USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1037 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 117 GLN : amide:sc= 0.579 K(o=0.58,f=-0.65) USER MOD Set 2.1: A 110 GLN : amide:sc= -0.0147 X(o=-2.2,f=-2.5) USER MOD Set 2.2: A 113 GLN : amide:sc= -2.17! C(o=-2.2!,f=-2.5!) USER MOD Set 3.1: A 46 THR OG1 : rot 69:sc= 0.806 USER MOD Set 3.2: A 47 HIS : no HD1:sc= -4.87! C(o=-7.3!,f=-13!) USER MOD Set 3.3: A 50 GLN : amide:sc= -3.28! C(o=-7.3!,f=-14!) USER MOD Set 4.1: A 8 CYS SG : rot 131:sc= -2.59! USER MOD Set 4.2: A 34 CYS SG : rot 137:sc= -3.32! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -133:sc= 0 (180deg=-0.151) USER MOD Single : A 3 SER OG : rot 77:sc= 0.00264 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.0432 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 CYS SG : rot 91:sc= -4.47! USER MOD Single : A 21 GLN : amide:sc= -5.56! C(o=-5.6!,f=-8.7!) USER MOD Single : A 25 SER OG : rot -2:sc= 0.0876 USER MOD Single : A 29 TYR OH : rot 90:sc= -0.545 USER MOD Single : A 30 GLN : amide:sc= -0.899 K(o=-0.9,f=0) USER MOD Single : A 32 GLN : amide:sc= -0.0467 X(o=-0.047,f=-0.32) USER MOD Single : A 36 SER OG : rot 180:sc= 0.688 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 150:sc=-0.00169 USER MOD Single : A 45 GLN : amide:sc= -1.45 K(o=-1.4,f=-4.4!) USER MOD Single : A 53 CYS SG : rot -9:sc= -1.15! USER MOD Single : A 60 ASN : amide:sc= -0.146 K(o=-0.15,f=-1.9!) USER MOD Single : A 62 SER OG : rot 180:sc= 0.0487 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= -1.43 K(o=-1.4,f=-6.6!) USER MOD Single : A 71 CYS SG : rot 78:sc= -3.22! USER MOD Single : A 87 SER OG : rot 180:sc= -0.167 USER MOD Single : A 95 LYS NZ :NH3+ -107:sc= -0.232 (180deg=-1.34!) USER MOD Single : A 97 GLN : amide:sc= -0.0188 K(o=-0.019,f=-1.6!) USER MOD Single : A 99 TYR OH : rot 7:sc= -0.319 USER MOD Single : A 100 HIS : no HD1:sc= -11.3! C(o=-11!,f=-25!) USER MOD Single : A 101 SER OG : rot 180:sc= -0.564 USER MOD Single : A 105 HIS : no HD1:sc= -0.203 X(o=-0.2,f=-0.068) USER MOD Single : A 109 HIS : no HD1:sc= -0.0554 X(o=-0.055,f=-0.27) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.08 USER MOD Single : A 134 MET CE :methyl 140:sc= -0.281 (180deg=-1.44!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.834 10.750 20.165 1.00 0.00 N ATOM 2 CA MET A 1 1.469 11.662 19.043 1.00 0.00 C ATOM 3 C MET A 1 1.647 10.949 17.698 1.00 0.00 C ATOM 4 O MET A 1 0.737 10.322 17.193 1.00 0.00 O ATOM 5 CB MET A 1 2.433 12.845 19.163 1.00 0.00 C ATOM 6 CG MET A 1 1.982 13.752 20.311 1.00 0.00 C ATOM 7 SD MET A 1 2.960 15.275 20.306 1.00 0.00 S ATOM 8 CE MET A 1 2.049 16.126 21.617 1.00 0.00 C ATOM 0 H1 MET A 1 1.098 10.790 20.898 1.00 0.00 H new ATOM 0 H2 MET A 1 1.915 9.776 19.809 1.00 0.00 H new ATOM 0 H3 MET A 1 2.744 11.047 20.572 1.00 0.00 H new ATOM 0 HA MET A 1 0.428 11.981 19.092 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.446 12.486 19.345 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.456 13.406 18.229 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.923 13.988 20.206 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.101 13.235 21.263 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.489 17.109 21.786 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.007 16.241 21.320 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.102 15.541 22.535 1.00 0.00 H new ATOM 20 N LEU A 2 2.809 11.040 17.113 1.00 0.00 N ATOM 21 CA LEU A 2 3.041 10.367 15.799 1.00 0.00 C ATOM 22 C LEU A 2 2.883 8.849 15.927 1.00 0.00 C ATOM 23 O LEU A 2 2.637 8.161 14.958 1.00 0.00 O ATOM 24 CB LEU A 2 4.477 10.718 15.418 1.00 0.00 C ATOM 25 CG LEU A 2 4.523 12.141 14.860 1.00 0.00 C ATOM 26 CD1 LEU A 2 4.716 13.131 16.010 1.00 0.00 C ATOM 27 CD2 LEU A 2 5.688 12.268 13.877 1.00 0.00 C ATOM 0 H LEU A 2 3.609 11.551 17.486 1.00 0.00 H new ATOM 0 HA LEU A 2 2.322 10.694 15.048 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.126 10.637 16.290 1.00 0.00 H new ATOM 0 HB3 LEU A 2 4.850 10.013 14.676 1.00 0.00 H new ATOM 0 HG LEU A 2 3.588 12.359 14.343 1.00 0.00 H new ATOM 0 HD11 LEU A 2 4.749 14.146 15.614 1.00 0.00 H new ATOM 0 HD12 LEU A 2 3.886 13.041 16.710 1.00 0.00 H new ATOM 0 HD13 LEU A 2 5.651 12.912 16.526 1.00 0.00 H new ATOM 0 HD21 LEU A 2 5.720 13.283 13.480 1.00 0.00 H new ATOM 0 HD22 LEU A 2 6.624 12.050 14.392 1.00 0.00 H new ATOM 0 HD23 LEU A 2 5.552 11.562 13.058 1.00 0.00 H new ATOM 39 N SER A 3 3.032 8.318 17.110 1.00 0.00 N ATOM 40 CA SER A 3 2.897 6.846 17.280 1.00 0.00 C ATOM 41 C SER A 3 3.754 6.120 16.230 1.00 0.00 C ATOM 42 O SER A 3 4.921 6.414 16.060 1.00 0.00 O ATOM 43 CB SER A 3 1.408 6.573 17.071 1.00 0.00 C ATOM 44 OG SER A 3 0.667 7.135 18.149 1.00 0.00 O ATOM 0 H SER A 3 3.241 8.838 17.962 1.00 0.00 H new ATOM 0 HA SER A 3 3.237 6.493 18.254 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.078 7.003 16.125 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.229 5.499 17.013 1.00 0.00 H new ATOM 0 HG SER A 3 0.591 8.104 18.023 1.00 0.00 H new ATOM 50 N GLN A 4 3.191 5.178 15.519 1.00 0.00 N ATOM 51 CA GLN A 4 3.977 4.447 14.485 1.00 0.00 C ATOM 52 C GLN A 4 3.125 4.255 13.226 1.00 0.00 C ATOM 53 O GLN A 4 1.915 4.361 13.262 1.00 0.00 O ATOM 54 CB GLN A 4 4.317 3.095 15.115 1.00 0.00 C ATOM 55 CG GLN A 4 5.197 3.310 16.349 1.00 0.00 C ATOM 56 CD GLN A 4 5.816 1.977 16.776 1.00 0.00 C ATOM 57 OE1 GLN A 4 5.113 1.023 17.044 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.116 1.874 16.848 1.00 0.00 N ATOM 0 H GLN A 4 2.219 4.884 15.611 1.00 0.00 H new ATOM 0 HA GLN A 4 4.876 4.988 14.189 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.402 2.573 15.395 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.835 2.465 14.392 1.00 0.00 H new ATOM 0 HG2 GLN A 4 5.982 4.033 16.127 1.00 0.00 H new ATOM 0 HG3 GLN A 4 4.603 3.725 17.164 1.00 0.00 H new ATOM 0 HE21 GLN A 4 7.704 2.676 16.623 1.00 0.00 H new ATOM 0 HE22 GLN A 4 7.543 0.991 17.130 1.00 0.00 H new ATOM 67 N ILE A 5 3.747 3.980 12.115 1.00 0.00 N ATOM 68 CA ILE A 5 2.981 3.783 10.851 1.00 0.00 C ATOM 69 C ILE A 5 3.098 2.330 10.388 1.00 0.00 C ATOM 70 O ILE A 5 4.165 1.755 10.393 1.00 0.00 O ATOM 71 CB ILE A 5 3.649 4.726 9.847 1.00 0.00 C ATOM 72 CG1 ILE A 5 3.338 6.175 10.224 1.00 0.00 C ATOM 73 CG2 ILE A 5 3.128 4.441 8.437 1.00 0.00 C ATOM 74 CD1 ILE A 5 4.275 7.116 9.465 1.00 0.00 C ATOM 0 H ILE A 5 4.758 3.882 12.026 1.00 0.00 H new ATOM 0 HA ILE A 5 1.917 3.992 10.966 1.00 0.00 H new ATOM 0 HB ILE A 5 4.727 4.566 9.868 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.300 6.409 9.985 1.00 0.00 H new ATOM 0 HG13 ILE A 5 3.457 6.315 11.298 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.608 5.116 7.728 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.355 3.410 8.167 1.00 0.00 H new ATOM 0 HG23 ILE A 5 2.049 4.594 8.410 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.051 8.148 9.735 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.309 6.888 9.726 1.00 0.00 H new ATOM 0 HD13 ILE A 5 4.134 6.983 8.392 1.00 0.00 H new ATOM 86 N ALA A 6 2.012 1.731 9.983 1.00 0.00 N ATOM 87 CA ALA A 6 2.080 0.318 9.521 1.00 0.00 C ATOM 88 C ALA A 6 2.180 0.275 7.998 1.00 0.00 C ATOM 89 O ALA A 6 1.272 0.671 7.295 1.00 0.00 O ATOM 90 CB ALA A 6 0.775 -0.319 9.986 1.00 0.00 C ATOM 0 H ALA A 6 1.086 2.157 9.952 1.00 0.00 H new ATOM 0 HA ALA A 6 2.949 -0.206 9.918 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.752 -1.365 9.681 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.706 -0.256 11.072 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.067 0.208 9.538 1.00 0.00 H new ATOM 96 N ILE A 7 3.275 -0.204 7.484 1.00 0.00 N ATOM 97 CA ILE A 7 3.424 -0.271 6.004 1.00 0.00 C ATOM 98 C ILE A 7 3.700 -1.709 5.563 1.00 0.00 C ATOM 99 O ILE A 7 4.727 -2.280 5.868 1.00 0.00 O ATOM 100 CB ILE A 7 4.609 0.638 5.685 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.364 2.016 6.302 1.00 0.00 C ATOM 102 CG2 ILE A 7 4.760 0.785 4.169 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.503 2.955 5.910 1.00 0.00 C ATOM 0 H ILE A 7 4.070 -0.551 8.020 1.00 0.00 H new ATOM 0 HA ILE A 7 2.522 0.045 5.481 1.00 0.00 H new ATOM 0 HB ILE A 7 5.519 0.201 6.096 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.411 2.417 5.957 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.301 1.935 7.387 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.607 1.435 3.949 1.00 0.00 H new ATOM 0 HG22 ILE A 7 4.929 -0.195 3.723 1.00 0.00 H new ATOM 0 HG23 ILE A 7 3.851 1.220 3.753 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.331 3.938 6.348 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.448 2.554 6.277 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.544 3.044 4.824 1.00 0.00 H new ATOM 115 N CYS A 8 2.788 -2.299 4.847 1.00 0.00 N ATOM 116 CA CYS A 8 2.990 -3.698 4.389 1.00 0.00 C ATOM 117 C CYS A 8 3.527 -3.709 2.963 1.00 0.00 C ATOM 118 O CYS A 8 2.879 -3.249 2.045 1.00 0.00 O ATOM 119 CB CYS A 8 1.596 -4.317 4.433 1.00 0.00 C ATOM 120 SG CYS A 8 1.718 -6.105 4.179 1.00 0.00 S ATOM 0 H CYS A 8 1.908 -1.871 4.558 1.00 0.00 H new ATOM 0 HA CYS A 8 3.707 -4.242 5.005 1.00 0.00 H new ATOM 0 HB2 CYS A 8 1.124 -4.107 5.393 1.00 0.00 H new ATOM 0 HB3 CYS A 8 0.965 -3.872 3.663 1.00 0.00 H new ATOM 0 HG CYS A 8 1.026 -6.721 5.091 1.00 0.00 H new ATOM 126 N ILE A 9 4.705 -4.222 2.760 1.00 0.00 N ATOM 127 CA ILE A 9 5.254 -4.244 1.380 1.00 0.00 C ATOM 128 C ILE A 9 5.187 -5.641 0.775 1.00 0.00 C ATOM 129 O ILE A 9 5.362 -6.635 1.451 1.00 0.00 O ATOM 130 CB ILE A 9 6.713 -3.827 1.513 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.388 -3.931 0.144 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.412 -4.760 2.495 1.00 0.00 C ATOM 133 CD1 ILE A 9 8.717 -3.181 0.170 1.00 0.00 C ATOM 0 H ILE A 9 5.305 -4.623 3.481 1.00 0.00 H new ATOM 0 HA ILE A 9 4.682 -3.583 0.729 1.00 0.00 H new ATOM 0 HB ILE A 9 6.775 -2.801 1.876 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.554 -4.977 -0.112 1.00 0.00 H new ATOM 0 HG13 ILE A 9 6.738 -3.514 -0.626 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.457 -4.467 2.595 1.00 0.00 H new ATOM 0 HG22 ILE A 9 6.923 -4.697 3.467 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.356 -5.784 2.126 1.00 0.00 H new ATOM 0 HD11 ILE A 9 9.196 -3.256 -0.806 1.00 0.00 H new ATOM 0 HD12 ILE A 9 8.538 -2.132 0.407 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.367 -3.618 0.928 1.00 0.00 H new ATOM 145 N TRP A 10 4.988 -5.715 -0.508 1.00 0.00 N ATOM 146 CA TRP A 10 4.973 -7.042 -1.181 1.00 0.00 C ATOM 147 C TRP A 10 6.086 -7.058 -2.213 1.00 0.00 C ATOM 148 O TRP A 10 6.049 -6.338 -3.191 1.00 0.00 O ATOM 149 CB TRP A 10 3.620 -7.190 -1.877 1.00 0.00 C ATOM 150 CG TRP A 10 3.691 -8.374 -2.796 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.586 -9.385 -2.684 1.00 0.00 C ATOM 152 CD2 TRP A 10 2.874 -8.684 -3.961 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.372 -10.293 -3.707 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.325 -9.907 -4.519 1.00 0.00 C ATOM 155 CE3 TRP A 10 1.797 -8.031 -4.580 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.725 -10.459 -5.652 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.192 -8.584 -5.720 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.655 -9.795 -6.255 1.00 0.00 C ATOM 0 H TRP A 10 4.835 -4.914 -1.121 1.00 0.00 H new ATOM 0 HA TRP A 10 5.120 -7.857 -0.472 1.00 0.00 H new ATOM 0 HB2 TRP A 10 2.827 -7.327 -1.141 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.381 -6.287 -2.439 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.344 -9.469 -1.920 1.00 0.00 H new ATOM 0 HE1 TRP A 10 4.920 -11.142 -3.844 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.432 -7.098 -4.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 3.086 -11.392 -6.059 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.364 -8.073 -6.188 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.184 -10.213 -7.132 1.00 0.00 H new ATOM 169 N VAL A 11 7.083 -7.853 -2.004 1.00 0.00 N ATOM 170 CA VAL A 11 8.197 -7.886 -2.975 1.00 0.00 C ATOM 171 C VAL A 11 8.960 -9.201 -2.836 1.00 0.00 C ATOM 172 O VAL A 11 9.436 -9.554 -1.775 1.00 0.00 O ATOM 173 CB VAL A 11 9.051 -6.675 -2.597 1.00 0.00 C ATOM 174 CG1 VAL A 11 9.558 -6.822 -1.164 1.00 0.00 C ATOM 175 CG2 VAL A 11 10.236 -6.555 -3.552 1.00 0.00 C ATOM 0 H VAL A 11 7.177 -8.481 -1.206 1.00 0.00 H new ATOM 0 HA VAL A 11 7.878 -7.837 -4.016 1.00 0.00 H new ATOM 0 HB VAL A 11 8.440 -5.775 -2.670 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.165 -5.956 -0.902 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.710 -6.889 -0.483 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.161 -7.726 -1.082 1.00 0.00 H new ATOM 0 HG21 VAL A 11 10.839 -5.690 -3.276 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.845 -7.457 -3.491 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.871 -6.432 -4.572 1.00 0.00 H new ATOM 185 N GLU A 12 9.060 -9.935 -3.900 1.00 0.00 N ATOM 186 CA GLU A 12 9.771 -11.239 -3.845 1.00 0.00 C ATOM 187 C GLU A 12 11.281 -11.020 -3.752 1.00 0.00 C ATOM 188 O GLU A 12 12.009 -11.860 -3.263 1.00 0.00 O ATOM 189 CB GLU A 12 9.394 -11.944 -5.148 1.00 0.00 C ATOM 190 CG GLU A 12 7.948 -12.436 -5.063 1.00 0.00 C ATOM 191 CD GLU A 12 7.634 -13.316 -6.275 1.00 0.00 C ATOM 192 OE1 GLU A 12 7.567 -12.781 -7.369 1.00 0.00 O ATOM 193 OE2 GLU A 12 7.465 -14.509 -6.087 1.00 0.00 O ATOM 0 H GLU A 12 8.678 -9.689 -4.813 1.00 0.00 H new ATOM 0 HA GLU A 12 9.494 -11.829 -2.971 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.508 -11.261 -5.990 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.065 -12.784 -5.327 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.799 -13.000 -4.142 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.265 -11.587 -5.031 1.00 0.00 H new ATOM 200 N SER A 13 11.758 -9.900 -4.219 1.00 0.00 N ATOM 201 CA SER A 13 13.225 -9.635 -4.158 1.00 0.00 C ATOM 202 C SER A 13 13.604 -9.001 -2.816 1.00 0.00 C ATOM 203 O SER A 13 13.105 -7.955 -2.449 1.00 0.00 O ATOM 204 CB SER A 13 13.498 -8.658 -5.301 1.00 0.00 C ATOM 205 OG SER A 13 14.823 -8.852 -5.777 1.00 0.00 O ATOM 0 H SER A 13 11.199 -9.158 -4.639 1.00 0.00 H new ATOM 0 HA SER A 13 13.808 -10.551 -4.249 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.782 -8.815 -6.108 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.369 -7.632 -4.956 1.00 0.00 H new ATOM 0 HG SER A 13 15.001 -8.228 -6.511 1.00 0.00 H new ATOM 211 N THR A 14 14.490 -9.626 -2.087 1.00 0.00 N ATOM 212 CA THR A 14 14.913 -9.060 -0.772 1.00 0.00 C ATOM 213 C THR A 14 15.566 -7.692 -0.985 1.00 0.00 C ATOM 214 O THR A 14 15.388 -6.776 -0.205 1.00 0.00 O ATOM 215 CB THR A 14 15.934 -10.058 -0.226 1.00 0.00 C ATOM 216 OG1 THR A 14 15.443 -11.380 -0.397 1.00 0.00 O ATOM 217 CG2 THR A 14 16.164 -9.789 1.260 1.00 0.00 C ATOM 0 H THR A 14 14.940 -10.504 -2.345 1.00 0.00 H new ATOM 0 HA THR A 14 14.076 -8.917 -0.088 1.00 0.00 H new ATOM 0 HB THR A 14 16.875 -9.947 -0.766 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.098 -12.020 -0.049 1.00 0.00 H new ATOM 0 HG21 THR A 14 16.892 -10.500 1.650 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.541 -8.775 1.392 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.223 -9.900 1.800 1.00 0.00 H new ATOM 225 N ALA A 15 16.317 -7.548 -2.044 1.00 0.00 N ATOM 226 CA ALA A 15 16.980 -6.242 -2.320 1.00 0.00 C ATOM 227 C ALA A 15 15.929 -5.135 -2.366 1.00 0.00 C ATOM 228 O ALA A 15 16.046 -4.119 -1.711 1.00 0.00 O ATOM 229 CB ALA A 15 17.629 -6.421 -3.693 1.00 0.00 C ATOM 0 H ALA A 15 16.500 -8.280 -2.730 1.00 0.00 H new ATOM 0 HA ALA A 15 17.708 -5.966 -1.557 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.142 -5.502 -3.976 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.348 -7.240 -3.652 1.00 0.00 H new ATOM 0 HB3 ALA A 15 16.861 -6.649 -4.432 1.00 0.00 H new ATOM 235 N ILE A 16 14.889 -5.344 -3.117 1.00 0.00 N ATOM 236 CA ILE A 16 13.805 -4.332 -3.196 1.00 0.00 C ATOM 237 C ILE A 16 13.110 -4.264 -1.840 1.00 0.00 C ATOM 238 O ILE A 16 12.741 -3.207 -1.364 1.00 0.00 O ATOM 239 CB ILE A 16 12.878 -4.864 -4.288 1.00 0.00 C ATOM 240 CG1 ILE A 16 13.633 -4.842 -5.621 1.00 0.00 C ATOM 241 CG2 ILE A 16 11.628 -3.990 -4.384 1.00 0.00 C ATOM 242 CD1 ILE A 16 13.016 -5.856 -6.586 1.00 0.00 C ATOM 0 H ILE A 16 14.742 -6.179 -3.684 1.00 0.00 H new ATOM 0 HA ILE A 16 14.145 -3.323 -3.429 1.00 0.00 H new ATOM 0 HB ILE A 16 12.571 -5.883 -4.050 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.593 -3.843 -6.055 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.685 -5.076 -5.457 1.00 0.00 H new ATOM 0 HG21 ILE A 16 10.973 -4.376 -5.165 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.101 -4.002 -3.430 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.917 -2.967 -4.626 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.558 -5.835 -7.532 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.079 -6.855 -6.154 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.971 -5.602 -6.761 1.00 0.00 H new ATOM 254 N LEU A 17 12.965 -5.390 -1.201 1.00 0.00 N ATOM 255 CA LEU A 17 12.337 -5.412 0.145 1.00 0.00 C ATOM 256 C LEU A 17 13.174 -4.563 1.093 1.00 0.00 C ATOM 257 O LEU A 17 12.662 -3.846 1.931 1.00 0.00 O ATOM 258 CB LEU A 17 12.367 -6.889 0.562 1.00 0.00 C ATOM 259 CG LEU A 17 12.279 -7.039 2.090 1.00 0.00 C ATOM 260 CD1 LEU A 17 13.675 -6.908 2.700 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.358 -5.969 2.688 1.00 0.00 C ATOM 0 H LEU A 17 13.257 -6.300 -1.557 1.00 0.00 H new ATOM 0 HA LEU A 17 11.323 -5.013 0.157 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.537 -7.418 0.094 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.285 -7.353 0.201 1.00 0.00 H new ATOM 0 HG LEU A 17 11.867 -8.022 2.318 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.610 -7.015 3.783 1.00 0.00 H new ATOM 0 HD12 LEU A 17 14.323 -7.686 2.297 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.088 -5.929 2.456 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.310 -6.094 3.770 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.750 -4.979 2.454 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.358 -6.072 2.266 1.00 0.00 H new ATOM 273 N GLN A 18 14.467 -4.636 0.958 1.00 0.00 N ATOM 274 CA GLN A 18 15.353 -3.832 1.843 1.00 0.00 C ATOM 275 C GLN A 18 15.336 -2.363 1.418 1.00 0.00 C ATOM 276 O GLN A 18 15.011 -1.493 2.192 1.00 0.00 O ATOM 277 CB GLN A 18 16.749 -4.435 1.676 1.00 0.00 C ATOM 278 CG GLN A 18 16.831 -5.751 2.455 1.00 0.00 C ATOM 279 CD GLN A 18 18.228 -6.360 2.297 1.00 0.00 C ATOM 280 OE1 GLN A 18 18.584 -6.820 1.231 1.00 0.00 O ATOM 281 NE2 GLN A 18 19.038 -6.382 3.324 1.00 0.00 N ATOM 0 H GLN A 18 14.949 -5.218 0.273 1.00 0.00 H new ATOM 0 HA GLN A 18 15.029 -3.860 2.883 1.00 0.00 H new ATOM 0 HB2 GLN A 18 16.957 -4.611 0.621 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.504 -3.737 2.038 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.618 -5.574 3.509 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.077 -6.448 2.090 1.00 0.00 H new ATOM 0 HE21 GLN A 18 18.738 -5.995 4.219 1.00 0.00 H new ATOM 0 HE22 GLN A 18 19.970 -6.786 3.230 1.00 0.00 H new ATOM 290 N ASP A 19 15.675 -2.070 0.196 1.00 0.00 N ATOM 291 CA ASP A 19 15.672 -0.645 -0.237 1.00 0.00 C ATOM 292 C ASP A 19 14.323 0.005 0.084 1.00 0.00 C ATOM 293 O ASP A 19 14.259 1.152 0.483 1.00 0.00 O ATOM 294 CB ASP A 19 15.914 -0.679 -1.746 1.00 0.00 C ATOM 295 CG ASP A 19 17.264 -1.340 -2.032 1.00 0.00 C ATOM 296 OD1 ASP A 19 18.101 -1.339 -1.145 1.00 0.00 O ATOM 297 OD2 ASP A 19 17.437 -1.836 -3.133 1.00 0.00 O ATOM 0 H ASP A 19 15.951 -2.746 -0.516 1.00 0.00 H new ATOM 0 HA ASP A 19 16.433 -0.059 0.277 1.00 0.00 H new ATOM 0 HB2 ASP A 19 15.115 -1.231 -2.241 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.900 0.333 -2.150 1.00 0.00 H new ATOM 302 N CYS A 20 13.243 -0.714 -0.078 1.00 0.00 N ATOM 303 CA CYS A 20 11.909 -0.121 0.227 1.00 0.00 C ATOM 304 C CYS A 20 11.762 0.131 1.731 1.00 0.00 C ATOM 305 O CYS A 20 11.362 1.199 2.152 1.00 0.00 O ATOM 306 CB CYS A 20 10.887 -1.158 -0.235 1.00 0.00 C ATOM 307 SG CYS A 20 10.746 -1.110 -2.039 1.00 0.00 S ATOM 0 H CYS A 20 13.227 -1.680 -0.406 1.00 0.00 H new ATOM 0 HA CYS A 20 11.773 0.838 -0.272 1.00 0.00 H new ATOM 0 HB2 CYS A 20 11.191 -2.153 0.090 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.918 -0.956 0.221 1.00 0.00 H new ATOM 0 HG CYS A 20 11.591 -1.947 -2.563 1.00 0.00 H new ATOM 313 N GLN A 21 12.083 -0.839 2.545 1.00 0.00 N ATOM 314 CA GLN A 21 11.959 -0.644 4.016 1.00 0.00 C ATOM 315 C GLN A 21 13.150 0.153 4.532 1.00 0.00 C ATOM 316 O GLN A 21 13.050 0.887 5.494 1.00 0.00 O ATOM 317 CB GLN A 21 11.952 -2.048 4.611 1.00 0.00 C ATOM 318 CG GLN A 21 10.634 -2.741 4.264 1.00 0.00 C ATOM 319 CD GLN A 21 10.516 -4.038 5.064 1.00 0.00 C ATOM 320 OE1 GLN A 21 9.428 -4.535 5.290 1.00 0.00 O ATOM 321 NE2 GLN A 21 11.600 -4.611 5.509 1.00 0.00 N ATOM 0 H GLN A 21 12.425 -1.755 2.255 1.00 0.00 H new ATOM 0 HA GLN A 21 11.059 -0.092 4.287 1.00 0.00 H new ATOM 0 HB2 GLN A 21 12.792 -2.624 4.222 1.00 0.00 H new ATOM 0 HB3 GLN A 21 12.075 -1.997 5.693 1.00 0.00 H new ATOM 0 HG2 GLN A 21 9.794 -2.084 4.490 1.00 0.00 H new ATOM 0 HG3 GLN A 21 10.593 -2.955 3.196 1.00 0.00 H new ATOM 0 HE21 GLN A 21 12.512 -4.194 5.320 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.536 -5.476 6.046 1.00 0.00 H new ATOM 330 N ARG A 22 14.277 0.028 3.892 1.00 0.00 N ATOM 331 CA ARG A 22 15.457 0.797 4.347 1.00 0.00 C ATOM 332 C ARG A 22 15.087 2.273 4.346 1.00 0.00 C ATOM 333 O ARG A 22 15.332 2.988 5.297 1.00 0.00 O ATOM 334 CB ARG A 22 16.551 0.483 3.324 1.00 0.00 C ATOM 335 CG ARG A 22 17.220 -0.850 3.685 1.00 0.00 C ATOM 336 CD ARG A 22 17.601 -0.836 5.161 1.00 0.00 C ATOM 337 NE ARG A 22 18.811 -1.699 5.260 1.00 0.00 N ATOM 338 CZ ARG A 22 19.151 -2.228 6.406 1.00 0.00 C ATOM 339 NH1 ARG A 22 18.439 -1.992 7.476 1.00 0.00 N ATOM 340 NH2 ARG A 22 20.205 -2.994 6.482 1.00 0.00 N ATOM 0 H ARG A 22 14.428 -0.570 3.080 1.00 0.00 H new ATOM 0 HA ARG A 22 15.792 0.544 5.353 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.123 0.428 2.323 1.00 0.00 H new ATOM 0 HB3 ARG A 22 17.292 1.282 3.311 1.00 0.00 H new ATOM 0 HG2 ARG A 22 16.542 -1.678 3.480 1.00 0.00 H new ATOM 0 HG3 ARG A 22 18.106 -1.004 3.070 1.00 0.00 H new ATOM 0 HD2 ARG A 22 17.811 0.177 5.504 1.00 0.00 H new ATOM 0 HD3 ARG A 22 16.791 -1.221 5.780 1.00 0.00 H new ATOM 0 HE ARG A 22 19.377 -1.878 4.430 1.00 0.00 H new ATOM 0 HH11 ARG A 22 17.615 -1.393 7.419 1.00 0.00 H new ATOM 0 HH12 ARG A 22 18.707 -2.406 8.369 1.00 0.00 H new ATOM 0 HH21 ARG A 22 20.762 -3.179 5.648 1.00 0.00 H new ATOM 0 HH22 ARG A 22 20.472 -3.407 7.376 1.00 0.00 H new ATOM 354 N ALA A 23 14.445 2.723 3.306 1.00 0.00 N ATOM 355 CA ALA A 23 14.002 4.141 3.283 1.00 0.00 C ATOM 356 C ALA A 23 12.934 4.302 4.370 1.00 0.00 C ATOM 357 O ALA A 23 12.945 5.243 5.137 1.00 0.00 O ATOM 358 CB ALA A 23 13.423 4.380 1.883 1.00 0.00 C ATOM 0 H ALA A 23 14.210 2.175 2.478 1.00 0.00 H new ATOM 0 HA ALA A 23 14.802 4.856 3.477 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.078 5.411 1.803 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.194 4.196 1.134 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.585 3.703 1.715 1.00 0.00 H new ATOM 364 N LEU A 24 12.024 3.358 4.455 1.00 0.00 N ATOM 365 CA LEU A 24 10.971 3.416 5.505 1.00 0.00 C ATOM 366 C LEU A 24 11.483 2.752 6.783 1.00 0.00 C ATOM 367 O LEU A 24 10.937 1.776 7.254 1.00 0.00 O ATOM 368 CB LEU A 24 9.809 2.626 4.913 1.00 0.00 C ATOM 369 CG LEU A 24 9.440 3.251 3.574 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.224 2.547 2.977 1.00 0.00 C ATOM 371 CD2 LEU A 24 9.120 4.722 3.804 1.00 0.00 C ATOM 0 H LEU A 24 11.971 2.549 3.836 1.00 0.00 H new ATOM 0 HA LEU A 24 10.683 4.434 5.769 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.089 1.581 4.780 1.00 0.00 H new ATOM 0 HB3 LEU A 24 8.954 2.644 5.589 1.00 0.00 H new ATOM 0 HG LEU A 24 10.272 3.148 2.878 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.972 3.005 2.020 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.452 1.492 2.826 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.378 2.641 3.658 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.853 5.189 2.856 1.00 0.00 H new ATOM 0 HD22 LEU A 24 8.285 4.808 4.499 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.993 5.223 4.222 1.00 0.00 H new ATOM 383 N SER A 25 12.529 3.278 7.345 1.00 0.00 N ATOM 384 CA SER A 25 13.085 2.688 8.593 1.00 0.00 C ATOM 385 C SER A 25 12.858 3.646 9.758 1.00 0.00 C ATOM 386 O SER A 25 13.354 3.443 10.849 1.00 0.00 O ATOM 387 CB SER A 25 14.580 2.511 8.325 1.00 0.00 C ATOM 388 OG SER A 25 14.759 1.574 7.271 1.00 0.00 O ATOM 0 H SER A 25 13.027 4.096 6.994 1.00 0.00 H new ATOM 0 HA SER A 25 12.611 1.742 8.853 1.00 0.00 H new ATOM 0 HB2 SER A 25 15.029 3.467 8.057 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.084 2.163 9.226 1.00 0.00 H new ATOM 0 HG SER A 25 13.886 1.234 6.984 1.00 0.00 H new ATOM 394 N ALA A 26 12.104 4.687 9.535 1.00 0.00 N ATOM 395 CA ALA A 26 11.834 5.656 10.627 1.00 0.00 C ATOM 396 C ALA A 26 11.535 4.886 11.915 1.00 0.00 C ATOM 397 O ALA A 26 11.017 3.788 11.883 1.00 0.00 O ATOM 398 CB ALA A 26 10.608 6.441 10.151 1.00 0.00 C ATOM 0 H ALA A 26 11.664 4.906 8.641 1.00 0.00 H new ATOM 0 HA ALA A 26 12.673 6.319 10.838 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.337 7.183 10.902 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.839 6.943 9.211 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.773 5.756 10.001 1.00 0.00 H new ATOM 404 N ASP A 27 11.868 5.438 13.045 1.00 0.00 N ATOM 405 CA ASP A 27 11.610 4.717 14.323 1.00 0.00 C ATOM 406 C ASP A 27 10.108 4.549 14.541 1.00 0.00 C ATOM 407 O ASP A 27 9.675 3.849 15.436 1.00 0.00 O ATOM 408 CB ASP A 27 12.230 5.597 15.408 1.00 0.00 C ATOM 409 CG ASP A 27 13.738 5.704 15.166 1.00 0.00 C ATOM 410 OD1 ASP A 27 14.120 6.377 14.223 1.00 0.00 O ATOM 411 OD2 ASP A 27 14.486 5.109 15.926 1.00 0.00 O ATOM 0 H ASP A 27 12.306 6.354 13.141 1.00 0.00 H new ATOM 0 HA ASP A 27 12.037 3.714 14.328 1.00 0.00 H new ATOM 0 HB2 ASP A 27 11.776 6.588 15.394 1.00 0.00 H new ATOM 0 HB3 ASP A 27 12.037 5.172 16.393 1.00 0.00 H new ATOM 416 N ARG A 28 9.306 5.181 13.728 1.00 0.00 N ATOM 417 CA ARG A 28 7.835 5.048 13.886 1.00 0.00 C ATOM 418 C ARG A 28 7.255 4.257 12.711 1.00 0.00 C ATOM 419 O ARG A 28 6.098 4.398 12.373 1.00 0.00 O ATOM 420 CB ARG A 28 7.311 6.484 13.885 1.00 0.00 C ATOM 421 CG ARG A 28 7.455 7.078 12.484 1.00 0.00 C ATOM 422 CD ARG A 28 7.356 8.604 12.562 1.00 0.00 C ATOM 423 NE ARG A 28 7.364 9.066 11.145 1.00 0.00 N ATOM 424 CZ ARG A 28 7.545 10.332 10.870 1.00 0.00 C ATOM 425 NH1 ARG A 28 7.733 11.194 11.834 1.00 0.00 N ATOM 426 NH2 ARG A 28 7.538 10.737 9.630 1.00 0.00 N ATOM 0 H ARG A 28 9.608 5.783 12.962 1.00 0.00 H new ATOM 0 HA ARG A 28 7.556 4.516 14.795 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.266 6.501 14.193 1.00 0.00 H new ATOM 0 HB3 ARG A 28 7.866 7.085 14.605 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.412 6.787 12.051 1.00 0.00 H new ATOM 0 HG3 ARG A 28 6.677 6.686 11.830 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.445 8.914 13.073 1.00 0.00 H new ATOM 0 HD3 ARG A 28 8.193 9.026 13.119 1.00 0.00 H new ATOM 0 HE ARG A 28 7.228 8.395 10.389 1.00 0.00 H new ATOM 0 HH11 ARG A 28 7.739 10.880 12.805 1.00 0.00 H new ATOM 0 HH12 ARG A 28 7.874 12.180 11.616 1.00 0.00 H new ATOM 0 HH21 ARG A 28 7.391 10.067 8.875 1.00 0.00 H new ATOM 0 HH22 ARG A 28 7.679 11.724 9.415 1.00 0.00 H new ATOM 440 N TYR A 29 8.050 3.436 12.075 1.00 0.00 N ATOM 441 CA TYR A 29 7.537 2.653 10.918 1.00 0.00 C ATOM 442 C TYR A 29 7.364 1.181 11.280 1.00 0.00 C ATOM 443 O TYR A 29 8.286 0.520 11.718 1.00 0.00 O ATOM 444 CB TYR A 29 8.597 2.811 9.829 1.00 0.00 C ATOM 445 CG TYR A 29 8.191 3.941 8.925 1.00 0.00 C ATOM 446 CD1 TYR A 29 8.103 5.233 9.439 1.00 0.00 C ATOM 447 CD2 TYR A 29 7.898 3.697 7.582 1.00 0.00 C ATOM 448 CE1 TYR A 29 7.717 6.290 8.613 1.00 0.00 C ATOM 449 CE2 TYR A 29 7.510 4.754 6.752 1.00 0.00 C ATOM 450 CZ TYR A 29 7.418 6.052 7.267 1.00 0.00 C ATOM 451 OH TYR A 29 7.035 7.098 6.451 1.00 0.00 O ATOM 0 H TYR A 29 9.030 3.276 12.308 1.00 0.00 H new ATOM 0 HA TYR A 29 6.557 3.008 10.598 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.570 3.015 10.275 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.695 1.887 9.259 1.00 0.00 H new ATOM 0 HD1 TYR A 29 8.334 5.417 10.478 1.00 0.00 H new ATOM 0 HD2 TYR A 29 7.971 2.695 7.185 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.649 7.291 9.013 1.00 0.00 H new ATOM 0 HE2 TYR A 29 7.281 4.568 5.713 1.00 0.00 H new ATOM 0 HH TYR A 29 7.828 7.496 6.036 1.00 0.00 H new ATOM 461 N GLN A 30 6.192 0.659 11.065 1.00 0.00 N ATOM 462 CA GLN A 30 5.950 -0.781 11.355 1.00 0.00 C ATOM 463 C GLN A 30 5.736 -1.507 10.034 1.00 0.00 C ATOM 464 O GLN A 30 4.639 -1.575 9.519 1.00 0.00 O ATOM 465 CB GLN A 30 4.682 -0.836 12.209 1.00 0.00 C ATOM 466 CG GLN A 30 4.304 -2.300 12.441 1.00 0.00 C ATOM 467 CD GLN A 30 2.992 -2.380 13.223 1.00 0.00 C ATOM 468 OE1 GLN A 30 2.307 -3.382 13.177 1.00 0.00 O ATOM 469 NE2 GLN A 30 2.611 -1.366 13.949 1.00 0.00 N ATOM 0 H GLN A 30 5.387 1.168 10.700 1.00 0.00 H new ATOM 0 HA GLN A 30 6.784 -1.251 11.876 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.847 -0.334 13.162 1.00 0.00 H new ATOM 0 HB3 GLN A 30 3.868 -0.311 11.709 1.00 0.00 H new ATOM 0 HG2 GLN A 30 4.200 -2.814 11.485 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.097 -2.807 12.991 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.185 -0.523 13.989 1.00 0.00 H new ATOM 0 HE22 GLN A 30 1.739 -1.415 14.477 1.00 0.00 H new ATOM 478 N LEU A 31 6.786 -2.013 9.459 1.00 0.00 N ATOM 479 CA LEU A 31 6.653 -2.690 8.145 1.00 0.00 C ATOM 480 C LEU A 31 6.507 -4.204 8.274 1.00 0.00 C ATOM 481 O LEU A 31 7.067 -4.834 9.148 1.00 0.00 O ATOM 482 CB LEU A 31 7.956 -2.369 7.423 1.00 0.00 C ATOM 483 CG LEU A 31 8.222 -0.868 7.482 1.00 0.00 C ATOM 484 CD1 LEU A 31 9.660 -0.632 7.937 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.022 -0.266 6.091 1.00 0.00 C ATOM 0 H LEU A 31 7.731 -1.987 9.842 1.00 0.00 H new ATOM 0 HA LEU A 31 5.759 -2.348 7.623 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.781 -2.912 7.883 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.898 -2.697 6.385 1.00 0.00 H new ATOM 0 HG LEU A 31 7.534 -0.398 8.185 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.856 0.439 7.981 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.805 -1.069 8.925 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.346 -1.098 7.230 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.211 0.807 6.128 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.714 -0.732 5.390 1.00 0.00 H new ATOM 0 HD23 LEU A 31 6.998 -0.443 5.762 1.00 0.00 H new ATOM 497 N GLN A 32 5.793 -4.786 7.353 1.00 0.00 N ATOM 498 CA GLN A 32 5.633 -6.263 7.331 1.00 0.00 C ATOM 499 C GLN A 32 6.028 -6.740 5.939 1.00 0.00 C ATOM 500 O GLN A 32 5.659 -6.144 4.947 1.00 0.00 O ATOM 501 CB GLN A 32 4.158 -6.549 7.599 1.00 0.00 C ATOM 502 CG GLN A 32 3.924 -8.061 7.510 1.00 0.00 C ATOM 503 CD GLN A 32 4.482 -8.744 8.760 1.00 0.00 C ATOM 504 OE1 GLN A 32 4.174 -8.353 9.867 1.00 0.00 O ATOM 505 NE2 GLN A 32 5.295 -9.758 8.626 1.00 0.00 N ATOM 0 H GLN A 32 5.307 -4.292 6.604 1.00 0.00 H new ATOM 0 HA GLN A 32 6.249 -6.770 8.074 1.00 0.00 H new ATOM 0 HB2 GLN A 32 3.875 -6.181 8.585 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.534 -6.027 6.873 1.00 0.00 H new ATOM 0 HG2 GLN A 32 2.858 -8.269 7.416 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.407 -8.462 6.619 1.00 0.00 H new ATOM 0 HE21 GLN A 32 5.553 -10.085 7.695 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.672 -10.222 9.452 1.00 0.00 H new ATOM 514 N VAL A 33 6.797 -7.778 5.844 1.00 0.00 N ATOM 515 CA VAL A 33 7.232 -8.236 4.499 1.00 0.00 C ATOM 516 C VAL A 33 6.438 -9.458 4.043 1.00 0.00 C ATOM 517 O VAL A 33 6.344 -10.456 4.731 1.00 0.00 O ATOM 518 CB VAL A 33 8.707 -8.564 4.683 1.00 0.00 C ATOM 519 CG1 VAL A 33 9.331 -8.923 3.335 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.400 -7.330 5.264 1.00 0.00 C ATOM 0 H VAL A 33 7.143 -8.328 6.630 1.00 0.00 H new ATOM 0 HA VAL A 33 7.066 -7.485 3.727 1.00 0.00 H new ATOM 0 HB VAL A 33 8.823 -9.414 5.356 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.387 -9.157 3.473 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.819 -9.790 2.916 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.233 -8.079 2.652 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.460 -7.541 5.405 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.285 -6.491 4.578 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.949 -7.078 6.224 1.00 0.00 H new ATOM 530 N CYS A 34 5.868 -9.374 2.873 1.00 0.00 N ATOM 531 CA CYS A 34 5.073 -10.510 2.331 1.00 0.00 C ATOM 532 C CYS A 34 5.819 -11.134 1.148 1.00 0.00 C ATOM 533 O CYS A 34 5.921 -10.546 0.090 1.00 0.00 O ATOM 534 CB CYS A 34 3.757 -9.884 1.860 1.00 0.00 C ATOM 535 SG CYS A 34 3.122 -8.758 3.128 1.00 0.00 S ATOM 0 H CYS A 34 5.920 -8.558 2.263 1.00 0.00 H new ATOM 0 HA CYS A 34 4.907 -11.296 3.067 1.00 0.00 H new ATOM 0 HB2 CYS A 34 3.915 -9.343 0.927 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.025 -10.665 1.656 1.00 0.00 H new ATOM 0 HG CYS A 34 2.692 -7.668 2.565 1.00 0.00 H new ATOM 541 N GLU A 35 6.343 -12.317 1.313 1.00 0.00 N ATOM 542 CA GLU A 35 7.086 -12.963 0.190 1.00 0.00 C ATOM 543 C GLU A 35 6.175 -13.144 -1.027 1.00 0.00 C ATOM 544 O GLU A 35 6.627 -13.123 -2.156 1.00 0.00 O ATOM 545 CB GLU A 35 7.526 -14.324 0.729 1.00 0.00 C ATOM 546 CG GLU A 35 8.628 -14.131 1.771 1.00 0.00 C ATOM 547 CD GLU A 35 9.327 -15.468 2.022 1.00 0.00 C ATOM 548 OE1 GLU A 35 9.545 -16.188 1.063 1.00 0.00 O ATOM 549 OE2 GLU A 35 9.635 -15.747 3.169 1.00 0.00 O ATOM 0 H GLU A 35 6.290 -12.864 2.172 1.00 0.00 H new ATOM 0 HA GLU A 35 7.932 -12.357 -0.135 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.677 -14.842 1.175 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.888 -14.950 -0.087 1.00 0.00 H new ATOM 0 HG2 GLU A 35 9.348 -13.391 1.422 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.203 -13.750 2.700 1.00 0.00 H new ATOM 556 N SER A 36 4.902 -13.325 -0.815 1.00 0.00 N ATOM 557 CA SER A 36 3.979 -13.512 -1.969 1.00 0.00 C ATOM 558 C SER A 36 2.888 -12.438 -1.961 1.00 0.00 C ATOM 559 O SER A 36 2.932 -11.499 -1.190 1.00 0.00 O ATOM 560 CB SER A 36 3.364 -14.896 -1.763 1.00 0.00 C ATOM 561 OG SER A 36 2.399 -14.834 -0.720 1.00 0.00 O ATOM 0 H SER A 36 4.461 -13.352 0.104 1.00 0.00 H new ATOM 0 HA SER A 36 4.497 -13.430 -2.925 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.897 -15.239 -2.686 1.00 0.00 H new ATOM 0 HB3 SER A 36 4.141 -15.618 -1.512 1.00 0.00 H new ATOM 0 HG SER A 36 2.003 -15.721 -0.588 1.00 0.00 H new ATOM 567 N GLY A 37 1.893 -12.586 -2.790 1.00 0.00 N ATOM 568 CA GLY A 37 0.786 -11.601 -2.810 1.00 0.00 C ATOM 569 C GLY A 37 -0.329 -12.184 -1.963 1.00 0.00 C ATOM 570 O GLY A 37 -1.145 -11.482 -1.407 1.00 0.00 O ATOM 0 H GLY A 37 1.802 -13.353 -3.457 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.114 -10.641 -2.411 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.445 -11.422 -3.830 1.00 0.00 H new ATOM 574 N GLU A 38 -0.334 -13.480 -1.838 1.00 0.00 N ATOM 575 CA GLU A 38 -1.347 -14.156 -1.007 1.00 0.00 C ATOM 576 C GLU A 38 -1.021 -13.896 0.459 1.00 0.00 C ATOM 577 O GLU A 38 -1.886 -13.615 1.267 1.00 0.00 O ATOM 578 CB GLU A 38 -1.185 -15.631 -1.356 1.00 0.00 C ATOM 579 CG GLU A 38 -2.129 -15.994 -2.501 1.00 0.00 C ATOM 580 CD GLU A 38 -3.446 -16.516 -1.924 1.00 0.00 C ATOM 581 OE1 GLU A 38 -4.272 -15.700 -1.552 1.00 0.00 O ATOM 582 OE2 GLU A 38 -3.604 -17.725 -1.859 1.00 0.00 O ATOM 0 H GLU A 38 0.336 -14.104 -2.287 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.367 -13.813 -1.178 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.154 -15.836 -1.643 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.402 -16.247 -0.483 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.313 -15.120 -3.126 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.672 -16.751 -3.138 1.00 0.00 H new ATOM 589 N MET A 39 0.235 -13.962 0.796 1.00 0.00 N ATOM 590 CA MET A 39 0.638 -13.693 2.195 1.00 0.00 C ATOM 591 C MET A 39 0.317 -12.237 2.536 1.00 0.00 C ATOM 592 O MET A 39 -0.089 -11.915 3.635 1.00 0.00 O ATOM 593 CB MET A 39 2.145 -13.961 2.237 1.00 0.00 C ATOM 594 CG MET A 39 2.380 -15.463 2.407 1.00 0.00 C ATOM 595 SD MET A 39 4.146 -15.825 2.258 1.00 0.00 S ATOM 596 CE MET A 39 4.029 -17.614 2.507 1.00 0.00 C ATOM 0 H MET A 39 0.998 -14.191 0.159 1.00 0.00 H new ATOM 0 HA MET A 39 0.114 -14.315 2.921 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.616 -13.608 1.319 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.602 -13.413 3.061 1.00 0.00 H new ATOM 0 HG2 MET A 39 2.013 -15.790 3.380 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.821 -16.016 1.652 1.00 0.00 H new ATOM 0 HE1 MET A 39 5.025 -18.055 2.454 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.594 -17.817 3.485 1.00 0.00 H new ATOM 0 HE3 MET A 39 3.398 -18.049 1.732 1.00 0.00 H new ATOM 606 N LEU A 40 0.476 -11.359 1.583 1.00 0.00 N ATOM 607 CA LEU A 40 0.160 -9.924 1.820 1.00 0.00 C ATOM 608 C LEU A 40 -1.320 -9.776 2.179 1.00 0.00 C ATOM 609 O LEU A 40 -1.691 -9.012 3.049 1.00 0.00 O ATOM 610 CB LEU A 40 0.474 -9.241 0.480 1.00 0.00 C ATOM 611 CG LEU A 40 -0.341 -7.951 0.336 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.170 -7.095 1.588 1.00 0.00 C ATOM 613 CD2 LEU A 40 0.150 -7.169 -0.884 1.00 0.00 C ATOM 0 H LEU A 40 0.813 -11.577 0.645 1.00 0.00 H new ATOM 0 HA LEU A 40 0.728 -9.488 2.642 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.539 -9.015 0.420 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.245 -9.918 -0.343 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.394 -8.202 0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.750 -6.178 1.484 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.521 -7.649 2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.883 -6.845 1.717 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.430 -6.252 -0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.203 -6.920 -0.757 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.027 -7.777 -1.780 1.00 0.00 H new ATOM 625 N LEU A 41 -2.164 -10.508 1.511 1.00 0.00 N ATOM 626 CA LEU A 41 -3.622 -10.422 1.800 1.00 0.00 C ATOM 627 C LEU A 41 -3.908 -10.863 3.233 1.00 0.00 C ATOM 628 O LEU A 41 -4.689 -10.252 3.935 1.00 0.00 O ATOM 629 CB LEU A 41 -4.267 -11.374 0.796 1.00 0.00 C ATOM 630 CG LEU A 41 -3.967 -10.873 -0.612 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.428 -11.907 -1.639 1.00 0.00 C ATOM 632 CD2 LEU A 41 -4.702 -9.555 -0.840 1.00 0.00 C ATOM 0 H LEU A 41 -1.907 -11.165 0.774 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.008 -9.407 1.709 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -3.879 -12.384 0.929 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.344 -11.423 0.959 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.894 -10.718 -0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.211 -11.544 -2.644 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -3.901 -12.846 -1.471 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.501 -12.069 -1.536 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.492 -9.190 -1.846 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.775 -9.712 -0.728 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.365 -8.819 -0.110 1.00 0.00 H new ATOM 644 N GLU A 42 -3.282 -11.914 3.682 1.00 0.00 N ATOM 645 CA GLU A 42 -3.531 -12.369 5.080 1.00 0.00 C ATOM 646 C GLU A 42 -3.148 -11.262 6.062 1.00 0.00 C ATOM 647 O GLU A 42 -3.835 -11.019 7.035 1.00 0.00 O ATOM 648 CB GLU A 42 -2.644 -13.596 5.284 1.00 0.00 C ATOM 649 CG GLU A 42 -2.939 -14.202 6.660 1.00 0.00 C ATOM 650 CD GLU A 42 -3.267 -15.689 6.505 1.00 0.00 C ATOM 651 OE1 GLU A 42 -2.426 -16.409 5.991 1.00 0.00 O ATOM 652 OE2 GLU A 42 -4.349 -16.084 6.904 1.00 0.00 O ATOM 0 H GLU A 42 -2.616 -12.473 3.149 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.581 -12.607 5.250 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.832 -14.331 4.501 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.593 -13.317 5.213 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -2.078 -14.075 7.317 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.775 -13.681 7.127 1.00 0.00 H new ATOM 659 N TYR A 43 -2.064 -10.583 5.814 1.00 0.00 N ATOM 660 CA TYR A 43 -1.657 -9.490 6.736 1.00 0.00 C ATOM 661 C TYR A 43 -2.708 -8.383 6.724 1.00 0.00 C ATOM 662 O TYR A 43 -3.163 -7.929 7.757 1.00 0.00 O ATOM 663 CB TYR A 43 -0.340 -8.965 6.179 1.00 0.00 C ATOM 664 CG TYR A 43 0.028 -7.692 6.899 1.00 0.00 C ATOM 665 CD1 TYR A 43 0.731 -7.748 8.108 1.00 0.00 C ATOM 666 CD2 TYR A 43 -0.332 -6.456 6.356 1.00 0.00 C ATOM 667 CE1 TYR A 43 1.076 -6.566 8.772 1.00 0.00 C ATOM 668 CE2 TYR A 43 0.010 -5.274 7.021 1.00 0.00 C ATOM 669 CZ TYR A 43 0.716 -5.328 8.228 1.00 0.00 C ATOM 670 OH TYR A 43 1.060 -4.161 8.878 1.00 0.00 O ATOM 0 H TYR A 43 -1.446 -10.737 5.017 1.00 0.00 H new ATOM 0 HA TYR A 43 -1.556 -9.836 7.765 1.00 0.00 H new ATOM 0 HB2 TYR A 43 0.446 -9.710 6.307 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.432 -8.779 5.109 1.00 0.00 H new ATOM 0 HD1 TYR A 43 1.007 -8.704 8.528 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -0.874 -6.413 5.423 1.00 0.00 H new ATOM 0 HE1 TYR A 43 1.620 -6.609 9.704 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -0.271 -4.319 6.603 1.00 0.00 H new ATOM 0 HH TYR A 43 1.187 -3.446 8.220 1.00 0.00 H new ATOM 680 N ALA A 44 -3.091 -7.942 5.558 1.00 0.00 N ATOM 681 CA ALA A 44 -4.106 -6.859 5.465 1.00 0.00 C ATOM 682 C ALA A 44 -5.503 -7.409 5.771 1.00 0.00 C ATOM 683 O ALA A 44 -6.320 -6.744 6.373 1.00 0.00 O ATOM 684 CB ALA A 44 -4.017 -6.363 4.022 1.00 0.00 C ATOM 0 H ALA A 44 -2.743 -8.287 4.663 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.926 -6.058 6.182 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.737 -5.559 3.869 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.011 -5.991 3.826 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.239 -7.184 3.341 1.00 0.00 H new ATOM 690 N GLN A 45 -5.784 -8.619 5.370 1.00 0.00 N ATOM 691 CA GLN A 45 -7.130 -9.207 5.644 1.00 0.00 C ATOM 692 C GLN A 45 -7.484 -9.109 7.126 1.00 0.00 C ATOM 693 O GLN A 45 -8.621 -9.294 7.511 1.00 0.00 O ATOM 694 CB GLN A 45 -7.012 -10.675 5.239 1.00 0.00 C ATOM 695 CG GLN A 45 -7.311 -10.814 3.752 1.00 0.00 C ATOM 696 CD GLN A 45 -6.966 -12.229 3.287 1.00 0.00 C ATOM 697 OE1 GLN A 45 -6.438 -13.019 4.042 1.00 0.00 O ATOM 698 NE2 GLN A 45 -7.245 -12.585 2.061 1.00 0.00 N ATOM 0 H GLN A 45 -5.140 -9.228 4.864 1.00 0.00 H new ATOM 0 HA GLN A 45 -7.912 -8.680 5.097 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.010 -11.044 5.456 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -7.708 -11.281 5.819 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.364 -10.605 3.562 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.733 -10.084 3.185 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.689 -11.922 1.426 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.019 -13.526 1.739 1.00 0.00 H new ATOM 707 N THR A 46 -6.524 -8.859 7.966 1.00 0.00 N ATOM 708 CA THR A 46 -6.828 -8.800 9.420 1.00 0.00 C ATOM 709 C THR A 46 -6.310 -7.493 10.027 1.00 0.00 C ATOM 710 O THR A 46 -6.336 -7.302 11.227 1.00 0.00 O ATOM 711 CB THR A 46 -6.101 -10.016 10.000 1.00 0.00 C ATOM 712 OG1 THR A 46 -4.725 -9.705 10.172 1.00 0.00 O ATOM 713 CG2 THR A 46 -6.243 -11.204 9.036 1.00 0.00 C ATOM 0 H THR A 46 -5.550 -8.694 7.713 1.00 0.00 H new ATOM 0 HA THR A 46 -7.897 -8.820 9.633 1.00 0.00 H new ATOM 0 HB THR A 46 -6.538 -10.277 10.964 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.626 -9.046 10.891 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.726 -12.071 9.448 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.299 -11.441 8.903 1.00 0.00 H new ATOM 0 HG23 THR A 46 -5.805 -10.945 8.072 1.00 0.00 H new ATOM 721 N HIS A 47 -5.847 -6.588 9.208 1.00 0.00 N ATOM 722 CA HIS A 47 -5.334 -5.291 9.737 1.00 0.00 C ATOM 723 C HIS A 47 -5.621 -4.165 8.736 1.00 0.00 C ATOM 724 O HIS A 47 -4.979 -3.133 8.745 1.00 0.00 O ATOM 725 CB HIS A 47 -3.825 -5.498 9.898 1.00 0.00 C ATOM 726 CG HIS A 47 -3.535 -6.068 11.261 1.00 0.00 C ATOM 727 ND1 HIS A 47 -3.854 -7.374 11.605 1.00 0.00 N ATOM 728 CD2 HIS A 47 -2.956 -5.519 12.378 1.00 0.00 C ATOM 729 CE1 HIS A 47 -3.467 -7.564 12.880 1.00 0.00 C ATOM 730 NE2 HIS A 47 -2.914 -6.464 13.398 1.00 0.00 N ATOM 0 H HIS A 47 -5.802 -6.691 8.194 1.00 0.00 H new ATOM 0 HA HIS A 47 -5.807 -5.009 10.677 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.456 -6.172 9.125 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.302 -4.550 9.771 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.589 -4.506 12.454 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.589 -8.492 13.418 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -2.541 -6.343 14.340 1.00 0.00 H new ATOM 738 N ARG A 48 -6.570 -4.371 7.862 1.00 0.00 N ATOM 739 CA ARG A 48 -6.887 -3.323 6.831 1.00 0.00 C ATOM 740 C ARG A 48 -6.855 -1.939 7.465 1.00 0.00 C ATOM 741 O ARG A 48 -6.161 -1.045 7.026 1.00 0.00 O ATOM 742 CB ARG A 48 -8.330 -3.572 6.346 1.00 0.00 C ATOM 743 CG ARG A 48 -8.727 -5.042 6.450 1.00 0.00 C ATOM 744 CD ARG A 48 -10.092 -5.245 5.791 1.00 0.00 C ATOM 745 NE ARG A 48 -11.080 -5.008 6.880 1.00 0.00 N ATOM 746 CZ ARG A 48 -12.359 -5.128 6.645 1.00 0.00 C ATOM 747 NH1 ARG A 48 -12.778 -5.459 5.453 1.00 0.00 N ATOM 748 NH2 ARG A 48 -13.221 -4.918 7.603 1.00 0.00 N ATOM 0 H ARG A 48 -7.141 -5.215 7.812 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.162 -3.375 6.019 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.019 -2.969 6.937 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.425 -3.244 5.311 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -7.979 -5.668 5.963 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -8.766 -5.347 7.496 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.240 -4.549 4.965 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -10.188 -6.251 5.382 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.757 -4.751 7.813 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.106 -5.624 4.704 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.777 -5.552 5.271 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.895 -4.660 8.535 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -14.220 -5.012 7.420 1.00 0.00 H new ATOM 762 N ASP A 49 -7.635 -1.761 8.487 1.00 0.00 N ATOM 763 CA ASP A 49 -7.708 -0.435 9.165 1.00 0.00 C ATOM 764 C ASP A 49 -6.397 -0.110 9.883 1.00 0.00 C ATOM 765 O ASP A 49 -6.159 1.017 10.270 1.00 0.00 O ATOM 766 CB ASP A 49 -8.847 -0.573 10.176 1.00 0.00 C ATOM 767 CG ASP A 49 -10.146 -0.906 9.439 1.00 0.00 C ATOM 768 OD1 ASP A 49 -10.329 -2.063 9.091 1.00 0.00 O ATOM 769 OD2 ASP A 49 -10.937 -0.001 9.232 1.00 0.00 O ATOM 0 H ASP A 49 -8.233 -2.483 8.889 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.878 0.373 8.453 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -8.614 -1.357 10.897 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -8.963 0.354 10.738 1.00 0.00 H new ATOM 774 N GLN A 50 -5.550 -1.080 10.079 1.00 0.00 N ATOM 775 CA GLN A 50 -4.269 -0.802 10.790 1.00 0.00 C ATOM 776 C GLN A 50 -3.102 -0.644 9.807 1.00 0.00 C ATOM 777 O GLN A 50 -1.978 -0.425 10.210 1.00 0.00 O ATOM 778 CB GLN A 50 -4.059 -2.001 11.712 1.00 0.00 C ATOM 779 CG GLN A 50 -5.266 -2.125 12.645 1.00 0.00 C ATOM 780 CD GLN A 50 -4.882 -2.923 13.890 1.00 0.00 C ATOM 781 OE1 GLN A 50 -3.939 -3.688 13.874 1.00 0.00 O ATOM 782 NE2 GLN A 50 -5.578 -2.772 14.983 1.00 0.00 N ATOM 0 H GLN A 50 -5.686 -2.046 9.781 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.311 0.135 11.345 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -3.941 -2.912 11.125 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.145 -1.875 12.292 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -5.618 -1.134 12.932 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.088 -2.618 12.126 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.370 -2.130 14.998 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.330 -3.296 15.822 1.00 0.00 H new ATOM 791 N ILE A 51 -3.350 -0.728 8.526 1.00 0.00 N ATOM 792 CA ILE A 51 -2.229 -0.549 7.551 1.00 0.00 C ATOM 793 C ILE A 51 -2.139 0.927 7.159 1.00 0.00 C ATOM 794 O ILE A 51 -3.087 1.505 6.662 1.00 0.00 O ATOM 795 CB ILE A 51 -2.579 -1.407 6.329 1.00 0.00 C ATOM 796 CG1 ILE A 51 -2.894 -2.853 6.748 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.395 -1.417 5.359 1.00 0.00 C ATOM 798 CD1 ILE A 51 -2.080 -3.249 7.986 1.00 0.00 C ATOM 0 H ILE A 51 -4.266 -0.910 8.115 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.269 -0.848 7.971 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.459 -0.980 5.848 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.959 -2.952 6.960 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.668 -3.532 5.926 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.642 -2.026 4.490 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.179 -0.398 5.038 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.520 -1.834 5.857 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.318 -4.275 8.265 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -1.016 -3.172 7.762 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.326 -2.582 8.812 1.00 0.00 H new ATOM 810 N ASP A 52 -1.018 1.550 7.392 1.00 0.00 N ATOM 811 CA ASP A 52 -0.888 2.994 7.048 1.00 0.00 C ATOM 812 C ASP A 52 -0.429 3.189 5.601 1.00 0.00 C ATOM 813 O ASP A 52 -0.698 4.206 5.007 1.00 0.00 O ATOM 814 CB ASP A 52 0.158 3.545 8.014 1.00 0.00 C ATOM 815 CG ASP A 52 -0.504 3.878 9.353 1.00 0.00 C ATOM 816 OD1 ASP A 52 -1.499 3.248 9.671 1.00 0.00 O ATOM 817 OD2 ASP A 52 -0.006 4.758 10.035 1.00 0.00 O ATOM 0 H ASP A 52 -0.188 1.124 7.804 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.846 3.507 7.135 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.952 2.813 8.162 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.621 4.438 7.594 1.00 0.00 H new ATOM 822 N CYS A 53 0.276 2.243 5.034 1.00 0.00 N ATOM 823 CA CYS A 53 0.751 2.415 3.624 1.00 0.00 C ATOM 824 C CYS A 53 1.129 1.057 3.016 1.00 0.00 C ATOM 825 O CYS A 53 1.761 0.241 3.651 1.00 0.00 O ATOM 826 CB CYS A 53 1.985 3.312 3.746 1.00 0.00 C ATOM 827 SG CYS A 53 2.249 4.207 2.195 1.00 0.00 S ATOM 0 H CYS A 53 0.542 1.365 5.480 1.00 0.00 H new ATOM 0 HA CYS A 53 -0.012 2.844 2.975 1.00 0.00 H new ATOM 0 HB2 CYS A 53 1.853 4.018 4.566 1.00 0.00 H new ATOM 0 HB3 CYS A 53 2.862 2.709 3.982 1.00 0.00 H new ATOM 0 HG CYS A 53 1.443 3.746 1.285 1.00 0.00 H new ATOM 833 N LEU A 54 0.751 0.799 1.792 1.00 0.00 N ATOM 834 CA LEU A 54 1.107 -0.521 1.181 1.00 0.00 C ATOM 835 C LEU A 54 2.158 -0.341 0.079 1.00 0.00 C ATOM 836 O LEU A 54 2.006 0.473 -0.807 1.00 0.00 O ATOM 837 CB LEU A 54 -0.205 -1.050 0.596 1.00 0.00 C ATOM 838 CG LEU A 54 0.069 -2.261 -0.301 1.00 0.00 C ATOM 839 CD1 LEU A 54 0.793 -3.343 0.500 1.00 0.00 C ATOM 840 CD2 LEU A 54 -1.260 -2.819 -0.820 1.00 0.00 C ATOM 0 H LEU A 54 0.219 1.432 1.195 1.00 0.00 H new ATOM 0 HA LEU A 54 1.538 -1.208 1.910 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.884 -1.330 1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.698 -0.266 0.021 1.00 0.00 H new ATOM 0 HG LEU A 54 0.693 -1.954 -1.141 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.986 -4.203 -0.142 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.738 -2.949 0.873 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.171 -3.650 1.341 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.068 -3.681 -1.459 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.881 -3.123 0.023 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.778 -2.051 -1.394 1.00 0.00 H new ATOM 852 N ILE A 55 3.221 -1.107 0.114 1.00 0.00 N ATOM 853 CA ILE A 55 4.253 -0.971 -0.953 1.00 0.00 C ATOM 854 C ILE A 55 4.074 -2.105 -1.954 1.00 0.00 C ATOM 855 O ILE A 55 4.053 -3.265 -1.594 1.00 0.00 O ATOM 856 CB ILE A 55 5.602 -1.097 -0.250 1.00 0.00 C ATOM 857 CG1 ILE A 55 5.701 -0.060 0.866 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.725 -0.862 -1.261 1.00 0.00 C ATOM 859 CD1 ILE A 55 6.741 -0.528 1.880 1.00 0.00 C ATOM 0 H ILE A 55 3.415 -1.811 0.826 1.00 0.00 H new ATOM 0 HA ILE A 55 4.177 -0.024 -1.488 1.00 0.00 H new ATOM 0 HB ILE A 55 5.694 -2.096 0.176 1.00 0.00 H new ATOM 0 HG12 ILE A 55 5.983 0.910 0.456 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.733 0.068 1.350 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.689 -0.952 -0.761 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.659 -1.604 -2.057 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.628 0.137 -1.687 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.822 0.205 2.683 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.438 -1.489 2.295 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.708 -0.634 1.387 1.00 0.00 H new ATOM 871 N LEU A 56 3.929 -1.787 -3.203 1.00 0.00 N ATOM 872 CA LEU A 56 3.732 -2.860 -4.205 1.00 0.00 C ATOM 873 C LEU A 56 4.729 -2.733 -5.348 1.00 0.00 C ATOM 874 O LEU A 56 5.222 -1.664 -5.653 1.00 0.00 O ATOM 875 CB LEU A 56 2.305 -2.668 -4.701 1.00 0.00 C ATOM 876 CG LEU A 56 1.335 -3.119 -3.610 1.00 0.00 C ATOM 877 CD1 LEU A 56 -0.098 -2.839 -4.054 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.508 -4.619 -3.368 1.00 0.00 C ATOM 0 H LEU A 56 3.938 -0.836 -3.572 1.00 0.00 H new ATOM 0 HA LEU A 56 3.890 -3.851 -3.780 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.131 -1.621 -4.951 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.142 -3.244 -5.612 1.00 0.00 H new ATOM 0 HG LEU A 56 1.543 -2.573 -2.690 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.790 -3.161 -3.275 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.222 -1.771 -4.230 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.307 -3.385 -4.974 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.817 -4.944 -2.590 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.299 -5.163 -4.289 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.531 -4.821 -3.052 1.00 0.00 H new ATOM 890 N VAL A 57 5.022 -3.826 -5.982 1.00 0.00 N ATOM 891 CA VAL A 57 5.984 -3.807 -7.115 1.00 0.00 C ATOM 892 C VAL A 57 5.254 -4.191 -8.406 1.00 0.00 C ATOM 893 O VAL A 57 4.579 -5.198 -8.469 1.00 0.00 O ATOM 894 CB VAL A 57 7.036 -4.856 -6.750 1.00 0.00 C ATOM 895 CG1 VAL A 57 7.935 -5.127 -7.955 1.00 0.00 C ATOM 896 CG2 VAL A 57 7.890 -4.338 -5.589 1.00 0.00 C ATOM 0 H VAL A 57 4.633 -4.743 -5.763 1.00 0.00 H new ATOM 0 HA VAL A 57 6.434 -2.828 -7.278 1.00 0.00 H new ATOM 0 HB VAL A 57 6.536 -5.779 -6.456 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.683 -5.875 -7.690 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.331 -5.496 -8.784 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.434 -4.204 -8.252 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.640 -5.084 -5.328 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.386 -3.414 -5.886 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.253 -4.147 -4.726 1.00 0.00 H new ATOM 906 N ALA A 58 5.367 -3.389 -9.426 1.00 0.00 N ATOM 907 CA ALA A 58 4.661 -3.703 -10.703 1.00 0.00 C ATOM 908 C ALA A 58 5.437 -4.732 -11.524 1.00 0.00 C ATOM 909 O ALA A 58 4.963 -5.217 -12.531 1.00 0.00 O ATOM 910 CB ALA A 58 4.594 -2.377 -11.444 1.00 0.00 C ATOM 0 H ALA A 58 5.917 -2.530 -9.433 1.00 0.00 H new ATOM 0 HA ALA A 58 3.675 -4.133 -10.525 1.00 0.00 H new ATOM 0 HB1 ALA A 58 4.087 -2.519 -12.399 1.00 0.00 H new ATOM 0 HB2 ALA A 58 4.042 -1.653 -10.845 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.604 -2.008 -11.621 1.00 0.00 H new ATOM 916 N ALA A 59 6.622 -5.067 -11.109 1.00 0.00 N ATOM 917 CA ALA A 59 7.416 -6.062 -11.878 1.00 0.00 C ATOM 918 C ALA A 59 6.738 -7.439 -11.826 1.00 0.00 C ATOM 919 O ALA A 59 7.097 -8.344 -12.551 1.00 0.00 O ATOM 920 CB ALA A 59 8.776 -6.095 -11.186 1.00 0.00 C ATOM 0 H ALA A 59 7.076 -4.697 -10.274 1.00 0.00 H new ATOM 0 HA ALA A 59 7.505 -5.800 -12.932 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.425 -6.808 -11.694 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.227 -5.103 -11.223 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.648 -6.397 -10.147 1.00 0.00 H new ATOM 926 N ASN A 60 5.755 -7.603 -10.977 1.00 0.00 N ATOM 927 CA ASN A 60 5.060 -8.924 -10.891 1.00 0.00 C ATOM 928 C ASN A 60 3.875 -8.974 -11.863 1.00 0.00 C ATOM 929 O ASN A 60 3.251 -7.967 -12.133 1.00 0.00 O ATOM 930 CB ASN A 60 4.569 -9.025 -9.448 1.00 0.00 C ATOM 931 CG ASN A 60 5.632 -9.709 -8.585 1.00 0.00 C ATOM 932 OD1 ASN A 60 6.411 -10.502 -9.075 1.00 0.00 O ATOM 933 ND2 ASN A 60 5.696 -9.441 -7.309 1.00 0.00 N ATOM 0 H ASN A 60 5.405 -6.884 -10.343 1.00 0.00 H new ATOM 0 HA ASN A 60 5.721 -9.749 -11.157 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.355 -8.030 -9.057 1.00 0.00 H new ATOM 0 HB3 ASN A 60 3.638 -9.590 -9.410 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.399 -9.897 -6.727 1.00 0.00 H new ATOM 0 HD22 ASN A 60 5.044 -8.776 -6.894 1.00 0.00 H new ATOM 940 N PRO A 61 3.607 -10.157 -12.357 1.00 0.00 N ATOM 941 CA PRO A 61 2.488 -10.356 -13.314 1.00 0.00 C ATOM 942 C PRO A 61 1.125 -10.303 -12.610 1.00 0.00 C ATOM 943 O PRO A 61 0.330 -9.419 -12.854 1.00 0.00 O ATOM 944 CB PRO A 61 2.756 -11.742 -13.895 1.00 0.00 C ATOM 945 CG PRO A 61 3.579 -12.455 -12.869 1.00 0.00 C ATOM 946 CD PRO A 61 4.323 -11.407 -12.075 1.00 0.00 C ATOM 0 HA PRO A 61 2.445 -9.577 -14.075 1.00 0.00 H new ATOM 0 HB2 PRO A 61 1.824 -12.273 -14.088 1.00 0.00 H new ATOM 0 HB3 PRO A 61 3.287 -11.673 -14.845 1.00 0.00 H new ATOM 0 HG2 PRO A 61 2.943 -13.052 -12.215 1.00 0.00 H new ATOM 0 HG3 PRO A 61 4.278 -13.141 -13.347 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.316 -11.637 -11.010 1.00 0.00 H new ATOM 0 HD3 PRO A 61 5.367 -11.344 -12.381 1.00 0.00 H new ATOM 954 N SER A 62 0.842 -11.241 -11.747 1.00 0.00 N ATOM 955 CA SER A 62 -0.483 -11.231 -11.045 1.00 0.00 C ATOM 956 C SER A 62 -0.545 -10.107 -10.007 1.00 0.00 C ATOM 957 O SER A 62 -1.496 -10.003 -9.256 1.00 0.00 O ATOM 958 CB SER A 62 -0.595 -12.587 -10.346 1.00 0.00 C ATOM 959 OG SER A 62 0.061 -13.579 -11.122 1.00 0.00 O ATOM 0 H SER A 62 1.463 -12.010 -11.496 1.00 0.00 H new ATOM 0 HA SER A 62 -1.297 -11.063 -11.750 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.148 -12.534 -9.353 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.644 -12.852 -10.210 1.00 0.00 H new ATOM 0 HG SER A 62 -0.010 -14.447 -10.672 1.00 0.00 H new ATOM 965 N PHE A 63 0.455 -9.274 -9.943 1.00 0.00 N ATOM 966 CA PHE A 63 0.443 -8.174 -8.943 1.00 0.00 C ATOM 967 C PHE A 63 -0.878 -7.389 -9.009 1.00 0.00 C ATOM 968 O PHE A 63 -1.534 -7.189 -8.006 1.00 0.00 O ATOM 969 CB PHE A 63 1.642 -7.298 -9.324 1.00 0.00 C ATOM 970 CG PHE A 63 1.419 -5.877 -8.871 1.00 0.00 C ATOM 971 CD1 PHE A 63 1.038 -5.609 -7.555 1.00 0.00 C ATOM 972 CD2 PHE A 63 1.596 -4.829 -9.778 1.00 0.00 C ATOM 973 CE1 PHE A 63 0.833 -4.290 -7.148 1.00 0.00 C ATOM 974 CE2 PHE A 63 1.391 -3.509 -9.372 1.00 0.00 C ATOM 975 CZ PHE A 63 1.010 -3.236 -8.055 1.00 0.00 C ATOM 0 H PHE A 63 1.281 -9.308 -10.541 1.00 0.00 H new ATOM 0 HA PHE A 63 0.516 -8.537 -7.918 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.549 -7.694 -8.868 1.00 0.00 H new ATOM 0 HB3 PHE A 63 1.791 -7.323 -10.404 1.00 0.00 H new ATOM 0 HD1 PHE A 63 0.902 -6.420 -6.854 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.892 -5.040 -10.795 1.00 0.00 H new ATOM 0 HE1 PHE A 63 0.537 -4.081 -6.131 1.00 0.00 H new ATOM 0 HE2 PHE A 63 1.527 -2.700 -10.074 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.852 -2.216 -7.737 1.00 0.00 H new ATOM 985 N ARG A 64 -1.281 -6.945 -10.170 1.00 0.00 N ATOM 986 CA ARG A 64 -2.564 -6.182 -10.258 1.00 0.00 C ATOM 987 C ARG A 64 -3.705 -7.017 -9.679 1.00 0.00 C ATOM 988 O ARG A 64 -4.608 -6.504 -9.048 1.00 0.00 O ATOM 989 CB ARG A 64 -2.789 -5.924 -11.749 1.00 0.00 C ATOM 990 CG ARG A 64 -2.271 -4.531 -12.108 1.00 0.00 C ATOM 991 CD ARG A 64 -0.769 -4.597 -12.390 1.00 0.00 C ATOM 992 NE ARG A 64 -0.634 -4.256 -13.832 1.00 0.00 N ATOM 993 CZ ARG A 64 0.544 -4.239 -14.395 1.00 0.00 C ATOM 994 NH1 ARG A 64 1.612 -4.508 -13.693 1.00 0.00 N ATOM 995 NH2 ARG A 64 0.653 -3.951 -15.663 1.00 0.00 N ATOM 0 H ARG A 64 -0.786 -7.074 -11.052 1.00 0.00 H new ATOM 0 HA ARG A 64 -2.526 -5.250 -9.694 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.273 -6.680 -12.342 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.850 -6.002 -11.987 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.799 -4.150 -12.982 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.467 -3.837 -11.290 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -0.219 -3.894 -11.765 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -0.371 -5.590 -12.180 1.00 0.00 H new ATOM 0 HE ARG A 64 -1.464 -4.035 -14.382 1.00 0.00 H new ATOM 0 HH11 ARG A 64 1.527 -4.732 -12.702 1.00 0.00 H new ATOM 0 HH12 ARG A 64 2.531 -4.494 -14.136 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -0.181 -3.740 -16.212 1.00 0.00 H new ATOM 0 HH22 ARG A 64 1.572 -3.937 -16.106 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.664 -8.304 -9.882 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.736 -9.184 -9.335 1.00 0.00 C ATOM 1011 C ALA A 65 -4.694 -9.162 -7.805 1.00 0.00 C ATOM 1012 O ALA A 65 -5.709 -9.113 -7.138 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.399 -10.580 -9.864 1.00 0.00 C ATOM 0 H ALA A 65 -2.933 -8.786 -10.404 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.735 -8.866 -9.632 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.142 -11.293 -9.507 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.403 -10.567 -10.954 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.412 -10.875 -9.508 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.520 -9.187 -7.243 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.400 -9.155 -5.759 1.00 0.00 C ATOM 1021 C VAL A 66 -3.908 -7.811 -5.231 1.00 0.00 C ATOM 1022 O VAL A 66 -4.572 -7.736 -4.212 1.00 0.00 O ATOM 1023 CB VAL A 66 -1.901 -9.312 -5.499 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.561 -8.967 -4.047 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.489 -10.758 -5.781 1.00 0.00 C ATOM 0 H VAL A 66 -2.635 -9.228 -7.748 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.984 -9.931 -5.264 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.361 -8.630 -6.156 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.490 -9.086 -3.886 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.846 -7.935 -3.842 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.105 -9.634 -3.378 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.421 -10.875 -5.597 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -2.045 -11.429 -5.127 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.707 -11.002 -6.821 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.598 -6.748 -5.917 1.00 0.00 N ATOM 1036 CA VAL A 67 -4.057 -5.412 -5.456 1.00 0.00 C ATOM 1037 C VAL A 67 -5.586 -5.326 -5.501 1.00 0.00 C ATOM 1038 O VAL A 67 -6.203 -4.805 -4.593 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.422 -4.415 -6.419 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.521 -3.016 -5.817 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -1.950 -4.773 -6.625 1.00 0.00 C ATOM 0 H VAL A 67 -3.047 -6.747 -6.776 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.767 -5.211 -4.425 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.940 -4.446 -7.378 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.070 -2.294 -6.498 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.569 -2.761 -5.660 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -2.995 -2.993 -4.863 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.495 -4.061 -7.313 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.429 -4.736 -5.668 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.875 -5.778 -7.041 1.00 0.00 H new ATOM 1051 N GLN A 68 -6.218 -5.846 -6.526 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.703 -5.786 -6.553 1.00 0.00 C ATOM 1053 C GLN A 68 -8.236 -6.632 -5.399 1.00 0.00 C ATOM 1054 O GLN A 68 -9.291 -6.371 -4.854 1.00 0.00 O ATOM 1055 CB GLN A 68 -8.141 -6.341 -7.916 1.00 0.00 C ATOM 1056 CG GLN A 68 -7.740 -7.810 -8.050 1.00 0.00 C ATOM 1057 CD GLN A 68 -8.684 -8.507 -9.035 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -8.674 -8.210 -10.214 1.00 0.00 O ATOM 1059 NE2 GLN A 68 -9.506 -9.423 -8.602 1.00 0.00 N ATOM 0 H GLN A 68 -5.777 -6.299 -7.326 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.089 -4.774 -6.433 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -9.221 -6.241 -8.026 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -7.684 -5.759 -8.716 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -6.710 -7.887 -8.399 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -7.784 -8.301 -7.078 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.516 -9.673 -7.613 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -10.139 -9.889 -9.252 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.489 -7.630 -5.000 1.00 0.00 N ATOM 1069 CA GLN A 69 -7.931 -8.472 -3.855 1.00 0.00 C ATOM 1070 C GLN A 69 -8.040 -7.588 -2.610 1.00 0.00 C ATOM 1071 O GLN A 69 -9.003 -7.656 -1.871 1.00 0.00 O ATOM 1072 CB GLN A 69 -6.842 -9.531 -3.679 1.00 0.00 C ATOM 1073 CG GLN A 69 -7.341 -10.620 -2.728 1.00 0.00 C ATOM 1074 CD GLN A 69 -7.331 -11.971 -3.447 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -6.283 -12.541 -3.678 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -8.461 -12.509 -3.815 1.00 0.00 N ATOM 0 H GLN A 69 -6.597 -7.895 -5.417 1.00 0.00 H new ATOM 0 HA GLN A 69 -8.902 -8.939 -4.020 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -6.583 -9.966 -4.644 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -5.936 -9.074 -3.282 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -6.707 -10.663 -1.843 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -8.349 -10.385 -2.387 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -9.341 -12.031 -3.621 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -8.465 -13.408 -4.297 1.00 0.00 H new ATOM 1085 N LEU A 70 -7.071 -6.735 -2.392 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.143 -5.827 -1.211 1.00 0.00 C ATOM 1087 C LEU A 70 -8.399 -4.963 -1.333 1.00 0.00 C ATOM 1088 O LEU A 70 -9.195 -4.866 -0.419 1.00 0.00 O ATOM 1089 CB LEU A 70 -5.883 -4.959 -1.291 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.739 -5.637 -0.534 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.506 -5.712 -1.429 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.397 -4.820 0.712 1.00 0.00 C ATOM 0 H LEU A 70 -6.241 -6.629 -2.976 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.194 -6.363 -0.263 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.601 -4.805 -2.333 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.080 -3.975 -0.866 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.047 -6.642 -0.246 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.692 -6.195 -0.888 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.740 -6.289 -2.323 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.203 -4.705 -1.716 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.582 -5.303 1.251 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.092 -3.816 0.416 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.273 -4.758 1.358 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.590 -4.351 -2.471 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.802 -3.509 -2.681 1.00 0.00 C ATOM 1106 C CYS A 71 -11.061 -4.371 -2.535 1.00 0.00 C ATOM 1107 O CYS A 71 -12.054 -3.951 -1.979 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.682 -2.996 -4.118 1.00 0.00 C ATOM 1109 SG CYS A 71 -8.060 -2.234 -4.365 1.00 0.00 S ATOM 0 H CYS A 71 -7.955 -4.399 -3.268 1.00 0.00 H new ATOM 0 HA CYS A 71 -9.874 -2.695 -1.959 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.818 -3.819 -4.820 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.469 -2.270 -4.321 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.164 -3.162 -4.522 1.00 0.00 H new ATOM 1115 N PHE A 72 -11.019 -5.575 -3.042 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.206 -6.478 -2.949 1.00 0.00 C ATOM 1117 C PHE A 72 -12.617 -6.667 -1.487 1.00 0.00 C ATOM 1118 O PHE A 72 -13.762 -6.487 -1.124 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.722 -7.799 -3.548 1.00 0.00 C ATOM 1120 CG PHE A 72 -12.827 -8.828 -3.501 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -13.934 -8.712 -4.350 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -12.739 -9.904 -2.611 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -14.953 -9.673 -4.309 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -13.757 -10.865 -2.569 1.00 0.00 C ATOM 1125 CZ PHE A 72 -14.864 -10.749 -3.418 1.00 0.00 C ATOM 0 H PHE A 72 -10.210 -5.974 -3.519 1.00 0.00 H new ATOM 0 HA PHE A 72 -13.078 -6.081 -3.468 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.403 -7.644 -4.579 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.854 -8.161 -2.996 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -14.003 -7.881 -5.037 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -11.885 -9.994 -1.956 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -15.807 -9.584 -4.965 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -13.688 -11.695 -1.882 1.00 0.00 H new ATOM 0 HZ PHE A 72 -15.649 -11.490 -3.386 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.687 -7.014 -0.642 1.00 0.00 N ATOM 1136 CA GLU A 73 -12.021 -7.199 0.798 1.00 0.00 C ATOM 1137 C GLU A 73 -12.382 -5.846 1.415 1.00 0.00 C ATOM 1138 O GLU A 73 -13.064 -5.768 2.417 1.00 0.00 O ATOM 1139 CB GLU A 73 -10.748 -7.765 1.430 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.407 -9.106 0.779 1.00 0.00 C ATOM 1141 CD GLU A 73 -11.294 -10.204 1.370 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -12.380 -9.881 1.828 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -10.874 -11.349 1.356 1.00 0.00 O ATOM 0 H GLU A 73 -10.710 -7.178 -0.886 1.00 0.00 H new ATOM 0 HA GLU A 73 -12.872 -7.861 0.954 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -9.923 -7.065 1.300 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -10.889 -7.895 2.503 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -10.555 -9.046 -0.299 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.356 -9.345 0.944 1.00 0.00 H new ATOM 1150 N GLY A 74 -11.923 -4.780 0.818 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.227 -3.427 1.358 1.00 0.00 C ATOM 1152 C GLY A 74 -10.961 -2.829 1.970 1.00 0.00 C ATOM 1153 O GLY A 74 -10.993 -1.797 2.610 1.00 0.00 O ATOM 0 H GLY A 74 -11.348 -4.790 -0.024 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.600 -2.781 0.563 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.013 -3.492 2.111 1.00 0.00 H new ATOM 1157 N VAL A 75 -9.844 -3.474 1.781 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.576 -2.952 2.353 1.00 0.00 C ATOM 1159 C VAL A 75 -7.980 -1.873 1.447 1.00 0.00 C ATOM 1160 O VAL A 75 -7.234 -2.161 0.532 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.658 -4.170 2.401 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.387 -3.826 3.176 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.390 -5.324 3.091 1.00 0.00 C ATOM 0 H VAL A 75 -9.756 -4.342 1.253 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.718 -2.493 3.331 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.387 -4.465 1.387 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.734 -4.698 3.209 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.870 -3.004 2.681 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.649 -3.531 4.192 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.739 -6.197 3.128 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.660 -5.029 4.105 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.293 -5.568 2.532 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.288 -0.631 1.702 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.721 0.456 0.857 1.00 0.00 C ATOM 1175 C VAL A 76 -6.693 1.251 1.666 1.00 0.00 C ATOM 1176 O VAL A 76 -6.950 1.665 2.777 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.901 1.346 0.473 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.451 2.331 -0.604 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -10.045 0.483 -0.067 1.00 0.00 C ATOM 0 H VAL A 76 -8.904 -0.324 2.455 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.216 0.066 -0.027 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.249 1.891 1.350 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.288 2.971 -0.884 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.638 2.946 -0.218 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.106 1.781 -1.479 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.885 1.122 -0.340 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.704 -0.064 -0.946 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.361 -0.224 0.700 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.527 1.454 1.120 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.472 2.211 1.857 1.00 0.00 C ATOM 1191 C VAL A 77 -3.623 3.010 0.877 1.00 0.00 C ATOM 1192 O VAL A 77 -3.635 2.741 -0.301 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.609 1.132 2.507 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.348 0.524 3.698 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -3.310 0.039 1.475 1.00 0.00 C ATOM 0 H VAL A 77 -5.256 1.128 0.192 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.894 2.910 2.579 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.676 1.574 2.856 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.727 -0.245 4.157 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.562 1.303 4.430 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.283 0.080 3.358 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.694 -0.735 1.933 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.246 -0.400 1.128 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.778 0.473 0.629 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.877 3.943 1.397 1.00 0.00 N ATOM 1206 CA PRO A 78 -1.987 4.747 0.535 1.00 0.00 C ATOM 1207 C PRO A 78 -0.890 3.825 0.022 1.00 0.00 C ATOM 1208 O PRO A 78 0.057 3.517 0.718 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.440 5.818 1.470 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.561 5.226 2.829 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.776 4.330 2.805 1.00 0.00 C ATOM 0 HA PRO A 78 -2.468 5.198 -0.333 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.404 6.059 1.233 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -2.009 6.744 1.389 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.666 4.658 3.085 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.670 6.006 3.583 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.650 3.463 3.453 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.670 4.854 3.144 1.00 0.00 H new ATOM 1219 N ALA A 79 -1.051 3.331 -1.166 1.00 0.00 N ATOM 1220 CA ALA A 79 -0.066 2.367 -1.712 1.00 0.00 C ATOM 1221 C ALA A 79 0.909 3.017 -2.693 1.00 0.00 C ATOM 1222 O ALA A 79 0.527 3.775 -3.564 1.00 0.00 O ATOM 1223 CB ALA A 79 -0.942 1.351 -2.432 1.00 0.00 C ATOM 0 H ALA A 79 -1.828 3.555 -1.788 1.00 0.00 H new ATOM 0 HA ALA A 79 0.563 1.940 -0.931 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.313 0.581 -2.880 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.627 0.891 -1.719 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.514 1.852 -3.213 1.00 0.00 H new ATOM 1229 N ILE A 80 2.167 2.691 -2.573 1.00 0.00 N ATOM 1230 CA ILE A 80 3.183 3.243 -3.507 1.00 0.00 C ATOM 1231 C ILE A 80 3.563 2.142 -4.505 1.00 0.00 C ATOM 1232 O ILE A 80 4.000 1.076 -4.117 1.00 0.00 O ATOM 1233 CB ILE A 80 4.375 3.612 -2.617 1.00 0.00 C ATOM 1234 CG1 ILE A 80 3.877 4.425 -1.413 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.368 4.453 -3.421 1.00 0.00 C ATOM 1236 CD1 ILE A 80 4.967 4.489 -0.339 1.00 0.00 C ATOM 0 H ILE A 80 2.535 2.060 -1.861 1.00 0.00 H new ATOM 0 HA ILE A 80 2.835 4.106 -4.075 1.00 0.00 H new ATOM 0 HB ILE A 80 4.866 2.703 -2.268 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.607 5.432 -1.730 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.976 3.968 -1.002 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.217 4.716 -2.790 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.719 3.880 -4.280 1.00 0.00 H new ATOM 0 HG23 ILE A 80 4.877 5.363 -3.768 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.606 5.067 0.512 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.215 3.479 -0.012 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.856 4.966 -0.751 1.00 0.00 H new ATOM 1248 N VAL A 81 3.381 2.366 -5.780 1.00 0.00 N ATOM 1249 CA VAL A 81 3.717 1.293 -6.764 1.00 0.00 C ATOM 1250 C VAL A 81 5.104 1.525 -7.361 1.00 0.00 C ATOM 1251 O VAL A 81 5.442 2.616 -7.780 1.00 0.00 O ATOM 1252 CB VAL A 81 2.637 1.380 -7.841 1.00 0.00 C ATOM 1253 CG1 VAL A 81 2.950 0.380 -8.955 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.276 1.040 -7.224 1.00 0.00 C ATOM 0 H VAL A 81 3.020 3.232 -6.179 1.00 0.00 H new ATOM 0 HA VAL A 81 3.742 0.307 -6.299 1.00 0.00 H new ATOM 0 HB VAL A 81 2.612 2.389 -8.251 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.181 0.440 -9.725 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.920 0.615 -9.393 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.972 -0.629 -8.543 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.503 1.101 -7.991 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.303 0.029 -6.817 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.052 1.747 -6.425 1.00 0.00 H new ATOM 1264 N VAL A 82 5.916 0.503 -7.394 1.00 0.00 N ATOM 1265 CA VAL A 82 7.292 0.654 -7.951 1.00 0.00 C ATOM 1266 C VAL A 82 7.386 0.028 -9.344 1.00 0.00 C ATOM 1267 O VAL A 82 6.769 -0.982 -9.625 1.00 0.00 O ATOM 1268 CB VAL A 82 8.199 -0.104 -6.984 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.649 0.325 -7.211 1.00 0.00 C ATOM 1270 CG2 VAL A 82 7.789 0.203 -5.543 1.00 0.00 C ATOM 0 H VAL A 82 5.686 -0.432 -7.059 1.00 0.00 H new ATOM 0 HA VAL A 82 7.570 1.703 -8.051 1.00 0.00 H new ATOM 0 HB VAL A 82 8.104 -1.176 -7.160 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.300 -0.214 -6.523 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.939 0.099 -8.237 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.743 1.397 -7.036 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.439 -0.340 -4.856 1.00 0.00 H new ATOM 0 HG22 VAL A 82 7.880 1.273 -5.359 1.00 0.00 H new ATOM 0 HG23 VAL A 82 6.756 -0.106 -5.385 1.00 0.00 H new ATOM 1280 N GLY A 83 8.169 0.610 -10.212 1.00 0.00 N ATOM 1281 CA GLY A 83 8.321 0.039 -11.580 1.00 0.00 C ATOM 1282 C GLY A 83 7.346 0.716 -12.544 1.00 0.00 C ATOM 1283 O GLY A 83 7.292 0.390 -13.713 1.00 0.00 O ATOM 0 H GLY A 83 8.710 1.456 -10.032 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.344 0.178 -11.929 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.135 -1.035 -11.557 1.00 0.00 H new ATOM 1287 N ASP A 84 6.571 1.649 -12.068 1.00 0.00 N ATOM 1288 CA ASP A 84 5.596 2.333 -12.968 1.00 0.00 C ATOM 1289 C ASP A 84 6.253 3.518 -13.681 1.00 0.00 C ATOM 1290 O ASP A 84 6.626 4.498 -13.066 1.00 0.00 O ATOM 1291 CB ASP A 84 4.480 2.822 -12.041 1.00 0.00 C ATOM 1292 CG ASP A 84 3.300 3.327 -12.877 1.00 0.00 C ATOM 1293 OD1 ASP A 84 3.405 3.300 -14.092 1.00 0.00 O ATOM 1294 OD2 ASP A 84 2.313 3.735 -12.286 1.00 0.00 O ATOM 0 H ASP A 84 6.568 1.968 -11.099 1.00 0.00 H new ATOM 0 HA ASP A 84 5.225 1.667 -13.747 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.155 2.012 -11.388 1.00 0.00 H new ATOM 0 HB3 ASP A 84 4.851 3.620 -11.398 1.00 0.00 H new ATOM 1299 N ARG A 85 6.384 3.441 -14.980 1.00 0.00 N ATOM 1300 CA ARG A 85 7.000 4.570 -15.738 1.00 0.00 C ATOM 1301 C ARG A 85 5.962 5.678 -15.950 1.00 0.00 C ATOM 1302 O ARG A 85 4.774 5.457 -15.826 1.00 0.00 O ATOM 1303 CB ARG A 85 7.420 3.976 -17.084 1.00 0.00 C ATOM 1304 CG ARG A 85 8.654 3.090 -16.901 1.00 0.00 C ATOM 1305 CD ARG A 85 9.340 2.892 -18.256 1.00 0.00 C ATOM 1306 NE ARG A 85 8.514 1.876 -18.966 1.00 0.00 N ATOM 1307 CZ ARG A 85 8.664 1.690 -20.252 1.00 0.00 C ATOM 1308 NH1 ARG A 85 9.518 2.414 -20.924 1.00 0.00 N ATOM 1309 NH2 ARG A 85 7.955 0.782 -20.869 1.00 0.00 N ATOM 0 H ARG A 85 6.091 2.646 -15.548 1.00 0.00 H new ATOM 0 HA ARG A 85 7.846 5.008 -15.208 1.00 0.00 H new ATOM 0 HB2 ARG A 85 6.602 3.392 -17.505 1.00 0.00 H new ATOM 0 HB3 ARG A 85 7.638 4.776 -17.792 1.00 0.00 H new ATOM 0 HG2 ARG A 85 9.345 3.550 -16.194 1.00 0.00 H new ATOM 0 HG3 ARG A 85 8.365 2.126 -16.482 1.00 0.00 H new ATOM 0 HD2 ARG A 85 9.383 3.826 -18.816 1.00 0.00 H new ATOM 0 HD3 ARG A 85 10.367 2.548 -18.131 1.00 0.00 H new ATOM 0 HE ARG A 85 7.830 1.324 -18.448 1.00 0.00 H new ATOM 0 HH11 ARG A 85 10.070 3.126 -20.446 1.00 0.00 H new ATOM 0 HH12 ARG A 85 9.633 2.267 -21.927 1.00 0.00 H new ATOM 0 HH21 ARG A 85 7.284 0.218 -20.348 1.00 0.00 H new ATOM 0 HH22 ARG A 85 8.073 0.638 -21.872 1.00 0.00 H new ATOM 1323 N ASP A 86 6.394 6.866 -16.276 1.00 0.00 N ATOM 1324 CA ASP A 86 5.412 7.969 -16.498 1.00 0.00 C ATOM 1325 C ASP A 86 5.457 8.425 -17.958 1.00 0.00 C ATOM 1326 O ASP A 86 6.381 9.088 -18.383 1.00 0.00 O ATOM 1327 CB ASP A 86 5.851 9.099 -15.566 1.00 0.00 C ATOM 1328 CG ASP A 86 4.717 10.119 -15.435 1.00 0.00 C ATOM 1329 OD1 ASP A 86 3.723 9.959 -16.124 1.00 0.00 O ATOM 1330 OD2 ASP A 86 4.862 11.039 -14.648 1.00 0.00 O ATOM 0 H ASP A 86 7.374 7.120 -16.398 1.00 0.00 H new ATOM 0 HA ASP A 86 4.389 7.655 -16.292 1.00 0.00 H new ATOM 0 HB2 ASP A 86 6.109 8.698 -14.586 1.00 0.00 H new ATOM 0 HB3 ASP A 86 6.746 9.582 -15.958 1.00 0.00 H new ATOM 1335 N SER A 87 4.464 8.074 -18.728 1.00 0.00 N ATOM 1336 CA SER A 87 4.453 8.484 -20.161 1.00 0.00 C ATOM 1337 C SER A 87 3.024 8.450 -20.711 1.00 0.00 C ATOM 1338 O SER A 87 2.086 8.120 -20.011 1.00 0.00 O ATOM 1339 CB SER A 87 5.329 7.454 -20.873 1.00 0.00 C ATOM 1340 OG SER A 87 5.398 7.771 -22.256 1.00 0.00 O ATOM 0 H SER A 87 3.661 7.522 -18.428 1.00 0.00 H new ATOM 0 HA SER A 87 4.822 9.500 -20.304 1.00 0.00 H new ATOM 0 HB2 SER A 87 6.329 7.448 -20.439 1.00 0.00 H new ATOM 0 HB3 SER A 87 4.917 6.454 -20.738 1.00 0.00 H new ATOM 0 HG SER A 87 5.961 7.113 -22.715 1.00 0.00 H new ATOM 1346 N GLU A 88 2.851 8.787 -21.960 1.00 0.00 N ATOM 1347 CA GLU A 88 1.486 8.775 -22.556 1.00 0.00 C ATOM 1348 C GLU A 88 0.828 7.411 -22.329 1.00 0.00 C ATOM 1349 O GLU A 88 -0.378 7.273 -22.391 1.00 0.00 O ATOM 1350 CB GLU A 88 1.710 9.024 -24.049 1.00 0.00 C ATOM 1351 CG GLU A 88 2.446 7.831 -24.661 1.00 0.00 C ATOM 1352 CD GLU A 88 3.243 8.293 -25.883 1.00 0.00 C ATOM 1353 OE1 GLU A 88 4.071 9.175 -25.727 1.00 0.00 O ATOM 1354 OE2 GLU A 88 3.011 7.757 -26.955 1.00 0.00 O ATOM 0 H GLU A 88 3.598 9.071 -22.594 1.00 0.00 H new ATOM 0 HA GLU A 88 0.829 9.523 -22.112 1.00 0.00 H new ATOM 0 HB2 GLU A 88 0.754 9.171 -24.551 1.00 0.00 H new ATOM 0 HB3 GLU A 88 2.290 9.936 -24.193 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.115 7.387 -23.924 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.732 7.059 -24.950 1.00 0.00 H new ATOM 1361 N ASP A 89 1.616 6.403 -22.064 1.00 0.00 N ATOM 1362 CA ASP A 89 1.046 5.046 -21.828 1.00 0.00 C ATOM 1363 C ASP A 89 -0.068 4.760 -22.837 1.00 0.00 C ATOM 1364 O ASP A 89 -1.237 4.782 -22.502 1.00 0.00 O ATOM 1365 CB ASP A 89 0.500 5.087 -20.401 1.00 0.00 C ATOM 1366 CG ASP A 89 1.647 4.865 -19.414 1.00 0.00 C ATOM 1367 OD1 ASP A 89 2.756 5.269 -19.726 1.00 0.00 O ATOM 1368 OD2 ASP A 89 1.398 4.298 -18.364 1.00 0.00 O ATOM 0 H ASP A 89 2.632 6.462 -22.001 1.00 0.00 H new ATOM 0 HA ASP A 89 1.787 4.256 -21.950 1.00 0.00 H new ATOM 0 HB2 ASP A 89 0.021 6.048 -20.210 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.262 4.319 -20.269 1.00 0.00 H new ATOM 1373 N PRO A 90 0.348 4.507 -24.047 1.00 0.00 N ATOM 1374 CA PRO A 90 -0.605 4.216 -25.141 1.00 0.00 C ATOM 1375 C PRO A 90 -1.096 2.768 -25.057 1.00 0.00 C ATOM 1376 O PRO A 90 -2.262 2.509 -24.828 1.00 0.00 O ATOM 1377 CB PRO A 90 0.226 4.441 -26.401 1.00 0.00 C ATOM 1378 CG PRO A 90 1.651 4.230 -25.986 1.00 0.00 C ATOM 1379 CD PRO A 90 1.739 4.469 -24.499 1.00 0.00 C ATOM 0 HA PRO A 90 -1.500 4.837 -25.108 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -0.060 3.744 -27.189 1.00 0.00 H new ATOM 0 HB3 PRO A 90 0.077 5.446 -26.795 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.974 3.218 -26.230 1.00 0.00 H new ATOM 0 HG3 PRO A 90 2.310 4.913 -26.522 1.00 0.00 H new ATOM 0 HD2 PRO A 90 2.295 3.674 -24.002 1.00 0.00 H new ATOM 0 HD3 PRO A 90 2.253 5.404 -24.278 1.00 0.00 H new ATOM 1387 N ASP A 91 -0.216 1.826 -25.235 1.00 0.00 N ATOM 1388 CA ASP A 91 -0.631 0.394 -25.161 1.00 0.00 C ATOM 1389 C ASP A 91 -0.414 -0.136 -23.742 1.00 0.00 C ATOM 1390 O ASP A 91 -0.447 -1.325 -23.499 1.00 0.00 O ATOM 1391 CB ASP A 91 0.271 -0.344 -26.149 1.00 0.00 C ATOM 1392 CG ASP A 91 0.030 0.187 -27.562 1.00 0.00 C ATOM 1393 OD1 ASP A 91 -0.768 1.098 -27.703 1.00 0.00 O ATOM 1394 OD2 ASP A 91 0.652 -0.324 -28.479 1.00 0.00 O ATOM 0 H ASP A 91 0.773 1.982 -25.429 1.00 0.00 H new ATOM 0 HA ASP A 91 -1.685 0.258 -25.402 1.00 0.00 H new ATOM 0 HB2 ASP A 91 1.317 -0.209 -25.873 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.068 -1.414 -26.113 1.00 0.00 H new ATOM 1399 N GLU A 92 -0.190 0.743 -22.804 1.00 0.00 N ATOM 1400 CA GLU A 92 0.029 0.300 -21.398 1.00 0.00 C ATOM 1401 C GLU A 92 -0.869 1.105 -20.453 1.00 0.00 C ATOM 1402 O GLU A 92 -1.114 2.273 -20.675 1.00 0.00 O ATOM 1403 CB GLU A 92 1.505 0.589 -21.126 1.00 0.00 C ATOM 1404 CG GLU A 92 2.372 -0.384 -21.932 1.00 0.00 C ATOM 1405 CD GLU A 92 2.619 -1.648 -21.108 1.00 0.00 C ATOM 1406 OE1 GLU A 92 2.157 -1.695 -19.979 1.00 0.00 O ATOM 1407 OE2 GLU A 92 3.262 -2.549 -21.619 1.00 0.00 O ATOM 0 H GLU A 92 -0.149 1.751 -22.951 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.213 -0.752 -21.243 1.00 0.00 H new ATOM 0 HB2 GLU A 92 1.742 1.617 -21.400 1.00 0.00 H new ATOM 0 HB3 GLU A 92 1.717 0.486 -20.062 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.877 -0.639 -22.869 1.00 0.00 H new ATOM 0 HG3 GLU A 92 3.321 0.086 -22.190 1.00 0.00 H new ATOM 1414 N PRO A 93 -1.339 0.445 -19.430 1.00 0.00 N ATOM 1415 CA PRO A 93 -2.228 1.101 -18.449 1.00 0.00 C ATOM 1416 C PRO A 93 -1.414 1.852 -17.389 1.00 0.00 C ATOM 1417 O PRO A 93 -1.122 3.023 -17.535 1.00 0.00 O ATOM 1418 CB PRO A 93 -2.986 -0.068 -17.830 1.00 0.00 C ATOM 1419 CG PRO A 93 -2.103 -1.270 -18.011 1.00 0.00 C ATOM 1420 CD PRO A 93 -1.093 -0.958 -19.093 1.00 0.00 C ATOM 0 HA PRO A 93 -2.885 1.846 -18.897 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.189 0.113 -16.774 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -3.949 -0.213 -18.320 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -1.596 -1.513 -17.077 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -2.698 -2.141 -18.287 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -0.073 -1.108 -18.739 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -1.228 -1.604 -19.960 1.00 0.00 H new ATOM 1428 N ALA A 94 -1.055 1.193 -16.321 1.00 0.00 N ATOM 1429 CA ALA A 94 -0.267 1.872 -15.247 1.00 0.00 C ATOM 1430 C ALA A 94 -0.899 3.222 -14.886 1.00 0.00 C ATOM 1431 O ALA A 94 -0.250 4.092 -14.339 1.00 0.00 O ATOM 1432 CB ALA A 94 1.128 2.080 -15.839 1.00 0.00 C ATOM 0 H ALA A 94 -1.273 0.212 -16.144 1.00 0.00 H new ATOM 0 HA ALA A 94 -0.238 1.281 -14.332 1.00 0.00 H new ATOM 0 HB1 ALA A 94 1.764 2.575 -15.106 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.560 1.114 -16.101 1.00 0.00 H new ATOM 0 HB3 ALA A 94 1.055 2.699 -16.733 1.00 0.00 H new ATOM 1438 N LYS A 95 -2.158 3.406 -15.183 1.00 0.00 N ATOM 1439 CA LYS A 95 -2.822 4.698 -14.846 1.00 0.00 C ATOM 1440 C LYS A 95 -3.418 4.622 -13.437 1.00 0.00 C ATOM 1441 O LYS A 95 -2.977 5.296 -12.526 1.00 0.00 O ATOM 1442 CB LYS A 95 -3.925 4.865 -15.896 1.00 0.00 C ATOM 1443 CG LYS A 95 -4.341 6.336 -15.977 1.00 0.00 C ATOM 1444 CD LYS A 95 -5.403 6.506 -17.066 1.00 0.00 C ATOM 1445 CE LYS A 95 -5.264 7.894 -17.696 1.00 0.00 C ATOM 1446 NZ LYS A 95 -3.956 7.869 -18.417 1.00 0.00 N ATOM 0 H LYS A 95 -2.754 2.718 -15.644 1.00 0.00 H new ATOM 0 HA LYS A 95 -2.130 5.540 -14.855 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -3.570 4.523 -16.868 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -4.785 4.248 -15.636 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -4.734 6.667 -15.016 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -3.474 6.959 -16.199 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.286 5.735 -17.828 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -6.399 6.385 -16.641 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -6.087 8.100 -18.381 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -5.279 8.675 -16.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -3.261 8.441 -17.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -3.616 6.889 -18.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -4.079 8.260 -19.373 1.00 0.00 H new ATOM 1460 N GLU A 96 -4.416 3.801 -13.253 1.00 0.00 N ATOM 1461 CA GLU A 96 -5.042 3.670 -11.903 1.00 0.00 C ATOM 1462 C GLU A 96 -5.541 2.235 -11.696 1.00 0.00 C ATOM 1463 O GLU A 96 -6.447 1.988 -10.924 1.00 0.00 O ATOM 1464 CB GLU A 96 -6.220 4.647 -11.916 1.00 0.00 C ATOM 1465 CG GLU A 96 -5.706 6.073 -12.123 1.00 0.00 C ATOM 1466 CD GLU A 96 -6.891 7.041 -12.143 1.00 0.00 C ATOM 1467 OE1 GLU A 96 -7.949 6.639 -12.596 1.00 0.00 O ATOM 1468 OE2 GLU A 96 -6.717 8.167 -11.708 1.00 0.00 O ATOM 0 H GLU A 96 -4.826 3.214 -13.979 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.341 3.888 -11.097 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -6.916 4.382 -12.712 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -6.770 4.581 -10.977 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -5.015 6.342 -11.324 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -5.152 6.140 -13.059 1.00 0.00 H new ATOM 1475 N GLN A 97 -4.969 1.287 -12.389 1.00 0.00 N ATOM 1476 CA GLN A 97 -5.425 -0.127 -12.238 1.00 0.00 C ATOM 1477 C GLN A 97 -4.492 -0.916 -11.314 1.00 0.00 C ATOM 1478 O GLN A 97 -4.878 -1.915 -10.740 1.00 0.00 O ATOM 1479 CB GLN A 97 -5.394 -0.705 -13.650 1.00 0.00 C ATOM 1480 CG GLN A 97 -5.558 -2.222 -13.580 1.00 0.00 C ATOM 1481 CD GLN A 97 -5.283 -2.826 -14.956 1.00 0.00 C ATOM 1482 OE1 GLN A 97 -4.501 -2.294 -15.720 1.00 0.00 O ATOM 1483 NE2 GLN A 97 -5.895 -3.923 -15.309 1.00 0.00 N ATOM 0 H GLN A 97 -4.207 1.429 -13.052 1.00 0.00 H new ATOM 0 HA GLN A 97 -6.417 -0.183 -11.789 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -6.192 -0.269 -14.251 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -4.453 -0.452 -14.138 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -4.871 -2.639 -12.844 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -6.567 -2.475 -13.255 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -6.551 -4.370 -14.668 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -5.717 -4.334 -16.226 1.00 0.00 H new ATOM 1492 N LEU A 98 -3.279 -0.472 -11.144 1.00 0.00 N ATOM 1493 CA LEU A 98 -2.353 -1.199 -10.233 1.00 0.00 C ATOM 1494 C LEU A 98 -2.976 -1.202 -8.847 1.00 0.00 C ATOM 1495 O LEU A 98 -2.687 -2.033 -8.013 1.00 0.00 O ATOM 1496 CB LEU A 98 -1.052 -0.398 -10.241 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.553 -0.239 -11.678 1.00 0.00 C ATOM 1498 CD1 LEU A 98 0.759 0.531 -11.665 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.315 -1.612 -12.297 1.00 0.00 C ATOM 0 H LEU A 98 -2.890 0.357 -11.593 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.169 -2.230 -10.534 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.214 0.582 -9.792 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.298 -0.904 -9.638 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.300 0.298 -12.263 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.122 0.649 -12.686 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.600 1.514 -11.221 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.497 -0.017 -11.079 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.040 -1.493 -13.321 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.433 -2.150 -11.714 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.248 -2.176 -12.300 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.838 -0.255 -8.619 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.530 -0.138 -7.311 1.00 0.00 C ATOM 1513 C TYR A 99 -5.540 1.007 -7.400 1.00 0.00 C ATOM 1514 O TYR A 99 -6.154 1.216 -8.427 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.411 0.170 -6.308 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.798 -0.232 -4.895 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -5.140 -0.449 -4.540 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.795 -0.368 -3.928 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.465 -0.804 -3.220 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -3.123 -0.726 -2.615 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.457 -0.941 -2.262 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.782 -1.291 -0.967 1.00 0.00 O ATOM 0 H TYR A 99 -4.097 0.458 -9.300 1.00 0.00 H new ATOM 0 HA TYR A 99 -5.080 -1.032 -7.018 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.504 -0.358 -6.601 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.182 1.235 -6.334 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -5.920 -0.343 -5.280 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.763 -0.196 -4.196 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.496 -0.971 -2.945 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.344 -0.836 -1.875 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.735 -1.514 -0.918 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.712 1.759 -6.356 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.676 2.892 -6.425 1.00 0.00 C ATOM 1534 C HIS A 100 -6.002 4.084 -7.104 1.00 0.00 C ATOM 1535 O HIS A 100 -4.858 4.011 -7.506 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.046 3.222 -4.978 1.00 0.00 C ATOM 1537 CG HIS A 100 -5.809 3.253 -4.132 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -4.551 3.541 -4.663 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -5.610 3.024 -2.793 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -3.658 3.477 -3.653 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.266 3.170 -2.524 1.00 0.00 N ATOM 0 H HIS A 100 -5.233 1.643 -5.463 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.567 2.645 -7.002 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -7.552 4.186 -4.933 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -7.743 2.478 -4.592 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -6.375 2.773 -2.074 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -2.597 3.652 -3.755 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.821 3.060 -1.613 1.00 0.00 H new ATOM 1549 N SER A 101 -6.698 5.173 -7.254 1.00 0.00 N ATOM 1550 CA SER A 101 -6.082 6.353 -7.926 1.00 0.00 C ATOM 1551 C SER A 101 -5.210 7.151 -6.947 1.00 0.00 C ATOM 1552 O SER A 101 -4.479 8.036 -7.341 1.00 0.00 O ATOM 1553 CB SER A 101 -7.263 7.191 -8.411 1.00 0.00 C ATOM 1554 OG SER A 101 -8.003 7.645 -7.290 1.00 0.00 O ATOM 0 H SER A 101 -7.661 5.300 -6.943 1.00 0.00 H new ATOM 0 HA SER A 101 -5.425 6.059 -8.745 1.00 0.00 H new ATOM 0 HB2 SER A 101 -6.907 8.040 -8.995 1.00 0.00 H new ATOM 0 HB3 SER A 101 -7.900 6.598 -9.067 1.00 0.00 H new ATOM 0 HG SER A 101 -8.761 8.185 -7.596 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.266 6.841 -5.679 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.423 7.584 -4.693 1.00 0.00 C ATOM 1562 C ALA A 102 -3.004 7.005 -4.688 1.00 0.00 C ATOM 1563 O ALA A 102 -2.060 7.639 -4.262 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.097 7.361 -3.340 1.00 0.00 C ATOM 0 H ALA A 102 -5.856 6.109 -5.283 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.341 8.644 -4.931 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.534 7.878 -2.563 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.114 7.752 -3.371 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.125 6.294 -3.119 1.00 0.00 H new ATOM 1570 N GLU A 103 -2.862 5.795 -5.151 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.527 5.135 -5.177 1.00 0.00 C ATOM 1572 C GLU A 103 -0.455 6.037 -5.793 1.00 0.00 C ATOM 1573 O GLU A 103 -0.623 6.587 -6.862 1.00 0.00 O ATOM 1574 CB GLU A 103 -1.736 3.903 -6.060 1.00 0.00 C ATOM 1575 CG GLU A 103 -1.987 4.345 -7.503 1.00 0.00 C ATOM 1576 CD GLU A 103 -2.393 3.136 -8.347 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -1.809 2.083 -8.155 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -3.283 3.283 -9.169 1.00 0.00 O ATOM 0 H GLU A 103 -3.626 5.227 -5.518 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.180 4.897 -4.172 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -0.860 3.257 -6.014 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.582 3.320 -5.695 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -2.772 5.101 -7.531 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -1.088 4.803 -7.915 1.00 0.00 H new ATOM 1585 N LEU A 104 0.664 6.160 -5.130 1.00 0.00 N ATOM 1586 CA LEU A 104 1.774 6.989 -5.674 1.00 0.00 C ATOM 1587 C LEU A 104 2.771 6.075 -6.388 1.00 0.00 C ATOM 1588 O LEU A 104 2.888 4.907 -6.072 1.00 0.00 O ATOM 1589 CB LEU A 104 2.434 7.633 -4.456 1.00 0.00 C ATOM 1590 CG LEU A 104 1.910 9.058 -4.269 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.431 9.021 -3.883 1.00 0.00 C ATOM 1592 CD2 LEU A 104 2.707 9.743 -3.155 1.00 0.00 C ATOM 0 H LEU A 104 0.856 5.719 -4.231 1.00 0.00 H new ATOM 0 HA LEU A 104 1.428 7.739 -6.386 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.227 7.041 -3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.516 7.649 -4.584 1.00 0.00 H new ATOM 0 HG LEU A 104 2.023 9.611 -5.202 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.064 10.039 -3.751 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.139 8.529 -4.671 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.312 8.469 -2.951 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.339 10.759 -3.016 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.589 9.184 -2.227 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.762 9.773 -3.428 1.00 0.00 H new ATOM 1604 N HIS A 105 3.483 6.583 -7.351 1.00 0.00 N ATOM 1605 CA HIS A 105 4.457 5.720 -8.075 1.00 0.00 C ATOM 1606 C HIS A 105 5.896 6.085 -7.700 1.00 0.00 C ATOM 1607 O HIS A 105 6.237 7.243 -7.556 1.00 0.00 O ATOM 1608 CB HIS A 105 4.219 6.005 -9.555 1.00 0.00 C ATOM 1609 CG HIS A 105 2.749 5.955 -9.859 1.00 0.00 C ATOM 1610 ND1 HIS A 105 2.113 6.943 -10.595 1.00 0.00 N ATOM 1611 CD2 HIS A 105 1.779 5.038 -9.544 1.00 0.00 C ATOM 1612 CE1 HIS A 105 0.815 6.599 -10.699 1.00 0.00 C ATOM 1613 NE2 HIS A 105 0.559 5.445 -10.074 1.00 0.00 N ATOM 0 H HIS A 105 3.435 7.551 -7.668 1.00 0.00 H new ATOM 0 HA HIS A 105 4.321 4.668 -7.825 1.00 0.00 H new ATOM 0 HB2 HIS A 105 4.619 6.985 -9.814 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.750 5.273 -10.164 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.938 4.136 -8.971 1.00 0.00 H new ATOM 0 HE1 HIS A 105 0.073 7.183 -11.223 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -0.339 4.966 -10.001 1.00 0.00 H new ATOM 1621 N LEU A 106 6.746 5.104 -7.562 1.00 0.00 N ATOM 1622 CA LEU A 106 8.169 5.389 -7.222 1.00 0.00 C ATOM 1623 C LEU A 106 9.088 4.707 -8.239 1.00 0.00 C ATOM 1624 O LEU A 106 8.949 3.533 -8.523 1.00 0.00 O ATOM 1625 CB LEU A 106 8.392 4.804 -5.825 1.00 0.00 C ATOM 1626 CG LEU A 106 9.862 4.984 -5.437 1.00 0.00 C ATOM 1627 CD1 LEU A 106 10.253 6.453 -5.601 1.00 0.00 C ATOM 1628 CD2 LEU A 106 10.065 4.568 -3.979 1.00 0.00 C ATOM 0 H LEU A 106 6.516 4.116 -7.670 1.00 0.00 H new ATOM 0 HA LEU A 106 8.388 6.457 -7.243 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.748 5.303 -5.101 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.126 3.747 -5.813 1.00 0.00 H new ATOM 0 HG LEU A 106 10.484 4.363 -6.081 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.299 6.584 -5.325 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.111 6.754 -6.639 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.628 7.070 -4.956 1.00 0.00 H new ATOM 0 HD21 LEU A 106 11.112 4.697 -3.706 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.443 5.188 -3.334 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.785 3.522 -3.857 1.00 0.00 H new ATOM 1640 N GLY A 107 10.023 5.429 -8.793 1.00 0.00 N ATOM 1641 CA GLY A 107 10.941 4.808 -9.790 1.00 0.00 C ATOM 1642 C GLY A 107 11.646 3.618 -9.140 1.00 0.00 C ATOM 1643 O GLY A 107 11.875 3.602 -7.947 1.00 0.00 O ATOM 0 H GLY A 107 10.191 6.416 -8.600 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.381 4.482 -10.666 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.674 5.538 -10.134 1.00 0.00 H new ATOM 1647 N ILE A 108 11.995 2.617 -9.904 1.00 0.00 N ATOM 1648 CA ILE A 108 12.680 1.450 -9.314 1.00 0.00 C ATOM 1649 C ILE A 108 14.001 1.881 -8.678 1.00 0.00 C ATOM 1650 O ILE A 108 14.317 1.512 -7.564 1.00 0.00 O ATOM 1651 CB ILE A 108 12.936 0.526 -10.497 1.00 0.00 C ATOM 1652 CG1 ILE A 108 11.609 0.124 -11.143 1.00 0.00 C ATOM 1653 CG2 ILE A 108 13.656 -0.712 -10.002 1.00 0.00 C ATOM 1654 CD1 ILE A 108 11.881 -0.810 -12.326 1.00 0.00 C ATOM 0 H ILE A 108 11.832 2.565 -10.910 1.00 0.00 H new ATOM 0 HA ILE A 108 12.094 0.970 -8.530 1.00 0.00 H new ATOM 0 HB ILE A 108 13.546 1.041 -11.239 1.00 0.00 H new ATOM 0 HG12 ILE A 108 10.972 -0.374 -10.412 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.073 1.011 -11.481 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.845 -1.382 -10.840 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.603 -0.424 -9.546 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.038 -1.221 -9.263 1.00 0.00 H new ATOM 0 HD11 ILE A 108 10.936 -1.097 -12.787 1.00 0.00 H new ATOM 0 HD12 ILE A 108 12.502 -0.296 -13.060 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.399 -1.702 -11.974 1.00 0.00 H new ATOM 1666 N HIS A 109 14.771 2.666 -9.379 1.00 0.00 N ATOM 1667 CA HIS A 109 16.069 3.130 -8.823 1.00 0.00 C ATOM 1668 C HIS A 109 15.832 4.273 -7.839 1.00 0.00 C ATOM 1669 O HIS A 109 16.748 4.779 -7.225 1.00 0.00 O ATOM 1670 CB HIS A 109 16.871 3.616 -10.031 1.00 0.00 C ATOM 1671 CG HIS A 109 18.324 3.727 -9.660 1.00 0.00 C ATOM 1672 ND1 HIS A 109 19.026 2.669 -9.104 1.00 0.00 N ATOM 1673 CD2 HIS A 109 19.223 4.761 -9.765 1.00 0.00 C ATOM 1674 CE1 HIS A 109 20.289 3.086 -8.898 1.00 0.00 C ATOM 1675 NE2 HIS A 109 20.463 4.353 -9.284 1.00 0.00 N ATOM 0 H HIS A 109 14.555 3.006 -10.316 1.00 0.00 H new ATOM 0 HA HIS A 109 16.595 2.344 -8.281 1.00 0.00 H new ATOM 0 HB2 HIS A 109 16.750 2.923 -10.863 1.00 0.00 H new ATOM 0 HB3 HIS A 109 16.495 4.583 -10.364 1.00 0.00 H new ATOM 0 HD2 HIS A 109 19.001 5.741 -10.161 1.00 0.00 H new ATOM 0 HE1 HIS A 109 21.068 2.471 -8.472 1.00 0.00 H new ATOM 0 HE2 HIS A 109 21.321 4.903 -9.236 1.00 0.00 H new ATOM 1683 N GLN A 110 14.604 4.686 -7.683 1.00 0.00 N ATOM 1684 CA GLN A 110 14.315 5.798 -6.738 1.00 0.00 C ATOM 1685 C GLN A 110 13.905 5.238 -5.375 1.00 0.00 C ATOM 1686 O GLN A 110 13.123 5.831 -4.660 1.00 0.00 O ATOM 1687 CB GLN A 110 13.167 6.587 -7.371 1.00 0.00 C ATOM 1688 CG GLN A 110 13.641 7.203 -8.689 1.00 0.00 C ATOM 1689 CD GLN A 110 12.582 8.176 -9.211 1.00 0.00 C ATOM 1690 OE1 GLN A 110 12.224 9.120 -8.536 1.00 0.00 O ATOM 1691 NE2 GLN A 110 12.063 7.983 -10.392 1.00 0.00 N ATOM 0 H GLN A 110 13.792 4.303 -8.167 1.00 0.00 H new ATOM 0 HA GLN A 110 15.187 6.431 -6.571 1.00 0.00 H new ATOM 0 HB2 GLN A 110 12.315 5.931 -7.549 1.00 0.00 H new ATOM 0 HB3 GLN A 110 12.830 7.370 -6.691 1.00 0.00 H new ATOM 0 HG2 GLN A 110 14.586 7.725 -8.539 1.00 0.00 H new ATOM 0 HG3 GLN A 110 13.823 6.419 -9.424 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.364 7.190 -10.958 1.00 0.00 H new ATOM 0 HE22 GLN A 110 11.356 8.625 -10.749 1.00 0.00 H new ATOM 1700 N LEU A 111 14.431 4.098 -5.005 1.00 0.00 N ATOM 1701 CA LEU A 111 14.068 3.515 -3.683 1.00 0.00 C ATOM 1702 C LEU A 111 14.768 4.294 -2.572 1.00 0.00 C ATOM 1703 O LEU A 111 15.933 4.106 -2.292 1.00 0.00 O ATOM 1704 CB LEU A 111 14.552 2.061 -3.730 1.00 0.00 C ATOM 1705 CG LEU A 111 13.577 1.158 -4.523 1.00 0.00 C ATOM 1706 CD1 LEU A 111 13.002 0.098 -3.584 1.00 0.00 C ATOM 1707 CD2 LEU A 111 12.419 1.968 -5.127 1.00 0.00 C ATOM 0 H LEU A 111 15.091 3.551 -5.558 1.00 0.00 H new ATOM 0 HA LEU A 111 12.998 3.564 -3.483 1.00 0.00 H new ATOM 0 HB2 LEU A 111 15.540 2.021 -4.189 1.00 0.00 H new ATOM 0 HB3 LEU A 111 14.657 1.679 -2.714 1.00 0.00 H new ATOM 0 HG LEU A 111 14.132 0.695 -5.338 1.00 0.00 H new ATOM 0 HD11 LEU A 111 12.314 -0.542 -4.136 1.00 0.00 H new ATOM 0 HD12 LEU A 111 13.813 -0.506 -3.177 1.00 0.00 H new ATOM 0 HD13 LEU A 111 12.469 0.586 -2.768 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.755 1.300 -5.676 1.00 0.00 H new ATOM 0 HD22 LEU A 111 11.862 2.457 -4.328 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.818 2.722 -5.806 1.00 0.00 H new ATOM 1719 N GLU A 112 14.031 5.169 -1.960 1.00 0.00 N ATOM 1720 CA GLU A 112 14.558 6.030 -0.861 1.00 0.00 C ATOM 1721 C GLU A 112 13.496 7.087 -0.559 1.00 0.00 C ATOM 1722 O GLU A 112 13.379 7.580 0.545 1.00 0.00 O ATOM 1723 CB GLU A 112 15.817 6.698 -1.411 1.00 0.00 C ATOM 1724 CG GLU A 112 15.435 7.530 -2.630 1.00 0.00 C ATOM 1725 CD GLU A 112 16.677 8.219 -3.201 1.00 0.00 C ATOM 1726 OE1 GLU A 112 17.560 8.547 -2.425 1.00 0.00 O ATOM 1727 OE2 GLU A 112 16.722 8.409 -4.405 1.00 0.00 O ATOM 0 H GLU A 112 13.049 5.332 -2.181 1.00 0.00 H new ATOM 0 HA GLU A 112 14.784 5.472 0.048 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.273 7.331 -0.649 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.556 5.945 -1.684 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.981 6.892 -3.389 1.00 0.00 H new ATOM 0 HG3 GLU A 112 14.690 8.276 -2.353 1.00 0.00 H new ATOM 1734 N GLN A 113 12.711 7.422 -1.557 1.00 0.00 N ATOM 1735 CA GLN A 113 11.626 8.428 -1.374 1.00 0.00 C ATOM 1736 C GLN A 113 10.405 7.746 -0.751 1.00 0.00 C ATOM 1737 O GLN A 113 9.399 8.368 -0.506 1.00 0.00 O ATOM 1738 CB GLN A 113 11.291 8.915 -2.789 1.00 0.00 C ATOM 1739 CG GLN A 113 12.450 9.749 -3.342 1.00 0.00 C ATOM 1740 CD GLN A 113 12.193 10.063 -4.819 1.00 0.00 C ATOM 1741 OE1 GLN A 113 11.400 10.925 -5.142 1.00 0.00 O ATOM 1742 NE2 GLN A 113 12.838 9.398 -5.738 1.00 0.00 N ATOM 0 H GLN A 113 12.780 7.035 -2.498 1.00 0.00 H new ATOM 0 HA GLN A 113 11.921 9.249 -0.721 1.00 0.00 H new ATOM 0 HB2 GLN A 113 11.102 8.062 -3.441 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.379 9.511 -2.771 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.550 10.674 -2.774 1.00 0.00 H new ATOM 0 HG3 GLN A 113 13.388 9.205 -3.233 1.00 0.00 H new ATOM 0 HE21 GLN A 113 13.504 8.674 -5.470 1.00 0.00 H new ATOM 0 HE22 GLN A 113 12.676 9.603 -6.724 1.00 0.00 H new ATOM 1751 N LEU A 114 10.487 6.463 -0.507 1.00 0.00 N ATOM 1752 CA LEU A 114 9.328 5.729 0.087 1.00 0.00 C ATOM 1753 C LEU A 114 8.773 6.433 1.331 1.00 0.00 C ATOM 1754 O LEU A 114 7.575 6.552 1.469 1.00 0.00 O ATOM 1755 CB LEU A 114 9.867 4.347 0.448 1.00 0.00 C ATOM 1756 CG LEU A 114 10.041 3.529 -0.830 1.00 0.00 C ATOM 1757 CD1 LEU A 114 11.531 3.341 -1.112 1.00 0.00 C ATOM 1758 CD2 LEU A 114 9.376 2.161 -0.657 1.00 0.00 C ATOM 0 H LEU A 114 11.310 5.890 -0.694 1.00 0.00 H new ATOM 0 HA LEU A 114 8.498 5.680 -0.618 1.00 0.00 H new ATOM 0 HB2 LEU A 114 10.820 4.439 0.968 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.181 3.841 1.128 1.00 0.00 H new ATOM 0 HG LEU A 114 9.576 4.054 -1.664 1.00 0.00 H new ATOM 0 HD11 LEU A 114 11.658 2.757 -2.024 1.00 0.00 H new ATOM 0 HD12 LEU A 114 12.004 4.315 -1.236 1.00 0.00 H new ATOM 0 HD13 LEU A 114 11.996 2.816 -0.278 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.501 1.578 -1.569 1.00 0.00 H new ATOM 0 HD22 LEU A 114 9.840 1.634 0.177 1.00 0.00 H new ATOM 0 HD23 LEU A 114 8.313 2.296 -0.455 1.00 0.00 H new ATOM 1770 N PRO A 115 9.639 6.870 2.213 1.00 0.00 N ATOM 1771 CA PRO A 115 9.163 7.551 3.446 1.00 0.00 C ATOM 1772 C PRO A 115 8.517 8.880 3.075 1.00 0.00 C ATOM 1773 O PRO A 115 7.409 9.176 3.473 1.00 0.00 O ATOM 1774 CB PRO A 115 10.435 7.742 4.270 1.00 0.00 C ATOM 1775 CG PRO A 115 11.541 7.725 3.268 1.00 0.00 C ATOM 1776 CD PRO A 115 11.106 6.792 2.167 1.00 0.00 C ATOM 0 HA PRO A 115 8.408 6.992 3.999 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.413 8.683 4.820 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.554 6.946 5.005 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.727 8.726 2.878 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.471 7.382 3.722 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.495 7.105 1.198 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.460 5.775 2.339 1.00 0.00 H new ATOM 1784 N TYR A 116 9.184 9.670 2.286 1.00 0.00 N ATOM 1785 CA TYR A 116 8.582 10.959 1.860 1.00 0.00 C ATOM 1786 C TYR A 116 7.400 10.633 0.937 1.00 0.00 C ATOM 1787 O TYR A 116 6.403 11.330 0.902 1.00 0.00 O ATOM 1788 CB TYR A 116 9.737 11.697 1.165 1.00 0.00 C ATOM 1789 CG TYR A 116 9.393 12.081 -0.250 1.00 0.00 C ATOM 1790 CD1 TYR A 116 8.365 12.994 -0.505 1.00 0.00 C ATOM 1791 CD2 TYR A 116 10.126 11.538 -1.307 1.00 0.00 C ATOM 1792 CE1 TYR A 116 8.069 13.359 -1.821 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.834 11.904 -2.620 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.805 12.815 -2.880 1.00 0.00 C ATOM 1795 OH TYR A 116 8.518 13.179 -4.179 1.00 0.00 O ATOM 0 H TYR A 116 10.116 9.480 1.919 1.00 0.00 H new ATOM 0 HA TYR A 116 8.180 11.583 2.658 1.00 0.00 H new ATOM 0 HB2 TYR A 116 9.988 12.593 1.733 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.623 11.062 1.163 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.801 13.416 0.314 1.00 0.00 H new ATOM 0 HD2 TYR A 116 10.920 10.834 -1.107 1.00 0.00 H new ATOM 0 HE1 TYR A 116 7.273 14.061 -2.021 1.00 0.00 H new ATOM 0 HE2 TYR A 116 10.402 11.484 -3.437 1.00 0.00 H new ATOM 0 HH TYR A 116 9.123 12.710 -4.791 1.00 0.00 H new ATOM 1805 N GLN A 117 7.497 9.537 0.233 1.00 0.00 N ATOM 1806 CA GLN A 117 6.385 9.094 -0.654 1.00 0.00 C ATOM 1807 C GLN A 117 5.252 8.576 0.222 1.00 0.00 C ATOM 1808 O GLN A 117 4.092 8.837 -0.012 1.00 0.00 O ATOM 1809 CB GLN A 117 6.974 7.958 -1.492 1.00 0.00 C ATOM 1810 CG GLN A 117 7.802 8.539 -2.636 1.00 0.00 C ATOM 1811 CD GLN A 117 6.864 9.118 -3.695 1.00 0.00 C ATOM 1812 OE1 GLN A 117 5.950 8.455 -4.141 1.00 0.00 O ATOM 1813 NE2 GLN A 117 7.048 10.338 -4.118 1.00 0.00 N ATOM 0 H GLN A 117 8.311 8.922 0.236 1.00 0.00 H new ATOM 0 HA GLN A 117 5.992 9.891 -1.286 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.597 7.318 -0.868 1.00 0.00 H new ATOM 0 HB3 GLN A 117 6.174 7.334 -1.890 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.468 9.315 -2.260 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.431 7.764 -3.075 1.00 0.00 H new ATOM 0 HE21 GLN A 117 7.815 10.897 -3.745 1.00 0.00 H new ATOM 0 HE22 GLN A 117 6.425 10.733 -4.822 1.00 0.00 H new ATOM 1822 N VAL A 118 5.603 7.850 1.245 1.00 0.00 N ATOM 1823 CA VAL A 118 4.582 7.307 2.178 1.00 0.00 C ATOM 1824 C VAL A 118 3.772 8.463 2.764 1.00 0.00 C ATOM 1825 O VAL A 118 2.558 8.466 2.719 1.00 0.00 O ATOM 1826 CB VAL A 118 5.407 6.581 3.251 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.674 6.580 4.594 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.644 5.137 2.806 1.00 0.00 C ATOM 0 H VAL A 118 6.566 7.607 1.476 1.00 0.00 H new ATOM 0 HA VAL A 118 3.864 6.635 1.708 1.00 0.00 H new ATOM 0 HB VAL A 118 6.357 7.102 3.374 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.278 6.060 5.338 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.505 7.607 4.917 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.716 6.072 4.485 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.229 4.615 3.563 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.686 4.634 2.677 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.186 5.132 1.860 1.00 0.00 H new ATOM 1838 N ASP A 119 4.430 9.464 3.287 1.00 0.00 N ATOM 1839 CA ASP A 119 3.674 10.622 3.834 1.00 0.00 C ATOM 1840 C ASP A 119 2.865 11.245 2.701 1.00 0.00 C ATOM 1841 O ASP A 119 1.690 11.527 2.836 1.00 0.00 O ATOM 1842 CB ASP A 119 4.736 11.600 4.336 1.00 0.00 C ATOM 1843 CG ASP A 119 5.343 11.071 5.635 1.00 0.00 C ATOM 1844 OD1 ASP A 119 4.768 10.161 6.208 1.00 0.00 O ATOM 1845 OD2 ASP A 119 6.376 11.585 6.033 1.00 0.00 O ATOM 0 H ASP A 119 5.446 9.528 3.358 1.00 0.00 H new ATOM 0 HA ASP A 119 2.986 10.346 4.634 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.514 11.726 3.583 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.292 12.581 4.503 1.00 0.00 H new ATOM 1850 N ALA A 120 3.489 11.435 1.570 1.00 0.00 N ATOM 1851 CA ALA A 120 2.767 12.010 0.405 1.00 0.00 C ATOM 1852 C ALA A 120 1.625 11.072 0.011 1.00 0.00 C ATOM 1853 O ALA A 120 0.524 11.496 -0.279 1.00 0.00 O ATOM 1854 CB ALA A 120 3.815 12.082 -0.706 1.00 0.00 C ATOM 0 H ALA A 120 4.471 11.215 1.405 1.00 0.00 H new ATOM 0 HA ALA A 120 2.331 12.988 0.611 1.00 0.00 H new ATOM 0 HB1 ALA A 120 3.363 12.497 -1.607 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.640 12.719 -0.387 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.191 11.081 -0.917 1.00 0.00 H new ATOM 1860 N ALA A 121 1.883 9.791 0.014 1.00 0.00 N ATOM 1861 CA ALA A 121 0.824 8.810 -0.346 1.00 0.00 C ATOM 1862 C ALA A 121 -0.294 8.852 0.697 1.00 0.00 C ATOM 1863 O ALA A 121 -1.461 8.729 0.382 1.00 0.00 O ATOM 1864 CB ALA A 121 1.533 7.449 -0.334 1.00 0.00 C ATOM 0 H ALA A 121 2.787 9.382 0.252 1.00 0.00 H new ATOM 0 HA ALA A 121 0.365 9.017 -1.312 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.820 6.665 -0.590 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.344 7.455 -1.063 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.939 7.259 0.659 1.00 0.00 H new ATOM 1870 N LEU A 122 0.057 9.030 1.941 1.00 0.00 N ATOM 1871 CA LEU A 122 -0.981 9.087 3.007 1.00 0.00 C ATOM 1872 C LEU A 122 -1.921 10.268 2.770 1.00 0.00 C ATOM 1873 O LEU A 122 -3.127 10.123 2.780 1.00 0.00 O ATOM 1874 CB LEU A 122 -0.203 9.265 4.310 1.00 0.00 C ATOM 1875 CG LEU A 122 0.336 7.909 4.765 1.00 0.00 C ATOM 1876 CD1 LEU A 122 1.696 8.099 5.436 1.00 0.00 C ATOM 1877 CD2 LEU A 122 -0.644 7.289 5.763 1.00 0.00 C ATOM 0 H LEU A 122 1.018 9.138 2.265 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.603 8.192 3.026 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.619 9.966 4.163 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.850 9.689 5.078 1.00 0.00 H new ATOM 0 HG LEU A 122 0.448 7.251 3.903 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.080 7.132 5.760 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.392 8.547 4.727 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.587 8.754 6.300 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -0.265 6.321 6.092 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.752 7.948 6.625 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -1.614 7.155 5.285 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.382 11.434 2.546 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.258 12.611 2.299 1.00 0.00 C ATOM 1891 C ALA A 123 -3.153 12.333 1.089 1.00 0.00 C ATOM 1892 O ALA A 123 -4.323 12.659 1.084 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.304 13.772 2.017 1.00 0.00 C ATOM 0 H ALA A 123 -0.380 11.622 2.523 1.00 0.00 H new ATOM 0 HA ALA A 123 -2.912 12.833 3.142 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.880 14.677 1.825 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.657 13.929 2.880 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.694 13.538 1.145 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.614 11.718 0.069 1.00 0.00 N ATOM 1900 CA GLU A 124 -3.445 11.406 -1.129 1.00 0.00 C ATOM 1901 C GLU A 124 -4.574 10.448 -0.747 1.00 0.00 C ATOM 1902 O GLU A 124 -5.711 10.618 -1.141 1.00 0.00 O ATOM 1903 CB GLU A 124 -2.495 10.726 -2.115 1.00 0.00 C ATOM 1904 CG GLU A 124 -3.226 10.490 -3.438 1.00 0.00 C ATOM 1905 CD GLU A 124 -3.095 11.732 -4.321 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -3.757 12.714 -4.028 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -2.335 11.679 -5.271 1.00 0.00 O ATOM 0 H GLU A 124 -1.640 11.420 0.014 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.902 12.300 -1.553 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.615 11.348 -2.278 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -2.144 9.779 -1.706 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.807 9.622 -3.948 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -4.278 10.273 -3.251 1.00 0.00 H new ATOM 1914 N PHE A 125 -4.263 9.434 0.014 1.00 0.00 N ATOM 1915 CA PHE A 125 -5.307 8.457 0.423 1.00 0.00 C ATOM 1916 C PHE A 125 -6.397 9.143 1.257 1.00 0.00 C ATOM 1917 O PHE A 125 -7.571 8.865 1.108 1.00 0.00 O ATOM 1918 CB PHE A 125 -4.565 7.414 1.259 1.00 0.00 C ATOM 1919 CG PHE A 125 -5.545 6.377 1.748 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -5.816 5.244 0.972 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -6.186 6.552 2.980 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -6.731 4.287 1.429 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -7.101 5.597 3.436 1.00 0.00 C ATOM 1924 CZ PHE A 125 -7.373 4.464 2.662 1.00 0.00 C ATOM 0 H PHE A 125 -3.327 9.241 0.370 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.810 8.013 -0.436 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.785 6.941 0.662 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.073 7.893 2.105 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -5.320 5.108 0.022 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -5.974 7.425 3.579 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -6.942 3.413 0.831 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -7.597 5.734 4.385 1.00 0.00 H new ATOM 0 HZ PHE A 125 -8.078 3.726 3.015 1.00 0.00 H new ATOM 1934 N LEU A 126 -6.020 10.031 2.137 1.00 0.00 N ATOM 1935 CA LEU A 126 -7.036 10.723 2.978 1.00 0.00 C ATOM 1936 C LEU A 126 -7.914 11.636 2.115 1.00 0.00 C ATOM 1937 O LEU A 126 -9.111 11.727 2.307 1.00 0.00 O ATOM 1938 CB LEU A 126 -6.214 11.537 3.978 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.370 10.582 4.826 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -4.537 11.377 5.834 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.294 9.624 5.579 1.00 0.00 C ATOM 0 H LEU A 126 -5.053 10.306 2.309 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.714 10.028 3.474 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.570 12.241 3.451 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.873 12.125 4.617 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.703 10.018 4.174 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.939 10.691 6.434 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.878 12.062 5.301 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.200 11.945 6.486 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.696 8.942 6.184 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -6.960 10.194 6.226 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.885 9.051 4.864 1.00 0.00 H new ATOM 1953 N ARG A 127 -7.328 12.311 1.168 1.00 0.00 N ATOM 1954 CA ARG A 127 -8.125 13.219 0.293 1.00 0.00 C ATOM 1955 C ARG A 127 -9.106 12.418 -0.571 1.00 0.00 C ATOM 1956 O ARG A 127 -10.227 12.831 -0.796 1.00 0.00 O ATOM 1957 CB ARG A 127 -7.093 13.928 -0.584 1.00 0.00 C ATOM 1958 CG ARG A 127 -7.782 15.025 -1.395 1.00 0.00 C ATOM 1959 CD ARG A 127 -6.788 15.636 -2.385 1.00 0.00 C ATOM 1960 NE ARG A 127 -7.464 16.859 -2.901 1.00 0.00 N ATOM 1961 CZ ARG A 127 -6.860 17.627 -3.767 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -5.675 17.309 -4.213 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -7.446 18.713 -4.192 1.00 0.00 N ATOM 0 H ARG A 127 -6.330 12.275 0.960 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.724 13.921 0.872 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -6.307 14.359 0.036 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -6.615 13.212 -1.253 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -8.637 14.612 -1.931 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -8.167 15.797 -0.728 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -5.845 15.882 -1.897 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -6.557 14.941 -3.193 1.00 0.00 H new ATOM 0 HE ARG A 127 -8.401 17.097 -2.577 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -5.218 16.458 -3.885 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -5.206 17.911 -4.890 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -8.374 18.960 -3.848 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -6.976 19.315 -4.869 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.691 11.286 -1.068 1.00 0.00 N ATOM 1978 CA LEU A 128 -9.599 10.472 -1.929 1.00 0.00 C ATOM 1979 C LEU A 128 -10.284 9.365 -1.128 1.00 0.00 C ATOM 1980 O LEU A 128 -11.207 8.733 -1.599 1.00 0.00 O ATOM 1981 CB LEU A 128 -8.685 9.878 -2.998 1.00 0.00 C ATOM 1982 CG LEU A 128 -8.650 10.806 -4.211 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -7.909 12.095 -3.851 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -7.924 10.107 -5.358 1.00 0.00 C ATOM 0 H LEU A 128 -7.764 10.888 -0.916 1.00 0.00 H new ATOM 0 HA LEU A 128 -10.403 11.074 -2.353 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.679 9.745 -2.599 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -9.044 8.892 -3.292 1.00 0.00 H new ATOM 0 HG LEU A 128 -9.669 11.048 -4.513 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.885 12.755 -4.718 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -8.424 12.593 -3.029 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -6.889 11.856 -3.549 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -7.896 10.765 -6.226 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -6.906 9.867 -5.052 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.451 9.188 -5.616 1.00 0.00 H new ATOM 1996 N ALA A 129 -9.838 9.111 0.071 1.00 0.00 N ATOM 1997 CA ALA A 129 -10.468 8.026 0.880 1.00 0.00 C ATOM 1998 C ALA A 129 -11.967 8.282 1.077 1.00 0.00 C ATOM 1999 O ALA A 129 -12.352 9.327 1.561 1.00 0.00 O ATOM 2000 CB ALA A 129 -9.766 8.066 2.228 1.00 0.00 C ATOM 0 H ALA A 129 -9.069 9.604 0.525 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.370 7.061 0.384 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.179 7.293 2.876 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.699 7.890 2.088 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -9.916 9.043 2.687 1.00 0.00 H new ATOM 2006 N PRO A 130 -12.776 7.310 0.728 1.00 0.00 N ATOM 2007 CA PRO A 130 -12.273 6.041 0.136 1.00 0.00 C ATOM 2008 C PRO A 130 -11.883 6.279 -1.325 1.00 0.00 C ATOM 2009 O PRO A 130 -12.720 6.549 -2.163 1.00 0.00 O ATOM 2010 CB PRO A 130 -13.468 5.104 0.232 1.00 0.00 C ATOM 2011 CG PRO A 130 -14.660 6.003 0.257 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.233 7.307 0.870 1.00 0.00 C ATOM 0 HA PRO A 130 -11.391 5.642 0.637 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -13.505 4.422 -0.618 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -13.417 4.490 1.131 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.042 6.161 -0.752 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -15.467 5.553 0.836 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -14.685 8.156 0.356 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -14.531 7.372 1.916 1.00 0.00 H new ATOM 2020 N VAL A 131 -10.618 6.193 -1.642 1.00 0.00 N ATOM 2021 CA VAL A 131 -10.187 6.429 -3.048 1.00 0.00 C ATOM 2022 C VAL A 131 -10.838 5.403 -3.976 1.00 0.00 C ATOM 2023 O VAL A 131 -11.247 4.342 -3.550 1.00 0.00 O ATOM 2024 CB VAL A 131 -8.669 6.247 -3.033 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -8.046 7.165 -1.979 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -8.344 4.798 -2.689 1.00 0.00 C ATOM 0 H VAL A 131 -9.867 5.970 -0.989 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.476 7.416 -3.409 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.265 6.498 -4.014 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -6.964 7.031 -1.973 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.282 8.203 -2.215 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.448 6.916 -0.997 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.263 4.661 -2.676 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -8.752 4.557 -1.707 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -8.785 4.139 -3.437 1.00 0.00 H new ATOM 2036 N GLU A 132 -10.933 5.706 -5.241 1.00 0.00 N ATOM 2037 CA GLU A 132 -11.556 4.737 -6.189 1.00 0.00 C ATOM 2038 C GLU A 132 -10.606 3.557 -6.423 1.00 0.00 C ATOM 2039 O GLU A 132 -9.589 3.688 -7.072 1.00 0.00 O ATOM 2040 CB GLU A 132 -11.759 5.517 -7.489 1.00 0.00 C ATOM 2041 CG GLU A 132 -12.746 6.665 -7.260 1.00 0.00 C ATOM 2042 CD GLU A 132 -13.115 7.287 -8.609 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -12.210 7.562 -9.379 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -14.296 7.475 -8.850 1.00 0.00 O ATOM 0 H GLU A 132 -10.608 6.578 -5.659 1.00 0.00 H new ATOM 0 HA GLU A 132 -12.494 4.333 -5.808 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -10.805 5.911 -7.840 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.135 4.853 -8.267 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.641 6.297 -6.759 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.302 7.418 -6.608 1.00 0.00 H new ATOM 2051 N THR A 133 -10.929 2.405 -5.898 1.00 0.00 N ATOM 2052 CA THR A 133 -10.039 1.224 -6.093 1.00 0.00 C ATOM 2053 C THR A 133 -10.492 0.409 -7.307 1.00 0.00 C ATOM 2054 O THR A 133 -9.800 -0.478 -7.767 1.00 0.00 O ATOM 2055 CB THR A 133 -10.178 0.401 -4.813 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.535 0.415 -4.386 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.287 0.999 -3.725 1.00 0.00 C ATOM 0 H THR A 133 -11.768 2.231 -5.344 1.00 0.00 H new ATOM 0 HA THR A 133 -9.006 1.517 -6.277 1.00 0.00 H new ATOM 0 HB THR A 133 -9.872 -0.628 -5.004 1.00 0.00 H new ATOM 0 HG1 THR A 133 -11.625 -0.114 -3.566 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.385 0.413 -2.811 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.249 0.984 -4.056 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.591 2.028 -3.531 1.00 0.00 H new ATOM 2065 N MET A 134 -11.648 0.704 -7.829 1.00 0.00 N ATOM 2066 CA MET A 134 -12.151 -0.049 -9.013 1.00 0.00 C ATOM 2067 C MET A 134 -12.323 -1.530 -8.667 1.00 0.00 C ATOM 2068 O MET A 134 -12.419 -2.371 -9.539 1.00 0.00 O ATOM 2069 CB MET A 134 -11.075 0.124 -10.089 1.00 0.00 C ATOM 2070 CG MET A 134 -10.592 1.576 -10.109 1.00 0.00 C ATOM 2071 SD MET A 134 -9.967 1.978 -11.759 1.00 0.00 S ATOM 2072 CE MET A 134 -11.564 1.953 -12.608 1.00 0.00 C ATOM 0 H MET A 134 -12.270 1.437 -7.486 1.00 0.00 H new ATOM 0 HA MET A 134 -13.122 0.317 -9.346 1.00 0.00 H new ATOM 0 HB2 MET A 134 -10.238 -0.545 -9.890 1.00 0.00 H new ATOM 0 HB3 MET A 134 -11.476 -0.149 -11.065 1.00 0.00 H new ATOM 0 HG2 MET A 134 -11.410 2.247 -9.844 1.00 0.00 H new ATOM 0 HG3 MET A 134 -9.808 1.720 -9.366 1.00 0.00 H new ATOM 0 HE1 MET A 134 -11.605 2.769 -13.330 1.00 0.00 H new ATOM 0 HE2 MET A 134 -11.685 1.002 -13.127 1.00 0.00 H new ATOM 0 HE3 MET A 134 -12.366 2.073 -11.879 1.00 0.00 H new ATOM 2082 N ALA A 135 -12.364 -1.858 -7.405 1.00 0.00 N ATOM 2083 CA ALA A 135 -12.533 -3.290 -7.013 1.00 0.00 C ATOM 2084 C ALA A 135 -13.330 -3.389 -5.710 1.00 0.00 C ATOM 2085 O ALA A 135 -14.421 -2.842 -5.662 1.00 0.00 O ATOM 2086 CB ALA A 135 -11.114 -3.828 -6.817 1.00 0.00 C ATOM 2087 OXT ALA A 135 -12.837 -4.008 -4.783 1.00 0.00 O ATOM 0 H ALA A 135 -12.288 -1.200 -6.629 1.00 0.00 H new ATOM 0 HA ALA A 135 -13.079 -3.859 -7.766 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -11.160 -4.878 -6.527 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -10.557 -3.733 -7.749 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -10.613 -3.257 -6.035 1.00 0.00 H new TER 2093 ALA A 135