0.00 H new ATOM 871 N LEU A 54 -10.235 -14.035 0.514 1.00 0.00 N ATOM 872 CA LEU A 54 -9.239 -14.094 1.625 1.00 0.00 C ATOM 873 C LEU A 54 -9.939 -13.755 2.954 1.00 0.00 C ATOM 874 O LEU A 54 -10.385 -12.639 3.132 1.00 0.00 O ATOM 875 CB LEU A 54 -8.129 -13.074 1.363 1.00 0.00 C ATOM 876 CG LEU A 54 -7.431 -13.405 0.042 1.00 0.00 C ATOM 877 CD1 LEU A 54 -6.439 -12.292 -0.303 1.00 0.00 C ATOM 878 CD2 LEU A 54 -6.679 -14.730 0.182 1.00 0.00 C ATOM 0 H LEU A 54 -10.179 -13.201 -0.071 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.811 -15.095 1.681 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -8.547 -12.068 1.323 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -7.408 -13.087 2.180 1.00 0.00 H new ATOM 0 HG LEU A 54 -8.174 -13.489 -0.751 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.941 -12.527 -1.244 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.973 -11.347 -0.401 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.696 -12.209 0.490 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.181 -14.967 -0.758 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -5.936 -14.644 0.975 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -7.384 -15.524 0.430 1.00 0.00 H new ATOM 890 N PRO A 55 -10.024 -14.716 3.854 1.00 0.00 N ATOM 891 CA PRO A 55 -10.672 -14.573 5.203 1.00 0.00 C ATOM 892 C PRO A 55 -9.718 -13.861 6.167 1.00 0.00 C ATOM 893 O PRO A 55 -8.621 -13.485 5.803 1.00 0.00 O ATOM 894 CB PRO A 55 -10.971 -15.987 5.698 1.00 0.00 C ATOM 895 CG PRO A 55 -10.239 -16.953 4.789 1.00 0.00 C ATOM 896 CD PRO A 55 -9.507 -16.128 3.736 1.00 0.00 C ATOM 0 HA PRO A 55 -11.585 -13.981 5.143 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -10.643 -16.109 6.730 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -12.043 -16.181 5.679 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -9.534 -17.557 5.360 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -10.940 -17.641 4.317 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -8.430 -16.160 3.899 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -9.690 -16.525 2.737 1.00 0.00 H new ATOM 904 N GLU A 56 -10.134 -13.675 7.396 1.00 0.00 N ATOM 905 CA GLU A 56 -9.263 -12.987 8.399 1.00 0.00 C ATOM 906 C GLU A 56 -8.953 -11.565 7.923 1.00 0.00 C ATOM 907 O GLU A 56 -7.895 -11.028 8.194 1.00 0.00 O ATOM 908 CB GLU A 56 -7.954 -13.764 8.569 1.00 0.00 C ATOM 909 CG GLU A 56 -8.265 -15.229 8.882 1.00 0.00 C ATOM 910 CD GLU A 56 -7.089 -15.851 9.639 1.00 0.00 C ATOM 911 OE1 GLU A 56 -7.080 -15.761 10.855 1.00 0.00 O ATOM 912 OE2 GLU A 56 -6.219 -16.406 8.989 1.00 0.00 O ATOM 0 H GLU A 56 -11.044 -13.972 7.749 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.785 -12.945 9.355 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.357 -13.695 7.660 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.362 -13.327 9.373 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -9.174 -15.299 9.480 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -8.448 -15.778 7.958 1.00 0.00 H new ATOM 919 N ARG A 57 -9.871 -10.951 7.219 1.00 0.00 N ATOM 920 CA ARG A 57 -9.639 -9.562 6.723 1.00 0.00 C ATOM 921 C ARG A 57 -10.890 -9.062 5.997 1.00 0.00 C ATOM 922 O ARG A 57 -11.927 -9.698 6.021 1.00 0.00 O ATOM 923 CB ARG A 57 -8.450 -9.553 5.758 1.00 0.00 C ATOM 924 CG ARG A 57 -8.691 -10.563 4.634 1.00 0.00 C ATOM 925 CD ARG A 57 -7.354 -10.943 3.993 1.00 0.00 C ATOM 926 NE ARG A 57 -6.724 -12.053 4.774 1.00 0.00 N ATOM 927 CZ ARG A 57 -5.554 -12.545 4.430 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.905 -12.077 3.393 1.00 0.00 N ATOM 929 NH2 ARG A 57 -5.031 -13.513 5.132 1.00 0.00 N ATOM 0 H ARG A 57 -10.773 -11.354 6.966 1.00 0.00 H new ATOM 0 HA ARG A 57 -9.424 -8.908 7.568 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.315 -8.555 5.341 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.533 -9.801 6.293 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -9.183 -11.452 5.029 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.358 -10.137 3.884 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.509 -11.253 2.960 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -6.691 -10.078 3.970 1.00 0.00 H new ATOM 0 HE ARG A 57 -7.210 -12.434 5.586 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.306 -11.320 2.839 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.998 -12.469 3.139 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -5.529 -13.883 5.941 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.124 -13.900 4.871 1.00 0.00 H new ATOM 943 N THR A 58 -10.797 -7.926 5.354 1.00 0.00 N ATOM 944 CA THR A 58 -11.975 -7.374 4.622 1.00 0.00 C ATOM 945 C THR A 58 -11.646 -7.274 3.131 1.00 0.00 C ATOM 946 O THR A 58 -10.805 -6.494 2.724 1.00 0.00 O ATOM 947 CB THR A 58 -12.307 -5.982 5.165 1.00 0.00 C ATOM 948 OG1 THR A 58 -12.304 -6.017 6.585 1.00 0.00 O ATOM 949 CG2 THR A 58 -13.687 -5.553 4.665 1.00 0.00 C ATOM 0 H THR A 58 -9.953 -7.356 5.305 1.00 0.00 H new ATOM 0 HA THR A 58 -12.832 -8.033 4.763 1.00 0.00 H new ATOM 0 HB THR A 58 -11.560 -5.268 4.818 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.515 -5.126 6.935 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.922 -4.562 5.052 1.00 0.00 H new ATOM 0 HG22 THR A 58 -13.687 -5.526 3.575 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.437 -6.265 5.010 1.00 0.00 H new ATOM 957 N ASN A 59 -12.305 -8.058 2.316 1.00 0.00 N ATOM 958 CA ASN A 59 -12.037 -8.018 0.848 1.00 0.00 C ATOM 959 C ASN A 59 -12.840 -6.879 0.215 1.00 0.00 C ATOM 960 O ASN A 59 -14.035 -6.987 0.017 1.00 0.00 O ATOM 961 CB ASN A 59 -12.455 -9.347 0.217 1.00 0.00 C ATOM 962 CG ASN A 59 -11.400 -10.411 0.522 1.00 0.00 C ATOM 963 OD1 ASN A 59 -11.005 -11.161 -0.349 1.00 0.00 O ATOM 964 ND2 ASN A 59 -10.921 -10.510 1.732 1.00 0.00 N ATOM 0 H ASN A 59 -13.019 -8.726 2.606 1.00 0.00 H new ATOM 0 HA ASN A 59 -10.973 -7.853 0.677 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -13.424 -9.658 0.607 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -12.568 -9.230 -0.861 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -10.216 -11.216 1.945 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -11.251 -9.881 2.464 1.00 0.00 H new ATOM 971 N VAL A 60 -12.188 -5.789 -0.103 1.00 0.00 N ATOM 972 CA VAL A 60 -12.903 -4.637 -0.725 1.00 0.00 C ATOM 973 C VAL A 60 -12.557 -4.566 -2.214 1.00 0.00 C ATOM 974 O VAL A 60 -11.578 -3.958 -2.602 1.00 0.00 O ATOM 975 CB VAL A 60 -12.474 -3.339 -0.039 1.00 0.00 C ATOM 976 CG1 VAL A 60 -13.317 -2.177 -0.569 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.681 -3.468 1.472 1.00 0.00 C ATOM 0 H VAL A 60 -11.188 -5.649 0.043 1.00 0.00 H new ATOM 0 HA VAL A 60 -13.978 -4.771 -0.608 1.00 0.00 H new ATOM 0 HB VAL A 60 -11.421 -3.150 -0.249 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.011 -1.252 -0.080 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -13.172 -2.083 -1.645 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -14.370 -2.366 -0.360 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.375 -2.543 1.961 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.734 -3.658 1.680 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -12.081 -4.295 1.852 1.00 0.00 H new ATOM 987 N VAL A 61 -13.355 -5.185 -3.047 1.00 0.00 N ATOM 988 CA VAL A 61 -13.080 -5.161 -4.514 1.00 0.00 C ATOM 989 C VAL A 61 -13.557 -3.829 -5.100 1.00 0.00 C ATOM 990 O VAL A 61 -14.626 -3.348 -4.774 1.00 0.00 O ATOM 991 CB VAL A 61 -13.824 -6.313 -5.192 1.00 0.00 C ATOM 992 CG1 VAL A 61 -13.423 -6.383 -6.667 1.00 0.00 C ATOM 993 CG2 VAL A 61 -13.460 -7.630 -4.503 1.00 0.00 C ATOM 0 H VAL A 61 -14.187 -5.707 -2.772 1.00 0.00 H new ATOM 0 HA VAL A 61 -12.009 -5.271 -4.685 1.00 0.00 H new ATOM 0 HB VAL A 61 -14.898 -6.146 -5.115 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -13.953 -7.204 -7.150 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.681 -5.445 -7.159 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -12.349 -6.550 -6.744 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -13.990 -8.452 -4.985 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -12.385 -7.796 -4.580 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -13.745 -7.582 -3.452 1.00 0.00 H new ATOM 1003 N LEU A 62 -12.770 -3.235 -5.960 1.00 0.00 N ATOM 1004 CA LEU A 62 -13.169 -1.935 -6.574 1.00 0.00 C ATOM 1005 C LEU A 62 -13.523 -2.153 -8.047 1.00 0.00 C ATOM 1006 O LEU A 62 -12.664 -2.418 -8.867 1.00 0.00 O ATOM 1007 CB LEU A 62 -12.007 -0.945 -6.470 1.00 0.00 C ATOM 1008 CG LEU A 62 -12.492 0.453 -6.860 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -13.278 1.063 -5.697 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -11.286 1.339 -7.178 1.00 0.00 C ATOM 0 H LEU A 62 -11.866 -3.596 -6.264 1.00 0.00 H new ATOM 0 HA LEU A 62 -14.036 -1.535 -6.048 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -11.614 -0.935 -5.453 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -11.192 -1.254 -7.124 1.00 0.00 H new ATOM 0 HG LEU A 62 -13.135 0.383 -7.737 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -13.624 2.059 -5.974 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -14.136 0.432 -5.467 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -12.634 1.133 -4.820 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -11.630 2.335 -7.456 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -10.644 1.409 -6.300 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.724 0.905 -8.005 1.00 0.00 H new ATOM 1022 N THR A 63 -14.782 -2.044 -8.385 1.00 0.00 N ATOM 1023 CA THR A 63 -15.203 -2.244 -9.803 1.00 0.00 C ATOM 1024 C THR A 63 -16.229 -1.176 -10.186 1.00 0.00 C ATOM 1025 O THR A 63 -16.959 -0.677 -9.351 1.00 0.00 O ATOM 1026 CB THR A 63 -15.830 -3.633 -9.958 1.00 0.00 C ATOM 1027 OG1 THR A 63 -16.356 -3.768 -11.271 1.00 0.00 O ATOM 1028 CG2 THR A 63 -16.954 -3.805 -8.935 1.00 0.00 C ATOM 0 H THR A 63 -15.539 -1.824 -7.737 1.00 0.00 H new ATOM 0 HA THR A 63 -14.333 -2.163 -10.455 1.00 0.00 H new ATOM 0 HB THR A 63 -15.070 -4.396 -9.790 1.00 0.00 H new ATOM 0 HG1 THR A 63 -16.756 -4.657 -11.373 1.00 0.00 H new ATOM 0 HG21 THR A 63 -17.399 -4.794 -9.046 1.00 0.00 H new ATOM 0 HG22 THR A 63 -16.549 -3.701 -7.928 1.00 0.00 H new ATOM 0 HG23 THR A 63 -17.716 -3.043 -9.100 1.00 0.00 H new ATOM 1036 N HIS A 64 -16.288 -0.823 -11.446 1.00 0.00 N ATOM 1037 CA HIS A 64 -17.263 0.213 -11.895 1.00 0.00 C ATOM 1038 C HIS A 64 -18.526 -0.469 -12.426 1.00 0.00 C ATOM 1039 O HIS A 64 -19.622 0.037 -12.281 1.00 0.00 O ATOM 1040 CB HIS A 64 -16.634 1.064 -13.003 1.00 0.00 C ATOM 1041 CG HIS A 64 -16.130 0.169 -14.104 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -16.797 0.036 -15.311 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -15.026 -0.641 -14.194 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -16.095 -0.826 -16.070 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -15.006 -1.269 -15.436 1.00 0.00 N ATOM 0 H HIS A 64 -15.700 -1.210 -12.184 1.00 0.00 H new ATOM 0 HA HIS A 64 -17.525 0.853 -11.053 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -17.369 1.765 -13.398 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -15.814 1.657 -12.599 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -14.285 -0.771 -13.419 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -16.378 -1.123 -17.069 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -14.309 -1.926 -15.787 1.00 0.00 H new ATOM 1053 N GLN A 65 -18.375 -1.616 -13.040 1.00 0.00 N ATOM 1054 CA GLN A 65 -19.561 -2.340 -13.586 1.00 0.00 C ATOM 1055 C GLN A 65 -20.307 -3.029 -12.441 1.00 0.00 C ATOM 1056 O GLN A 65 -19.723 -3.746 -11.651 1.00 0.00 O ATOM 1057 CB GLN A 65 -19.096 -3.390 -14.597 1.00 0.00 C ATOM 1058 CG GLN A 65 -18.857 -2.722 -15.953 1.00 0.00 C ATOM 1059 CD GLN A 65 -20.184 -2.600 -16.703 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -21.164 -2.133 -16.158 1.00 0.00 O ATOM 1061 NE2 GLN A 65 -20.258 -3.003 -17.942 1.00 0.00 N ATOM 0 H GLN A 65 -17.480 -2.082 -13.186 1.00 0.00 H new ATOM 0 HA GLN A 65 -20.226 -1.631 -14.079 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -18.180 -3.866 -14.248 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -19.846 -4.175 -14.693 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -18.415 -1.736 -15.811 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -18.149 -3.308 -16.539 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -19.436 -3.395 -18.401 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -21.138 -2.926 -18.452 1.00 0.00 H new ATOM 1070 N GLU A 66 -21.596 -2.816 -12.350 1.00 0.00 N ATOM 1071 CA GLU A 66 -22.391 -3.454 -11.261 1.00 0.00 C ATOM 1072 C GLU A 66 -22.810 -4.861 -11.691 1.00 0.00 C ATOM 1073 O GLU A 66 -23.846 -5.358 -11.291 1.00 0.00 O ATOM 1074 CB GLU A 66 -23.639 -2.613 -10.979 1.00 0.00 C ATOM 1075 CG GLU A 66 -24.413 -2.395 -12.282 1.00 0.00 C ATOM 1076 CD GLU A 66 -25.628 -1.505 -12.011 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -26.326 -1.768 -11.047 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -25.839 -0.577 -12.775 1.00 0.00 O ATOM 0 H GLU A 66 -22.132 -2.225 -12.986 1.00 0.00 H new ATOM 0 HA GLU A 66 -21.784 -3.516 -10.358 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -24.272 -3.116 -10.248 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.354 -1.653 -10.548 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.768 -1.930 -13.027 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -24.734 -3.353 -12.691 1.00 0.00 H new ATOM 1085 N ASP A 67 -22.011 -5.503 -12.504 1.00 0.00 N ATOM 1086 CA ASP A 67 -22.352 -6.880 -12.966 1.00 0.00 C ATOM 1087 C ASP A 67 -21.594 -7.907 -12.121 1.00 0.00 C ATOM 1088 O ASP A 67 -22.104 -8.967 -11.814 1.00 0.00 O ATOM 1089 CB ASP A 67 -21.956 -7.037 -14.436 1.00 0.00 C ATOM 1090 CG ASP A 67 -22.980 -6.322 -15.320 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -24.161 -6.440 -15.039 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -22.564 -5.669 -16.264 1.00 0.00 O ATOM 0 H ASP A 67 -21.134 -5.131 -12.868 1.00 0.00 H new ATOM 0 HA ASP A 67 -23.424 -7.043 -12.858 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -20.963 -6.621 -14.602 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -21.907 -8.094 -14.700 1.00 0.00 H new ATOM 1097 N TYR A 68 -20.379 -7.595 -11.745 1.00 0.00 N ATOM 1098 CA TYR A 68 -19.579 -8.545 -10.918 1.00 0.00 C ATOM 1099 C TYR A 68 -20.159 -8.605 -9.504 1.00 0.00 C ATOM 1100 O TYR A 68 -20.668 -7.626 -8.992 1.00 0.00 O ATOM 1101 CB TYR A 68 -18.127 -8.066 -10.854 1.00 0.00 C ATOM 1102 CG TYR A 68 -17.245 -9.194 -10.376 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -16.967 -10.273 -11.223 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -16.706 -9.162 -9.083 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -16.149 -11.319 -10.779 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -15.889 -10.209 -8.640 1.00 0.00 C ATOM 1107 CZ TYR A 68 -15.611 -11.287 -9.487 1.00 0.00 C ATOM 1108 OH TYR A 68 -14.805 -12.318 -9.050 1.00 0.00 O ATOM 0 H TYR A 68 -19.907 -6.721 -11.976 1.00 0.00 H new ATOM 0 HA TYR A 68 -19.615 -9.537 -11.367 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.801 -7.727 -11.837 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -18.043 -7.214 -10.179 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -17.383 -10.299 -12.219 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.921 -8.330 -8.429 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -15.933 -12.151 -11.433 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -15.473 -10.184 -7.644 1.00 0.00 H new ATOM 0 HH TYR A 68 -14.328 -12.707 -9.813 1.00 0.00 H new ATOM 1118 N GLN A 69 -20.086 -9.750 -8.873 1.00 0.00 N ATOM 1119 CA GLN A 69 -20.631 -9.885 -7.490 1.00 0.00 C ATOM 1120 C GLN A 69 -19.739 -10.827 -6.680 1.00 0.00 C ATOM 1121 O GLN A 69 -19.791 -12.033 -6.838 1.00 0.00 O ATOM 1122 CB GLN A 69 -22.049 -10.455 -7.554 1.00 0.00 C ATOM 1123 CG GLN A 69 -23.021 -9.360 -8.000 1.00 0.00 C ATOM 1124 CD GLN A 69 -24.431 -9.943 -8.113 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -24.998 -10.384 -7.134 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -25.024 -9.962 -9.275 1.00 0.00 N ATOM 0 H GLN A 69 -19.671 -10.599 -9.258 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.654 -8.906 -7.012 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -22.084 -11.293 -8.250 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -22.342 -10.840 -6.577 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -23.012 -8.538 -7.284 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.708 -8.950 -8.960 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -24.547 -9.591 -10.097 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -25.964 -10.347 -9.361 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.921 -10.285 -5.814 1.00 0.00 N ATOM 1136 CA ALA A 70 -18.019 -11.140 -4.988 1.00 0.00 C ATOM 1137 C ALA A 70 -18.754 -11.577 -3.718 1.00 0.00 C ATOM 1138 O ALA A 70 -19.136 -10.761 -2.901 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.770 -10.344 -4.605 1.00 0.00 C ATOM 0 H ALA A 70 -18.840 -9.283 -5.644 1.00 0.00 H new ATOM 0 HA ALA A 70 -17.727 -12.020 -5.561 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -16.111 -10.969 -4.002 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -16.247 -10.031 -5.509 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -17.061 -9.464 -4.032 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.952 -12.860 -3.551 1.00 0.00 N ATOM 1146 CA GLN A 71 -19.661 -13.362 -2.337 1.00 0.00 C ATOM 1147 C GLN A 71 -18.728 -13.275 -1.129 1.00 0.00 C ATOM 1148 O GLN A 71 -17.615 -13.767 -1.158 1.00 0.00 O ATOM 1149 CB GLN A 71 -20.080 -14.817 -2.556 1.00 0.00 C ATOM 1150 CG GLN A 71 -21.200 -14.877 -3.597 1.00 0.00 C ATOM 1151 CD GLN A 71 -21.604 -16.334 -3.829 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -22.326 -16.910 -3.041 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -21.165 -16.959 -4.888 1.00 0.00 N ATOM 0 H GLN A 71 -18.652 -13.583 -4.205 1.00 0.00 H new ATOM 0 HA GLN A 71 -20.547 -12.753 -2.156 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.226 -15.405 -2.891 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -20.419 -15.254 -1.617 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -22.060 -14.300 -3.255 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -20.866 -14.428 -4.532 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -20.558 -16.476 -5.551 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -21.429 -17.930 -5.053 1.00 0.00 H new ATOM 1162 N GLY A 72 -19.175 -12.652 -0.067 1.00 0.00 N ATOM 1163 CA GLY A 72 -18.321 -12.528 1.150 1.00 0.00 C ATOM 1164 C GLY A 72 -17.258 -11.452 0.921 1.00 0.00 C ATOM 1165 O GLY A 72 -16.126 -11.586 1.347 1.00 0.00 O ATOM 0 H GLY A 72 -20.098 -12.223 0.008 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -18.935 -12.270 2.013 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -17.845 -13.483 1.372 1.00 0.00 H new ATOM 1169 N ALA A 73 -17.617 -10.385 0.252 1.00 0.00 N ATOM 1170 CA ALA A 73 -16.634 -9.293 -0.009 1.00 0.00 C ATOM 1171 C ALA A 73 -17.383 -7.978 -0.237 1.00 0.00 C ATOM 1172 O ALA A 73 -18.456 -7.957 -0.810 1.00 0.00 O ATOM 1173 CB ALA A 73 -15.812 -9.633 -1.254 1.00 0.00 C ATOM 0 H ALA A 73 -18.551 -10.224 -0.125 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.969 -9.190 0.848 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -15.094 -8.835 -1.445 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -15.279 -10.570 -1.093 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -16.477 -9.736 -2.112 1.00 0.00 H new ATOM 1179 N VAL A 74 -16.823 -6.882 0.210 1.00 0.00 N ATOM 1180 CA VAL A 74 -17.495 -5.562 0.025 1.00 0.00 C ATOM 1181 C VAL A 74 -17.253 -5.063 -1.401 1.00 0.00 C ATOM 1182 O VAL A 74 -16.177 -4.602 -1.732 1.00 0.00 O ATOM 1183 CB VAL A 74 -16.922 -4.553 1.023 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -17.712 -3.246 0.939 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -17.028 -5.121 2.440 1.00 0.00 C ATOM 0 H VAL A 74 -15.927 -6.846 0.696 1.00 0.00 H new ATOM 0 HA VAL A 74 -18.566 -5.672 0.195 1.00 0.00 H new ATOM 0 HB VAL A 74 -15.876 -4.361 0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -17.304 -2.528 1.650 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -17.638 -2.840 -0.070 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -18.758 -3.437 1.177 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -16.620 -4.403 3.151 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -18.074 -5.313 2.678 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -16.465 -6.052 2.502 1.00 0.00 H new ATOM 1195 N VAL A 75 -18.249 -5.153 -2.246 1.00 0.00 N ATOM 1196 CA VAL A 75 -18.088 -4.687 -3.655 1.00 0.00 C ATOM 1197 C VAL A 75 -18.374 -3.186 -3.730 1.00 0.00 C ATOM 1198 O VAL A 75 -19.510 -2.768 -3.857 1.00 0.00 O ATOM 1199 CB VAL A 75 -19.067 -5.439 -4.557 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -18.800 -5.076 -6.018 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -18.882 -6.946 -4.366 1.00 0.00 C ATOM 0 H VAL A 75 -19.169 -5.530 -2.019 1.00 0.00 H new ATOM 0 HA VAL A 75 -17.068 -4.880 -3.988 1.00 0.00 H new ATOM 0 HB VAL A 75 -20.088 -5.160 -4.294 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -19.499 -5.613 -6.660 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -18.932 -4.003 -6.156 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -17.779 -5.353 -6.281 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -19.580 -7.483 -5.009 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -17.861 -7.223 -4.628 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -19.073 -7.207 -3.325 1.00 0.00 H new ATOM 1211 N VAL A 76 -17.350 -2.374 -3.652 1.00 0.00 N ATOM 1212 CA VAL A 76 -17.552 -0.896 -3.717 1.00 0.00 C ATOM 1213 C VAL A 76 -17.512 -0.440 -5.177 1.00 0.00 C ATOM 1214 O VAL A 76 -17.193 -1.208 -6.067 1.00 0.00 O ATOM 1215 CB VAL A 76 -16.442 -0.195 -2.933 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.575 -0.532 -1.446 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -15.078 -0.669 -3.442 1.00 0.00 C ATOM 0 H VAL A 76 -16.381 -2.673 -3.546 1.00 0.00 H new ATOM 0 HA VAL A 76 -18.519 -0.642 -3.283 1.00 0.00 H new ATOM 0 HB VAL A 76 -16.527 0.883 -3.071 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.784 -0.032 -0.887 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.545 -0.194 -1.082 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.491 -1.610 -1.308 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.287 -0.169 -2.883 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.993 -1.747 -3.305 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -14.981 -0.429 -4.501 1.00 0.00 H new ATOM 1227 N HIS A 77 -17.834 0.803 -5.427 1.00 0.00 N ATOM 1228 CA HIS A 77 -17.818 1.320 -6.827 1.00 0.00 C ATOM 1229 C HIS A 77 -17.341 2.773 -6.829 1.00 0.00 C ATOM 1230 O HIS A 77 -17.725 3.560 -7.674 1.00 0.00 O ATOM 1231 CB HIS A 77 -19.230 1.247 -7.413 1.00 0.00 C ATOM 1232 CG HIS A 77 -19.646 -0.193 -7.545 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -19.594 -0.869 -8.754 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -20.122 -1.097 -6.629 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -20.027 -2.124 -8.535 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -20.362 -2.316 -7.255 1.00 0.00 N ATOM 0 H HIS A 77 -18.108 1.484 -4.719 1.00 0.00 H new ATOM 0 HA HIS A 77 -17.141 0.715 -7.430 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -19.930 1.781 -6.770 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -19.256 1.735 -8.387 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -19.284 -0.485 -9.647 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -20.286 -0.893 -5.581 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -20.096 -2.883 -9.300 1.00 0.00 H new ATOM 1244 N ASP A 78 -16.505 3.132 -5.888 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.995 4.533 -5.826 1.00 0.00 C ATOM 1246 C ASP A 78 -14.881 4.624 -4.780 1.00 0.00 C ATOM 1247 O ASP A 78 -14.939 3.988 -3.744 1.00 0.00 O ATOM 1248 CB ASP A 78 -17.137 5.475 -5.438 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.742 6.917 -5.761 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -16.074 7.525 -4.940 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.114 7.389 -6.822 1.00 0.00 O ATOM 0 H ASP A 78 -16.153 2.512 -5.158 1.00 0.00 H new ATOM 0 HA ASP A 78 -15.602 4.820 -6.801 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -18.044 5.206 -5.979 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -17.358 5.377 -4.375 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.870 5.412 -5.046 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.746 5.551 -4.073 1.00 0.00 C ATOM 1258 C VAL A 79 -13.255 6.236 -2.802 1.00 0.00 C ATOM 1259 O VAL A 79 -12.800 5.952 -1.711 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.632 6.394 -4.697 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.420 6.409 -3.764 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -11.230 5.790 -6.044 1.00 0.00 C ATOM 0 H VAL A 79 -13.775 5.966 -5.897 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.357 4.564 -3.823 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.988 7.413 -4.847 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.626 7.009 -4.208 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.705 6.838 -2.804 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.063 5.390 -3.614 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.436 6.390 -6.489 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.874 4.771 -5.894 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -12.093 5.778 -6.710 1.00 0.00 H new ATOM 1272 N ALA A 80 -14.195 7.137 -2.941 1.00 0.00 N ATOM 1273 CA ALA A 80 -14.740 7.847 -1.747 1.00 0.00 C ATOM 1274 C ALA A 80 -15.509 6.856 -0.870 1.00 0.00 C ATOM 1275 O ALA A 80 -15.534 6.976 0.340 1.00 0.00 O ATOM 1276 CB ALA A 80 -15.682 8.962 -2.203 1.00 0.00 C ATOM 0 H ALA A 80 -14.608 7.411 -3.832 1.00 0.00 H new ATOM 0 HA ALA A 80 -13.918 8.277 -1.174 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.080 9.481 -1.331 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.134 9.668 -2.827 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.504 8.532 -2.776 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.135 5.879 -1.476 1.00 0.00 N ATOM 1283 CA ALA A 81 -16.907 4.874 -0.687 1.00 0.00 C ATOM 1284 C ALA A 81 -15.940 4.024 0.141 1.00 0.00 C ATOM 1285 O ALA A 81 -16.240 3.639 1.255 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.691 3.970 -1.642 1.00 0.00 C ATOM 0 H ALA A 81 -16.144 5.735 -2.486 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.600 5.388 -0.021 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.255 3.236 -1.067 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.379 4.575 -2.233 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.998 3.455 -2.307 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.784 3.732 -0.397 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.790 2.908 0.351 1.00 0.00 C ATOM 1294 C VAL A 82 -13.285 3.694 1.562 1.00 0.00 C ATOM 1295 O VAL A 82 -13.105 3.148 2.635 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.611 2.572 -0.566 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.668 1.603 0.148 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -13.133 1.921 -1.849 1.00 0.00 C ATOM 0 H VAL A 82 -14.485 4.030 -1.326 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.263 1.985 0.687 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.072 3.487 -0.814 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.829 1.364 -0.505 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.296 2.065 1.063 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.206 0.688 0.397 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.294 1.681 -2.503 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.672 1.007 -1.600 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.805 2.611 -2.359 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.056 4.973 1.397 1.00 0.00 N ATOM 1309 CA PHE A 83 -12.563 5.804 2.534 1.00 0.00 C ATOM 1310 C PHE A 83 -13.677 5.963 3.570 1.00 0.00 C ATOM 1311 O PHE A 83 -13.419 6.106 4.751 1.00 0.00 O ATOM 1312 CB PHE A 83 -12.149 7.183 2.015 1.00 0.00 C ATOM 1313 CG PHE A 83 -10.796 7.086 1.351 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -9.689 6.640 2.082 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -10.650 7.444 0.006 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -8.434 6.550 1.465 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -9.396 7.355 -0.609 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.288 6.908 0.120 1.00 0.00 C ATOM 0 H PHE A 83 -13.190 5.477 0.521 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.705 5.316 2.996 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -12.889 7.553 1.305 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -12.112 7.897 2.838 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -9.802 6.366 3.120 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.505 7.789 -0.557 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -7.579 6.204 2.028 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.283 7.631 -1.647 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.321 6.839 -0.355 1.00 0.00 H new ATOM 1328 N ALA A 84 -14.911 5.939 3.135 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.050 6.087 4.088 1.00 0.00 C ATOM 1330 C ALA A 84 -16.101 4.873 5.016 1.00 0.00 C ATOM 1331 O ALA A 84 -16.454 4.981 6.175 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.360 6.186 3.305 1.00 0.00 C ATOM 0 H ALA A 84 -15.179 5.823 2.158 1.00 0.00 H new ATOM 0 HA ALA A 84 -15.912 6.991 4.681 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.192 6.294 4.000 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -17.324 7.052 2.644 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.498 5.282 2.711 1.00 0.00 H new ATOM 1338 N TYR A 85 -15.751 3.716 4.512 1.00 0.00 N ATOM 1339 CA TYR A 85 -15.776 2.486 5.357 1.00 0.00 C ATOM 1340 C TYR A 85 -14.621 2.533 6.360 1.00 0.00 C ATOM 1341 O TYR A 85 -14.738 2.061 7.474 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.626 1.252 4.465 1.00 0.00 C ATOM 1343 CG TYR A 85 -15.977 0.014 5.254 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -15.034 -0.557 6.117 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -17.246 -0.562 5.124 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -15.359 -1.705 6.848 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -17.571 -1.711 5.857 1.00 0.00 C ATOM 1348 CZ TYR A 85 -16.628 -2.282 6.719 1.00 0.00 C ATOM 1349 OH TYR A 85 -16.948 -3.414 7.441 1.00 0.00 O ATOM 0 H TYR A 85 -15.448 3.571 3.549 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.723 2.433 5.895 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.277 1.338 3.595 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.604 1.181 4.093 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -14.056 -0.111 6.219 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -17.974 -0.121 4.459 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -14.630 -2.146 7.512 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -18.550 -2.156 5.757 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.867 -3.684 7.236 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.507 3.100 5.969 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.338 3.183 6.892 1.00 0.00 C ATOM 1361 C ALA A 86 -12.648 4.171 8.019 1.00 0.00 C ATOM 1362 O ALA A 86 -12.165 4.030 9.128 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.110 3.663 6.116 1.00 0.00 C ATOM 0 H ALA A 86 -13.358 3.510 5.047 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.138 2.199 7.316 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.255 3.724 6.789 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -10.890 2.960 5.313 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.309 4.647 5.692 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.449 5.167 7.742 1.00 0.00 N ATOM 1370 CA LYS A 87 -13.796 6.171 8.791 1.00 0.00 C ATOM 1371 C LYS A 87 -14.609 5.493 9.896 1.00 0.00 C ATOM 1372 O LYS A 87 -14.417 5.758 11.068 1.00 0.00 O ATOM 1373 CB LYS A 87 -14.625 7.295 8.166 1.00 0.00 C ATOM 1374 CG LYS A 87 -13.705 8.229 7.376 1.00 0.00 C ATOM 1375 CD LYS A 87 -14.541 9.080 6.419 1.00 0.00 C ATOM 1376 CE LYS A 87 -15.245 10.189 7.203 1.00 0.00 C ATOM 1377 NZ LYS A 87 -14.251 11.227 7.595 1.00 0.00 N ATOM 0 H LYS A 87 -13.879 5.329 6.831 1.00 0.00 H new ATOM 0 HA LYS A 87 -12.881 6.586 9.214 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -15.387 6.877 7.509 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.146 7.853 8.944 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.148 8.871 8.059 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -12.972 7.647 6.817 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.903 9.514 5.649 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.276 8.457 5.910 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.032 10.635 6.595 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.723 9.775 8.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.744 12.120 7.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.738 10.913 8.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.577 11.374 6.817 1.00 0.00 H new ATOM 1391 N GLN A 88 -15.513 4.621 9.529 1.00 0.00 N ATOM 1392 CA GLN A 88 -16.343 3.920 10.551 1.00 0.00 C ATOM 1393 C GLN A 88 -15.450 3.016 11.403 1.00 0.00 C ATOM 1394 O GLN A 88 -15.726 2.770 12.562 1.00 0.00 O ATOM 1395 CB GLN A 88 -17.407 3.072 9.850 1.00 0.00 C ATOM 1396 CG GLN A 88 -18.562 3.970 9.402 1.00 0.00 C ATOM 1397 CD GLN A 88 -19.712 3.103 8.885 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -19.545 2.347 7.949 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -20.881 3.182 9.460 1.00 0.00 N ATOM 0 H GLN A 88 -15.712 4.364 8.562 1.00 0.00 H new ATOM 0 HA GLN A 88 -16.829 4.657 11.191 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -16.973 2.563 8.989 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -17.774 2.299 10.525 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -18.902 4.585 10.235 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -18.225 4.650 8.620 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -21.021 3.817 10.246 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -21.655 2.609 9.123 1.00 0.00 H new ATOM 1408 N HIS A 89 -14.380 2.520 10.834 1.00 0.00 N ATOM 1409 CA HIS A 89 -13.461 1.630 11.601 1.00 0.00 C ATOM 1410 C HIS A 89 -12.067 2.271 11.673 1.00 0.00 C ATOM 1411 O HIS A 89 -11.243 2.038 10.812 1.00 0.00 O ATOM 1412 CB HIS A 89 -13.361 0.274 10.899 1.00 0.00 C ATOM 1413 CG HIS A 89 -14.575 -0.551 11.228 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -14.487 -1.762 11.898 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -15.912 -0.354 10.985 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -15.736 -2.241 12.035 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -16.644 -1.422 11.496 1.00 0.00 N ATOM 0 H HIS A 89 -14.104 2.695 9.868 1.00 0.00 H new ATOM 0 HA HIS A 89 -13.850 1.491 12.610 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.285 0.415 9.821 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -12.457 -0.246 11.217 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.332 0.500 10.475 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -15.976 -3.175 12.522 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -17.655 -1.552 11.466 1.00 0.00 H new ATOM 1425 N PRO A 90 -11.838 3.063 12.701 1.00 0.00 N ATOM 1426 CA PRO A 90 -10.548 3.789 12.961 1.00 0.00 C ATOM 1427 C PRO A 90 -9.531 2.832 13.592 1.00 0.00 C ATOM 1428 O PRO A 90 -8.335 3.040 13.504 1.00 0.00 O ATOM 1429 CB PRO A 90 -10.875 4.927 13.925 1.00 0.00 C ATOM 1430 CG PRO A 90 -12.271 4.683 14.463 1.00 0.00 C ATOM 1431 CD PRO A 90 -12.798 3.407 13.810 1.00 0.00 C ATOM 0 HA PRO A 90 -10.114 4.173 12.038 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -10.151 4.960 14.739 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -10.824 5.889 13.414 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -12.251 4.578 15.548 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.922 5.527 14.236 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -12.858 2.596 14.536 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -13.804 3.559 13.419 1.00 0.00 H new ATOM 1439 N ASP A 91 -10.002 1.788 14.224 1.00 0.00 N ATOM 1440 CA ASP A 91 -9.071 0.811 14.864 1.00 0.00 C ATOM 1441 C ASP A 91 -8.337 0.020 13.780 1.00 0.00 C ATOM 1442 O ASP A 91 -7.249 -0.480 13.995 1.00 0.00 O ATOM 1443 CB ASP A 91 -9.869 -0.150 15.747 1.00 0.00 C ATOM 1444 CG ASP A 91 -10.136 0.503 17.104 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -9.237 1.152 17.613 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -11.234 0.344 17.611 1.00 0.00 O ATOM 0 H ASP A 91 -10.993 1.570 14.325 1.00 0.00 H new ATOM 0 HA ASP A 91 -8.345 1.347 15.475 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -10.812 -0.406 15.264 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -9.317 -1.080 15.882 1.00 0.00 H new ATOM 1451 N GLN A 92 -8.927 -0.095 12.617 1.00 0.00 N ATOM 1452 CA GLN A 92 -8.272 -0.853 11.511 1.00 0.00 C ATOM 1453 C GLN A 92 -7.495 0.118 10.619 1.00 0.00 C ATOM 1454 O GLN A 92 -7.477 1.311 10.856 1.00 0.00 O ATOM 1455 CB GLN A 92 -9.339 -1.566 10.679 1.00 0.00 C ATOM 1456 CG GLN A 92 -8.769 -2.876 10.129 1.00 0.00 C ATOM 1457 CD GLN A 92 -8.986 -3.995 11.149 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -8.709 -3.828 12.320 1.00 0.00 O ATOM 1459 NE2 GLN A 92 -9.475 -5.137 10.751 1.00 0.00 N ATOM 0 H GLN A 92 -9.837 0.305 12.387 1.00 0.00 H new ATOM 0 HA GLN A 92 -7.587 -1.590 11.931 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -10.217 -1.768 11.292 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -9.663 -0.926 9.859 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -9.255 -3.129 9.187 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -7.706 -2.762 9.919 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -9.708 -5.277 9.768 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -9.625 -5.890 11.423 1.00 0.00 H new ATOM 1468 N GLU A 93 -6.854 -0.388 9.595 1.00 0.00 N ATOM 1469 CA GLU A 93 -6.075 0.497 8.681 1.00 0.00 C ATOM 1470 C GLU A 93 -6.341 0.092 7.230 1.00 0.00 C ATOM 1471 O GLU A 93 -6.702 -1.035 6.949 1.00 0.00 O ATOM 1472 CB GLU A 93 -4.581 0.357 8.984 1.00 0.00 C ATOM 1473 CG GLU A 93 -4.304 0.820 10.416 1.00 0.00 C ATOM 1474 CD GLU A 93 -2.810 1.101 10.583 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -2.374 2.155 10.148 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -2.127 0.260 11.141 1.00 0.00 O ATOM 0 H GLU A 93 -6.838 -1.379 9.354 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.380 1.533 8.831 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.270 -0.680 8.859 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.999 0.951 8.280 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.880 1.718 10.637 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -4.622 0.055 11.124 1.00 0.00 H new ATOM 1483 N LEU A 94 -6.163 1.005 6.309 1.00 0.00 N ATOM 1484 CA LEU A 94 -6.403 0.683 4.872 1.00 0.00 C ATOM 1485 C LEU A 94 -5.073 0.342 4.197 1.00 0.00 C ATOM 1486 O LEU A 94 -4.036 0.870 4.552 1.00 0.00 O ATOM 1487 CB LEU A 94 -7.033 1.892 4.177 1.00 0.00 C ATOM 1488 CG LEU A 94 -7.711 1.441 2.882 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -9.075 0.830 3.205 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -7.899 2.648 1.959 1.00 0.00 C ATOM 0 H LEU A 94 -5.861 1.962 6.492 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.077 -0.170 4.798 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.762 2.365 4.836 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.269 2.638 3.959 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.088 0.696 2.386 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -9.558 0.509 2.282 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -8.942 -0.029 3.863 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.699 1.574 3.701 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.382 2.328 1.036 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.522 3.392 2.455 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.927 3.084 1.728 1.00 0.00 H new ATOM 1502 N VAL A 95 -5.098 -0.536 3.227 1.00 0.00 N ATOM 1503 CA VAL A 95 -3.840 -0.918 2.523 1.00 0.00 C ATOM 1504 C VAL A 95 -4.147 -1.204 1.051 1.00 0.00 C ATOM 1505 O VAL A 95 -5.147 -1.815 0.725 1.00 0.00 O ATOM 1506 CB VAL A 95 -3.250 -2.172 3.173 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -1.885 -2.477 2.553 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -3.085 -1.937 4.676 1.00 0.00 C ATOM 0 H VAL A 95 -5.939 -1.006 2.892 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.122 -0.101 2.594 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.920 -3.015 3.007 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.466 -3.370 3.017 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.001 -2.645 1.482 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.214 -1.634 2.718 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.665 -2.829 5.140 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.415 -1.093 4.841 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.057 -1.721 5.119 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.291 -0.766 0.162 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.523 -1.008 -1.292 1.00 0.00 C ATOM 1520 C ILE A 96 -2.578 -2.105 -1.782 1.00 0.00 C ATOM 1521 O ILE A 96 -1.370 -1.979 -1.697 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.256 0.283 -2.074 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -4.066 1.440 -1.466 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.653 0.085 -3.541 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.568 1.133 -1.529 1.00 0.00 C ATOM 0 H ILE A 96 -2.439 -0.250 0.383 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.555 -1.320 -1.449 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.195 0.525 -2.017 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.764 1.599 -0.431 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.854 2.363 -2.005 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.463 1.003 -4.097 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -3.066 -0.727 -3.970 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.713 -0.162 -3.601 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.127 1.962 -1.095 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.868 0.997 -2.568 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.777 0.221 -0.969 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.119 -3.182 -2.294 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.259 -4.296 -2.791 1.00 0.00 C ATOM 1539 C ALA A 97 -2.181 -4.236 -4.318 1.00 0.00 C ATOM 1540 O ALA A 97 -1.203 -4.647 -4.913 1.00 0.00 O ATOM 1541 CB ALA A 97 -2.862 -5.635 -2.364 1.00 0.00 C ATOM 0 H ALA A 97 -4.123 -3.337 -2.389 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.258 -4.198 -2.371 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.234 -6.449 -2.727 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -2.919 -5.678 -1.276 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.863 -5.734 -2.784 1.00 0.00 H new ATOM 1547 N GLY A 98 -3.207 -3.729 -4.953 1.00 0.00 N ATOM 1548 CA GLY A 98 -3.202 -3.640 -6.444 1.00 0.00 C ATOM 1549 C GLY A 98 -4.650 -3.580 -6.960 1.00 0.00 C ATOM 1550 O GLY A 98 -5.578 -3.507 -6.178 1.00 0.00 O ATOM 0 H GLY A 98 -4.049 -3.372 -4.502 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.654 -2.754 -6.764 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -2.689 -4.503 -6.869 1.00 0.00 H new ATOM 1554 N GLY A 99 -4.877 -3.610 -8.264 1.00 0.00 N ATOM 1555 CA GLY A 99 -3.757 -3.700 -9.256 1.00 0.00 C ATOM 1556 C GLY A 99 -3.183 -2.305 -9.509 1.00 0.00 C ATOM 1557 O GLY A 99 -3.204 -1.450 -8.644 1.00 0.00 O ATOM 0 H GLY A 99 -5.807 -3.575 -8.681 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -2.977 -4.363 -8.880 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -4.118 -4.131 -10.190 1.00 0.00 H new ATOM 1561 N ALA A 100 -2.669 -2.072 -10.691 1.00 0.00 N ATOM 1562 CA ALA A 100 -2.090 -0.734 -11.012 1.00 0.00 C ATOM 1563 C ALA A 100 -3.211 0.305 -11.082 1.00 0.00 C ATOM 1564 O ALA A 100 -3.016 1.461 -10.756 1.00 0.00 O ATOM 1565 CB ALA A 100 -1.370 -0.801 -12.360 1.00 0.00 C ATOM 0 H ALA A 100 -2.626 -2.754 -11.449 1.00 0.00 H new ATOM 0 HA ALA A 100 -1.381 -0.449 -10.235 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.947 0.176 -12.595 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.571 -1.540 -12.309 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -2.079 -1.086 -13.137 1.00 0.00 H new ATOM 1571 N GLN A 101 -4.381 -0.100 -11.505 1.00 0.00 N ATOM 1572 CA GLN A 101 -5.521 0.857 -11.600 1.00 0.00 C ATOM 1573 C GLN A 101 -5.970 1.258 -10.193 1.00 0.00 C ATOM 1574 O GLN A 101 -6.490 2.339 -9.984 1.00 0.00 O ATOM 1575 CB GLN A 101 -6.686 0.191 -12.337 1.00 0.00 C ATOM 1576 CG GLN A 101 -6.231 -0.228 -13.736 1.00 0.00 C ATOM 1577 CD GLN A 101 -7.168 -1.310 -14.275 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -7.298 -2.365 -13.686 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -7.831 -1.093 -15.377 1.00 0.00 N ATOM 0 H GLN A 101 -4.595 -1.056 -11.789 1.00 0.00 H new ATOM 0 HA GLN A 101 -5.205 1.745 -12.147 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -7.033 -0.679 -11.780 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -7.527 0.880 -12.408 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -6.232 0.634 -14.403 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -5.208 -0.603 -13.700 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -7.722 -0.208 -15.872 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -8.458 -1.809 -15.744 1.00 0.00 H new ATOM 1588 N ILE A 102 -5.773 0.394 -9.230 1.00 0.00 N ATOM 1589 CA ILE A 102 -6.185 0.716 -7.832 1.00 0.00 C ATOM 1590 C ILE A 102 -5.139 1.627 -7.187 1.00 0.00 C ATOM 1591 O ILE A 102 -5.465 2.509 -6.415 1.00 0.00 O ATOM 1592 CB ILE A 102 -6.302 -0.581 -7.024 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -7.231 -1.567 -7.752 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -6.862 -0.271 -5.633 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -8.632 -0.961 -7.916 1.00 0.00 C ATOM 0 H ILE A 102 -5.343 -0.523 -9.353 1.00 0.00 H new ATOM 0 HA ILE A 102 -7.149 1.225 -7.845 1.00 0.00 H new ATOM 0 HB ILE A 102 -5.315 -1.031 -6.922 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.817 -1.812 -8.730 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -7.294 -2.499 -7.190 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.945 -1.194 -5.060 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -6.193 0.418 -5.117 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -7.847 0.185 -5.731 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -9.277 -1.671 -8.433 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -9.050 -0.739 -6.934 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -8.565 -0.042 -8.498 1.00 0.00 H new ATOM 1607 N PHE A 103 -3.884 1.419 -7.499 1.00 0.00 N ATOM 1608 CA PHE A 103 -2.810 2.269 -6.908 1.00 0.00 C ATOM 1609 C PHE A 103 -2.998 3.719 -7.363 1.00 0.00 C ATOM 1610 O PHE A 103 -3.048 4.629 -6.558 1.00 0.00 O ATOM 1611 CB PHE A 103 -1.441 1.763 -7.373 1.00 0.00 C ATOM 1612 CG PHE A 103 -1.073 0.512 -6.608 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -1.094 0.513 -5.207 1.00 0.00 C ATOM 1614 CD2 PHE A 103 -0.706 -0.647 -7.301 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.749 -0.646 -4.502 1.00 0.00 C ATOM 1616 CE2 PHE A 103 -0.362 -1.806 -6.595 1.00 0.00 C ATOM 1617 CZ PHE A 103 -0.384 -1.806 -5.195 1.00 0.00 C ATOM 0 H PHE A 103 -3.558 0.695 -8.139 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.866 2.218 -5.821 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -1.464 1.553 -8.442 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -0.685 2.533 -7.215 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -1.376 1.407 -4.671 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -0.688 -0.647 -8.381 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.764 -0.645 -3.422 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -0.080 -2.700 -7.130 1.00 0.00 H new ATOM 0 HZ PHE A 103 -0.120 -2.700 -4.650 1.00 0.00 H new ATOM 1627 N THR A 104 -3.101 3.935 -8.650 1.00 0.00 N ATOM 1628 CA THR A 104 -3.286 5.321 -9.170 1.00 0.00 C ATOM 1629 C THR A 104 -4.614 5.886 -8.660 1.00 0.00 C ATOM 1630 O THR A 104 -4.769 7.082 -8.505 1.00 0.00 O ATOM 1631 CB THR A 104 -3.298 5.295 -10.701 1.00 0.00 C ATOM 1632 OG1 THR A 104 -3.763 4.030 -11.150 1.00 0.00 O ATOM 1633 CG2 THR A 104 -1.884 5.538 -11.229 1.00 0.00 C ATOM 0 H THR A 104 -3.065 3.208 -9.364 1.00 0.00 H new ATOM 0 HA THR A 104 -2.466 5.950 -8.823 1.00 0.00 H new ATOM 0 HB THR A 104 -3.961 6.077 -11.071 1.00 0.00 H new ATOM 0 HG1 THR A 104 -3.772 4.014 -12.130 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.894 5.519 -12.319 1.00 0.00 H new ATOM 0 HG22 THR A 104 -1.530 6.510 -10.886 1.00 0.00 H new ATOM 0 HG23 THR A 104 -1.218 4.758 -10.859 1.00 0.00 H new ATOM 1641 N ALA A 105 -5.570 5.031 -8.400 1.00 0.00 N ATOM 1642 CA ALA A 105 -6.893 5.507 -7.899 1.00 0.00 C ATOM 1643 C ALA A 105 -6.728 6.092 -6.495 1.00 0.00 C ATOM 1644 O ALA A 105 -7.385 7.050 -6.133 1.00 0.00 O ATOM 1645 CB ALA A 105 -7.872 4.332 -7.849 1.00 0.00 C ATOM 0 H ALA A 105 -5.490 4.021 -8.514 1.00 0.00 H new ATOM 0 HA ALA A 105 -7.279 6.275 -8.569 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -8.838 4.679 -7.483 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.991 3.915 -8.849 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.485 3.564 -7.179 1.00 0.00 H new ATOM 1651 N PHE A 106 -5.854 5.523 -5.703 1.00 0.00 N ATOM 1652 CA PHE A 106 -5.640 6.041 -4.318 1.00 0.00 C ATOM 1653 C PHE A 106 -4.363 6.888 -4.267 1.00 0.00 C ATOM 1654 O PHE A 106 -3.912 7.275 -3.206 1.00 0.00 O ATOM 1655 CB PHE A 106 -5.506 4.862 -3.351 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.863 4.241 -3.122 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -7.541 3.629 -4.183 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -7.443 4.277 -1.848 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -8.799 3.053 -3.970 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -8.700 3.700 -1.635 1.00 0.00 C ATOM 1661 CZ PHE A 106 -9.378 3.088 -2.696 1.00 0.00 C ATOM 0 H PHE A 106 -5.278 4.720 -5.957 1.00 0.00 H new ATOM 0 HA PHE A 106 -6.491 6.659 -4.031 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.819 4.120 -3.758 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -5.085 5.201 -2.404 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.094 3.601 -5.166 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.920 4.750 -1.030 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -9.323 2.582 -4.788 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.147 3.727 -0.652 1.00 0.00 H new ATOM 0 HZ PHE A 106 -10.348 2.643 -2.532 1.00 0.00 H new ATOM 1671 N LYS A 107 -3.778 7.176 -5.404 1.00 0.00 N ATOM 1672 CA LYS A 107 -2.531 7.997 -5.424 1.00 0.00 C ATOM 1673 C LYS A 107 -2.844 9.415 -4.942 1.00 0.00 C ATOM 1674 O LYS A 107 -2.007 10.078 -4.357 1.00 0.00 O ATOM 1675 CB LYS A 107 -1.980 8.053 -6.850 1.00 0.00 C ATOM 1676 CG LYS A 107 -0.580 8.667 -6.833 1.00 0.00 C ATOM 1677 CD LYS A 107 0.429 7.626 -6.344 1.00 0.00 C ATOM 1678 CE LYS A 107 1.754 8.315 -6.012 1.00 0.00 C ATOM 1679 NZ LYS A 107 1.527 9.349 -4.963 1.00 0.00 N ATOM 0 H LYS A 107 -4.112 6.877 -6.320 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.789 7.546 -4.765 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -1.944 7.051 -7.277 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.641 8.645 -7.483 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -0.310 9.010 -7.832 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.562 9.540 -6.181 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.042 7.115 -5.462 1.00 0.00 H new ATOM 0 HD3 LYS A 107 0.584 6.866 -7.110 1.00 0.00 H new ATOM 0 HE2 LYS A 107 2.480 7.581 -5.663 1.00 0.00 H new ATOM 0 HE3 LYS A 107 2.171 8.776 -6.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 1.604 10.296 -5.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.578 9.228 -4.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 2.241 9.246 -4.214 1.00 0.00 H new ATOM 1693 N ASP A 108 -4.042 9.882 -5.184 1.00 0.00 N ATOM 1694 CA ASP A 108 -4.419 11.258 -4.744 1.00 0.00 C ATOM 1695 C ASP A 108 -4.717 11.261 -3.239 1.00 0.00 C ATOM 1696 O ASP A 108 -5.290 12.198 -2.717 1.00 0.00 O ATOM 1697 CB ASP A 108 -5.663 11.715 -5.508 1.00 0.00 C ATOM 1698 CG ASP A 108 -5.785 13.238 -5.425 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -5.230 13.905 -6.283 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -6.430 13.712 -4.504 1.00 0.00 O ATOM 0 H ASP A 108 -4.777 9.368 -5.669 1.00 0.00 H new ATOM 0 HA ASP A 108 -3.592 11.938 -4.949 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -5.598 11.401 -6.550 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.553 11.245 -5.089 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.333 10.219 -2.543 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.591 10.157 -1.076 1.00 0.00 C ATOM 1707 C ASP A 109 -3.647 9.134 -0.436 1.00 0.00 C ATOM 1708 O ASP A 109 -4.022 8.414 0.471 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.041 9.737 -0.830 1.00 0.00 C ATOM 1710 CG ASP A 109 -6.945 10.970 -0.878 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -6.572 11.976 -0.295 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.994 10.889 -1.495 1.00 0.00 O ATOM 0 H ASP A 109 -3.851 9.408 -2.931 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.418 11.138 -0.634 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.354 9.014 -1.583 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.129 9.246 0.139 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.427 9.067 -0.905 1.00 0.00 N ATOM 1718 CA VAL A 110 -1.451 8.094 -0.332 1.00 0.00 C ATOM 1719 C VAL A 110 -0.593 8.796 0.729 1.00 0.00 C ATOM 1720 O VAL A 110 -0.392 9.996 0.682 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.563 7.543 -1.460 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.204 8.689 -2.129 1.00 0.00 C ATOM 1723 CG2 VAL A 110 0.432 6.528 -0.889 1.00 0.00 C ATOM 0 H VAL A 110 -2.065 9.646 -1.662 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.983 7.266 0.137 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.196 7.053 -2.200 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.831 8.290 -2.927 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.503 9.405 -2.547 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.831 9.187 -1.390 1.00 0.00 H new ATOM 0 HG21 VAL A 110 1.058 6.141 -1.693 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.059 7.014 -0.142 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.113 5.706 -0.426 1.00 0.00 H new ATOM 1733 N ASP A 111 -0.087 8.053 1.680 1.00 0.00 N ATOM 1734 CA ASP A 111 0.759 8.664 2.746 1.00 0.00 C ATOM 1735 C ASP A 111 2.046 7.850 2.902 1.00 0.00 C ATOM 1736 O ASP A 111 3.138 8.385 2.849 1.00 0.00 O ATOM 1737 CB ASP A 111 -0.008 8.662 4.071 1.00 0.00 C ATOM 1738 CG ASP A 111 -1.297 9.471 3.916 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -1.252 10.501 3.263 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -2.307 9.048 4.453 1.00 0.00 O ATOM 0 H ASP A 111 -0.225 7.046 1.763 1.00 0.00 H new ATOM 0 HA ASP A 111 1.006 9.689 2.471 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.241 7.639 4.367 1.00 0.00 H new ATOM 0 HB3 ASP A 111 0.609 9.089 4.861 1.00 0.00 H new ATOM 1745 N THR A 112 1.922 6.562 3.091 1.00 0.00 N ATOM 1746 CA THR A 112 3.132 5.702 3.251 1.00 0.00 C ATOM 1747 C THR A 112 3.399 4.955 1.943 1.00 0.00 C ATOM 1748 O THR A 112 2.515 4.789 1.123 1.00 0.00 O ATOM 1749 CB THR A 112 2.897 4.693 4.377 1.00 0.00 C ATOM 1750 OG1 THR A 112 2.344 5.361 5.502 1.00 0.00 O ATOM 1751 CG2 THR A 112 4.226 4.043 4.768 1.00 0.00 C ATOM 0 H THR A 112 1.032 6.067 3.142 1.00 0.00 H new ATOM 0 HA THR A 112 3.992 6.325 3.497 1.00 0.00 H new ATOM 0 HB THR A 112 2.205 3.922 4.036 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.989 6.014 5.844 1.00 0.00 H new ATOM 0 HG21 THR A 112 4.058 3.324 5.570 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.648 3.530 3.904 1.00 0.00 H new ATOM 0 HG23 THR A 112 4.920 4.811 5.109 1.00 0.00 H new ATOM 1759 N LEU A 113 4.612 4.504 1.744 1.00 0.00 N ATOM 1760 CA LEU A 113 4.945 3.766 0.490 1.00 0.00 C ATOM 1761 C LEU A 113 5.860 2.585 0.819 1.00 0.00 C ATOM 1762 O LEU A 113 7.025 2.758 1.127 1.00 0.00 O ATOM 1763 CB LEU A 113 5.658 4.709 -0.482 1.00 0.00 C ATOM 1764 CG LEU A 113 4.649 5.697 -1.068 1.00 0.00 C ATOM 1765 CD1 LEU A 113 5.389 6.918 -1.617 1.00 0.00 C ATOM 1766 CD2 LEU A 113 3.872 5.021 -2.200 1.00 0.00 C ATOM 0 H LEU A 113 5.387 4.616 2.398 1.00 0.00 H new ATOM 0 HA LEU A 113 4.028 3.397 0.032 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.452 5.248 0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.129 4.136 -1.281 1.00 0.00 H new ATOM 0 HG LEU A 113 3.956 6.013 -0.288 1.00 0.00 H new ATOM 0 HD11 LEU A 113 4.669 7.622 -2.035 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.943 7.400 -0.812 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.083 6.603 -2.396 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.152 5.725 -2.618 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.566 4.705 -2.979 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.344 4.151 -1.810 1.00 0.00 H new ATOM 1778 N LEU A 114 5.340 1.386 0.751 1.00 0.00 N ATOM 1779 CA LEU A 114 6.171 0.184 1.055 1.00 0.00 C ATOM 1780 C LEU A 114 6.534 -0.522 -0.253 1.00 0.00 C ATOM 1781 O LEU A 114 5.725 -1.219 -0.836 1.00 0.00 O ATOM 1782 CB LEU A 114 5.377 -0.772 1.949 1.00 0.00 C ATOM 1783 CG LEU A 114 5.162 -0.128 3.320 1.00 0.00 C ATOM 1784 CD1 LEU A 114 4.000 -0.821 4.033 1.00 0.00 C ATOM 1785 CD2 LEU A 114 6.434 -0.276 4.156 1.00 0.00 C ATOM 0 H LEU A 114 4.372 1.188 0.497 1.00 0.00 H new ATOM 0 HA LEU A 114 7.082 0.489 1.571 1.00 0.00 H new ATOM 0 HB2 LEU A 114 4.416 -1.003 1.489 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.913 -1.715 2.058 1.00 0.00 H new ATOM 0 HG LEU A 114 4.931 0.930 3.193 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.847 -0.362 5.010 1.00 0.00 H new ATOM 0 HD12 LEU A 114 3.093 -0.717 3.437 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.230 -1.879 4.161 1.00 0.00 H new ATOM 0 HD21 LEU A 114 6.282 0.182 5.133 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.665 -1.334 4.283 1.00 0.00 H new ATOM 0 HD23 LEU A 114 7.263 0.218 3.648 1.00 0.00 H new ATOM 1797 N VAL A 115 7.745 -0.343 -0.716 1.00 0.00 N ATOM 1798 CA VAL A 115 8.170 -0.996 -1.988 1.00 0.00 C ATOM 1799 C VAL A 115 9.159 -2.128 -1.678 1.00 0.00 C ATOM 1800 O VAL A 115 10.039 -1.985 -0.851 1.00 0.00 O ATOM 1801 CB VAL A 115 8.829 0.053 -2.899 1.00 0.00 C ATOM 1802 CG1 VAL A 115 10.059 0.648 -2.209 1.00 0.00 C ATOM 1803 CG2 VAL A 115 9.251 -0.599 -4.222 1.00 0.00 C ATOM 0 H VAL A 115 8.459 0.229 -0.265 1.00 0.00 H new ATOM 0 HA VAL A 115 7.303 -1.417 -2.497 1.00 0.00 H new ATOM 0 HB VAL A 115 8.110 0.848 -3.099 1.00 0.00 H new ATOM 0 HG11 VAL A 115 10.519 1.390 -2.862 1.00 0.00 H new ATOM 0 HG12 VAL A 115 9.758 1.123 -1.275 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.777 -0.145 -1.998 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.717 0.149 -4.864 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.962 -1.400 -4.022 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.373 -1.009 -4.722 1.00 0.00 H new ATOM 1813 N THR A 116 9.014 -3.248 -2.342 1.00 0.00 N ATOM 1814 CA THR A 116 9.939 -4.394 -2.099 1.00 0.00 C ATOM 1815 C THR A 116 10.855 -4.569 -3.311 1.00 0.00 C ATOM 1816 O THR A 116 10.468 -5.140 -4.313 1.00 0.00 O ATOM 1817 CB THR A 116 9.124 -5.672 -1.884 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.121 -5.433 -0.907 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.048 -6.793 -1.408 1.00 0.00 C ATOM 0 H THR A 116 8.293 -3.417 -3.043 1.00 0.00 H new ATOM 0 HA THR A 116 10.541 -4.196 -1.212 1.00 0.00 H new ATOM 0 HB THR A 116 8.654 -5.967 -2.822 1.00 0.00 H new ATOM 0 HG1 THR A 116 8.429 -5.759 -0.036 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.467 -7.703 -1.255 1.00 0.00 H new ATOM 0 HG22 THR A 116 10.816 -6.975 -2.159 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.520 -6.502 -0.470 1.00 0.00 H new ATOM 1827 N ARG A 117 12.065 -4.077 -3.227 1.00 0.00 N ATOM 1828 CA ARG A 117 13.015 -4.206 -4.371 1.00 0.00 C ATOM 1829 C ARG A 117 13.669 -5.588 -4.342 1.00 0.00 C ATOM 1830 O ARG A 117 13.892 -6.157 -3.291 1.00 0.00 O ATOM 1831 CB ARG A 117 14.095 -3.128 -4.261 1.00 0.00 C ATOM 1832 CG ARG A 117 13.460 -1.747 -4.429 1.00 0.00 C ATOM 1833 CD ARG A 117 14.548 -0.719 -4.738 1.00 0.00 C ATOM 1834 NE ARG A 117 13.931 0.638 -4.867 1.00 0.00 N ATOM 1835 CZ ARG A 117 14.668 1.697 -5.118 1.00 0.00 C ATOM 1836 NH1 ARG A 117 15.965 1.596 -5.266 1.00 0.00 N ATOM 1837 NH2 ARG A 117 14.099 2.867 -5.225 1.00 0.00 N ATOM 0 H ARG A 117 12.436 -3.590 -2.411 1.00 0.00 H new ATOM 0 HA ARG A 117 12.472 -4.083 -5.308 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.593 -3.195 -3.294 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.858 -3.284 -5.024 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.726 -1.768 -5.234 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.928 -1.467 -3.520 1.00 0.00 H new ATOM 0 HD2 ARG A 117 15.296 -0.716 -3.945 1.00 0.00 H new ATOM 0 HD3 ARG A 117 15.063 -0.985 -5.661 1.00 0.00 H new ATOM 0 HE ARG A 117 12.922 0.743 -4.758 1.00 0.00 H new ATOM 0 HH11 ARG A 117 16.418 0.686 -5.187 1.00 0.00 H new ATOM 0 HH12 ARG A 117 16.522 2.428 -5.460 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.089 2.955 -5.114 1.00 0.00 H new ATOM 0 HH22 ARG A 117 14.665 3.693 -5.420 1.00 0.00 H new ATOM 1851 N LEU A 118 13.981 -6.128 -5.493 1.00 0.00 N ATOM 1852 CA LEU A 118 14.626 -7.473 -5.548 1.00 0.00 C ATOM 1853 C LEU A 118 15.913 -7.383 -6.372 1.00 0.00 C ATOM 1854 O LEU A 118 15.926 -6.832 -7.458 1.00 0.00 O ATOM 1855 CB LEU A 118 13.663 -8.475 -6.200 1.00 0.00 C ATOM 1856 CG LEU A 118 13.045 -9.374 -5.126 1.00 0.00 C ATOM 1857 CD1 LEU A 118 11.971 -8.599 -4.363 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.414 -10.600 -5.791 1.00 0.00 C ATOM 0 H LEU A 118 13.816 -5.692 -6.400 1.00 0.00 H new ATOM 0 HA LEU A 118 14.864 -7.808 -4.538 1.00 0.00 H new ATOM 0 HB2 LEU A 118 12.878 -7.942 -6.737 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.196 -9.081 -6.933 1.00 0.00 H new ATOM 0 HG LEU A 118 13.821 -9.694 -4.431 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.533 -9.241 -3.599 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.420 -7.726 -3.889 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.194 -8.277 -5.056 1.00 0.00 H new ATOM 0 HD21 LEU A 118 11.973 -11.241 -5.028 1.00 0.00 H new ATOM 0 HD22 LEU A 118 11.639 -10.278 -6.486 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.180 -11.155 -6.333 1.00 0.00 H new ATOM 1870 N ALA A 119 16.993 -7.920 -5.863 1.00 0.00 N ATOM 1871 CA ALA A 119 18.285 -7.870 -6.609 1.00 0.00 C ATOM 1872 C ALA A 119 18.185 -8.744 -7.861 1.00 0.00 C ATOM 1873 O ALA A 119 18.800 -8.464 -8.873 1.00 0.00 O ATOM 1874 CB ALA A 119 19.411 -8.387 -5.713 1.00 0.00 C ATOM 0 H ALA A 119 17.035 -8.392 -4.960 1.00 0.00 H new ATOM 0 HA ALA A 119 18.497 -6.841 -6.901 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.355 -8.351 -6.257 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.482 -7.764 -4.822 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.200 -9.416 -5.421 1.00 0.00 H new ATOM 1880 N GLY A 120 17.418 -9.802 -7.797 1.00 0.00 N ATOM 1881 CA GLY A 120 17.272 -10.702 -8.978 1.00 0.00 C ATOM 1882 C GLY A 120 16.439 -10.004 -10.054 1.00 0.00 C ATOM 1883 O GLY A 120 15.350 -9.527 -9.793 1.00 0.00 O ATOM 0 H GLY A 120 16.885 -10.082 -6.974 1.00 0.00 H new ATOM 0 HA2 GLY A 120 18.254 -10.961 -9.375 1.00 0.00 H new ATOM 0 HA3 GLY A 120 16.793 -11.635 -8.680 1.00 0.00 H new ATOM 1887 N SER A 121 16.944 -9.942 -11.260 1.00 0.00 N ATOM 1888 CA SER A 121 16.188 -9.276 -12.361 1.00 0.00 C ATOM 1889 C SER A 121 15.110 -10.226 -12.887 1.00 0.00 C ATOM 1890 O SER A 121 15.328 -11.416 -13.012 1.00 0.00 O ATOM 1891 CB SER A 121 17.149 -8.917 -13.495 1.00 0.00 C ATOM 1892 OG SER A 121 17.899 -10.069 -13.857 1.00 0.00 O ATOM 0 H SER A 121 17.850 -10.325 -11.529 1.00 0.00 H new ATOM 0 HA SER A 121 15.719 -8.368 -11.982 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.592 -8.546 -14.356 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.819 -8.117 -13.180 1.00 0.00 H new ATOM 0 HG SER A 121 18.515 -9.843 -14.585 1.00 0.00 H new ATOM 1898 N PHE A 122 13.950 -9.705 -13.196 1.00 0.00 N ATOM 1899 CA PHE A 122 12.849 -10.568 -13.715 1.00 0.00 C ATOM 1900 C PHE A 122 11.990 -9.765 -14.693 1.00 0.00 C ATOM 1901 O PHE A 122 11.552 -8.670 -14.392 1.00 0.00 O ATOM 1902 CB PHE A 122 11.982 -11.047 -12.548 1.00 0.00 C ATOM 1903 CG PHE A 122 12.820 -11.880 -11.608 1.00 0.00 C ATOM 1904 CD1 PHE A 122 13.114 -13.211 -11.924 1.00 0.00 C ATOM 1905 CD2 PHE A 122 13.303 -11.320 -10.419 1.00 0.00 C ATOM 1906 CE1 PHE A 122 13.891 -13.983 -11.052 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.079 -12.091 -9.547 1.00 0.00 C ATOM 1908 CZ PHE A 122 14.373 -13.423 -9.863 1.00 0.00 C ATOM 0 H PHE A 122 13.718 -8.715 -13.110 1.00 0.00 H new ATOM 0 HA PHE A 122 13.275 -11.430 -14.228 1.00 0.00 H new ATOM 0 HB2 PHE A 122 11.562 -10.192 -12.018 1.00 0.00 H new ATOM 0 HB3 PHE A 122 11.143 -11.634 -12.921 1.00 0.00 H new ATOM 0 HD1 PHE A 122 12.741 -13.643 -12.841 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.076 -10.293 -10.175 1.00 0.00 H new ATOM 0 HE1 PHE A 122 14.118 -15.010 -11.297 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.451 -11.659 -8.630 1.00 0.00 H new ATOM 0 HZ PHE A 122 14.972 -14.018 -9.189 1.00 0.00 H new ATOM 1918 N GLU A 123 11.745 -10.303 -15.861 1.00 0.00 N ATOM 1919 CA GLU A 123 10.913 -9.579 -16.867 1.00 0.00 C ATOM 1920 C GLU A 123 9.484 -10.122 -16.833 1.00 0.00 C ATOM 1921 O GLU A 123 9.256 -11.274 -16.511 1.00 0.00 O ATOM 1922 CB GLU A 123 11.505 -9.785 -18.263 1.00 0.00 C ATOM 1923 CG GLU A 123 11.665 -11.283 -18.535 1.00 0.00 C ATOM 1924 CD GLU A 123 12.155 -11.492 -19.969 1.00 0.00 C ATOM 1925 OE1 GLU A 123 12.998 -10.726 -20.404 1.00 0.00 O ATOM 1926 OE2 GLU A 123 11.678 -12.416 -20.608 1.00 0.00 O ATOM 0 H GLU A 123 12.087 -11.216 -16.161 1.00 0.00 H new ATOM 0 HA GLU A 123 10.902 -8.515 -16.631 1.00 0.00 H new ATOM 0 HB2 GLU A 123 10.856 -9.336 -19.015 1.00 0.00 H new ATOM 0 HB3 GLU A 123 12.471 -9.286 -18.337 1.00 0.00 H new ATOM 0 HG2 GLU A 123 12.374 -11.718 -17.830 1.00 0.00 H new ATOM 0 HG3 GLU A 123 10.714 -11.794 -18.386 1.00 0.00 H new ATOM 1933 N GLY A 124 8.521 -9.300 -17.166 1.00 0.00 N ATOM 1934 CA GLY A 124 7.101 -9.760 -17.157 1.00 0.00 C ATOM 1935 C GLY A 124 6.322 -9.034 -18.255 1.00 0.00 C ATOM 1936 O GLY A 124 6.670 -9.098 -19.420 1.00 0.00 O ATOM 0 H GLY A 124 8.658 -8.328 -17.444 1.00 0.00 H new ATOM 0 HA2 GLY A 124 7.056 -10.837 -17.316 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.650 -9.562 -16.185 1.00 0.00 H new ATOM 1940 N ASP A 125 5.273 -8.343 -17.890 1.00 0.00 N ATOM 1941 CA ASP A 125 4.463 -7.607 -18.906 1.00 0.00 C ATOM 1942 C ASP A 125 3.914 -6.321 -18.286 1.00 0.00 C ATOM 1943 O ASP A 125 3.823 -5.297 -18.939 1.00 0.00 O ATOM 1944 CB ASP A 125 3.300 -8.488 -19.368 1.00 0.00 C ATOM 1945 CG ASP A 125 2.685 -7.898 -20.638 1.00 0.00 C ATOM 1946 OD1 ASP A 125 2.540 -6.687 -20.696 1.00 0.00 O ATOM 1947 OD2 ASP A 125 2.370 -8.666 -21.532 1.00 0.00 O ATOM 0 H ASP A 125 4.942 -8.257 -16.929 1.00 0.00 H new ATOM 0 HA ASP A 125 5.092 -7.359 -19.761 1.00 0.00 H new ATOM 0 HB2 ASP A 125 3.652 -9.502 -19.559 1.00 0.00 H new ATOM 0 HB3 ASP A 125 2.546 -8.554 -18.583 1.00 0.00 H new ATOM 1952 N THR A 126 3.548 -6.368 -17.030 1.00 0.00 N ATOM 1953 CA THR A 126 3.003 -5.151 -16.358 1.00 0.00 C ATOM 1954 C THR A 126 4.107 -4.488 -15.531 1.00 0.00 C ATOM 1955 O THR A 126 4.850 -5.149 -14.830 1.00 0.00 O ATOM 1956 CB THR A 126 1.848 -5.552 -15.437 1.00 0.00 C ATOM 1957 OG1 THR A 126 1.054 -6.540 -16.080 1.00 0.00 O ATOM 1958 CG2 THR A 126 0.989 -4.325 -15.130 1.00 0.00 C ATOM 0 H THR A 126 3.604 -7.199 -16.441 1.00 0.00 H new ATOM 0 HA THR A 126 2.642 -4.450 -17.111 1.00 0.00 H new ATOM 0 HB THR A 126 2.247 -5.955 -14.506 1.00 0.00 H new ATOM 0 HG1 THR A 126 0.315 -6.800 -15.491 1.00 0.00 H new ATOM 0 HG21 THR A 126 0.167 -4.611 -14.474 1.00 0.00 H new ATOM 0 HG22 THR A 126 1.599 -3.568 -14.638 1.00 0.00 H new ATOM 0 HG23 THR A 126 0.588 -3.920 -16.059 1.00 0.00 H new ATOM 1966 N LYS A 127 4.217 -3.187 -15.610 1.00 0.00 N ATOM 1967 CA LYS A 127 5.270 -2.469 -14.832 1.00 0.00 C ATOM 1968 C LYS A 127 4.612 -1.652 -13.718 1.00 0.00 C ATOM 1969 O LYS A 127 3.405 -1.652 -13.567 1.00 0.00 O ATOM 1970 CB LYS A 127 6.042 -1.532 -15.764 1.00 0.00 C ATOM 1971 CG LYS A 127 6.766 -2.356 -16.831 1.00 0.00 C ATOM 1972 CD LYS A 127 7.441 -1.415 -17.831 1.00 0.00 C ATOM 1973 CE LYS A 127 8.758 -0.904 -17.243 1.00 0.00 C ATOM 1974 NZ LYS A 127 9.523 -0.176 -18.295 1.00 0.00 N ATOM 0 H LYS A 127 3.621 -2.589 -16.182 1.00 0.00 H new ATOM 0 HA LYS A 127 5.957 -3.193 -14.394 1.00 0.00 H new ATOM 0 HB2 LYS A 127 5.358 -0.827 -16.236 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.761 -0.945 -15.193 1.00 0.00 H new ATOM 0 HG2 LYS A 127 7.510 -3.002 -16.364 1.00 0.00 H new ATOM 0 HG3 LYS A 127 6.058 -3.005 -17.347 1.00 0.00 H new ATOM 0 HD2 LYS A 127 7.628 -1.938 -18.769 1.00 0.00 H new ATOM 0 HD3 LYS A 127 6.783 -0.577 -18.059 1.00 0.00 H new ATOM 0 HE2 LYS A 127 8.560 -0.243 -16.399 1.00 0.00 H new ATOM 0 HE3 LYS A 127 9.347 -1.739 -16.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 10.418 0.171 -17.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 9.724 -0.820 -19.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 8.961 0.629 -18.638 1.00 0.00 H new ATOM 1988 N MET A 128 5.400 -0.958 -12.936 1.00 0.00 N ATOM 1989 CA MET A 128 4.832 -0.139 -11.827 1.00 0.00 C ATOM 1990 C MET A 128 4.646 1.305 -12.300 1.00 0.00 C ATOM 1991 O MET A 128 5.432 1.819 -13.073 1.00 0.00 O ATOM 1992 CB MET A 128 5.788 -0.164 -10.632 1.00 0.00 C ATOM 1993 CG MET A 128 4.983 -0.111 -9.333 1.00 0.00 C ATOM 1994 SD MET A 128 4.532 1.604 -8.972 1.00 0.00 S ATOM 1995 CE MET A 128 2.950 1.258 -8.164 1.00 0.00 C ATOM 0 H MET A 128 6.416 -0.925 -13.020 1.00 0.00 H new ATOM 0 HA MET A 128 3.867 -0.551 -11.530 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.396 -1.068 -10.658 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.473 0.683 -10.683 1.00 0.00 H new ATOM 0 HG2 MET A 128 4.085 -0.723 -9.424 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.569 -0.525 -8.512 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.504 2.192 -7.822 1.00 0.00 H new ATOM 0 HE2 MET A 128 2.278 0.774 -8.872 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.114 0.600 -7.311 1.00 0.00 H new ATOM 2005 N ILE A 129 3.609 1.958 -11.840 1.00 0.00 N ATOM 2006 CA ILE A 129 3.363 3.370 -12.255 1.00 0.00 C ATOM 2007 C ILE A 129 4.467 4.273 -11.684 1.00 0.00 C ATOM 2008 O ILE A 129 5.177 3.873 -10.783 1.00 0.00 O ATOM 2009 CB ILE A 129 2.004 3.829 -11.720 1.00 0.00 C ATOM 2010 CG1 ILE A 129 1.946 3.597 -10.208 1.00 0.00 C ATOM 2011 CG2 ILE A 129 0.891 3.030 -12.400 1.00 0.00 C ATOM 2012 CD1 ILE A 129 0.739 4.332 -9.623 1.00 0.00 C ATOM 0 H ILE A 129 2.921 1.572 -11.193 1.00 0.00 H new ATOM 0 HA ILE A 129 3.368 3.434 -13.343 1.00 0.00 H new ATOM 0 HB ILE A 129 1.871 4.890 -11.931 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.873 2.530 -9.996 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.864 3.953 -9.740 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.076 3.357 -12.019 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.931 3.194 -13.477 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.024 1.969 -12.189 1.00 0.00 H new ATOM 0 HD11 ILE A 129 0.699 4.166 -8.546 1.00 0.00 H new ATOM 0 HD12 ILE A 129 0.831 5.400 -9.822 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.175 3.955 -10.083 1.00 0.00 H new ATOM 2024 N PRO A 130 4.587 5.469 -12.224 1.00 0.00 N ATOM 2025 CA PRO A 130 5.597 6.503 -11.818 1.00 0.00 C ATOM 2026 C PRO A 130 5.127 7.223 -10.552 1.00 0.00 C ATOM 2027 O PRO A 130 4.372 8.176 -10.614 1.00 0.00 O ATOM 2028 CB PRO A 130 5.703 7.488 -12.981 1.00 0.00 C ATOM 2029 CG PRO A 130 4.548 7.209 -13.923 1.00 0.00 C ATOM 2030 CD PRO A 130 3.753 6.044 -13.342 1.00 0.00 C ATOM 0 HA PRO A 130 6.564 6.050 -11.601 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.662 8.515 -12.618 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.656 7.370 -13.497 1.00 0.00 H new ATOM 0 HG2 PRO A 130 3.916 8.091 -14.026 1.00 0.00 H new ATOM 0 HG3 PRO A 130 4.916 6.963 -14.919 1.00 0.00 H new ATOM 0 HD2 PRO A 130 2.786 6.382 -12.970 1.00 0.00 H new ATOM 0 HD3 PRO A 130 3.555 5.291 -14.105 1.00 0.00 H new ATOM 2038 N LEU A 131 5.569 6.773 -9.404 1.00 0.00 N ATOM 2039 CA LEU A 131 5.153 7.424 -8.127 1.00 0.00 C ATOM 2040 C LEU A 131 5.950 8.715 -7.932 1.00 0.00 C ATOM 2041 O LEU A 131 7.096 8.813 -8.331 1.00 0.00 O ATOM 2042 CB LEU A 131 5.426 6.475 -6.959 1.00 0.00 C ATOM 2043 CG LEU A 131 4.620 5.188 -7.146 1.00 0.00 C ATOM 2044 CD1 LEU A 131 5.143 4.113 -6.192 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.145 5.464 -6.841 1.00 0.00 C ATOM 0 H LEU A 131 6.202 5.980 -9.298 1.00 0.00 H new ATOM 0 HA LEU A 131 4.089 7.655 -8.166 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.490 6.245 -6.905 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.155 6.953 -6.018 1.00 0.00 H new ATOM 0 HG LEU A 131 4.723 4.841 -8.174 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.568 3.197 -6.326 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.194 3.917 -6.406 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.040 4.458 -5.163 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.569 4.548 -6.974 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.045 5.810 -5.812 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.770 6.230 -7.520 1.00 0.00 H new ATOM 2057 N ASN A 132 5.351 9.705 -7.320 1.00 0.00 N ATOM 2058 CA ASN A 132 6.066 10.995 -7.093 1.00 0.00 C ATOM 2059 C ASN A 132 6.996 10.858 -5.886 1.00 0.00 C ATOM 2060 O ASN A 132 6.627 11.172 -4.769 1.00 0.00 O ATOM 2061 CB ASN A 132 5.046 12.104 -6.826 1.00 0.00 C ATOM 2062 CG ASN A 132 5.697 13.467 -7.068 1.00 0.00 C ATOM 2063 OD1 ASN A 132 5.473 14.087 -8.088 1.00 0.00 O ATOM 2064 ND2 ASN A 132 6.500 13.962 -6.166 1.00 0.00 N ATOM 0 H ASN A 132 4.394 9.674 -6.967 1.00 0.00 H new ATOM 0 HA ASN A 132 6.652 11.245 -7.977 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.181 11.982 -7.478 1.00 0.00 H new ATOM 0 HB3 ASN A 132 4.683 12.040 -5.800 1.00 0.00 H new ATOM 0 HD21 ASN A 132 6.940 14.870 -6.318 1.00 0.00 H new ATOM 0 HD22 ASN A 132 6.688 13.441 -5.309 1.00 0.00 H new ATOM 2071 N TRP A 133 8.199 10.390 -6.104 1.00 0.00 N ATOM 2072 CA TRP A 133 9.162 10.228 -4.974 1.00 0.00 C ATOM 2073 C TRP A 133 9.688 11.598 -4.535 1.00 0.00 C ATOM 2074 O TRP A 133 10.317 11.726 -3.501 1.00 0.00 O ATOM 2075 CB TRP A 133 10.333 9.354 -5.428 1.00 0.00 C ATOM 2076 CG TRP A 133 9.828 7.997 -5.794 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.566 7.580 -7.054 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.520 6.873 -4.919 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.115 6.272 -7.008 1.00 0.00 N ATOM 2080 CE2 TRP A 133 9.070 5.792 -5.715 1.00 0.00 C ATOM 2081 CE3 TRP A 133 9.586 6.688 -3.527 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.699 4.572 -5.148 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 9.213 5.462 -2.953 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.771 4.406 -3.763 1.00 0.00 C ATOM 0 H TRP A 133 8.556 10.113 -7.018 1.00 0.00 H new ATOM 0 HA TRP A 133 8.654 9.755 -4.134 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.832 9.811 -6.283 1.00 0.00 H new ATOM 0 HB3 TRP A 133 11.073 9.276 -4.631 1.00 0.00 H new ATOM 0 HD1 TRP A 133 9.689 8.171 -7.950 1.00 0.00 H new ATOM 0 HE1 TRP A 133 8.849 5.729 -7.830 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.926 7.495 -2.895 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.359 3.762 -5.776 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 9.267 5.332 -1.882 1.00 0.00 H new ATOM 0 HH2 TRP A 133 8.486 3.465 -3.316 1.00 0.00 H new ATOM 2095 N ASP A 134 9.437 12.624 -5.312 1.00 0.00 N ATOM 2096 CA ASP A 134 9.921 13.988 -4.943 1.00 0.00 C ATOM 2097 C ASP A 134 9.073 14.551 -3.794 1.00 0.00 C ATOM 2098 O ASP A 134 9.174 15.715 -3.456 1.00 0.00 O ATOM 2099 CB ASP A 134 9.808 14.913 -6.158 1.00 0.00 C ATOM 2100 CG ASP A 134 11.136 14.923 -6.916 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.136 15.284 -6.316 1.00 0.00 O ATOM 2102 OD2 ASP A 134 11.132 14.573 -8.084 1.00 0.00 O ATOM 0 H ASP A 134 8.916 12.574 -6.188 1.00 0.00 H new ATOM 0 HA ASP A 134 10.961 13.925 -4.623 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.006 14.574 -6.813 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.552 15.923 -5.837 1.00 0.00 H new ATOM 2107 N ASP A 135 8.243 13.734 -3.194 1.00 0.00 N ATOM 2108 CA ASP A 135 7.390 14.216 -2.069 1.00 0.00 C ATOM 2109 C ASP A 135 7.352 13.154 -0.968 1.00 0.00 C ATOM 2110 O ASP A 135 6.374 13.022 -0.256 1.00 0.00 O ATOM 2111 CB ASP A 135 5.971 14.475 -2.577 1.00 0.00 C ATOM 2112 CG ASP A 135 5.907 15.855 -3.236 1.00 0.00 C ATOM 2113 OD1 ASP A 135 6.169 15.935 -4.425 1.00 0.00 O ATOM 2114 OD2 ASP A 135 5.599 16.808 -2.540 1.00 0.00 O ATOM 0 H ASP A 135 8.121 12.751 -3.437 1.00 0.00 H new ATOM 0 HA ASP A 135 7.806 15.141 -1.669 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.684 13.705 -3.293 1.00 0.00 H new ATOM 0 HB3 ASP A 135 5.262 14.422 -1.750 1.00 0.00 H new ATOM 2119 N PHE A 136 8.411 12.397 -0.826 1.00 0.00 N ATOM 2120 CA PHE A 136 8.447 11.340 0.225 1.00 0.00 C ATOM 2121 C PHE A 136 9.857 11.252 0.813 1.00 0.00 C ATOM 2122 O PHE A 136 10.761 11.942 0.379 1.00 0.00 O ATOM 2123 CB PHE A 136 8.070 9.992 -0.394 1.00 0.00 C ATOM 2124 CG PHE A 136 6.582 9.958 -0.654 1.00 0.00 C ATOM 2125 CD1 PHE A 136 5.686 9.865 0.417 1.00 0.00 C ATOM 2126 CD2 PHE A 136 6.100 10.016 -1.967 1.00 0.00 C ATOM 2127 CE1 PHE A 136 4.308 9.832 0.177 1.00 0.00 C ATOM 2128 CE2 PHE A 136 4.720 9.983 -2.208 1.00 0.00 C ATOM 2129 CZ PHE A 136 3.825 9.891 -1.136 1.00 0.00 C ATOM 0 H PHE A 136 9.254 12.468 -1.396 1.00 0.00 H new ATOM 0 HA PHE A 136 7.738 11.590 1.015 1.00 0.00 H new ATOM 0 HB2 PHE A 136 8.617 9.841 -1.325 1.00 0.00 H new ATOM 0 HB3 PHE A 136 8.352 9.180 0.276 1.00 0.00 H new ATOM 0 HD1 PHE A 136 6.059 9.819 1.430 1.00 0.00 H new ATOM 0 HD2 PHE A 136 6.791 10.086 -2.794 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.617 9.761 1.004 1.00 0.00 H new ATOM 0 HE2 PHE A 136 4.347 10.029 -3.221 1.00 0.00 H new ATOM 0 HZ PHE A 136 2.761 9.865 -1.322 1.00 0.00 H new ATOM 2139 N THR A 137 10.048 10.411 1.796 1.00 0.00 N ATOM 2140 CA THR A 137 11.396 10.272 2.420 1.00 0.00 C ATOM 2141 C THR A 137 11.510 8.900 3.087 1.00 0.00 C ATOM 2142 O THR A 137 10.574 8.420 3.700 1.00 0.00 O ATOM 2143 CB THR A 137 11.588 11.368 3.470 1.00 0.00 C ATOM 2144 OG1 THR A 137 11.089 12.599 2.964 1.00 0.00 O ATOM 2145 CG2 THR A 137 13.076 11.513 3.793 1.00 0.00 C ATOM 0 H THR A 137 9.325 9.812 2.195 1.00 0.00 H new ATOM 0 HA THR A 137 12.163 10.367 1.652 1.00 0.00 H new ATOM 0 HB THR A 137 11.046 11.101 4.377 1.00 0.00 H new ATOM 0 HG1 THR A 137 10.318 12.884 3.498 1.00 0.00 H new ATOM 0 HG21 THR A 137 13.211 12.294 4.541 1.00 0.00 H new ATOM 0 HG22 THR A 137 13.458 10.569 4.181 1.00 0.00 H new ATOM 0 HG23 THR A 137 13.621 11.780 2.887 1.00 0.00 H new ATOM 2153 N LYS A 138 12.651 8.268 2.973 1.00 0.00 N ATOM 2154 CA LYS A 138 12.836 6.925 3.598 1.00 0.00 C ATOM 2155 C LYS A 138 13.174 7.094 5.080 1.00 0.00 C ATOM 2156 O LYS A 138 14.154 7.721 5.434 1.00 0.00 O ATOM 2157 CB LYS A 138 13.978 6.189 2.895 1.00 0.00 C ATOM 2158 CG LYS A 138 13.799 4.680 3.071 1.00 0.00 C ATOM 2159 CD LYS A 138 15.021 3.952 2.509 1.00 0.00 C ATOM 2160 CE LYS A 138 14.950 3.937 0.982 1.00 0.00 C ATOM 2161 NZ LYS A 138 16.084 3.136 0.440 1.00 0.00 N ATOM 0 H LYS A 138 13.464 8.626 2.472 1.00 0.00 H new ATOM 0 HA LYS A 138 11.916 6.348 3.499 1.00 0.00 H new ATOM 0 HB2 LYS A 138 13.990 6.443 1.835 1.00 0.00 H new ATOM 0 HB3 LYS A 138 14.936 6.503 3.309 1.00 0.00 H new ATOM 0 HG2 LYS A 138 13.672 4.439 4.126 1.00 0.00 H new ATOM 0 HG3 LYS A 138 12.897 4.348 2.558 1.00 0.00 H new ATOM 0 HD2 LYS A 138 15.935 4.448 2.836 1.00 0.00 H new ATOM 0 HD3 LYS A 138 15.057 2.932 2.892 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.001 3.511 0.656 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.992 4.955 0.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 15.831 2.768 -0.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 16.928 3.739 0.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 16.286 2.342 1.081 1.00 0.00 H new ATOM 2175 N VAL A 139 12.366 6.538 5.948 1.00 0.00 N ATOM 2176 CA VAL A 139 12.631 6.661 7.412 1.00 0.00 C ATOM 2177 C VAL A 139 13.403 5.431 7.897 1.00 0.00 C ATOM 2178 O VAL A 139 14.246 5.522 8.768 1.00 0.00 O ATOM 2179 CB VAL A 139 11.303 6.761 8.165 1.00 0.00 C ATOM 2180 CG1 VAL A 139 10.602 8.069 7.793 1.00 0.00 C ATOM 2181 CG2 VAL A 139 10.410 5.578 7.783 1.00 0.00 C ATOM 0 H VAL A 139 11.533 6.003 5.704 1.00 0.00 H new ATOM 0 HA VAL A 139 13.222 7.557 7.600 1.00 0.00 H new ATOM 0 HB VAL A 139 11.492 6.743 9.238 1.00 0.00 H new ATOM 0 HG11 VAL A 139 9.656 8.140 8.330 1.00 0.00 H new ATOM 0 HG12 VAL A 139 11.237 8.912 8.064 1.00 0.00 H new ATOM 0 HG13 VAL A 139 10.413 8.088 6.720 1.00 0.00 H new ATOM 0 HG21 VAL A 139 9.464 5.649 8.319 1.00 0.00 H new ATOM 0 HG22 VAL A 139 10.221 5.596 6.710 1.00 0.00 H new ATOM 0 HG23 VAL A 139 10.908 4.645 8.048 1.00 0.00 H new ATOM 2191 N SER A 140 13.117 4.283 7.335 1.00 0.00 N ATOM 2192 CA SER A 140 13.828 3.041 7.757 1.00 0.00 C ATOM 2193 C SER A 140 13.943 2.089 6.565 1.00 0.00 C ATOM 2194 O SER A 140 13.344 2.306 5.528 1.00 0.00 O ATOM 2195 CB SER A 140 13.043 2.360 8.878 1.00 0.00 C ATOM 2196 OG SER A 140 11.667 2.313 8.527 1.00 0.00 O ATOM 0 H SER A 140 12.420 4.154 6.601 1.00 0.00 H new ATOM 0 HA SER A 140 14.825 3.297 8.115 1.00 0.00 H new ATOM 0 HB2 SER A 140 13.423 1.352 9.043 1.00 0.00 H new ATOM 0 HB3 SER A 140 13.173 2.906 9.812 1.00 0.00 H new ATOM 0 HG SER A 140 11.161 1.875 9.243 1.00 0.00 H new ATOM 2202 N SER A 141 14.709 1.037 6.707 1.00 0.00 N ATOM 2203 CA SER A 141 14.871 0.064 5.586 1.00 0.00 C ATOM 2204 C SER A 141 15.314 -1.289 6.146 1.00 0.00 C ATOM 2205 O SER A 141 16.403 -1.427 6.669 1.00 0.00 O ATOM 2206 CB SER A 141 15.927 0.581 4.609 1.00 0.00 C ATOM 2207 OG SER A 141 17.191 0.612 5.258 1.00 0.00 O ATOM 0 H SER A 141 15.230 0.810 7.554 1.00 0.00 H new ATOM 0 HA SER A 141 13.920 -0.051 5.065 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.972 -0.062 3.730 1.00 0.00 H new ATOM 0 HB3 SER A 141 15.659 1.579 4.261 1.00 0.00 H new ATOM 0 HG SER A 141 17.127 0.151 6.120 1.00 0.00 H new ATOM 2213 N ARG A 142 14.473 -2.289 6.039 1.00 0.00 N ATOM 2214 CA ARG A 142 14.835 -3.638 6.562 1.00 0.00 C ATOM 2215 C ARG A 142 15.454 -4.472 5.437 1.00 0.00 C ATOM 2216 O ARG A 142 14.761 -4.961 4.565 1.00 0.00 O ATOM 2217 CB ARG A 142 13.579 -4.338 7.082 1.00 0.00 C ATOM 2218 CG ARG A 142 13.981 -5.493 8.002 1.00 0.00 C ATOM 2219 CD ARG A 142 14.345 -4.943 9.383 1.00 0.00 C ATOM 2220 NE ARG A 142 15.178 -5.946 10.115 1.00 0.00 N ATOM 2221 CZ ARG A 142 15.977 -5.578 11.094 1.00 0.00 C ATOM 2222 NH1 ARG A 142 16.065 -4.322 11.456 1.00 0.00 N ATOM 2223 NH2 ARG A 142 16.691 -6.478 11.714 1.00 0.00 N ATOM 0 H ARG A 142 13.550 -2.226 5.610 1.00 0.00 H new ATOM 0 HA ARG A 142 15.554 -3.531 7.374 1.00 0.00 H new ATOM 0 HB2 ARG A 142 12.953 -3.629 7.623 1.00 0.00 H new ATOM 0 HB3 ARG A 142 12.987 -4.713 6.247 1.00 0.00 H new ATOM 0 HG2 ARG A 142 13.161 -6.206 8.087 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.829 -6.031 7.578 1.00 0.00 H new ATOM 0 HD2 ARG A 142 14.892 -4.006 9.280 1.00 0.00 H new ATOM 0 HD3 ARG A 142 13.440 -4.724 9.949 1.00 0.00 H new ATOM 0 HE ARG A 142 15.126 -6.930 9.852 1.00 0.00 H new ATOM 0 HH11 ARG A 142 15.510 -3.613 10.977 1.00 0.00 H new ATOM 0 HH12 ARG A 142 16.689 -4.053 12.217 1.00 0.00 H new ATOM 0 HH21 ARG A 142 16.627 -7.458 11.439 1.00 0.00 H new ATOM 0 HH22 ARG A 142 17.313 -6.201 12.474 1.00 0.00 H new ATOM 2237 N THR A 143 16.752 -4.634 5.453 1.00 0.00 N ATOM 2238 CA THR A 143 17.426 -5.435 4.390 1.00 0.00 C ATOM 2239 C THR A 143 17.410 -6.915 4.778 1.00 0.00 C ATOM 2240 O THR A 143 17.478 -7.259 5.943 1.00 0.00 O ATOM 2241 CB THR A 143 18.874 -4.963 4.235 1.00 0.00 C ATOM 2242 OG1 THR A 143 18.915 -3.543 4.283 1.00 0.00 O ATOM 2243 CG2 THR A 143 19.431 -5.447 2.895 1.00 0.00 C ATOM 0 H THR A 143 17.376 -4.244 6.160 1.00 0.00 H new ATOM 0 HA THR A 143 16.898 -5.302 3.446 1.00 0.00 H new ATOM 0 HB THR A 143 19.478 -5.372 5.045 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.842 -3.239 4.186 1.00 0.00 H new ATOM 0 HG21 THR A 143 20.462 -5.110 2.786 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.400 -6.536 2.860 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.829 -5.040 2.082 1.00 0.00 H new ATOM 2251 N VAL A 144 17.322 -7.790 3.809 1.00 0.00 N ATOM 2252 CA VAL A 144 17.302 -9.251 4.111 1.00 0.00 C ATOM 2253 C VAL A 144 17.889 -10.024 2.924 1.00 0.00 C ATOM 2254 O VAL A 144 17.533 -9.788 1.783 1.00 0.00 O ATOM 2255 CB VAL A 144 15.853 -9.693 4.375 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.989 -9.421 3.140 1.00 0.00 C ATOM 2257 CG2 VAL A 144 15.818 -11.190 4.703 1.00 0.00 C ATOM 0 H VAL A 144 17.263 -7.553 2.819 1.00 0.00 H new ATOM 0 HA VAL A 144 17.903 -9.457 4.997 1.00 0.00 H new ATOM 0 HB VAL A 144 15.460 -9.127 5.220 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.964 -9.737 3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 144 15.003 -8.355 2.914 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.384 -9.977 2.290 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.789 -11.498 4.889 1.00 0.00 H new ATOM 0 HG22 VAL A 144 16.220 -11.756 3.863 1.00 0.00 H new ATOM 0 HG23 VAL A 144 16.420 -11.382 5.591 1.00 0.00 H new ATOM 2267 N GLU A 145 18.784 -10.942 3.188 1.00 0.00 N ATOM 2268 CA GLU A 145 19.400 -11.734 2.083 1.00 0.00 C ATOM 2269 C GLU A 145 18.853 -13.163 2.113 1.00 0.00 C ATOM 2270 O GLU A 145 18.863 -13.818 3.138 1.00 0.00 O ATOM 2271 CB GLU A 145 20.920 -11.766 2.266 1.00 0.00 C ATOM 2272 CG GLU A 145 21.256 -12.272 3.671 1.00 0.00 C ATOM 2273 CD GLU A 145 22.754 -12.104 3.929 1.00 0.00 C ATOM 2274 OE1 GLU A 145 23.525 -12.358 3.018 1.00 0.00 O ATOM 2275 OE2 GLU A 145 23.106 -11.726 5.034 1.00 0.00 O ATOM 0 H GLU A 145 19.115 -11.177 4.124 1.00 0.00 H new ATOM 0 HA GLU A 145 19.158 -11.272 1.126 1.00 0.00 H new ATOM 0 HB2 GLU A 145 21.373 -12.415 1.517 1.00 0.00 H new ATOM 0 HB3 GLU A 145 21.336 -10.769 2.118 1.00 0.00 H new ATOM 0 HG2 GLU A 145 20.684 -11.718 4.415 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.975 -13.321 3.768 1.00 0.00 H new ATOM 2282 N ASP A 146 18.377 -13.647 0.994 1.00 0.00 N ATOM 2283 CA ASP A 146 17.826 -15.033 0.945 1.00 0.00 C ATOM 2284 C ASP A 146 18.965 -16.025 0.695 1.00 0.00 C ATOM 2285 O ASP A 146 20.129 -15.689 0.817 1.00 0.00 O ATOM 2286 CB ASP A 146 16.800 -15.135 -0.186 1.00 0.00 C ATOM 2287 CG ASP A 146 15.846 -16.298 0.093 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.209 -16.280 1.132 1.00 0.00 O ATOM 2289 OD2 ASP A 146 15.770 -17.187 -0.739 1.00 0.00 O ATOM 0 H ASP A 146 18.347 -13.139 0.110 1.00 0.00 H new ATOM 0 HA ASP A 146 17.343 -15.267 1.894 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.240 -14.203 -0.268 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.307 -15.287 -1.139 1.00 0.00 H new ATOM 2294 N THR A 147 18.636 -17.243 0.346 1.00 0.00 N ATOM 2295 CA THR A 147 19.692 -18.265 0.086 1.00 0.00 C ATOM 2296 C THR A 147 20.437 -17.919 -1.204 1.00 0.00 C ATOM 2297 O THR A 147 21.640 -18.074 -1.296 1.00 0.00 O ATOM 2298 CB THR A 147 19.044 -19.645 -0.054 1.00 0.00 C ATOM 2299 OG1 THR A 147 17.841 -19.526 -0.802 1.00 0.00 O ATOM 2300 CG2 THR A 147 18.731 -20.207 1.334 1.00 0.00 C ATOM 0 H THR A 147 17.678 -17.573 0.230 1.00 0.00 H new ATOM 0 HA THR A 147 20.396 -18.276 0.918 1.00 0.00 H new ATOM 0 HB THR A 147 19.728 -20.319 -0.569 1.00 0.00 H new ATOM 0 HG1 THR A 147 17.425 -20.408 -0.895 1.00 0.00 H new ATOM 0 HG21 THR A 147 18.270 -21.189 1.233 1.00 0.00 H new ATOM 0 HG22 THR A 147 19.654 -20.297 1.907 1.00 0.00 H new ATOM 0 HG23 THR A 147 18.046 -19.536 1.852 1.00 0.00 H new ATOM 2308 N ASN A 148 19.729 -17.450 -2.202 1.00 0.00 N ATOM 2309 CA ASN A 148 20.390 -17.093 -3.491 1.00 0.00 C ATOM 2310 C ASN A 148 20.482 -15.561 -3.612 1.00 0.00 C ATOM 2311 O ASN A 148 19.535 -14.870 -3.289 1.00 0.00 O ATOM 2312 CB ASN A 148 19.563 -17.646 -4.655 1.00 0.00 C ATOM 2313 CG ASN A 148 20.420 -17.682 -5.921 1.00 0.00 C ATOM 2314 OD1 ASN A 148 20.623 -16.668 -6.560 1.00 0.00 O ATOM 2315 ND2 ASN A 148 20.936 -18.814 -6.314 1.00 0.00 N ATOM 0 H ASN A 148 18.720 -17.300 -2.177 1.00 0.00 H new ATOM 0 HA ASN A 148 21.392 -17.521 -3.518 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.206 -18.648 -4.417 1.00 0.00 H new ATOM 0 HB3 ASN A 148 18.683 -17.024 -4.817 1.00 0.00 H new ATOM 0 HD21 ASN A 148 21.509 -18.848 -7.157 1.00 0.00 H new ATOM 0 HD22 ASN A 148 20.766 -19.665 -5.778 1.00 0.00 H new ATOM 2322 N PRO A 149 21.614 -15.062 -4.074 1.00 0.00 N ATOM 2323 CA PRO A 149 21.892 -13.593 -4.263 1.00 0.00 C ATOM 2324 C PRO A 149 20.730 -12.930 -5.012 1.00 0.00 C ATOM 2325 O PRO A 149 20.289 -11.853 -4.660 1.00 0.00 O ATOM 2326 CB PRO A 149 23.179 -13.478 -5.081 1.00 0.00 C ATOM 2327 CG PRO A 149 23.739 -14.872 -5.260 1.00 0.00 C ATOM 2328 CD PRO A 149 22.840 -15.835 -4.496 1.00 0.00 C ATOM 0 HA PRO A 149 22.000 -13.092 -3.301 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.977 -13.020 -6.049 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.900 -12.839 -4.571 1.00 0.00 H new ATOM 0 HG2 PRO A 149 23.773 -15.138 -6.317 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.761 -14.924 -4.885 1.00 0.00 H new ATOM 0 HD2 PRO A 149 22.563 -16.683 -5.123 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.359 -16.238 -3.626 1.00 0.00 H new ATOM 2336 N ALA A 150 20.238 -13.568 -6.043 1.00 0.00 N ATOM 2337 CA ALA A 150 19.109 -12.984 -6.825 1.00 0.00 C ATOM 2338 C ALA A 150 17.862 -12.901 -5.940 1.00 0.00 C ATOM 2339 O ALA A 150 17.019 -12.043 -6.123 1.00 0.00 O ATOM 2340 CB ALA A 150 18.815 -13.870 -8.036 1.00 0.00 C ATOM 0 H ALA A 150 20.572 -14.472 -6.377 1.00 0.00 H new ATOM 0 HA ALA A 150 19.382 -11.984 -7.163 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.990 -13.444 -8.607 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.702 -13.929 -8.667 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.543 -14.870 -7.698 1.00 0.00 H new ATOM 2346 N LEU A 151 17.742 -13.788 -4.986 1.00 0.00 N ATOM 2347 CA LEU A 151 16.551 -13.771 -4.086 1.00 0.00 C ATOM 2348 C LEU A 151 16.744 -12.712 -2.996 1.00 0.00 C ATOM 2349 O LEU A 151 16.119 -12.765 -1.954 1.00 0.00 O ATOM 2350 CB LEU A 151 16.383 -15.146 -3.437 1.00 0.00 C ATOM 2351 CG LEU A 151 15.736 -16.107 -4.437 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.824 -17.537 -3.901 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.266 -15.727 -4.630 1.00 0.00 C ATOM 0 H LEU A 151 18.420 -14.525 -4.791 1.00 0.00 H new ATOM 0 HA LEU A 151 15.661 -13.532 -4.669 1.00 0.00 H new ATOM 0 HB2 LEU A 151 17.352 -15.532 -3.121 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.765 -15.065 -2.543 1.00 0.00 H new ATOM 0 HG LEU A 151 16.258 -16.043 -5.392 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.363 -18.222 -4.613 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.870 -17.809 -3.761 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.301 -17.601 -2.947 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.804 -16.411 -5.342 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.745 -15.791 -3.675 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.201 -14.708 -5.011 1.00 0.00 H new ATOM 2365 N THR A 152 17.604 -11.753 -3.231 1.00 0.00 N ATOM 2366 CA THR A 152 17.840 -10.687 -2.212 1.00 0.00 C ATOM 2367 C THR A 152 16.855 -9.538 -2.441 1.00 0.00 C ATOM 2368 O THR A 152 16.547 -9.188 -3.564 1.00 0.00 O ATOM 2369 CB THR A 152 19.275 -10.166 -2.342 1.00 0.00 C ATOM 2370 OG1 THR A 152 20.182 -11.255 -2.246 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.563 -9.163 -1.224 1.00 0.00 C ATOM 0 H THR A 152 18.153 -11.663 -4.086 1.00 0.00 H new ATOM 0 HA THR A 152 17.693 -11.098 -1.213 1.00 0.00 H new ATOM 0 HB THR A 152 19.395 -9.674 -3.307 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.612 -11.400 -3.115 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.584 -8.795 -1.320 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.867 -8.327 -1.297 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.443 -9.651 -0.257 1.00 0.00 H new ATOM 2379 N HIS A 153 16.360 -8.951 -1.380 1.00 0.00 N ATOM 2380 CA HIS A 153 15.392 -7.824 -1.524 1.00 0.00 C ATOM 2381 C HIS A 153 15.469 -6.923 -0.290 1.00 0.00 C ATOM 2382 O HIS A 153 16.070 -7.274 0.708 1.00 0.00 O ATOM 2383 CB HIS A 153 13.972 -8.381 -1.665 1.00 0.00 C ATOM 2384 CG HIS A 153 13.675 -9.310 -0.519 1.00 0.00 C ATOM 2385 ND1 HIS A 153 14.236 -10.575 -0.430 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.880 -9.173 0.592 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.774 -11.144 0.699 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.944 -10.333 1.359 1.00 0.00 N ATOM 0 H HIS A 153 16.586 -9.205 -0.418 1.00 0.00 H new ATOM 0 HA HIS A 153 15.642 -7.244 -2.412 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.250 -7.564 -1.680 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.872 -8.912 -2.612 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.881 -10.997 -1.098 1.00 0.00 H new ATOM 0 HD2 HIS A 153 12.294 -8.299 0.834 1.00 0.00 H new ATOM 0 HE1 HIS A 153 14.042 -12.136 1.031 1.00 0.00 H new ATOM 2396 N THR A 154 14.863 -5.764 -0.353 1.00 0.00 N ATOM 2397 CA THR A 154 14.895 -4.832 0.812 1.00 0.00 C ATOM 2398 C THR A 154 13.537 -4.141 0.948 1.00 0.00 C ATOM 2399 O THR A 154 13.019 -3.579 0.001 1.00 0.00 O ATOM 2400 CB THR A 154 15.983 -3.778 0.594 1.00 0.00 C ATOM 2401 OG1 THR A 154 17.200 -4.421 0.243 1.00 0.00 O ATOM 2402 CG2 THR A 154 16.181 -2.973 1.879 1.00 0.00 C ATOM 0 H THR A 154 14.346 -5.424 -1.164 1.00 0.00 H new ATOM 0 HA THR A 154 15.111 -5.394 1.721 1.00 0.00 H new ATOM 0 HB THR A 154 15.682 -3.106 -0.210 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.897 -3.747 0.102 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.956 -2.223 1.723 1.00 0.00 H new ATOM 0 HG22 THR A 154 15.247 -2.479 2.147 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.481 -3.642 2.685 1.00 0.00 H new ATOM 2410 N TYR A 155 12.957 -4.180 2.121 1.00 0.00 N ATOM 2411 CA TYR A 155 11.631 -3.528 2.332 1.00 0.00 C ATOM 2412 C TYR A 155 11.836 -2.043 2.639 1.00 0.00 C ATOM 2413 O TYR A 155 12.078 -1.664 3.770 1.00 0.00 O ATOM 2414 CB TYR A 155 10.915 -4.198 3.506 1.00 0.00 C ATOM 2415 CG TYR A 155 10.673 -5.653 3.185 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.718 -6.010 2.225 1.00 0.00 C ATOM 2417 CD2 TYR A 155 11.404 -6.647 3.846 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.494 -7.359 1.927 1.00 0.00 C ATOM 2419 CE2 TYR A 155 11.181 -7.996 3.549 1.00 0.00 C ATOM 2420 CZ TYR A 155 10.225 -8.352 2.589 1.00 0.00 C ATOM 2421 OH TYR A 155 10.005 -9.683 2.296 1.00 0.00 O ATOM 0 H TYR A 155 13.348 -4.638 2.945 1.00 0.00 H new ATOM 0 HA TYR A 155 11.027 -3.632 1.431 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.516 -4.110 4.411 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.968 -3.696 3.702 1.00 0.00 H new ATOM 0 HD1 TYR A 155 9.154 -5.244 1.714 1.00 0.00 H new ATOM 0 HD2 TYR A 155 12.141 -6.372 4.586 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.757 -7.634 1.186 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.746 -8.762 4.060 1.00 0.00 H new ATOM 0 HH TYR A 155 10.847 -10.100 2.017 1.00 0.00 H new ATOM 2431 N GLU A 156 11.739 -1.203 1.640 1.00 0.00 N ATOM 2432 CA GLU A 156 11.926 0.260 1.864 1.00 0.00 C ATOM 2433 C GLU A 156 10.630 0.862 2.410 1.00 0.00 C ATOM 2434 O GLU A 156 9.561 0.645 1.872 1.00 0.00 O ATOM 2435 CB GLU A 156 12.285 0.938 0.539 1.00 0.00 C ATOM 2436 CG GLU A 156 13.769 0.717 0.238 1.00 0.00 C ATOM 2437 CD GLU A 156 14.056 1.094 -1.216 1.00 0.00 C ATOM 2438 OE1 GLU A 156 13.862 0.250 -2.075 1.00 0.00 O ATOM 2439 OE2 GLU A 156 14.466 2.220 -1.445 1.00 0.00 O ATOM 0 H GLU A 156 11.538 -1.470 0.676 1.00 0.00 H new ATOM 0 HA GLU A 156 12.731 0.417 2.582 1.00 0.00 H new ATOM 0 HB2 GLU A 156 11.675 0.531 -0.267 1.00 0.00 H new ATOM 0 HB3 GLU A 156 12.069 2.005 0.594 1.00 0.00 H new ATOM 0 HG2 GLU A 156 14.381 1.320 0.909 1.00 0.00 H new ATOM 0 HG3 GLU A 156 14.035 -0.325 0.414 1.00 0.00 H new ATOM 2446 N VAL A 157 10.720 1.616 3.476 1.00 0.00 N ATOM 2447 CA VAL A 157 9.498 2.238 4.066 1.00 0.00 C ATOM 2448 C VAL A 157 9.619 3.761 4.003 1.00 0.00 C ATOM 2449 O VAL A 157 10.364 4.364 4.753 1.00 0.00 O ATOM 2450 CB VAL A 157 9.354 1.797 5.524 1.00 0.00 C ATOM 2451 CG1 VAL A 157 8.025 2.306 6.083 1.00 0.00 C ATOM 2452 CG2 VAL A 157 9.385 0.269 5.601 1.00 0.00 C ATOM 0 H VAL A 157 11.590 1.828 3.964 1.00 0.00 H new ATOM 0 HA VAL A 157 8.621 1.920 3.502 1.00 0.00 H new ATOM 0 HB VAL A 157 10.177 2.208 6.109 1.00 0.00 H new ATOM 0 HG11 VAL A 157 7.923 1.992 7.122 1.00 0.00 H new ATOM 0 HG12 VAL A 157 8.001 3.394 6.029 1.00 0.00 H new ATOM 0 HG13 VAL A 157 7.203 1.895 5.497 1.00 0.00 H new ATOM 0 HG21 VAL A 157 9.282 -0.045 6.640 1.00 0.00 H new ATOM 0 HG22 VAL A 157 8.563 -0.142 5.015 1.00 0.00 H new ATOM 0 HG23 VAL A 157 10.332 -0.096 5.203 1.00 0.00 H new ATOM 2462 N TRP A 158 8.891 4.386 3.112 1.00 0.00 N ATOM 2463 CA TRP A 158 8.956 5.871 2.993 1.00 0.00 C ATOM 2464 C TRP A 158 7.751 6.493 3.702 1.00 0.00 C ATOM 2465 O TRP A 158 6.802 5.811 4.043 1.00 0.00 O ATOM 2466 CB TRP A 158 8.937 6.266 1.515 1.00 0.00 C ATOM 2467 CG TRP A 158 10.172 5.754 0.846 1.00 0.00 C ATOM 2468 CD1 TRP A 158 10.502 4.449 0.718 1.00 0.00 C ATOM 2469 CD2 TRP A 158 11.243 6.512 0.213 1.00 0.00 C ATOM 2470 NE1 TRP A 158 11.709 4.357 0.048 1.00 0.00 N ATOM 2471 CE2 TRP A 158 12.205 5.601 -0.286 1.00 0.00 C ATOM 2472 CE3 TRP A 158 11.472 7.887 0.023 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 13.354 6.038 -0.947 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 12.627 8.331 -0.643 1.00 0.00 C ATOM 2475 CH2 TRP A 158 13.565 7.408 -1.127 1.00 0.00 C ATOM 0 H TRP A 158 8.253 3.928 2.461 1.00 0.00 H new ATOM 0 HA TRP A 158 9.875 6.232 3.454 1.00 0.00 H new ATOM 0 HB2 TRP A 158 8.051 5.856 1.030 1.00 0.00 H new ATOM 0 HB3 TRP A 158 8.881 7.350 1.418 1.00 0.00 H new ATOM 0 HD1 TRP A 158 9.919 3.615 1.080 1.00 0.00 H new ATOM 0 HE1 TRP A 158 12.175 3.477 -0.172 1.00 0.00 H new ATOM 0 HE3 TRP A 158 10.755 8.606 0.391 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 14.074 5.323 -1.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 12.793 9.389 -0.783 1.00 0.00 H new ATOM 0 HH2 TRP A 158 14.450 7.756 -1.639 1.00 0.00 H new ATOM 2486 N GLN A 159 7.784 7.782 3.925 1.00 0.00 N ATOM 2487 CA GLN A 159 6.644 8.458 4.612 1.00 0.00 C ATOM 2488 C GLN A 159 6.417 9.836 3.987 1.00 0.00 C ATOM 2489 O GLN A 159 7.346 10.488 3.550 1.00 0.00 O ATOM 2490 CB GLN A 159 6.968 8.619 6.099 1.00 0.00 C ATOM 2491 CG GLN A 159 6.683 7.305 6.830 1.00 0.00 C ATOM 2492 CD GLN A 159 5.180 7.179 7.085 1.00 0.00 C ATOM 2493 OE1 GLN A 159 4.401 7.074 6.158 1.00 0.00 O ATOM 2494 NE2 GLN A 159 4.736 7.186 8.312 1.00 0.00 N ATOM 0 H GLN A 159 8.554 8.396 3.660 1.00 0.00 H new ATOM 0 HA GLN A 159 5.743 7.855 4.500 1.00 0.00 H new ATOM 0 HB2 GLN A 159 8.014 8.898 6.226 1.00 0.00 H new ATOM 0 HB3 GLN A 159 6.369 9.423 6.527 1.00 0.00 H new ATOM 0 HG2 GLN A 159 7.034 6.462 6.235 1.00 0.00 H new ATOM 0 HG3 GLN A 159 7.227 7.276 7.774 1.00 0.00 H new ATOM 0 HE21 GLN A 159 5.389 7.274 9.090 1.00 0.00 H new ATOM 0 HE22 GLN A 159 3.736 7.103 8.493 1.00 0.00 H new ATOM 2503 N LYS A 160 5.187 10.281 3.944 1.00 0.00 N ATOM 2504 CA LYS A 160 4.889 11.617 3.349 1.00 0.00 C ATOM 2505 C LYS A 160 5.511 12.713 4.217 1.00 0.00 C ATOM 2506 O LYS A 160 4.966 13.091 5.238 1.00 0.00 O ATOM 2507 CB LYS A 160 3.373 11.818 3.282 1.00 0.00 C ATOM 2508 CG LYS A 160 3.057 13.017 2.386 1.00 0.00 C ATOM 2509 CD LYS A 160 1.607 13.454 2.611 1.00 0.00 C ATOM 2510 CE LYS A 160 1.250 14.568 1.623 1.00 0.00 C ATOM 2511 NZ LYS A 160 1.961 15.819 2.009 1.00 0.00 N ATOM 0 H LYS A 160 4.375 9.775 4.297 1.00 0.00 H new ATOM 0 HA LYS A 160 5.308 11.669 2.344 1.00 0.00 H new ATOM 0 HB2 LYS A 160 2.893 10.921 2.890 1.00 0.00 H new ATOM 0 HB3 LYS A 160 2.973 11.982 4.282 1.00 0.00 H new ATOM 0 HG2 LYS A 160 3.735 13.841 2.610 1.00 0.00 H new ATOM 0 HG3 LYS A 160 3.210 12.753 1.340 1.00 0.00 H new ATOM 0 HD2 LYS A 160 0.936 12.606 2.477 1.00 0.00 H new ATOM 0 HD3 LYS A 160 1.477 13.806 3.634 1.00 0.00 H new ATOM 0 HE2 LYS A 160 1.530 14.275 0.611 1.00 0.00 H new ATOM 0 HE3 LYS A 160 0.173 14.735 1.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 1.594 16.614 1.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 1.807 16.008 3.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 2.979 15.709 1.828 1.00 0.00 H new ATOM 2525 N LYS A 161 6.648 13.222 3.818 1.00 0.00 N ATOM 2526 CA LYS A 161 7.315 14.294 4.613 1.00 0.00 C ATOM 2527 C LYS A 161 8.269 15.079 3.710 1.00 0.00 C ATOM 2528 O LYS A 161 9.260 14.555 3.235 1.00 0.00 O ATOM 2529 CB LYS A 161 8.105 13.662 5.762 1.00 0.00 C ATOM 2530 CG LYS A 161 8.387 14.719 6.830 1.00 0.00 C ATOM 2531 CD LYS A 161 9.631 15.520 6.441 1.00 0.00 C ATOM 2532 CE LYS A 161 10.227 16.177 7.687 1.00 0.00 C ATOM 2533 NZ LYS A 161 11.542 16.790 7.345 1.00 0.00 N ATOM 0 H LYS A 161 7.144 12.940 2.973 1.00 0.00 H new ATOM 0 HA LYS A 161 6.560 14.968 5.019 1.00 0.00 H new ATOM 0 HB2 LYS A 161 7.541 12.835 6.194 1.00 0.00 H new ATOM 0 HB3 LYS A 161 9.042 13.248 5.389 1.00 0.00 H new ATOM 0 HG2 LYS A 161 7.530 15.385 6.932 1.00 0.00 H new ATOM 0 HG3 LYS A 161 8.537 14.242 7.798 1.00 0.00 H new ATOM 0 HD2 LYS A 161 10.367 14.865 5.975 1.00 0.00 H new ATOM 0 HD3 LYS A 161 9.371 16.281 5.705 1.00 0.00 H new ATOM 0 HE2 LYS A 161 9.547 16.938 8.070 1.00 0.00 H new ATOM 0 HE3 LYS A 161 10.353 15.436 8.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 11.948 17.237 8.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 12.189 16.053 6.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 11.408 17.508 6.605 1.00 0.00 H new ATOM 2547 N ALA A 162 7.977 16.333 3.472 1.00 0.00 N ATOM 2548 CA ALA A 162 8.860 17.162 2.602 1.00 0.00 C ATOM 2549 C ALA A 162 9.952 17.813 3.455 1.00 0.00 C ATOM 2550 O ALA A 162 9.627 18.305 4.523 1.00 0.00 O ATOM 2551 CB ALA A 162 8.029 18.251 1.920 1.00 0.00 C ATOM 2552 OXT ALA A 162 11.093 17.808 3.025 1.00 0.00 O ATOM 0 H ALA A 162 7.161 16.818 3.845 1.00 0.00 H new ATOM 0 HA ALA A 162 9.320 16.528 1.844 1.00 0.00 H new ATOM 0 HB1 ALA A 162 8.675 18.857 1.284 1.00 0.00 H new ATOM 0 HB2 ALA A 162 7.252 17.788 1.312 1.00 0.00 H new ATOM 0 HB3 ALA A 162 7.568 18.885 2.677 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 N1 TMQ A 170 3.885 -8.530 -1.810 1.00 0.00 N HETATM 2560 C2 TMQ A 170 3.662 -7.454 -1.041 1.00 0.00 C HETATM 2561 N3 TMQ A 170 2.522 -6.726 -1.134 1.00 0.00 N HETATM 2562 C4 TMQ A 170 1.542 -7.066 -2.029 1.00 0.00 C HETATM 2563 C3A TMQ A 170 2.971 -8.961 -2.740 1.00 0.00 C HETATM 2564 C4A TMQ A 170 1.706 -8.226 -2.906 1.00 0.00 C HETATM 2565 C5 TMQ A 170 0.756 -8.727 -3.919 1.00 0.00 C HETATM 2566 C6 TMQ A 170 1.102 -9.901 -4.694 1.00 0.00 C HETATM 2567 C7 TMQ A 170 2.326 -10.560 -4.489 1.00 0.00 C HETATM 2568 C8 TMQ A 170 3.242 -10.107 -3.539 1.00 0.00 C HETATM 2569 C9 TMQ A 170 0.150 -10.447 -5.748 1.00 0.00 C HETATM 2570 N10 TMQ A 170 0.498 -11.796 -6.208 1.00 0.00 N HETATM 2571 C11 TMQ A 170 0.372 -12.890 -5.381 1.00 0.00 C HETATM 2572 C12 TMQ A 170 -0.476 -12.853 -4.238 1.00 0.00 C HETATM 2573 C13 TMQ A 170 -0.599 -14.007 -3.383 1.00 0.00 C HETATM 2574 C14 TMQ A 170 0.135 -15.180 -3.694 1.00 0.00 C HETATM 2575 C15 TMQ A 170 0.983 -15.229 -4.832 1.00 0.00 C HETATM 2576 C16 TMQ A 170 1.098 -14.066 -5.679 1.00 0.00 C HETATM 2577 C17 TMQ A 170 -0.579 -8.060 -4.191 1.00 0.00 C HETATM 2578 O18 TMQ A 170 -1.434 -14.019 -2.226 1.00 0.00 O HETATM 2579 O19 TMQ A 170 0.020 -16.291 -2.881 1.00 0.00 O HETATM 2580 O20 TMQ A 170 1.695 -16.438 -5.093 1.00 0.00 O HETATM 2581 C21 TMQ A 170 -1.707 -12.704 -1.743 1.00 0.00 C HETATM 2582 C22 TMQ A 170 1.158 -16.345 -2.053 1.00 0.00 C HETATM 2583 C23 TMQ A 170 2.092 -16.548 -6.459 1.00 0.00 C HETATM 2584 N24 TMQ A 170 4.605 -7.082 -0.142 1.00 0.00 N HETATM 2585 N25 TMQ A 170 0.447 -6.250 -2.019 1.00 0.00 N HETATM 0 HN52 TMQ A 170 -0.330 -6.431 -2.654 1.00 0.00 H new HETATM 0 HN51 TMQ A 170 0.406 -5.459 -1.376 1.00 0.00 H new HETATM 0 HN22 TMQ A 170 4.451 -6.266 0.450 1.00 0.00 H new HETATM 0 HN21 TMQ A 170 5.469 -7.618 -0.058 1.00 0.00 H new HETATM 0 H233 TMQ A 170 1.208 -16.532 -7.097 1.00 0.00 H new HETATM 0 H232 TMQ A 170 2.741 -15.712 -6.718 1.00 0.00 H new HETATM 0 H231 TMQ A 170 2.630 -17.484 -6.607 1.00 0.00 H new HETATM 0 H223 TMQ A 170 2.053 -16.422 -2.670 1.00 0.00 H new HETATM 0 H222 TMQ A 170 1.211 -15.440 -1.448 1.00 0.00 H new HETATM 0 H221 TMQ A 170 1.092 -17.215 -1.400 1.00 0.00 H new HETATM 0 H213 TMQ A 170 -0.771 -12.212 -1.479 1.00 0.00 H new HETATM 0 H212 TMQ A 170 -2.213 -12.129 -2.519 1.00 0.00 H new HETATM 0 H211 TMQ A 170 -2.346 -12.765 -0.862 1.00 0.00 H new HETATM 0 H173 TMQ A 170 -1.180 -8.064 -3.282 1.00 0.00 H new HETATM 0 H172 TMQ A 170 -0.413 -7.031 -4.511 1.00 0.00 H new HETATM 0 H171 TMQ A 170 -1.104 -8.604 -4.976 1.00 0.00 H new HETATM 0 HN1 TMQ A 170 0.840 -11.926 -7.160 1.00 0.00 H new HETATM 0 HN TMQ A 170 4.760 -9.044 -1.701 1.00 0.00 H new HETATM 0 H92 TMQ A 170 -0.861 -10.460 -5.341 1.00 0.00 H new HETATM 0 H91 TMQ A 170 0.141 -9.771 -6.603 1.00 0.00 H new HETATM 0 H8 TMQ A 170 4.183 -10.641 -3.406 1.00 0.00 H new HETATM 0 H7 TMQ A 170 2.564 -11.442 -5.083 1.00 0.00 H new HETATM 0 H16 TMQ A 170 1.748 -14.095 -6.553 1.00 0.00 H new HETATM 0 H12 TMQ A 170 -1.036 -11.946 -4.008 1.00 0.00 H new