USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=23 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 165:sc= -0.422 USER MOD Set 1.2: A 117 GLN : amide:sc= -3.09! C(o=-3.5!,f=-4.9!) USER MOD Set 2.1: A 110 GLN : amide:sc= 0.0529 K(o=-0.48,f=-3) USER MOD Set 2.2: A 113 GLN : amide:sc= -0.531 K(o=-0.48,f=-2.4!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0336) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= -0.187 X(o=-0.19,f=0) USER MOD Single : A 8 CYS SG : rot -174:sc= -9.84! USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 104:sc= 0.047 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.0081) USER MOD Single : A 20 CYS SG : rot 91:sc= 0.0973 USER MOD Single : A 21 GLN : amide:sc= -6.81! C(o=-6.8!,f=-11!) USER MOD Single : A 25 SER OG : rot -89:sc= 1.29 USER MOD Single : A 29 TYR OH : rot 180:sc= -0.527 USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 32 GLN : amide:sc= -0.288 X(o=-0.29,f=-0.29) USER MOD Single : A 34 CYS SG : rot 88:sc= -2.6 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl -123:sc= -0.0641 (180deg=-0.453) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.823 USER MOD Single : A 45 GLN : amide:sc= -1.93 K(o=-1.9,f=-5.3!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= -5.63! C(o=-5.6!,f=-7.8!) USER MOD Single : A 50 GLN : amide:sc= 1.04 K(o=1,f=-0.41) USER MOD Single : A 53 CYS SG : rot -27:sc=-0.00439 USER MOD Single : A 60 ASN : amide:sc= -0.974 K(o=-0.97,f=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0.104 USER MOD Single : A 68 GLN : amide:sc= -2.65! C(o=-2.6!,f=-3.2!) USER MOD Single : A 69 GLN : amide:sc= -1.14 K(o=-1.1,f=-4.6!) USER MOD Single : A 71 CYS SG : rot 60:sc= -5.99! USER MOD Single : A 87 SER OG : rot -4:sc= -0.299! USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0.836 K(o=0.84,f=-3.4!) USER MOD Single : A 99 TYR OH : rot -2:sc= 0.523 USER MOD Single : A 100 HIS : no HE2:sc= -15.3! C(o=-15!,f=-20!) USER MOD Single : A 101 SER OG : rot 180:sc= -3.63! USER MOD Single : A 105 HIS : no HD1:sc= 0.69 K(o=0.69,f=-4.4!) USER MOD Single : A 109 HIS : no HD1:sc= -0.0391 X(o=-0.039,f=-0.4) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.0599 USER MOD Single : A 134 MET CE :methyl -102:sc= -0.17 (180deg=-1.52) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.833 9.258 17.336 1.00 0.00 N ATOM 2 CA MET A 1 -0.936 8.493 16.061 1.00 0.00 C ATOM 3 C MET A 1 0.409 8.506 15.325 1.00 0.00 C ATOM 4 O MET A 1 0.829 7.514 14.763 1.00 0.00 O ATOM 5 CB MET A 1 -2.007 9.228 15.250 1.00 0.00 C ATOM 6 CG MET A 1 -2.197 8.534 13.899 1.00 0.00 C ATOM 7 SD MET A 1 -3.392 9.464 12.905 1.00 0.00 S ATOM 8 CE MET A 1 -4.586 8.125 12.669 1.00 0.00 C ATOM 0 H1 MET A 1 -1.718 9.157 17.874 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.041 8.888 17.900 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.668 10.263 17.125 1.00 0.00 H new ATOM 0 HA MET A 1 -1.194 7.446 16.222 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.948 9.240 15.799 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.713 10.267 15.098 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.244 8.469 13.374 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.549 7.513 14.049 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.423 8.485 12.070 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.103 7.293 12.155 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.952 7.789 13.639 1.00 0.00 H new ATOM 20 N LEU A 2 1.089 9.621 15.328 1.00 0.00 N ATOM 21 CA LEU A 2 2.407 9.696 14.630 1.00 0.00 C ATOM 22 C LEU A 2 3.421 8.765 15.300 1.00 0.00 C ATOM 23 O LEU A 2 4.480 8.502 14.766 1.00 0.00 O ATOM 24 CB LEU A 2 2.847 11.155 14.769 1.00 0.00 C ATOM 25 CG LEU A 2 4.162 11.371 14.012 1.00 0.00 C ATOM 26 CD1 LEU A 2 3.892 12.148 12.719 1.00 0.00 C ATOM 27 CD2 LEU A 2 5.130 12.167 14.890 1.00 0.00 C ATOM 0 H LEU A 2 0.790 10.483 15.783 1.00 0.00 H new ATOM 0 HA LEU A 2 2.337 9.387 13.587 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.076 11.817 14.375 1.00 0.00 H new ATOM 0 HB3 LEU A 2 2.976 11.408 15.821 1.00 0.00 H new ATOM 0 HG LEU A 2 4.600 10.403 13.767 1.00 0.00 H new ATOM 0 HD11 LEU A 2 4.829 12.300 12.183 1.00 0.00 H new ATOM 0 HD12 LEU A 2 3.203 11.582 12.092 1.00 0.00 H new ATOM 0 HD13 LEU A 2 3.452 13.115 12.961 1.00 0.00 H new ATOM 0 HD21 LEU A 2 6.066 12.321 14.353 1.00 0.00 H new ATOM 0 HD22 LEU A 2 4.689 13.133 15.135 1.00 0.00 H new ATOM 0 HD23 LEU A 2 5.326 11.614 15.809 1.00 0.00 H new ATOM 39 N SER A 3 3.111 8.270 16.468 1.00 0.00 N ATOM 40 CA SER A 3 4.067 7.365 17.170 1.00 0.00 C ATOM 41 C SER A 3 4.678 6.370 16.185 1.00 0.00 C ATOM 42 O SER A 3 5.875 6.336 15.982 1.00 0.00 O ATOM 43 CB SER A 3 3.231 6.629 18.214 1.00 0.00 C ATOM 44 OG SER A 3 4.067 6.248 19.300 1.00 0.00 O ATOM 0 H SER A 3 2.239 8.452 16.966 1.00 0.00 H new ATOM 0 HA SER A 3 4.892 7.916 17.621 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.424 7.270 18.569 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.767 5.748 17.770 1.00 0.00 H new ATOM 0 HG SER A 3 3.534 5.777 19.974 1.00 0.00 H new ATOM 50 N GLN A 4 3.866 5.557 15.573 1.00 0.00 N ATOM 51 CA GLN A 4 4.410 4.565 14.605 1.00 0.00 C ATOM 52 C GLN A 4 3.468 4.384 13.407 1.00 0.00 C ATOM 53 O GLN A 4 2.288 4.660 13.477 1.00 0.00 O ATOM 54 CB GLN A 4 4.552 3.268 15.400 1.00 0.00 C ATOM 55 CG GLN A 4 5.692 3.420 16.413 1.00 0.00 C ATOM 56 CD GLN A 4 6.367 2.065 16.631 1.00 0.00 C ATOM 57 OE1 GLN A 4 5.769 1.154 17.167 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.598 1.894 16.232 1.00 0.00 N ATOM 0 H GLN A 4 2.854 5.535 15.699 1.00 0.00 H new ATOM 0 HA GLN A 4 5.363 4.888 14.186 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.619 3.040 15.916 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.756 2.435 14.727 1.00 0.00 H new ATOM 0 HG2 GLN A 4 6.420 4.146 16.051 1.00 0.00 H new ATOM 0 HG3 GLN A 4 5.304 3.801 17.358 1.00 0.00 H new ATOM 0 HE21 GLN A 4 8.099 2.660 15.782 1.00 0.00 H new ATOM 0 HE22 GLN A 4 8.059 0.995 16.370 1.00 0.00 H new ATOM 67 N ILE A 5 4.002 3.927 12.307 1.00 0.00 N ATOM 68 CA ILE A 5 3.183 3.722 11.076 1.00 0.00 C ATOM 69 C ILE A 5 3.225 2.248 10.647 1.00 0.00 C ATOM 70 O ILE A 5 4.273 1.634 10.632 1.00 0.00 O ATOM 71 CB ILE A 5 3.863 4.603 10.029 1.00 0.00 C ATOM 72 CG1 ILE A 5 3.844 6.058 10.504 1.00 0.00 C ATOM 73 CG2 ILE A 5 3.128 4.482 8.697 1.00 0.00 C ATOM 74 CD1 ILE A 5 4.705 6.916 9.573 1.00 0.00 C ATOM 0 H ILE A 5 4.987 3.683 12.207 1.00 0.00 H new ATOM 0 HA ILE A 5 2.133 3.975 11.220 1.00 0.00 H new ATOM 0 HB ILE A 5 4.895 4.279 9.894 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.821 6.433 10.517 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.220 6.122 11.525 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.616 5.112 7.953 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.148 3.445 8.363 1.00 0.00 H new ATOM 0 HG23 ILE A 5 2.094 4.803 8.822 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.689 7.951 9.914 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.730 6.546 9.582 1.00 0.00 H new ATOM 0 HD13 ILE A 5 4.309 6.862 8.559 1.00 0.00 H new ATOM 86 N ALA A 6 2.102 1.674 10.287 1.00 0.00 N ATOM 87 CA ALA A 6 2.104 0.248 9.858 1.00 0.00 C ATOM 88 C ALA A 6 2.165 0.160 8.335 1.00 0.00 C ATOM 89 O ALA A 6 1.267 0.587 7.642 1.00 0.00 O ATOM 90 CB ALA A 6 0.784 -0.315 10.367 1.00 0.00 C ATOM 0 H ALA A 6 1.191 2.132 10.273 1.00 0.00 H new ATOM 0 HA ALA A 6 2.962 -0.301 10.246 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.706 -1.367 10.091 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.742 -0.220 11.452 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.043 0.239 9.923 1.00 0.00 H new ATOM 96 N ILE A 7 3.217 -0.390 7.808 1.00 0.00 N ATOM 97 CA ILE A 7 3.327 -0.499 6.327 1.00 0.00 C ATOM 98 C ILE A 7 3.454 -1.963 5.911 1.00 0.00 C ATOM 99 O ILE A 7 4.322 -2.680 6.355 1.00 0.00 O ATOM 100 CB ILE A 7 4.587 0.301 5.971 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.384 1.759 6.395 1.00 0.00 C ATOM 102 CG2 ILE A 7 4.844 0.248 4.462 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.630 2.581 6.051 1.00 0.00 C ATOM 0 H ILE A 7 4.005 -0.769 8.334 1.00 0.00 H new ATOM 0 HA ILE A 7 2.449 -0.114 5.809 1.00 0.00 H new ATOM 0 HB ILE A 7 5.443 -0.130 6.490 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.512 2.175 5.890 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.188 1.811 7.466 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.741 0.820 4.225 1.00 0.00 H new ATOM 0 HG22 ILE A 7 4.982 -0.788 4.153 1.00 0.00 H new ATOM 0 HG23 ILE A 7 3.992 0.674 3.933 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.478 3.617 6.355 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.493 2.171 6.576 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.807 2.541 4.976 1.00 0.00 H new ATOM 115 N CYS A 8 2.588 -2.408 5.055 1.00 0.00 N ATOM 116 CA CYS A 8 2.655 -3.821 4.599 1.00 0.00 C ATOM 117 C CYS A 8 3.311 -3.875 3.232 1.00 0.00 C ATOM 118 O CYS A 8 2.743 -3.465 2.253 1.00 0.00 O ATOM 119 CB CYS A 8 1.206 -4.282 4.504 1.00 0.00 C ATOM 120 SG CYS A 8 0.273 -3.175 3.421 1.00 0.00 S ATOM 0 H CYS A 8 1.833 -1.855 4.648 1.00 0.00 H new ATOM 0 HA CYS A 8 3.235 -4.451 5.274 1.00 0.00 H new ATOM 0 HB2 CYS A 8 1.165 -5.301 4.119 1.00 0.00 H new ATOM 0 HB3 CYS A 8 0.755 -4.298 5.496 1.00 0.00 H new ATOM 0 HG CYS A 8 -0.985 -3.502 3.446 1.00 0.00 H new ATOM 126 N ILE A 9 4.505 -4.357 3.143 1.00 0.00 N ATOM 127 CA ILE A 9 5.157 -4.395 1.811 1.00 0.00 C ATOM 128 C ILE A 9 5.127 -5.804 1.231 1.00 0.00 C ATOM 129 O ILE A 9 5.330 -6.782 1.926 1.00 0.00 O ATOM 130 CB ILE A 9 6.586 -3.948 2.068 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.404 -4.064 0.770 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.192 -4.823 3.159 1.00 0.00 C ATOM 133 CD1 ILE A 9 7.988 -5.476 0.613 1.00 0.00 C ATOM 0 H ILE A 9 5.056 -4.723 3.919 1.00 0.00 H new ATOM 0 HA ILE A 9 4.649 -3.757 1.087 1.00 0.00 H new ATOM 0 HB ILE A 9 6.599 -2.908 2.395 1.00 0.00 H new ATOM 0 HG12 ILE A 9 6.770 -3.831 -0.086 1.00 0.00 H new ATOM 0 HG13 ILE A 9 8.211 -3.331 0.778 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.218 -4.509 3.350 1.00 0.00 H new ATOM 0 HG22 ILE A 9 6.606 -4.723 4.073 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.186 -5.864 2.836 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.562 -5.532 -0.312 1.00 0.00 H new ATOM 0 HD12 ILE A 9 8.640 -5.696 1.458 1.00 0.00 H new ATOM 0 HD13 ILE A 9 7.177 -6.204 0.581 1.00 0.00 H new ATOM 145 N TRP A 10 4.909 -5.912 -0.049 1.00 0.00 N ATOM 146 CA TRP A 10 4.903 -7.255 -0.684 1.00 0.00 C ATOM 147 C TRP A 10 5.978 -7.284 -1.760 1.00 0.00 C ATOM 148 O TRP A 10 5.856 -6.651 -2.789 1.00 0.00 O ATOM 149 CB TRP A 10 3.521 -7.456 -1.312 1.00 0.00 C ATOM 150 CG TRP A 10 3.608 -8.594 -2.285 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.432 -9.661 -2.153 1.00 0.00 C ATOM 152 CD2 TRP A 10 2.886 -8.791 -3.532 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.262 -10.497 -3.240 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.317 -10.007 -4.116 1.00 0.00 C ATOM 155 CE3 TRP A 10 1.907 -8.044 -4.205 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.796 -10.462 -5.326 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.381 -8.497 -5.423 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.824 -9.705 -5.983 1.00 0.00 C ATOM 0 H TRP A 10 4.735 -5.130 -0.680 1.00 0.00 H new ATOM 0 HA TRP A 10 5.104 -8.045 0.039 1.00 0.00 H new ATOM 0 HB2 TRP A 10 2.781 -7.671 -0.541 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.198 -6.547 -1.819 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.112 -9.831 -1.331 1.00 0.00 H new ATOM 0 HE1 TRP A 10 4.773 -11.369 -3.377 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.557 -7.114 -3.782 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 3.141 -11.392 -5.752 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.630 -7.912 -5.934 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.414 -10.049 -6.921 1.00 0.00 H new ATOM 169 N VAL A 11 7.031 -7.998 -1.532 1.00 0.00 N ATOM 170 CA VAL A 11 8.107 -8.041 -2.545 1.00 0.00 C ATOM 171 C VAL A 11 8.815 -9.397 -2.491 1.00 0.00 C ATOM 172 O VAL A 11 9.176 -9.877 -1.434 1.00 0.00 O ATOM 173 CB VAL A 11 9.029 -6.896 -2.136 1.00 0.00 C ATOM 174 CG1 VAL A 11 9.714 -7.236 -0.813 1.00 0.00 C ATOM 175 CG2 VAL A 11 10.069 -6.661 -3.230 1.00 0.00 C ATOM 0 H VAL A 11 7.195 -8.553 -0.692 1.00 0.00 H new ATOM 0 HA VAL A 11 7.755 -7.931 -3.571 1.00 0.00 H new ATOM 0 HB VAL A 11 8.445 -5.985 -2.004 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.372 -6.417 -0.523 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.960 -7.386 -0.041 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.300 -8.148 -0.930 1.00 0.00 H new ATOM 0 HG21 VAL A 11 10.727 -5.843 -2.937 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.658 -7.567 -3.373 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.565 -6.405 -4.162 1.00 0.00 H new ATOM 185 N GLU A 12 9.004 -10.026 -3.618 1.00 0.00 N ATOM 186 CA GLU A 12 9.672 -11.360 -3.618 1.00 0.00 C ATOM 187 C GLU A 12 11.190 -11.201 -3.752 1.00 0.00 C ATOM 188 O GLU A 12 11.907 -12.161 -3.947 1.00 0.00 O ATOM 189 CB GLU A 12 9.101 -12.100 -4.831 1.00 0.00 C ATOM 190 CG GLU A 12 7.612 -12.376 -4.625 1.00 0.00 C ATOM 191 CD GLU A 12 7.112 -13.303 -5.736 1.00 0.00 C ATOM 192 OE1 GLU A 12 7.887 -13.588 -6.636 1.00 0.00 O ATOM 193 OE2 GLU A 12 5.966 -13.715 -5.668 1.00 0.00 O ATOM 0 H GLU A 12 8.727 -9.677 -4.535 1.00 0.00 H new ATOM 0 HA GLU A 12 9.493 -11.903 -2.690 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.247 -11.504 -5.732 1.00 0.00 H new ATOM 0 HB3 GLU A 12 9.636 -13.038 -4.979 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.447 -12.835 -3.650 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.052 -11.441 -4.636 1.00 0.00 H new ATOM 200 N SER A 13 11.685 -10.001 -3.649 1.00 0.00 N ATOM 201 CA SER A 13 13.155 -9.795 -3.769 1.00 0.00 C ATOM 202 C SER A 13 13.698 -9.121 -2.509 1.00 0.00 C ATOM 203 O SER A 13 13.088 -8.225 -1.961 1.00 0.00 O ATOM 204 CB SER A 13 13.330 -8.884 -4.981 1.00 0.00 C ATOM 205 OG SER A 13 14.690 -8.910 -5.399 1.00 0.00 O ATOM 0 H SER A 13 11.138 -9.155 -3.487 1.00 0.00 H new ATOM 0 HA SER A 13 13.695 -10.735 -3.885 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.682 -9.213 -5.793 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.035 -7.865 -4.730 1.00 0.00 H new ATOM 0 HG SER A 13 14.804 -8.327 -6.178 1.00 0.00 H new ATOM 211 N THR A 14 14.842 -9.543 -2.042 1.00 0.00 N ATOM 212 CA THR A 14 15.415 -8.919 -0.817 1.00 0.00 C ATOM 213 C THR A 14 15.929 -7.518 -1.140 1.00 0.00 C ATOM 214 O THR A 14 15.633 -6.564 -0.448 1.00 0.00 O ATOM 215 CB THR A 14 16.566 -9.832 -0.405 1.00 0.00 C ATOM 216 OG1 THR A 14 16.242 -11.175 -0.736 1.00 0.00 O ATOM 217 CG2 THR A 14 16.795 -9.714 1.102 1.00 0.00 C ATOM 0 H THR A 14 15.402 -10.289 -2.454 1.00 0.00 H new ATOM 0 HA THR A 14 14.678 -8.815 -0.020 1.00 0.00 H new ATOM 0 HB THR A 14 17.474 -9.538 -0.931 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.737 -11.443 -1.538 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.617 -10.366 1.397 1.00 0.00 H new ATOM 0 HG22 THR A 14 17.042 -8.682 1.353 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.889 -10.009 1.632 1.00 0.00 H new ATOM 225 N ALA A 15 16.692 -7.378 -2.188 1.00 0.00 N ATOM 226 CA ALA A 15 17.206 -6.029 -2.543 1.00 0.00 C ATOM 227 C ALA A 15 16.033 -5.052 -2.592 1.00 0.00 C ATOM 228 O ALA A 15 16.074 -3.986 -2.012 1.00 0.00 O ATOM 229 CB ALA A 15 17.848 -6.193 -3.922 1.00 0.00 C ATOM 0 H ALA A 15 16.979 -8.134 -2.809 1.00 0.00 H new ATOM 0 HA ALA A 15 17.926 -5.640 -1.823 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.251 -5.236 -4.252 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.653 -6.925 -3.864 1.00 0.00 H new ATOM 0 HB3 ALA A 15 17.097 -6.535 -4.634 1.00 0.00 H new ATOM 235 N ILE A 16 14.973 -5.422 -3.257 1.00 0.00 N ATOM 236 CA ILE A 16 13.789 -4.527 -3.313 1.00 0.00 C ATOM 237 C ILE A 16 13.175 -4.434 -1.914 1.00 0.00 C ATOM 238 O ILE A 16 12.819 -3.370 -1.449 1.00 0.00 O ATOM 239 CB ILE A 16 12.830 -5.201 -4.292 1.00 0.00 C ATOM 240 CG1 ILE A 16 13.443 -5.182 -5.696 1.00 0.00 C ATOM 241 CG2 ILE A 16 11.503 -4.441 -4.311 1.00 0.00 C ATOM 242 CD1 ILE A 16 12.665 -6.128 -6.612 1.00 0.00 C ATOM 0 H ILE A 16 14.878 -6.303 -3.762 1.00 0.00 H new ATOM 0 HA ILE A 16 14.028 -3.513 -3.633 1.00 0.00 H new ATOM 0 HB ILE A 16 12.656 -6.231 -3.980 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.420 -4.170 -6.099 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.489 -5.484 -5.650 1.00 0.00 H new ATOM 0 HG21 ILE A 16 10.818 -4.922 -5.010 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.066 -4.447 -3.312 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.678 -3.412 -4.624 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.104 -6.112 -7.609 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.711 -7.141 -6.212 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.625 -5.807 -6.668 1.00 0.00 H new ATOM 254 N LEU A 17 13.076 -5.543 -1.229 1.00 0.00 N ATOM 255 CA LEU A 17 12.515 -5.521 0.151 1.00 0.00 C ATOM 256 C LEU A 17 13.365 -4.601 1.020 1.00 0.00 C ATOM 257 O LEU A 17 12.863 -3.831 1.813 1.00 0.00 O ATOM 258 CB LEU A 17 12.612 -6.976 0.635 1.00 0.00 C ATOM 259 CG LEU A 17 12.665 -7.047 2.173 1.00 0.00 C ATOM 260 CD1 LEU A 17 14.091 -6.770 2.654 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.721 -6.010 2.792 1.00 0.00 C ATOM 0 H LEU A 17 13.360 -6.463 -1.567 1.00 0.00 H new ATOM 0 HA LEU A 17 11.490 -5.153 0.193 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.754 -7.541 0.271 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.503 -7.443 0.215 1.00 0.00 H new ATOM 0 HG LEU A 17 12.354 -8.045 2.482 1.00 0.00 H new ATOM 0 HD11 LEU A 17 14.124 -6.821 3.742 1.00 0.00 H new ATOM 0 HD12 LEU A 17 14.767 -7.515 2.235 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.398 -5.776 2.328 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.772 -6.075 3.879 1.00 0.00 H new ATOM 0 HD22 LEU A 17 12.019 -5.011 2.474 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.700 -6.206 2.464 1.00 0.00 H new ATOM 273 N GLN A 18 14.655 -4.673 0.866 1.00 0.00 N ATOM 274 CA GLN A 18 15.547 -3.796 1.675 1.00 0.00 C ATOM 275 C GLN A 18 15.408 -2.340 1.229 1.00 0.00 C ATOM 276 O GLN A 18 15.284 -1.441 2.038 1.00 0.00 O ATOM 277 CB GLN A 18 16.963 -4.304 1.402 1.00 0.00 C ATOM 278 CG GLN A 18 17.166 -5.655 2.092 1.00 0.00 C ATOM 279 CD GLN A 18 18.659 -5.987 2.140 1.00 0.00 C ATOM 280 OE1 GLN A 18 19.337 -5.942 1.132 1.00 0.00 O ATOM 281 NE2 GLN A 18 19.203 -6.320 3.279 1.00 0.00 N ATOM 0 H GLN A 18 15.131 -5.299 0.217 1.00 0.00 H new ATOM 0 HA GLN A 18 15.299 -3.829 2.736 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.123 -4.405 0.329 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.695 -3.584 1.767 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.757 -5.624 3.102 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.627 -6.434 1.554 1.00 0.00 H new ATOM 0 HE21 GLN A 18 18.634 -6.358 4.124 1.00 0.00 H new ATOM 0 HE22 GLN A 18 20.197 -6.543 3.323 1.00 0.00 H new ATOM 290 N ASP A 19 15.436 -2.100 -0.050 1.00 0.00 N ATOM 291 CA ASP A 19 15.315 -0.700 -0.542 1.00 0.00 C ATOM 292 C ASP A 19 13.983 -0.090 -0.102 1.00 0.00 C ATOM 293 O ASP A 19 13.910 1.062 0.284 1.00 0.00 O ATOM 294 CB ASP A 19 15.373 -0.814 -2.066 1.00 0.00 C ATOM 295 CG ASP A 19 16.703 -1.441 -2.485 1.00 0.00 C ATOM 296 OD1 ASP A 19 17.469 -1.802 -1.607 1.00 0.00 O ATOM 297 OD2 ASP A 19 16.932 -1.555 -3.678 1.00 0.00 O ATOM 0 H ASP A 19 15.537 -2.810 -0.775 1.00 0.00 H new ATOM 0 HA ASP A 19 16.101 -0.056 -0.147 1.00 0.00 H new ATOM 0 HB2 ASP A 19 14.543 -1.422 -2.427 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.266 0.172 -2.519 1.00 0.00 H new ATOM 302 N CYS A 20 12.930 -0.853 -0.160 1.00 0.00 N ATOM 303 CA CYS A 20 11.603 -0.322 0.248 1.00 0.00 C ATOM 304 C CYS A 20 11.589 0.002 1.745 1.00 0.00 C ATOM 305 O CYS A 20 11.018 0.990 2.164 1.00 0.00 O ATOM 306 CB CYS A 20 10.622 -1.445 -0.082 1.00 0.00 C ATOM 307 SG CYS A 20 10.513 -1.631 -1.879 1.00 0.00 S ATOM 0 H CYS A 20 12.931 -1.824 -0.473 1.00 0.00 H new ATOM 0 HA CYS A 20 11.349 0.606 -0.265 1.00 0.00 H new ATOM 0 HB2 CYS A 20 10.953 -2.379 0.373 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.639 -1.219 0.333 1.00 0.00 H new ATOM 0 HG CYS A 20 11.386 -2.508 -2.278 1.00 0.00 H new ATOM 313 N GLN A 21 12.206 -0.813 2.560 1.00 0.00 N ATOM 314 CA GLN A 21 12.217 -0.525 4.019 1.00 0.00 C ATOM 315 C GLN A 21 13.380 0.401 4.363 1.00 0.00 C ATOM 316 O GLN A 21 13.290 1.213 5.264 1.00 0.00 O ATOM 317 CB GLN A 21 12.380 -1.881 4.696 1.00 0.00 C ATOM 318 CG GLN A 21 11.225 -2.795 4.284 1.00 0.00 C ATOM 319 CD GLN A 21 11.263 -4.072 5.121 1.00 0.00 C ATOM 320 OE1 GLN A 21 10.261 -4.739 5.279 1.00 0.00 O ATOM 321 NE2 GLN A 21 12.387 -4.444 5.666 1.00 0.00 N ATOM 0 H GLN A 21 12.699 -1.660 2.278 1.00 0.00 H new ATOM 0 HA GLN A 21 11.307 -0.022 4.348 1.00 0.00 H new ATOM 0 HB2 GLN A 21 13.332 -2.329 4.413 1.00 0.00 H new ATOM 0 HB3 GLN A 21 12.394 -1.760 5.779 1.00 0.00 H new ATOM 0 HG2 GLN A 21 10.273 -2.283 4.426 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.301 -3.039 3.224 1.00 0.00 H new ATOM 0 HE21 GLN A 21 13.229 -3.883 5.533 1.00 0.00 H new ATOM 0 HE22 GLN A 21 12.425 -5.296 6.226 1.00 0.00 H new ATOM 330 N ARG A 22 14.476 0.295 3.653 1.00 0.00 N ATOM 331 CA ARG A 22 15.626 1.188 3.958 1.00 0.00 C ATOM 332 C ARG A 22 15.145 2.630 3.944 1.00 0.00 C ATOM 333 O ARG A 22 15.331 3.366 4.894 1.00 0.00 O ATOM 334 CB ARG A 22 16.648 0.951 2.841 1.00 0.00 C ATOM 335 CG ARG A 22 17.579 -0.210 3.214 1.00 0.00 C ATOM 336 CD ARG A 22 18.047 -0.047 4.660 1.00 0.00 C ATOM 337 NE ARG A 22 19.473 -0.483 4.666 1.00 0.00 N ATOM 338 CZ ARG A 22 20.283 -0.072 5.607 1.00 0.00 C ATOM 339 NH1 ARG A 22 19.846 0.702 6.564 1.00 0.00 N ATOM 340 NH2 ARG A 22 21.532 -0.450 5.596 1.00 0.00 N ATOM 0 H ARG A 22 14.620 -0.363 2.887 1.00 0.00 H new ATOM 0 HA ARG A 22 16.064 0.987 4.936 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.132 0.728 1.907 1.00 0.00 H new ATOM 0 HB3 ARG A 22 17.232 1.856 2.674 1.00 0.00 H new ATOM 0 HG2 ARG A 22 17.058 -1.160 3.095 1.00 0.00 H new ATOM 0 HG3 ARG A 22 18.438 -0.231 2.543 1.00 0.00 H new ATOM 0 HD2 ARG A 22 17.951 0.987 4.990 1.00 0.00 H new ATOM 0 HD3 ARG A 22 17.447 -0.655 5.338 1.00 0.00 H new ATOM 0 HE ARG A 22 19.818 -1.104 3.934 1.00 0.00 H new ATOM 0 HH11 ARG A 22 18.868 0.990 6.581 1.00 0.00 H new ATOM 0 HH12 ARG A 22 20.483 1.019 7.295 1.00 0.00 H new ATOM 0 HH21 ARG A 22 21.873 -1.063 4.856 1.00 0.00 H new ATOM 0 HH22 ARG A 22 22.168 -0.132 6.328 1.00 0.00 H new ATOM 354 N ALA A 23 14.488 3.033 2.893 1.00 0.00 N ATOM 355 CA ALA A 23 13.956 4.418 2.859 1.00 0.00 C ATOM 356 C ALA A 23 12.964 4.547 4.015 1.00 0.00 C ATOM 357 O ALA A 23 13.037 5.459 4.816 1.00 0.00 O ATOM 358 CB ALA A 23 13.265 4.556 1.505 1.00 0.00 C ATOM 0 H ALA A 23 14.299 2.468 2.065 1.00 0.00 H new ATOM 0 HA ALA A 23 14.715 5.193 2.969 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.847 5.558 1.410 1.00 0.00 H new ATOM 0 HB2 ALA A 23 13.989 4.388 0.708 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.464 3.820 1.428 1.00 0.00 H new ATOM 364 N LEU A 24 12.063 3.601 4.130 1.00 0.00 N ATOM 365 CA LEU A 24 11.094 3.617 5.257 1.00 0.00 C ATOM 366 C LEU A 24 11.771 2.991 6.479 1.00 0.00 C ATOM 367 O LEU A 24 11.395 1.935 6.938 1.00 0.00 O ATOM 368 CB LEU A 24 9.936 2.739 4.777 1.00 0.00 C ATOM 369 CG LEU A 24 9.368 3.319 3.485 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.212 2.456 2.986 1.00 0.00 C ATOM 371 CD2 LEU A 24 8.858 4.723 3.760 1.00 0.00 C ATOM 0 H LEU A 24 11.961 2.817 3.485 1.00 0.00 H new ATOM 0 HA LEU A 24 10.755 4.616 5.532 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.282 1.719 4.610 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.159 2.691 5.540 1.00 0.00 H new ATOM 0 HG LEU A 24 10.149 3.342 2.725 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.814 2.879 2.064 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.569 1.444 2.797 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.426 2.428 3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.449 5.148 2.843 1.00 0.00 H new ATOM 0 HD22 LEU A 24 8.078 4.684 4.521 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.680 5.346 4.114 1.00 0.00 H new ATOM 383 N SER A 25 12.790 3.625 6.989 1.00 0.00 N ATOM 384 CA SER A 25 13.518 3.052 8.161 1.00 0.00 C ATOM 385 C SER A 25 13.183 3.818 9.439 1.00 0.00 C ATOM 386 O SER A 25 13.580 3.434 10.522 1.00 0.00 O ATOM 387 CB SER A 25 15.000 3.198 7.813 1.00 0.00 C ATOM 388 OG SER A 25 15.212 4.453 7.181 1.00 0.00 O ATOM 0 H SER A 25 13.152 4.515 6.647 1.00 0.00 H new ATOM 0 HA SER A 25 13.240 2.014 8.346 1.00 0.00 H new ATOM 0 HB2 SER A 25 15.606 3.125 8.716 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.312 2.388 7.153 1.00 0.00 H new ATOM 0 HG SER A 25 15.095 4.356 6.213 1.00 0.00 H new ATOM 394 N ALA A 26 12.446 4.891 9.321 1.00 0.00 N ATOM 395 CA ALA A 26 12.066 5.678 10.530 1.00 0.00 C ATOM 396 C ALA A 26 11.748 4.727 11.688 1.00 0.00 C ATOM 397 O ALA A 26 11.138 3.693 11.504 1.00 0.00 O ATOM 398 CB ALA A 26 10.813 6.456 10.115 1.00 0.00 C ATOM 0 H ALA A 26 12.090 5.257 8.438 1.00 0.00 H new ATOM 0 HA ALA A 26 12.863 6.341 10.867 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.468 7.063 10.952 1.00 0.00 H new ATOM 0 HB2 ALA A 26 11.050 7.103 9.271 1.00 0.00 H new ATOM 0 HB3 ALA A 26 10.029 5.756 9.827 1.00 0.00 H new ATOM 404 N ASP A 27 12.167 5.062 12.877 1.00 0.00 N ATOM 405 CA ASP A 27 11.897 4.171 14.042 1.00 0.00 C ATOM 406 C ASP A 27 10.396 3.996 14.241 1.00 0.00 C ATOM 407 O ASP A 27 9.951 3.137 14.975 1.00 0.00 O ATOM 408 CB ASP A 27 12.510 4.891 15.241 1.00 0.00 C ATOM 409 CG ASP A 27 14.017 4.641 15.272 1.00 0.00 C ATOM 410 OD1 ASP A 27 14.459 3.726 14.596 1.00 0.00 O ATOM 411 OD2 ASP A 27 14.703 5.366 15.972 1.00 0.00 O ATOM 0 H ASP A 27 12.685 5.914 13.093 1.00 0.00 H new ATOM 0 HA ASP A 27 12.317 3.175 13.902 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.310 5.961 15.177 1.00 0.00 H new ATOM 0 HB3 ASP A 27 12.053 4.535 16.164 1.00 0.00 H new ATOM 416 N ARG A 28 9.611 4.808 13.600 1.00 0.00 N ATOM 417 CA ARG A 28 8.141 4.695 13.757 1.00 0.00 C ATOM 418 C ARG A 28 7.553 3.876 12.608 1.00 0.00 C ATOM 419 O ARG A 28 6.361 3.845 12.410 1.00 0.00 O ATOM 420 CB ARG A 28 7.643 6.140 13.700 1.00 0.00 C ATOM 421 CG ARG A 28 7.818 6.672 12.277 1.00 0.00 C ATOM 422 CD ARG A 28 7.693 8.197 12.268 1.00 0.00 C ATOM 423 NE ARG A 28 7.755 8.559 10.825 1.00 0.00 N ATOM 424 CZ ARG A 28 7.434 9.760 10.433 1.00 0.00 C ATOM 425 NH1 ARG A 28 7.056 10.658 11.302 1.00 0.00 N ATOM 426 NH2 ARG A 28 7.496 10.062 9.165 1.00 0.00 N ATOM 0 H ARG A 28 9.925 5.548 12.972 1.00 0.00 H new ATOM 0 HA ARG A 28 7.851 4.194 14.681 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.594 6.189 13.994 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.200 6.758 14.404 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.792 6.377 11.887 1.00 0.00 H new ATOM 0 HG3 ARG A 28 7.066 6.234 11.621 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.756 8.523 12.721 1.00 0.00 H new ATOM 0 HD3 ARG A 28 8.499 8.666 12.832 1.00 0.00 H new ATOM 0 HE ARG A 28 8.050 7.864 10.140 1.00 0.00 H new ATOM 0 HH11 ARG A 28 7.011 10.421 12.293 1.00 0.00 H new ATOM 0 HH12 ARG A 28 6.806 11.596 10.990 1.00 0.00 H new ATOM 0 HH21 ARG A 28 7.794 9.360 8.488 1.00 0.00 H new ATOM 0 HH22 ARG A 28 7.246 11.000 8.851 1.00 0.00 H new ATOM 440 N TYR A 29 8.377 3.221 11.836 1.00 0.00 N ATOM 441 CA TYR A 29 7.835 2.430 10.698 1.00 0.00 C ATOM 442 C TYR A 29 7.692 0.955 11.056 1.00 0.00 C ATOM 443 O TYR A 29 8.612 0.320 11.531 1.00 0.00 O ATOM 444 CB TYR A 29 8.844 2.615 9.564 1.00 0.00 C ATOM 445 CG TYR A 29 8.441 3.817 8.751 1.00 0.00 C ATOM 446 CD1 TYR A 29 7.102 3.996 8.401 1.00 0.00 C ATOM 447 CD2 TYR A 29 9.396 4.759 8.366 1.00 0.00 C ATOM 448 CE1 TYR A 29 6.713 5.115 7.666 1.00 0.00 C ATOM 449 CE2 TYR A 29 9.010 5.884 7.634 1.00 0.00 C ATOM 450 CZ TYR A 29 7.667 6.065 7.281 1.00 0.00 C ATOM 451 OH TYR A 29 7.284 7.174 6.556 1.00 0.00 O ATOM 0 H TYR A 29 9.391 3.200 11.943 1.00 0.00 H new ATOM 0 HA TYR A 29 6.836 2.768 10.421 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.847 2.752 9.969 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.873 1.725 8.935 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.365 3.266 8.700 1.00 0.00 H new ATOM 0 HD2 TYR A 29 10.433 4.618 8.634 1.00 0.00 H new ATOM 0 HE1 TYR A 29 5.677 5.249 7.394 1.00 0.00 H new ATOM 0 HE2 TYR A 29 9.748 6.615 7.340 1.00 0.00 H new ATOM 0 HH TYR A 29 8.069 7.732 6.372 1.00 0.00 H new ATOM 461 N GLN A 30 6.541 0.402 10.800 1.00 0.00 N ATOM 462 CA GLN A 30 6.322 -1.044 11.085 1.00 0.00 C ATOM 463 C GLN A 30 6.079 -1.764 9.762 1.00 0.00 C ATOM 464 O GLN A 30 4.956 -1.932 9.331 1.00 0.00 O ATOM 465 CB GLN A 30 5.081 -1.105 11.978 1.00 0.00 C ATOM 466 CG GLN A 30 4.769 -2.563 12.323 1.00 0.00 C ATOM 467 CD GLN A 30 3.513 -2.632 13.194 1.00 0.00 C ATOM 468 OE1 GLN A 30 3.158 -1.673 13.848 1.00 0.00 O ATOM 469 NE2 GLN A 30 2.821 -3.738 13.228 1.00 0.00 N ATOM 0 H GLN A 30 5.738 0.891 10.404 1.00 0.00 H new ATOM 0 HA GLN A 30 7.172 -1.518 11.575 1.00 0.00 H new ATOM 0 HB2 GLN A 30 5.248 -0.533 12.890 1.00 0.00 H new ATOM 0 HB3 GLN A 30 4.231 -0.651 11.468 1.00 0.00 H new ATOM 0 HG2 GLN A 30 4.621 -3.139 11.409 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.612 -3.010 12.849 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.120 -4.544 12.678 1.00 0.00 H new ATOM 0 HE22 GLN A 30 1.981 -3.797 13.804 1.00 0.00 H new ATOM 478 N LEU A 31 7.126 -2.150 9.092 1.00 0.00 N ATOM 479 CA LEU A 31 6.951 -2.811 7.775 1.00 0.00 C ATOM 480 C LEU A 31 6.839 -4.329 7.900 1.00 0.00 C ATOM 481 O LEU A 31 7.728 -4.997 8.391 1.00 0.00 O ATOM 482 CB LEU A 31 8.203 -2.437 6.994 1.00 0.00 C ATOM 483 CG LEU A 31 8.425 -0.930 7.086 1.00 0.00 C ATOM 484 CD1 LEU A 31 9.848 -0.657 7.575 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.222 -0.306 5.704 1.00 0.00 C ATOM 0 H LEU A 31 8.092 -2.036 9.399 1.00 0.00 H new ATOM 0 HA LEU A 31 6.029 -2.489 7.290 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.067 -2.968 7.394 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.098 -2.738 5.952 1.00 0.00 H new ATOM 0 HG LEU A 31 7.714 -0.493 7.787 1.00 0.00 H new ATOM 0 HD11 LEU A 31 10.010 0.419 7.642 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.987 -1.107 8.558 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.563 -1.088 6.874 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.379 0.771 5.764 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.935 -0.738 5.001 1.00 0.00 H new ATOM 0 HD23 LEU A 31 7.207 -0.506 5.360 1.00 0.00 H new ATOM 497 N GLN A 32 5.761 -4.877 7.413 1.00 0.00 N ATOM 498 CA GLN A 32 5.583 -6.355 7.445 1.00 0.00 C ATOM 499 C GLN A 32 5.890 -6.894 6.047 1.00 0.00 C ATOM 500 O GLN A 32 5.238 -6.537 5.086 1.00 0.00 O ATOM 501 CB GLN A 32 4.110 -6.571 7.796 1.00 0.00 C ATOM 502 CG GLN A 32 3.838 -8.063 7.983 1.00 0.00 C ATOM 503 CD GLN A 32 4.648 -8.581 9.171 1.00 0.00 C ATOM 504 OE1 GLN A 32 4.468 -8.131 10.285 1.00 0.00 O ATOM 505 NE2 GLN A 32 5.540 -9.514 8.981 1.00 0.00 N ATOM 0 H GLN A 32 4.990 -4.360 6.991 1.00 0.00 H new ATOM 0 HA GLN A 32 6.233 -6.860 8.159 1.00 0.00 H new ATOM 0 HB2 GLN A 32 3.860 -6.029 8.708 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.475 -6.172 7.005 1.00 0.00 H new ATOM 0 HG2 GLN A 32 2.775 -8.232 8.152 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.107 -8.609 7.079 1.00 0.00 H new ATOM 0 HE21 GLN A 32 5.691 -9.892 8.046 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.086 -9.865 9.768 1.00 0.00 H new ATOM 514 N VAL A 33 6.887 -7.718 5.907 1.00 0.00 N ATOM 515 CA VAL A 33 7.221 -8.221 4.547 1.00 0.00 C ATOM 516 C VAL A 33 6.468 -9.506 4.224 1.00 0.00 C ATOM 517 O VAL A 33 6.503 -10.472 4.961 1.00 0.00 O ATOM 518 CB VAL A 33 8.725 -8.470 4.562 1.00 0.00 C ATOM 519 CG1 VAL A 33 9.207 -8.720 3.133 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.441 -7.243 5.129 1.00 0.00 C ATOM 0 H VAL A 33 7.479 -8.062 6.663 1.00 0.00 H new ATOM 0 HA VAL A 33 6.933 -7.501 3.781 1.00 0.00 H new ATOM 0 HB VAL A 33 8.945 -9.338 5.183 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.282 -8.899 3.138 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.696 -9.592 2.724 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.987 -7.848 2.517 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.516 -7.422 5.139 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.223 -6.375 4.507 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.094 -7.057 6.145 1.00 0.00 H new ATOM 530 N CYS A 34 5.801 -9.523 3.105 1.00 0.00 N ATOM 531 CA CYS A 34 5.050 -10.744 2.693 1.00 0.00 C ATOM 532 C CYS A 34 5.761 -11.387 1.498 1.00 0.00 C ATOM 533 O CYS A 34 5.907 -10.783 0.455 1.00 0.00 O ATOM 534 CB CYS A 34 3.659 -10.243 2.306 1.00 0.00 C ATOM 535 SG CYS A 34 2.785 -9.687 3.792 1.00 0.00 S ATOM 0 H CYS A 34 5.742 -8.740 2.454 1.00 0.00 H new ATOM 0 HA CYS A 34 4.990 -11.498 3.478 1.00 0.00 H new ATOM 0 HB2 CYS A 34 3.741 -9.424 1.591 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.097 -11.038 1.816 1.00 0.00 H new ATOM 0 HG CYS A 34 3.061 -8.437 4.016 1.00 0.00 H new ATOM 541 N GLU A 35 6.227 -12.597 1.654 1.00 0.00 N ATOM 542 CA GLU A 35 6.958 -13.266 0.538 1.00 0.00 C ATOM 543 C GLU A 35 6.089 -13.371 -0.714 1.00 0.00 C ATOM 544 O GLU A 35 6.560 -13.200 -1.818 1.00 0.00 O ATOM 545 CB GLU A 35 7.275 -14.665 1.053 1.00 0.00 C ATOM 546 CG GLU A 35 8.085 -14.575 2.346 1.00 0.00 C ATOM 547 CD GLU A 35 8.624 -15.962 2.696 1.00 0.00 C ATOM 548 OE1 GLU A 35 7.851 -16.772 3.179 1.00 0.00 O ATOM 549 OE2 GLU A 35 9.800 -16.192 2.468 1.00 0.00 O ATOM 0 H GLU A 35 6.133 -13.151 2.505 1.00 0.00 H new ATOM 0 HA GLU A 35 7.848 -12.702 0.259 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.350 -15.214 1.231 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.836 -15.220 0.301 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.908 -13.871 2.226 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.460 -14.199 3.156 1.00 0.00 H new ATOM 556 N SER A 36 4.833 -13.670 -0.557 1.00 0.00 N ATOM 557 CA SER A 36 3.958 -13.803 -1.753 1.00 0.00 C ATOM 558 C SER A 36 2.982 -12.629 -1.825 1.00 0.00 C ATOM 559 O SER A 36 3.112 -11.660 -1.105 1.00 0.00 O ATOM 560 CB SER A 36 3.218 -15.124 -1.546 1.00 0.00 C ATOM 561 OG SER A 36 4.167 -16.159 -1.319 1.00 0.00 O ATOM 0 H SER A 36 4.375 -13.827 0.341 1.00 0.00 H new ATOM 0 HA SER A 36 4.518 -13.796 -2.688 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.538 -15.045 -0.698 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.611 -15.356 -2.421 1.00 0.00 H new ATOM 0 HG SER A 36 3.698 -17.009 -1.184 1.00 0.00 H new ATOM 567 N GLY A 37 1.993 -12.712 -2.672 1.00 0.00 N ATOM 568 CA GLY A 37 1.005 -11.608 -2.767 1.00 0.00 C ATOM 569 C GLY A 37 -0.197 -12.015 -1.941 1.00 0.00 C ATOM 570 O GLY A 37 -0.910 -11.199 -1.391 1.00 0.00 O ATOM 0 H GLY A 37 1.829 -13.498 -3.301 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.431 -10.676 -2.394 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.719 -11.435 -3.804 1.00 0.00 H new ATOM 574 N GLU A 38 -0.400 -13.294 -1.832 1.00 0.00 N ATOM 575 CA GLU A 38 -1.518 -13.813 -1.025 1.00 0.00 C ATOM 576 C GLU A 38 -1.209 -13.556 0.445 1.00 0.00 C ATOM 577 O GLU A 38 -2.088 -13.337 1.252 1.00 0.00 O ATOM 578 CB GLU A 38 -1.539 -15.305 -1.341 1.00 0.00 C ATOM 579 CG GLU A 38 -2.467 -15.565 -2.529 1.00 0.00 C ATOM 580 CD GLU A 38 -3.498 -16.629 -2.150 1.00 0.00 C ATOM 581 OE1 GLU A 38 -4.332 -16.345 -1.306 1.00 0.00 O ATOM 582 OE2 GLU A 38 -3.437 -17.711 -2.711 1.00 0.00 O ATOM 0 H GLU A 38 0.175 -14.009 -2.278 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.481 -13.348 -1.238 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.532 -15.653 -1.571 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.879 -15.867 -0.471 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.971 -14.643 -2.819 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.887 -15.896 -3.391 1.00 0.00 H new ATOM 589 N MET A 39 0.051 -13.563 0.787 1.00 0.00 N ATOM 590 CA MET A 39 0.442 -13.300 2.195 1.00 0.00 C ATOM 591 C MET A 39 0.120 -11.845 2.563 1.00 0.00 C ATOM 592 O MET A 39 -0.279 -11.552 3.672 1.00 0.00 O ATOM 593 CB MET A 39 1.946 -13.588 2.251 1.00 0.00 C ATOM 594 CG MET A 39 2.170 -15.098 2.112 1.00 0.00 C ATOM 595 SD MET A 39 3.904 -15.493 2.453 1.00 0.00 S ATOM 596 CE MET A 39 3.813 -15.381 4.257 1.00 0.00 C ATOM 0 H MET A 39 0.826 -13.740 0.148 1.00 0.00 H new ATOM 0 HA MET A 39 -0.099 -13.920 2.910 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.461 -13.056 1.452 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.363 -13.231 3.192 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.522 -15.636 2.803 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.904 -15.424 1.106 1.00 0.00 H new ATOM 0 HE1 MET A 39 4.537 -14.648 4.613 1.00 0.00 H new ATOM 0 HE2 MET A 39 2.810 -15.073 4.552 1.00 0.00 H new ATOM 0 HE3 MET A 39 4.037 -16.354 4.694 1.00 0.00 H new ATOM 606 N LEU A 40 0.266 -10.934 1.632 1.00 0.00 N ATOM 607 CA LEU A 40 -0.063 -9.505 1.926 1.00 0.00 C ATOM 608 C LEU A 40 -1.548 -9.402 2.256 1.00 0.00 C ATOM 609 O LEU A 40 -1.946 -8.759 3.207 1.00 0.00 O ATOM 610 CB LEU A 40 0.245 -8.745 0.632 1.00 0.00 C ATOM 611 CG LEU A 40 0.429 -7.251 0.924 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.738 -6.732 1.766 1.00 0.00 C ATOM 613 CD2 LEU A 40 1.736 -7.035 1.685 1.00 0.00 C ATOM 0 H LEU A 40 0.597 -11.117 0.685 1.00 0.00 H new ATOM 0 HA LEU A 40 0.502 -9.105 2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.148 -9.147 0.172 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.566 -8.886 -0.082 1.00 0.00 H new ATOM 0 HG LEU A 40 0.459 -6.708 -0.020 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.597 -5.670 1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.672 -6.878 1.223 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.778 -7.278 2.709 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.865 -5.973 1.892 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.705 -7.586 2.625 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.571 -7.392 1.082 1.00 0.00 H new ATOM 625 N LEU A 41 -2.368 -10.043 1.469 1.00 0.00 N ATOM 626 CA LEU A 41 -3.828 -10.001 1.721 1.00 0.00 C ATOM 627 C LEU A 41 -4.130 -10.518 3.125 1.00 0.00 C ATOM 628 O LEU A 41 -4.850 -9.904 3.877 1.00 0.00 O ATOM 629 CB LEU A 41 -4.427 -10.934 0.671 1.00 0.00 C ATOM 630 CG LEU A 41 -4.199 -10.354 -0.721 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.746 -11.325 -1.765 1.00 0.00 C ATOM 632 CD2 LEU A 41 -4.933 -9.017 -0.840 1.00 0.00 C ATOM 0 H LEU A 41 -2.084 -10.595 0.660 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.235 -8.992 1.657 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -3.970 -11.921 0.744 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.494 -11.063 0.852 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.132 -10.200 -0.884 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.586 -10.915 -2.762 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.230 -12.281 -1.678 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.813 -11.473 -1.601 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.771 -8.600 -1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.000 -9.172 -0.681 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.551 -8.324 -0.090 1.00 0.00 H new ATOM 644 N GLU A 42 -3.585 -11.642 3.489 1.00 0.00 N ATOM 645 CA GLU A 42 -3.862 -12.177 4.850 1.00 0.00 C ATOM 646 C GLU A 42 -3.487 -11.134 5.909 1.00 0.00 C ATOM 647 O GLU A 42 -4.183 -10.961 6.889 1.00 0.00 O ATOM 648 CB GLU A 42 -3.000 -13.434 4.982 1.00 0.00 C ATOM 649 CG GLU A 42 -3.442 -14.222 6.220 1.00 0.00 C ATOM 650 CD GLU A 42 -4.885 -14.698 6.036 1.00 0.00 C ATOM 651 OE1 GLU A 42 -5.276 -14.918 4.901 1.00 0.00 O ATOM 652 OE2 GLU A 42 -5.576 -14.834 7.033 1.00 0.00 O ATOM 0 H GLU A 42 -2.966 -12.210 2.911 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.917 -12.409 4.996 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.098 -14.052 4.089 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.948 -13.161 5.067 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -2.783 -15.077 6.374 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.365 -13.596 7.109 1.00 0.00 H new ATOM 659 N TYR A 43 -2.401 -10.430 5.722 1.00 0.00 N ATOM 660 CA TYR A 43 -2.019 -9.398 6.728 1.00 0.00 C ATOM 661 C TYR A 43 -2.997 -8.219 6.671 1.00 0.00 C ATOM 662 O TYR A 43 -3.344 -7.640 7.682 1.00 0.00 O ATOM 663 CB TYR A 43 -0.612 -8.936 6.341 1.00 0.00 C ATOM 664 CG TYR A 43 -0.284 -7.668 7.099 1.00 0.00 C ATOM 665 CD1 TYR A 43 -0.637 -6.421 6.566 1.00 0.00 C ATOM 666 CD2 TYR A 43 0.356 -7.741 8.341 1.00 0.00 C ATOM 667 CE1 TYR A 43 -0.346 -5.249 7.274 1.00 0.00 C ATOM 668 CE2 TYR A 43 0.644 -6.567 9.051 1.00 0.00 C ATOM 669 CZ TYR A 43 0.293 -5.321 8.517 1.00 0.00 C ATOM 670 OH TYR A 43 0.572 -4.165 9.219 1.00 0.00 O ATOM 0 H TYR A 43 -1.770 -10.524 4.926 1.00 0.00 H new ATOM 0 HA TYR A 43 -2.045 -9.796 7.742 1.00 0.00 H new ATOM 0 HB2 TYR A 43 0.117 -9.713 6.573 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.556 -8.758 5.267 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -1.134 -6.364 5.609 1.00 0.00 H new ATOM 0 HD2 TYR A 43 0.628 -8.702 8.753 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -0.615 -4.288 6.861 1.00 0.00 H new ATOM 0 HE2 TYR A 43 1.137 -6.624 10.010 1.00 0.00 H new ATOM 0 HH TYR A 43 1.016 -4.393 10.062 1.00 0.00 H new ATOM 680 N ALA A 44 -3.435 -7.855 5.496 1.00 0.00 N ATOM 681 CA ALA A 44 -4.381 -6.707 5.375 1.00 0.00 C ATOM 682 C ALA A 44 -5.828 -7.183 5.528 1.00 0.00 C ATOM 683 O ALA A 44 -6.709 -6.416 5.838 1.00 0.00 O ATOM 684 CB ALA A 44 -4.150 -6.146 3.970 1.00 0.00 C ATOM 0 H ALA A 44 -3.179 -8.302 4.615 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.213 -5.958 6.149 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.812 -5.296 3.804 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.113 -5.823 3.873 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.360 -6.919 3.231 1.00 0.00 H new ATOM 690 N GLN A 45 -6.077 -8.441 5.309 1.00 0.00 N ATOM 691 CA GLN A 45 -7.469 -8.968 5.435 1.00 0.00 C ATOM 692 C GLN A 45 -7.948 -8.908 6.882 1.00 0.00 C ATOM 693 O GLN A 45 -9.106 -9.144 7.168 1.00 0.00 O ATOM 694 CB GLN A 45 -7.385 -10.429 4.987 1.00 0.00 C ATOM 695 CG GLN A 45 -7.439 -10.503 3.465 1.00 0.00 C ATOM 696 CD GLN A 45 -7.130 -11.930 3.008 1.00 0.00 C ATOM 697 OE1 GLN A 45 -6.722 -12.759 3.798 1.00 0.00 O ATOM 698 NE2 GLN A 45 -7.310 -12.254 1.756 1.00 0.00 N ATOM 0 H GLN A 45 -5.376 -9.133 5.047 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.170 -8.382 4.840 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.461 -10.878 5.350 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.208 -11.000 5.418 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.425 -10.203 3.111 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.720 -9.808 3.032 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.652 -11.558 1.093 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.108 -13.203 1.441 1.00 0.00 H new ATOM 707 N THR A 46 -7.076 -8.629 7.807 1.00 0.00 N ATOM 708 CA THR A 46 -7.514 -8.605 9.232 1.00 0.00 C ATOM 709 C THR A 46 -7.012 -7.344 9.938 1.00 0.00 C ATOM 710 O THR A 46 -6.934 -7.292 11.151 1.00 0.00 O ATOM 711 CB THR A 46 -6.900 -9.867 9.855 1.00 0.00 C ATOM 712 OG1 THR A 46 -5.576 -9.585 10.288 1.00 0.00 O ATOM 713 CG2 THR A 46 -6.872 -10.998 8.816 1.00 0.00 C ATOM 0 H THR A 46 -6.091 -8.419 7.644 1.00 0.00 H new ATOM 0 HA THR A 46 -8.600 -8.590 9.326 1.00 0.00 H new ATOM 0 HB THR A 46 -7.503 -10.178 10.708 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.184 -10.390 10.687 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.436 -11.891 9.262 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.888 -11.216 8.488 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.272 -10.690 7.959 1.00 0.00 H new ATOM 721 N HIS A 47 -6.673 -6.327 9.196 1.00 0.00 N ATOM 722 CA HIS A 47 -6.180 -5.074 9.838 1.00 0.00 C ATOM 723 C HIS A 47 -6.055 -3.947 8.807 1.00 0.00 C ATOM 724 O HIS A 47 -5.130 -3.164 8.856 1.00 0.00 O ATOM 725 CB HIS A 47 -4.800 -5.435 10.389 1.00 0.00 C ATOM 726 CG HIS A 47 -4.914 -5.831 11.835 1.00 0.00 C ATOM 727 ND1 HIS A 47 -5.858 -5.276 12.683 1.00 0.00 N ATOM 728 CD2 HIS A 47 -4.202 -6.723 12.600 1.00 0.00 C ATOM 729 CE1 HIS A 47 -5.690 -5.831 13.897 1.00 0.00 C ATOM 730 NE2 HIS A 47 -4.694 -6.720 13.903 1.00 0.00 N ATOM 0 H HIS A 47 -6.715 -6.308 8.177 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.861 -4.719 10.612 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.371 -6.254 9.811 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.125 -4.585 10.288 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.385 -7.334 12.245 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -6.289 -5.587 14.762 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.365 -7.277 14.692 1.00 0.00 H new ATOM 738 N ARG A 48 -6.969 -3.853 7.876 1.00 0.00 N ATOM 739 CA ARG A 48 -6.863 -2.759 6.849 1.00 0.00 C ATOM 740 C ARG A 48 -6.734 -1.413 7.551 1.00 0.00 C ATOM 741 O ARG A 48 -5.817 -0.652 7.313 1.00 0.00 O ATOM 742 CB ARG A 48 -8.164 -2.754 6.028 1.00 0.00 C ATOM 743 CG ARG A 48 -8.785 -4.141 5.952 1.00 0.00 C ATOM 744 CD ARG A 48 -9.799 -4.170 4.809 1.00 0.00 C ATOM 745 NE ARG A 48 -11.010 -4.819 5.382 1.00 0.00 N ATOM 746 CZ ARG A 48 -11.001 -6.095 5.662 1.00 0.00 C ATOM 747 NH1 ARG A 48 -9.935 -6.810 5.428 1.00 0.00 N ATOM 748 NH2 ARG A 48 -12.062 -6.660 6.172 1.00 0.00 N ATOM 0 H ARG A 48 -7.774 -4.472 7.778 1.00 0.00 H new ATOM 0 HA ARG A 48 -5.994 -2.926 6.212 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.875 -2.061 6.477 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.958 -2.392 5.021 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.012 -4.891 5.788 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.273 -4.387 6.895 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.022 -3.164 4.454 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -9.417 -4.732 3.957 1.00 0.00 H new ATOM 0 HE ARG A 48 -11.849 -4.266 5.556 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -9.106 -6.373 5.026 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -9.931 -7.806 5.648 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.899 -6.105 6.352 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -12.054 -7.656 6.390 1.00 0.00 H new ATOM 762 N ASP A 49 -7.663 -1.121 8.409 1.00 0.00 N ATOM 763 CA ASP A 49 -7.632 0.179 9.142 1.00 0.00 C ATOM 764 C ASP A 49 -6.336 0.314 9.940 1.00 0.00 C ATOM 765 O ASP A 49 -5.940 1.399 10.319 1.00 0.00 O ATOM 766 CB ASP A 49 -8.832 0.129 10.091 1.00 0.00 C ATOM 767 CG ASP A 49 -8.617 -0.980 11.123 1.00 0.00 C ATOM 768 OD1 ASP A 49 -8.242 -2.069 10.723 1.00 0.00 O ATOM 769 OD2 ASP A 49 -8.832 -0.720 12.295 1.00 0.00 O ATOM 0 H ASP A 49 -8.450 -1.727 8.639 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.677 1.030 8.462 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -8.953 1.089 10.592 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -9.747 -0.055 9.528 1.00 0.00 H new ATOM 774 N GLN A 50 -5.677 -0.774 10.215 1.00 0.00 N ATOM 775 CA GLN A 50 -4.417 -0.693 11.005 1.00 0.00 C ATOM 776 C GLN A 50 -3.205 -0.476 10.087 1.00 0.00 C ATOM 777 O GLN A 50 -2.167 -0.020 10.525 1.00 0.00 O ATOM 778 CB GLN A 50 -4.333 -2.030 11.736 1.00 0.00 C ATOM 779 CG GLN A 50 -5.567 -2.188 12.632 1.00 0.00 C ATOM 780 CD GLN A 50 -5.592 -1.079 13.688 1.00 0.00 C ATOM 781 OE1 GLN A 50 -4.606 -0.835 14.358 1.00 0.00 O ATOM 782 NE2 GLN A 50 -6.688 -0.389 13.868 1.00 0.00 N ATOM 0 H GLN A 50 -5.954 -1.713 9.929 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.415 0.149 11.697 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.282 -2.849 11.018 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.424 -2.075 12.336 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.473 -2.147 12.028 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.552 -3.164 13.118 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.516 -0.591 13.308 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.715 0.352 14.569 1.00 0.00 H new ATOM 791 N ILE A 51 -3.324 -0.774 8.818 1.00 0.00 N ATOM 792 CA ILE A 51 -2.166 -0.550 7.898 1.00 0.00 C ATOM 793 C ILE A 51 -2.101 0.933 7.523 1.00 0.00 C ATOM 794 O ILE A 51 -3.098 1.542 7.191 1.00 0.00 O ATOM 795 CB ILE A 51 -2.435 -1.414 6.657 1.00 0.00 C ATOM 796 CG1 ILE A 51 -2.971 -2.791 7.066 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.130 -1.605 5.879 1.00 0.00 C ATOM 798 CD1 ILE A 51 -2.309 -3.247 8.373 1.00 0.00 C ATOM 0 H ILE A 51 -4.162 -1.158 8.382 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.215 -0.819 8.357 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.177 -0.910 6.037 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -4.053 -2.746 7.193 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.773 -3.516 6.277 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.318 -2.218 4.998 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -0.745 -0.633 5.570 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.396 -2.100 6.515 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.697 -4.226 8.655 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -1.230 -3.311 8.231 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.529 -2.529 9.162 1.00 0.00 H new ATOM 810 N ASP A 52 -0.940 1.525 7.593 1.00 0.00 N ATOM 811 CA ASP A 52 -0.822 2.974 7.264 1.00 0.00 C ATOM 812 C ASP A 52 -0.281 3.189 5.845 1.00 0.00 C ATOM 813 O ASP A 52 -0.460 4.241 5.271 1.00 0.00 O ATOM 814 CB ASP A 52 0.146 3.529 8.308 1.00 0.00 C ATOM 815 CG ASP A 52 -0.603 3.736 9.628 1.00 0.00 C ATOM 816 OD1 ASP A 52 -1.741 3.303 9.716 1.00 0.00 O ATOM 817 OD2 ASP A 52 -0.025 4.320 10.530 1.00 0.00 O ATOM 0 H ASP A 52 -0.069 1.069 7.863 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.790 3.474 7.287 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.978 2.840 8.452 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.569 4.473 7.964 1.00 0.00 H new ATOM 822 N CYS A 53 0.377 2.214 5.272 1.00 0.00 N ATOM 823 CA CYS A 53 0.909 2.393 3.886 1.00 0.00 C ATOM 824 C CYS A 53 1.224 1.029 3.261 1.00 0.00 C ATOM 825 O CYS A 53 1.889 0.205 3.857 1.00 0.00 O ATOM 826 CB CYS A 53 2.180 3.225 4.054 1.00 0.00 C ATOM 827 SG CYS A 53 2.105 4.658 2.950 1.00 0.00 S ATOM 0 H CYS A 53 0.568 1.308 5.699 1.00 0.00 H new ATOM 0 HA CYS A 53 0.193 2.882 3.225 1.00 0.00 H new ATOM 0 HB2 CYS A 53 2.280 3.553 5.089 1.00 0.00 H new ATOM 0 HB3 CYS A 53 3.058 2.620 3.825 1.00 0.00 H new ATOM 0 HG CYS A 53 1.356 4.378 1.925 1.00 0.00 H new ATOM 833 N LEU A 54 0.745 0.773 2.068 1.00 0.00 N ATOM 834 CA LEU A 54 1.025 -0.555 1.435 1.00 0.00 C ATOM 835 C LEU A 54 2.100 -0.423 0.354 1.00 0.00 C ATOM 836 O LEU A 54 2.003 0.413 -0.522 1.00 0.00 O ATOM 837 CB LEU A 54 -0.321 -0.986 0.829 1.00 0.00 C ATOM 838 CG LEU A 54 -0.123 -2.083 -0.232 1.00 0.00 C ATOM 839 CD1 LEU A 54 0.775 -3.186 0.314 1.00 0.00 C ATOM 840 CD2 LEU A 54 -1.479 -2.694 -0.589 1.00 0.00 C ATOM 0 H LEU A 54 0.180 1.415 1.512 1.00 0.00 H new ATOM 0 HA LEU A 54 1.404 -1.285 2.150 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.978 -1.352 1.618 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.814 -0.124 0.379 1.00 0.00 H new ATOM 0 HG LEU A 54 0.338 -1.638 -1.114 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.908 -3.956 -0.446 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.746 -2.767 0.579 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.315 -3.625 1.199 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.341 -3.471 -1.341 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.929 -3.128 0.304 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.135 -1.918 -0.985 1.00 0.00 H new ATOM 852 N ILE A 55 3.122 -1.247 0.393 1.00 0.00 N ATOM 853 CA ILE A 55 4.174 -1.141 -0.665 1.00 0.00 C ATOM 854 C ILE A 55 3.970 -2.241 -1.695 1.00 0.00 C ATOM 855 O ILE A 55 3.702 -3.377 -1.359 1.00 0.00 O ATOM 856 CB ILE A 55 5.521 -1.335 0.027 1.00 0.00 C ATOM 857 CG1 ILE A 55 5.681 -0.322 1.154 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.648 -1.132 -0.990 1.00 0.00 C ATOM 859 CD1 ILE A 55 6.932 -0.677 1.955 1.00 0.00 C ATOM 0 H ILE A 55 3.271 -1.972 1.095 1.00 0.00 H new ATOM 0 HA ILE A 55 4.127 -0.177 -1.171 1.00 0.00 H new ATOM 0 HB ILE A 55 5.566 -2.343 0.439 1.00 0.00 H new ATOM 0 HG12 ILE A 55 5.766 0.686 0.747 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.803 -0.333 1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.611 -1.270 -0.498 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.545 -1.858 -1.797 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.591 -0.124 -1.400 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.060 0.040 2.766 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.826 -1.679 2.370 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.804 -0.645 1.301 1.00 0.00 H new ATOM 871 N LEU A 56 4.088 -1.919 -2.947 1.00 0.00 N ATOM 872 CA LEU A 56 3.891 -2.962 -3.981 1.00 0.00 C ATOM 873 C LEU A 56 4.890 -2.797 -5.124 1.00 0.00 C ATOM 874 O LEU A 56 5.467 -1.746 -5.322 1.00 0.00 O ATOM 875 CB LEU A 56 2.456 -2.768 -4.456 1.00 0.00 C ATOM 876 CG LEU A 56 1.505 -3.226 -3.357 1.00 0.00 C ATOM 877 CD1 LEU A 56 0.077 -2.846 -3.739 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.607 -4.747 -3.211 1.00 0.00 C ATOM 0 H LEU A 56 4.310 -0.987 -3.297 1.00 0.00 H new ATOM 0 HA LEU A 56 4.056 -3.967 -3.593 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.277 -1.720 -4.696 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.281 -3.339 -5.368 1.00 0.00 H new ATOM 0 HG LEU A 56 1.769 -2.748 -2.413 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.608 -3.171 -2.956 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.007 -1.765 -3.856 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.189 -3.330 -4.678 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.929 -5.083 -2.426 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.335 -5.222 -4.154 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.629 -5.020 -2.949 1.00 0.00 H new ATOM 890 N VAL A 57 5.103 -3.846 -5.868 1.00 0.00 N ATOM 891 CA VAL A 57 6.073 -3.790 -6.998 1.00 0.00 C ATOM 892 C VAL A 57 5.414 -4.279 -8.292 1.00 0.00 C ATOM 893 O VAL A 57 4.992 -5.414 -8.391 1.00 0.00 O ATOM 894 CB VAL A 57 7.189 -4.750 -6.584 1.00 0.00 C ATOM 895 CG1 VAL A 57 8.054 -5.089 -7.801 1.00 0.00 C ATOM 896 CG2 VAL A 57 8.053 -4.097 -5.503 1.00 0.00 C ATOM 0 H VAL A 57 4.643 -4.747 -5.741 1.00 0.00 H new ATOM 0 HA VAL A 57 6.434 -2.779 -7.187 1.00 0.00 H new ATOM 0 HB VAL A 57 6.749 -5.666 -6.189 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.849 -5.773 -7.503 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.437 -5.560 -8.566 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.493 -4.175 -8.201 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.848 -4.783 -5.209 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.492 -3.179 -5.893 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.436 -3.864 -4.635 1.00 0.00 H new ATOM 906 N ALA A 58 5.335 -3.442 -9.287 1.00 0.00 N ATOM 907 CA ALA A 58 4.711 -3.870 -10.574 1.00 0.00 C ATOM 908 C ALA A 58 5.511 -5.019 -11.202 1.00 0.00 C ATOM 909 O ALA A 58 4.985 -5.819 -11.949 1.00 0.00 O ATOM 910 CB ALA A 58 4.764 -2.634 -11.470 1.00 0.00 C ATOM 0 H ALA A 58 5.674 -2.480 -9.267 1.00 0.00 H new ATOM 0 HA ALA A 58 3.693 -4.233 -10.434 1.00 0.00 H new ATOM 0 HB1 ALA A 58 4.322 -2.868 -12.439 1.00 0.00 H new ATOM 0 HB2 ALA A 58 4.206 -1.822 -11.003 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.801 -2.329 -11.608 1.00 0.00 H new ATOM 916 N ALA A 59 6.780 -5.096 -10.909 1.00 0.00 N ATOM 917 CA ALA A 59 7.628 -6.181 -11.491 1.00 0.00 C ATOM 918 C ALA A 59 6.960 -7.549 -11.330 1.00 0.00 C ATOM 919 O ALA A 59 7.257 -8.480 -12.051 1.00 0.00 O ATOM 920 CB ALA A 59 8.921 -6.137 -10.678 1.00 0.00 C ATOM 0 H ALA A 59 7.271 -4.452 -10.289 1.00 0.00 H new ATOM 0 HA ALA A 59 7.792 -6.036 -12.559 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.605 -6.905 -11.040 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.386 -5.157 -10.786 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.696 -6.318 -9.627 1.00 0.00 H new ATOM 926 N ASN A 60 6.082 -7.690 -10.379 1.00 0.00 N ATOM 927 CA ASN A 60 5.426 -9.014 -10.164 1.00 0.00 C ATOM 928 C ASN A 60 4.366 -9.310 -11.237 1.00 0.00 C ATOM 929 O ASN A 60 3.821 -8.411 -11.847 1.00 0.00 O ATOM 930 CB ASN A 60 4.793 -8.916 -8.779 1.00 0.00 C ATOM 931 CG ASN A 60 5.811 -9.362 -7.729 1.00 0.00 C ATOM 932 OD1 ASN A 60 6.424 -8.541 -7.074 1.00 0.00 O ATOM 933 ND2 ASN A 60 6.020 -10.636 -7.541 1.00 0.00 N ATOM 0 H ASN A 60 5.789 -6.950 -9.741 1.00 0.00 H new ATOM 0 HA ASN A 60 6.143 -9.832 -10.235 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.475 -7.892 -8.583 1.00 0.00 H new ATOM 0 HB3 ASN A 60 3.902 -9.542 -8.728 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.698 -10.944 -6.844 1.00 0.00 H new ATOM 0 HD22 ASN A 60 5.505 -11.324 -8.091 1.00 0.00 H new ATOM 940 N PRO A 61 4.127 -10.587 -11.422 1.00 0.00 N ATOM 941 CA PRO A 61 3.138 -11.069 -12.427 1.00 0.00 C ATOM 942 C PRO A 61 1.694 -10.890 -11.937 1.00 0.00 C ATOM 943 O PRO A 61 0.961 -10.051 -12.425 1.00 0.00 O ATOM 944 CB PRO A 61 3.476 -12.553 -12.570 1.00 0.00 C ATOM 945 CG PRO A 61 4.143 -12.937 -11.285 1.00 0.00 C ATOM 946 CD PRO A 61 4.771 -11.695 -10.708 1.00 0.00 C ATOM 0 HA PRO A 61 3.196 -10.516 -13.365 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.577 -13.146 -12.738 1.00 0.00 H new ATOM 0 HB3 PRO A 61 4.135 -12.725 -13.421 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.418 -13.358 -10.588 1.00 0.00 H new ATOM 0 HG3 PRO A 61 4.899 -13.702 -11.460 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.600 -11.627 -9.634 1.00 0.00 H new ATOM 0 HD3 PRO A 61 5.850 -11.690 -10.860 1.00 0.00 H new ATOM 954 N SER A 62 1.277 -11.680 -10.982 1.00 0.00 N ATOM 955 CA SER A 62 -0.122 -11.574 -10.462 1.00 0.00 C ATOM 956 C SER A 62 -0.286 -10.328 -9.586 1.00 0.00 C ATOM 957 O SER A 62 -1.313 -10.119 -8.974 1.00 0.00 O ATOM 958 CB SER A 62 -0.338 -12.841 -9.635 1.00 0.00 C ATOM 959 OG SER A 62 0.846 -13.136 -8.906 1.00 0.00 O ATOM 0 H SER A 62 1.848 -12.399 -10.536 1.00 0.00 H new ATOM 0 HA SER A 62 -0.847 -11.483 -11.271 1.00 0.00 H new ATOM 0 HB2 SER A 62 -1.175 -12.704 -8.950 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.594 -13.676 -10.288 1.00 0.00 H new ATOM 0 HG SER A 62 0.709 -13.947 -8.374 1.00 0.00 H new ATOM 965 N PHE A 63 0.713 -9.498 -9.527 1.00 0.00 N ATOM 966 CA PHE A 63 0.616 -8.264 -8.702 1.00 0.00 C ATOM 967 C PHE A 63 -0.725 -7.570 -8.943 1.00 0.00 C ATOM 968 O PHE A 63 -1.461 -7.285 -8.019 1.00 0.00 O ATOM 969 CB PHE A 63 1.786 -7.421 -9.203 1.00 0.00 C ATOM 970 CG PHE A 63 1.627 -5.970 -8.815 1.00 0.00 C ATOM 971 CD1 PHE A 63 0.644 -5.172 -9.416 1.00 0.00 C ATOM 972 CD2 PHE A 63 2.489 -5.412 -7.870 1.00 0.00 C ATOM 973 CE1 PHE A 63 0.526 -3.827 -9.074 1.00 0.00 C ATOM 974 CE2 PHE A 63 2.370 -4.068 -7.529 1.00 0.00 C ATOM 975 CZ PHE A 63 1.391 -3.271 -8.131 1.00 0.00 C ATOM 0 H PHE A 63 1.599 -9.621 -10.018 1.00 0.00 H new ATOM 0 HA PHE A 63 0.663 -8.446 -7.628 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.718 -7.809 -8.792 1.00 0.00 H new ATOM 0 HB3 PHE A 63 1.857 -7.503 -10.288 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -0.025 -5.602 -10.147 1.00 0.00 H new ATOM 0 HD2 PHE A 63 3.248 -6.023 -7.404 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.234 -3.216 -9.538 1.00 0.00 H new ATOM 0 HE2 PHE A 63 3.037 -3.638 -6.796 1.00 0.00 H new ATOM 0 HZ PHE A 63 1.305 -2.227 -7.866 1.00 0.00 H new ATOM 985 N ARG A 64 -1.053 -7.296 -10.172 1.00 0.00 N ATOM 986 CA ARG A 64 -2.347 -6.621 -10.451 1.00 0.00 C ATOM 987 C ARG A 64 -3.447 -7.360 -9.708 1.00 0.00 C ATOM 988 O ARG A 64 -4.263 -6.778 -9.021 1.00 0.00 O ATOM 989 CB ARG A 64 -2.573 -6.770 -11.959 1.00 0.00 C ATOM 990 CG ARG A 64 -1.403 -6.188 -12.756 1.00 0.00 C ATOM 991 CD ARG A 64 -1.258 -4.699 -12.459 1.00 0.00 C ATOM 992 NE ARG A 64 -0.480 -4.158 -13.615 1.00 0.00 N ATOM 993 CZ ARG A 64 0.832 -4.138 -13.595 1.00 0.00 C ATOM 994 NH1 ARG A 64 1.491 -4.617 -12.574 1.00 0.00 N ATOM 995 NH2 ARG A 64 1.486 -3.639 -14.610 1.00 0.00 N ATOM 0 H ARG A 64 -0.484 -7.509 -10.992 1.00 0.00 H new ATOM 0 HA ARG A 64 -2.346 -5.576 -10.141 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.697 -7.824 -12.208 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.496 -6.265 -12.242 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -0.481 -6.710 -12.498 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -1.568 -6.340 -13.823 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -2.231 -4.215 -12.375 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -0.736 -4.532 -11.517 1.00 0.00 H new ATOM 0 HE ARG A 64 -0.976 -3.799 -14.431 1.00 0.00 H new ATOM 0 HH11 ARG A 64 0.986 -5.012 -11.781 1.00 0.00 H new ATOM 0 HH12 ARG A 64 2.511 -4.596 -12.570 1.00 0.00 H new ATOM 0 HH21 ARG A 64 0.977 -3.268 -15.412 1.00 0.00 H new ATOM 0 HH22 ARG A 64 2.506 -3.621 -14.600 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.461 -8.649 -9.849 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.492 -9.469 -9.163 1.00 0.00 C ATOM 1011 C ALA A 65 -4.375 -9.300 -7.652 1.00 0.00 C ATOM 1012 O ALA A 65 -5.354 -9.113 -6.965 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.189 -10.911 -9.572 1.00 0.00 C ATOM 0 H ALA A 65 -2.797 -9.177 -10.415 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.506 -9.176 -9.437 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -4.910 -11.581 -9.104 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.258 -11.004 -10.656 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.183 -11.177 -9.248 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.189 -9.357 -7.123 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.042 -9.187 -5.654 1.00 0.00 C ATOM 1021 C VAL A 66 -3.530 -7.794 -5.244 1.00 0.00 C ATOM 1022 O VAL A 66 -4.169 -7.629 -4.220 1.00 0.00 O ATOM 1023 CB VAL A 66 -1.549 -9.366 -5.375 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.239 -8.948 -3.936 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.178 -10.840 -5.562 1.00 0.00 C ATOM 0 H VAL A 66 -2.322 -9.512 -7.638 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.633 -9.904 -5.084 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.974 -8.747 -6.063 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.174 -9.077 -3.741 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.510 -7.902 -3.795 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -1.812 -9.567 -3.246 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.115 -10.975 -5.365 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.756 -11.451 -4.869 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.399 -11.144 -6.585 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.256 -6.787 -6.040 1.00 0.00 N ATOM 1036 CA VAL A 67 -3.732 -5.421 -5.678 1.00 0.00 C ATOM 1037 C VAL A 67 -5.251 -5.343 -5.819 1.00 0.00 C ATOM 1038 O VAL A 67 -5.943 -4.952 -4.900 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.073 -4.459 -6.659 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.453 -3.030 -6.263 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -1.551 -4.617 -6.611 1.00 0.00 C ATOM 0 H VAL A 67 -2.731 -6.853 -6.912 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.476 -5.175 -4.647 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.413 -4.675 -7.672 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -2.990 -2.326 -6.954 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.537 -2.918 -6.302 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.103 -2.828 -5.251 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.091 -3.925 -7.316 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.194 -4.400 -5.604 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.283 -5.639 -6.879 1.00 0.00 H new ATOM 1051 N GLN A 68 -5.788 -5.712 -6.954 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.262 -5.648 -7.099 1.00 0.00 C ATOM 1053 C GLN A 68 -7.890 -6.556 -6.044 1.00 0.00 C ATOM 1054 O GLN A 68 -9.010 -6.351 -5.621 1.00 0.00 O ATOM 1055 CB GLN A 68 -7.562 -6.109 -8.529 1.00 0.00 C ATOM 1056 CG GLN A 68 -7.363 -7.616 -8.653 1.00 0.00 C ATOM 1057 CD GLN A 68 -7.365 -8.006 -10.133 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -6.730 -7.362 -10.945 1.00 0.00 O ATOM 1059 NE2 GLN A 68 -8.053 -9.045 -10.520 1.00 0.00 N ATOM 0 H GLN A 68 -5.276 -6.048 -7.769 1.00 0.00 H new ATOM 0 HA GLN A 68 -7.674 -4.650 -6.945 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.586 -5.848 -8.795 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -6.908 -5.590 -9.230 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -6.421 -7.910 -8.189 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -8.157 -8.144 -8.125 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -8.586 -9.586 -9.839 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -8.058 -9.316 -11.503 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.159 -7.543 -5.582 1.00 0.00 N ATOM 1069 CA GLN A 69 -7.711 -8.427 -4.521 1.00 0.00 C ATOM 1070 C GLN A 69 -7.942 -7.595 -3.259 1.00 0.00 C ATOM 1071 O GLN A 69 -8.980 -7.680 -2.632 1.00 0.00 O ATOM 1072 CB GLN A 69 -6.649 -9.497 -4.278 1.00 0.00 C ATOM 1073 CG GLN A 69 -7.309 -10.718 -3.644 1.00 0.00 C ATOM 1074 CD GLN A 69 -8.239 -11.382 -4.662 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -8.462 -10.857 -5.736 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -8.789 -12.528 -4.370 1.00 0.00 N ATOM 0 H GLN A 69 -6.214 -7.769 -5.893 1.00 0.00 H new ATOM 0 HA GLN A 69 -8.661 -8.881 -4.802 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -6.171 -9.773 -5.218 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -5.867 -9.110 -3.624 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -6.548 -11.426 -3.315 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -7.873 -10.422 -2.760 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -8.602 -12.969 -3.469 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -9.406 -12.984 -5.042 1.00 0.00 H new ATOM 1085 N LEU A 70 -6.996 -6.759 -2.899 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.200 -5.898 -1.698 1.00 0.00 C ATOM 1087 C LEU A 70 -8.453 -5.059 -1.942 1.00 0.00 C ATOM 1088 O LEU A 70 -9.329 -4.957 -1.106 1.00 0.00 O ATOM 1089 CB LEU A 70 -5.953 -5.008 -1.609 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.865 -5.721 -0.797 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.592 -5.848 -1.634 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.545 -4.907 0.457 1.00 0.00 C ATOM 0 H LEU A 70 -6.104 -6.639 -3.380 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.332 -6.461 -0.774 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.584 -4.782 -2.609 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.206 -4.057 -1.140 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.225 -6.711 -0.519 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.823 -6.355 -1.052 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.805 -6.424 -2.534 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.240 -4.855 -1.913 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.772 -5.415 1.033 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.191 -3.917 0.168 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.444 -4.807 1.065 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.552 -4.487 -3.112 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.757 -3.684 -3.458 1.00 0.00 C ATOM 1106 C CYS A 71 -10.997 -4.584 -3.419 1.00 0.00 C ATOM 1107 O CYS A 71 -12.038 -4.210 -2.917 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.513 -3.207 -4.891 1.00 0.00 C ATOM 1109 SG CYS A 71 -8.306 -1.860 -4.900 1.00 0.00 S ATOM 0 H CYS A 71 -7.846 -4.543 -3.846 1.00 0.00 H new ATOM 0 HA CYS A 71 -9.919 -2.856 -2.768 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.151 -4.034 -5.501 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.450 -2.870 -5.335 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.182 -2.281 -4.400 1.00 0.00 H new ATOM 1115 N PHE A 72 -10.888 -5.772 -3.956 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.052 -6.705 -3.967 1.00 0.00 C ATOM 1117 C PHE A 72 -12.618 -6.863 -2.559 1.00 0.00 C ATOM 1118 O PHE A 72 -13.803 -6.711 -2.332 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.475 -8.030 -4.455 1.00 0.00 C ATOM 1120 CG PHE A 72 -12.595 -9.010 -4.689 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -13.525 -8.773 -5.706 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -12.704 -10.154 -3.890 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -14.566 -9.681 -5.927 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -13.746 -11.064 -4.111 1.00 0.00 C ATOM 1125 CZ PHE A 72 -14.677 -10.827 -5.130 1.00 0.00 C ATOM 0 H PHE A 72 -10.039 -6.136 -4.389 1.00 0.00 H new ATOM 0 HA PHE A 72 -12.866 -6.347 -4.598 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -10.913 -7.877 -5.376 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.777 -8.428 -3.719 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -13.440 -7.889 -6.321 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -11.986 -10.335 -3.104 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -15.284 -9.498 -6.713 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -13.831 -11.948 -3.496 1.00 0.00 H new ATOM 0 HZ PHE A 72 -15.481 -11.528 -5.301 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.776 -7.152 -1.608 1.00 0.00 N ATOM 1136 CA GLU A 73 -12.261 -7.300 -0.211 1.00 0.00 C ATOM 1137 C GLU A 73 -12.614 -5.921 0.333 1.00 0.00 C ATOM 1138 O GLU A 73 -13.401 -5.777 1.247 1.00 0.00 O ATOM 1139 CB GLU A 73 -11.088 -7.903 0.561 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.570 -9.132 -0.186 1.00 0.00 C ATOM 1141 CD GLU A 73 -9.583 -9.898 0.697 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -10.020 -10.469 1.682 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -8.408 -9.903 0.370 1.00 0.00 O ATOM 0 H GLU A 73 -10.774 -7.292 -1.738 1.00 0.00 H new ATOM 0 HA GLU A 73 -13.148 -7.928 -0.131 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -10.292 -7.166 0.669 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.404 -8.181 1.567 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.403 -9.779 -0.462 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -10.083 -8.827 -1.112 1.00 0.00 H new ATOM 1150 N GLY A 74 -12.030 -4.904 -0.231 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.313 -3.526 0.241 1.00 0.00 C ATOM 1152 C GLY A 74 -11.091 -2.992 0.985 1.00 0.00 C ATOM 1153 O GLY A 74 -11.160 -1.993 1.672 1.00 0.00 O ATOM 0 H GLY A 74 -11.366 -4.970 -1.002 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.550 -2.880 -0.604 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.183 -3.525 0.897 1.00 0.00 H new ATOM 1157 N VAL A 75 -9.970 -3.650 0.853 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.748 -3.171 1.558 1.00 0.00 C ATOM 1159 C VAL A 75 -8.116 -2.024 0.765 1.00 0.00 C ATOM 1160 O VAL A 75 -7.441 -2.238 -0.222 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.793 -4.371 1.608 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.716 -4.105 2.661 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.556 -5.652 1.978 1.00 0.00 C ATOM 0 H VAL A 75 -9.849 -4.493 0.291 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.972 -2.801 2.558 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.339 -4.505 0.626 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.032 -4.953 2.704 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.162 -3.205 2.395 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.186 -3.968 3.635 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.863 -6.492 2.009 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -9.021 -5.529 2.956 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.327 -5.845 1.232 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.329 -0.807 1.190 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.739 0.352 0.456 1.00 0.00 C ATOM 1175 C VAL A 76 -6.790 1.130 1.370 1.00 0.00 C ATOM 1176 O VAL A 76 -7.143 1.514 2.468 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.929 1.225 0.058 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.456 2.308 -0.912 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -9.997 0.364 -0.620 1.00 0.00 C ATOM 0 H VAL A 76 -8.884 -0.565 2.011 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.160 0.034 -0.411 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.354 1.689 0.948 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.301 2.934 -1.199 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.697 2.923 -0.429 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.032 1.841 -1.801 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.844 0.990 -0.902 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.577 -0.102 -1.511 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.332 -0.410 0.070 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.589 1.366 0.920 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.604 2.117 1.755 1.00 0.00 C ATOM 1191 C VAL A 77 -3.701 2.977 0.868 1.00 0.00 C ATOM 1192 O VAL A 77 -3.637 2.777 -0.328 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.758 1.038 2.441 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.512 0.452 3.636 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -3.441 -0.079 1.438 1.00 0.00 C ATOM 0 H VAL A 77 -5.244 1.071 0.007 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.100 2.779 2.465 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.831 1.489 2.795 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.899 -0.313 4.113 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.728 1.244 4.353 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.446 0.007 3.294 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.840 -0.846 1.926 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.371 -0.521 1.079 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.887 0.335 0.595 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.994 3.883 1.492 1.00 0.00 N ATOM 1206 CA PRO A 78 -2.044 4.744 0.747 1.00 0.00 C ATOM 1207 C PRO A 78 -0.912 3.847 0.255 1.00 0.00 C ATOM 1208 O PRO A 78 0.103 3.680 0.905 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.560 5.741 1.794 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.767 5.040 3.094 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.996 4.188 2.926 1.00 0.00 C ATOM 0 HA PRO A 78 -2.462 5.258 -0.119 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.512 5.998 1.643 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -2.126 6.671 1.749 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.902 4.428 3.347 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.899 5.756 3.905 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.945 3.283 3.531 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.899 4.720 3.224 1.00 0.00 H new ATOM 1219 N ALA A 79 -1.123 3.213 -0.858 1.00 0.00 N ATOM 1220 CA ALA A 79 -0.121 2.255 -1.388 1.00 0.00 C ATOM 1221 C ALA A 79 0.852 2.903 -2.377 1.00 0.00 C ATOM 1222 O ALA A 79 0.460 3.596 -3.295 1.00 0.00 O ATOM 1223 CB ALA A 79 -0.984 1.213 -2.094 1.00 0.00 C ATOM 0 H ALA A 79 -1.959 3.319 -1.432 1.00 0.00 H new ATOM 0 HA ALA A 79 0.514 1.850 -0.600 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.344 0.445 -2.530 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.663 0.755 -1.375 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.562 1.694 -2.883 1.00 0.00 H new ATOM 1229 N ILE A 80 2.124 2.649 -2.204 1.00 0.00 N ATOM 1230 CA ILE A 80 3.142 3.206 -3.136 1.00 0.00 C ATOM 1231 C ILE A 80 3.505 2.124 -4.161 1.00 0.00 C ATOM 1232 O ILE A 80 3.864 1.020 -3.804 1.00 0.00 O ATOM 1233 CB ILE A 80 4.330 3.548 -2.238 1.00 0.00 C ATOM 1234 CG1 ILE A 80 3.851 4.496 -1.132 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.421 4.226 -3.068 1.00 0.00 C ATOM 1236 CD1 ILE A 80 4.886 4.554 -0.008 1.00 0.00 C ATOM 0 H ILE A 80 2.501 2.075 -1.450 1.00 0.00 H new ATOM 0 HA ILE A 80 2.805 4.080 -3.693 1.00 0.00 H new ATOM 0 HB ILE A 80 4.738 2.640 -1.794 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.690 5.493 -1.541 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.894 4.155 -0.739 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.268 4.469 -2.426 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.748 3.552 -3.860 1.00 0.00 H new ATOM 0 HG23 ILE A 80 5.026 5.141 -3.510 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.537 5.230 0.773 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.025 3.557 0.410 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.834 4.917 -0.405 1.00 0.00 H new ATOM 1248 N VAL A 81 3.384 2.416 -5.428 1.00 0.00 N ATOM 1249 CA VAL A 81 3.688 1.381 -6.461 1.00 0.00 C ATOM 1250 C VAL A 81 5.061 1.613 -7.093 1.00 0.00 C ATOM 1251 O VAL A 81 5.463 2.731 -7.344 1.00 0.00 O ATOM 1252 CB VAL A 81 2.578 1.537 -7.498 1.00 0.00 C ATOM 1253 CG1 VAL A 81 2.791 0.541 -8.640 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.227 1.263 -6.834 1.00 0.00 C ATOM 0 H VAL A 81 3.089 3.322 -5.792 1.00 0.00 H new ATOM 0 HA VAL A 81 3.723 0.378 -6.036 1.00 0.00 H new ATOM 0 HB VAL A 81 2.596 2.551 -7.897 1.00 0.00 H new ATOM 0 HG11 VAL A 81 1.996 0.657 -9.377 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.755 0.730 -9.113 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.774 -0.475 -8.245 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.431 1.373 -7.570 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.216 0.248 -6.437 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.070 1.972 -6.021 1.00 0.00 H new ATOM 1264 N VAL A 82 5.784 0.556 -7.347 1.00 0.00 N ATOM 1265 CA VAL A 82 7.135 0.701 -7.956 1.00 0.00 C ATOM 1266 C VAL A 82 7.149 0.175 -9.395 1.00 0.00 C ATOM 1267 O VAL A 82 6.561 -0.842 -9.701 1.00 0.00 O ATOM 1268 CB VAL A 82 8.054 -0.150 -7.086 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.504 0.072 -7.516 1.00 0.00 C ATOM 1270 CG2 VAL A 82 7.883 0.256 -5.623 1.00 0.00 C ATOM 0 H VAL A 82 5.495 -0.404 -7.158 1.00 0.00 H new ATOM 0 HA VAL A 82 7.444 1.745 -7.998 1.00 0.00 H new ATOM 0 HB VAL A 82 7.800 -1.204 -7.201 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.164 -0.535 -6.896 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.622 -0.215 -8.561 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.761 1.125 -7.398 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.539 -0.350 -4.998 1.00 0.00 H new ATOM 0 HG22 VAL A 82 8.141 1.308 -5.505 1.00 0.00 H new ATOM 0 HG23 VAL A 82 6.847 0.100 -5.321 1.00 0.00 H new ATOM 1280 N GLY A 83 7.834 0.852 -10.275 1.00 0.00 N ATOM 1281 CA GLY A 83 7.908 0.379 -11.687 1.00 0.00 C ATOM 1282 C GLY A 83 6.577 0.616 -12.406 1.00 0.00 C ATOM 1283 O GLY A 83 5.766 -0.278 -12.540 1.00 0.00 O ATOM 0 H GLY A 83 8.346 1.712 -10.078 1.00 0.00 H new ATOM 0 HA2 GLY A 83 8.708 0.903 -12.210 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.155 -0.682 -11.708 1.00 0.00 H new ATOM 1287 N ASP A 84 6.360 1.807 -12.890 1.00 0.00 N ATOM 1288 CA ASP A 84 5.096 2.101 -13.627 1.00 0.00 C ATOM 1289 C ASP A 84 5.426 2.826 -14.936 1.00 0.00 C ATOM 1290 O ASP A 84 5.766 3.993 -14.940 1.00 0.00 O ATOM 1291 CB ASP A 84 4.283 3.007 -12.700 1.00 0.00 C ATOM 1292 CG ASP A 84 3.575 2.156 -11.645 1.00 0.00 C ATOM 1293 OD1 ASP A 84 3.988 1.025 -11.449 1.00 0.00 O ATOM 1294 OD2 ASP A 84 2.630 2.648 -11.051 1.00 0.00 O ATOM 0 H ASP A 84 7.005 2.593 -12.807 1.00 0.00 H new ATOM 0 HA ASP A 84 4.543 1.197 -13.883 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.938 3.732 -12.217 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.551 3.572 -13.277 1.00 0.00 H new ATOM 1299 N ARG A 85 5.337 2.144 -16.045 1.00 0.00 N ATOM 1300 CA ARG A 85 5.654 2.799 -17.347 1.00 0.00 C ATOM 1301 C ARG A 85 4.393 3.390 -17.973 1.00 0.00 C ATOM 1302 O ARG A 85 3.333 3.400 -17.377 1.00 0.00 O ATOM 1303 CB ARG A 85 6.218 1.691 -18.237 1.00 0.00 C ATOM 1304 CG ARG A 85 7.634 1.340 -17.779 1.00 0.00 C ATOM 1305 CD ARG A 85 8.268 0.360 -18.767 1.00 0.00 C ATOM 1306 NE ARG A 85 9.728 0.423 -18.480 1.00 0.00 N ATOM 1307 CZ ARG A 85 10.592 -0.023 -19.351 1.00 0.00 C ATOM 1308 NH1 ARG A 85 10.186 -0.495 -20.498 1.00 0.00 N ATOM 1309 NH2 ARG A 85 11.867 0.015 -19.079 1.00 0.00 N ATOM 0 H ARG A 85 5.059 1.164 -16.107 1.00 0.00 H new ATOM 0 HA ARG A 85 6.361 3.619 -17.221 1.00 0.00 H new ATOM 0 HB2 ARG A 85 5.579 0.809 -18.187 1.00 0.00 H new ATOM 0 HB3 ARG A 85 6.231 2.017 -19.277 1.00 0.00 H new ATOM 0 HG2 ARG A 85 8.239 2.244 -17.710 1.00 0.00 H new ATOM 0 HG3 ARG A 85 7.605 0.899 -16.783 1.00 0.00 H new ATOM 0 HD2 ARG A 85 7.880 -0.649 -18.627 1.00 0.00 H new ATOM 0 HD3 ARG A 85 8.055 0.644 -19.798 1.00 0.00 H new ATOM 0 HE ARG A 85 10.055 0.817 -17.598 1.00 0.00 H new ATOM 0 HH11 ARG A 85 9.190 -0.516 -20.717 1.00 0.00 H new ATOM 0 HH12 ARG A 85 10.865 -0.842 -21.176 1.00 0.00 H new ATOM 0 HH21 ARG A 85 12.187 0.393 -18.187 1.00 0.00 H new ATOM 0 HH22 ARG A 85 12.544 -0.333 -19.758 1.00 0.00 H new ATOM 1323 N ASP A 86 4.503 3.881 -19.175 1.00 0.00 N ATOM 1324 CA ASP A 86 3.317 4.471 -19.851 1.00 0.00 C ATOM 1325 C ASP A 86 2.814 3.520 -20.943 1.00 0.00 C ATOM 1326 O ASP A 86 2.753 2.321 -20.753 1.00 0.00 O ATOM 1327 CB ASP A 86 3.821 5.781 -20.460 1.00 0.00 C ATOM 1328 CG ASP A 86 2.690 6.810 -20.459 1.00 0.00 C ATOM 1329 OD1 ASP A 86 1.634 6.496 -19.936 1.00 0.00 O ATOM 1330 OD2 ASP A 86 2.899 7.892 -20.981 1.00 0.00 O ATOM 0 H ASP A 86 5.366 3.899 -19.719 1.00 0.00 H new ATOM 0 HA ASP A 86 2.485 4.639 -19.168 1.00 0.00 H new ATOM 0 HB2 ASP A 86 4.670 6.157 -19.889 1.00 0.00 H new ATOM 0 HB3 ASP A 86 4.171 5.610 -21.478 1.00 0.00 H new ATOM 1335 N SER A 87 2.452 4.041 -22.082 1.00 0.00 N ATOM 1336 CA SER A 87 1.951 3.162 -23.180 1.00 0.00 C ATOM 1337 C SER A 87 0.890 2.198 -22.647 1.00 0.00 C ATOM 1338 O SER A 87 1.203 1.163 -22.091 1.00 0.00 O ATOM 1339 CB SER A 87 3.172 2.384 -23.668 1.00 0.00 C ATOM 1340 OG SER A 87 2.784 1.529 -24.737 1.00 0.00 O ATOM 0 H SER A 87 2.481 5.037 -22.302 1.00 0.00 H new ATOM 0 HA SER A 87 1.489 3.739 -23.981 1.00 0.00 H new ATOM 0 HB2 SER A 87 3.948 3.073 -24.001 1.00 0.00 H new ATOM 0 HB3 SER A 87 3.595 1.798 -22.852 1.00 0.00 H new ATOM 0 HG SER A 87 1.814 1.586 -24.866 1.00 0.00 H new ATOM 1346 N GLU A 88 -0.361 2.522 -22.815 1.00 0.00 N ATOM 1347 CA GLU A 88 -1.433 1.613 -22.322 1.00 0.00 C ATOM 1348 C GLU A 88 -1.544 0.397 -23.246 1.00 0.00 C ATOM 1349 O GLU A 88 -2.580 0.133 -23.822 1.00 0.00 O ATOM 1350 CB GLU A 88 -2.713 2.449 -22.364 1.00 0.00 C ATOM 1351 CG GLU A 88 -3.033 2.838 -23.809 1.00 0.00 C ATOM 1352 CD GLU A 88 -4.070 3.962 -23.812 1.00 0.00 C ATOM 1353 OE1 GLU A 88 -4.610 4.246 -22.756 1.00 0.00 O ATOM 1354 OE2 GLU A 88 -4.306 4.521 -24.871 1.00 0.00 O ATOM 0 H GLU A 88 -0.687 3.374 -23.271 1.00 0.00 H new ATOM 0 HA GLU A 88 -1.235 1.235 -21.319 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.542 1.883 -21.938 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -2.593 3.345 -21.755 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -2.126 3.163 -24.320 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.414 1.975 -24.354 1.00 0.00 H new ATOM 1361 N ASP A 89 -0.480 -0.344 -23.388 1.00 0.00 N ATOM 1362 CA ASP A 89 -0.514 -1.543 -24.273 1.00 0.00 C ATOM 1363 C ASP A 89 -0.906 -2.780 -23.460 1.00 0.00 C ATOM 1364 O ASP A 89 -0.956 -2.735 -22.247 1.00 0.00 O ATOM 1365 CB ASP A 89 0.908 -1.669 -24.821 1.00 0.00 C ATOM 1366 CG ASP A 89 1.022 -0.862 -26.117 1.00 0.00 C ATOM 1367 OD1 ASP A 89 1.241 0.335 -26.027 1.00 0.00 O ATOM 1368 OD2 ASP A 89 0.880 -1.452 -27.176 1.00 0.00 O ATOM 0 H ASP A 89 0.414 -0.171 -22.928 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.245 -1.453 -25.077 1.00 0.00 H new ATOM 0 HB2 ASP A 89 1.627 -1.304 -24.087 1.00 0.00 H new ATOM 0 HB3 ASP A 89 1.147 -2.716 -25.008 1.00 0.00 H new ATOM 1373 N PRO A 90 -1.182 -3.845 -24.161 1.00 0.00 N ATOM 1374 CA PRO A 90 -1.589 -5.108 -23.497 1.00 0.00 C ATOM 1375 C PRO A 90 -0.392 -5.757 -22.806 1.00 0.00 C ATOM 1376 O PRO A 90 -0.462 -6.160 -21.662 1.00 0.00 O ATOM 1377 CB PRO A 90 -2.091 -5.971 -24.650 1.00 0.00 C ATOM 1378 CG PRO A 90 -1.396 -5.440 -25.863 1.00 0.00 C ATOM 1379 CD PRO A 90 -1.137 -3.975 -25.621 1.00 0.00 C ATOM 0 HA PRO A 90 -2.342 -4.964 -22.722 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -1.854 -7.023 -24.488 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -3.174 -5.901 -24.753 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -0.461 -5.973 -26.035 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -2.011 -5.581 -26.752 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -0.170 -3.669 -26.020 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -1.891 -3.351 -26.101 1.00 0.00 H new ATOM 1387 N ASP A 91 0.706 -5.856 -23.491 1.00 0.00 N ATOM 1388 CA ASP A 91 1.914 -6.472 -22.877 1.00 0.00 C ATOM 1389 C ASP A 91 2.418 -5.594 -21.725 1.00 0.00 C ATOM 1390 O ASP A 91 3.044 -6.070 -20.798 1.00 0.00 O ATOM 1391 CB ASP A 91 2.933 -6.543 -24.012 1.00 0.00 C ATOM 1392 CG ASP A 91 2.518 -7.647 -24.990 1.00 0.00 C ATOM 1393 OD1 ASP A 91 1.517 -8.296 -24.729 1.00 0.00 O ATOM 1394 OD2 ASP A 91 3.204 -7.823 -25.983 1.00 0.00 O ATOM 0 H ASP A 91 0.823 -5.537 -24.453 1.00 0.00 H new ATOM 0 HA ASP A 91 1.721 -7.457 -22.453 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.988 -5.585 -24.528 1.00 0.00 H new ATOM 0 HB3 ASP A 91 3.926 -6.748 -23.613 1.00 0.00 H new ATOM 1399 N GLU A 92 2.137 -4.318 -21.769 1.00 0.00 N ATOM 1400 CA GLU A 92 2.588 -3.414 -20.666 1.00 0.00 C ATOM 1401 C GLU A 92 1.372 -2.767 -19.991 1.00 0.00 C ATOM 1402 O GLU A 92 1.050 -1.626 -20.252 1.00 0.00 O ATOM 1403 CB GLU A 92 3.452 -2.346 -21.342 1.00 0.00 C ATOM 1404 CG GLU A 92 4.734 -2.983 -21.885 1.00 0.00 C ATOM 1405 CD GLU A 92 5.787 -3.059 -20.775 1.00 0.00 C ATOM 1406 OE1 GLU A 92 5.435 -3.453 -19.676 1.00 0.00 O ATOM 1407 OE2 GLU A 92 6.930 -2.727 -21.047 1.00 0.00 O ATOM 0 H GLU A 92 1.616 -3.862 -22.518 1.00 0.00 H new ATOM 0 HA GLU A 92 3.141 -3.951 -19.895 1.00 0.00 H new ATOM 0 HB2 GLU A 92 2.897 -1.876 -22.154 1.00 0.00 H new ATOM 0 HB3 GLU A 92 3.700 -1.560 -20.628 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.521 -3.982 -22.266 1.00 0.00 H new ATOM 0 HG3 GLU A 92 5.116 -2.397 -22.721 1.00 0.00 H new ATOM 1414 N PRO A 93 0.737 -3.531 -19.143 1.00 0.00 N ATOM 1415 CA PRO A 93 -0.462 -3.040 -18.414 1.00 0.00 C ATOM 1416 C PRO A 93 -0.050 -2.120 -17.261 1.00 0.00 C ATOM 1417 O PRO A 93 -0.376 -2.361 -16.116 1.00 0.00 O ATOM 1418 CB PRO A 93 -1.091 -4.316 -17.869 1.00 0.00 C ATOM 1419 CG PRO A 93 0.040 -5.288 -17.756 1.00 0.00 C ATOM 1420 CD PRO A 93 1.068 -4.915 -18.792 1.00 0.00 C ATOM 0 HA PRO A 93 -1.137 -2.462 -19.046 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -1.560 -4.142 -16.901 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -1.867 -4.690 -18.537 1.00 0.00 H new ATOM 0 HG2 PRO A 93 0.474 -5.255 -16.757 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.313 -6.307 -17.917 1.00 0.00 H new ATOM 0 HD2 PRO A 93 2.080 -4.994 -18.396 1.00 0.00 H new ATOM 0 HD3 PRO A 93 1.014 -5.570 -19.661 1.00 0.00 H new ATOM 1428 N ALA A 94 0.671 -1.075 -17.552 1.00 0.00 N ATOM 1429 CA ALA A 94 1.114 -0.147 -16.470 1.00 0.00 C ATOM 1430 C ALA A 94 0.075 0.957 -16.232 1.00 0.00 C ATOM 1431 O ALA A 94 0.413 2.066 -15.871 1.00 0.00 O ATOM 1432 CB ALA A 94 2.420 0.456 -16.983 1.00 0.00 C ATOM 0 H ALA A 94 0.974 -0.821 -18.492 1.00 0.00 H new ATOM 0 HA ALA A 94 1.239 -0.664 -15.519 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.814 1.153 -16.244 1.00 0.00 H new ATOM 0 HB2 ALA A 94 3.145 -0.339 -17.155 1.00 0.00 H new ATOM 0 HB3 ALA A 94 2.234 0.985 -17.918 1.00 0.00 H new ATOM 1438 N LYS A 95 -1.183 0.666 -16.426 1.00 0.00 N ATOM 1439 CA LYS A 95 -2.231 1.706 -16.203 1.00 0.00 C ATOM 1440 C LYS A 95 -2.255 2.136 -14.734 1.00 0.00 C ATOM 1441 O LYS A 95 -1.653 1.510 -13.885 1.00 0.00 O ATOM 1442 CB LYS A 95 -3.546 1.029 -16.578 1.00 0.00 C ATOM 1443 CG LYS A 95 -3.794 -0.159 -15.647 1.00 0.00 C ATOM 1444 CD LYS A 95 -5.013 -0.943 -16.138 1.00 0.00 C ATOM 1445 CE LYS A 95 -4.630 -2.407 -16.351 1.00 0.00 C ATOM 1446 NZ LYS A 95 -5.366 -3.155 -15.294 1.00 0.00 N ATOM 0 H LYS A 95 -1.531 -0.244 -16.728 1.00 0.00 H new ATOM 0 HA LYS A 95 -2.047 2.604 -16.793 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -4.368 1.741 -16.503 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -3.511 0.691 -17.614 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -2.917 -0.806 -15.623 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -3.959 0.191 -14.628 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.822 -0.870 -15.411 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -5.383 -0.514 -17.069 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -4.914 -2.748 -17.346 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -3.553 -2.551 -16.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -5.154 -4.170 -15.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -5.071 -2.813 -14.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -6.388 -3.005 -15.411 1.00 0.00 H new ATOM 1460 N GLU A 96 -2.945 3.202 -14.430 1.00 0.00 N ATOM 1461 CA GLU A 96 -3.010 3.677 -13.018 1.00 0.00 C ATOM 1462 C GLU A 96 -4.030 2.857 -12.225 1.00 0.00 C ATOM 1463 O GLU A 96 -4.218 3.065 -11.042 1.00 0.00 O ATOM 1464 CB GLU A 96 -3.453 5.135 -13.112 1.00 0.00 C ATOM 1465 CG GLU A 96 -2.419 5.922 -13.920 1.00 0.00 C ATOM 1466 CD GLU A 96 -2.894 7.363 -14.104 1.00 0.00 C ATOM 1467 OE1 GLU A 96 -3.762 7.782 -13.356 1.00 0.00 O ATOM 1468 OE2 GLU A 96 -2.381 8.025 -14.992 1.00 0.00 O ATOM 0 H GLU A 96 -3.468 3.766 -15.100 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.054 3.572 -12.505 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -4.431 5.201 -13.588 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -3.555 5.562 -12.114 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.457 5.909 -13.408 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.269 5.452 -14.892 1.00 0.00 H new ATOM 1475 N GLN A 97 -4.688 1.926 -12.859 1.00 0.00 N ATOM 1476 CA GLN A 97 -5.686 1.105 -12.120 1.00 0.00 C ATOM 1477 C GLN A 97 -4.995 -0.057 -11.404 1.00 0.00 C ATOM 1478 O GLN A 97 -5.630 -1.011 -11.003 1.00 0.00 O ATOM 1479 CB GLN A 97 -6.663 0.576 -13.169 1.00 0.00 C ATOM 1480 CG GLN A 97 -7.752 -0.236 -12.463 1.00 0.00 C ATOM 1481 CD GLN A 97 -8.955 -0.419 -13.392 1.00 0.00 C ATOM 1482 OE1 GLN A 97 -9.079 0.263 -14.390 1.00 0.00 O ATOM 1483 NE2 GLN A 97 -9.856 -1.318 -13.102 1.00 0.00 N ATOM 0 H GLN A 97 -4.579 1.700 -13.848 1.00 0.00 H new ATOM 0 HA GLN A 97 -6.199 1.694 -11.360 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -7.108 1.403 -13.722 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -6.138 -0.046 -13.894 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -7.358 -1.209 -12.169 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -8.061 0.272 -11.550 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -9.753 -1.891 -12.265 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -10.663 -1.447 -13.713 1.00 0.00 H new ATOM 1492 N LEU A 98 -3.703 0.019 -11.217 1.00 0.00 N ATOM 1493 CA LEU A 98 -3.005 -1.074 -10.500 1.00 0.00 C ATOM 1494 C LEU A 98 -3.645 -1.200 -9.137 1.00 0.00 C ATOM 1495 O LEU A 98 -3.894 -2.278 -8.639 1.00 0.00 O ATOM 1496 CB LEU A 98 -1.560 -0.600 -10.360 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.931 -0.490 -11.741 1.00 0.00 C ATOM 1498 CD1 LEU A 98 0.404 0.248 -11.644 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.699 -1.893 -12.289 1.00 0.00 C ATOM 0 H LEU A 98 -3.110 0.787 -11.530 1.00 0.00 H new ATOM 0 HA LEU A 98 -3.057 -2.037 -11.009 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.529 0.366 -9.856 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.994 -1.299 -9.745 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.595 0.064 -12.405 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.850 0.324 -12.635 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.239 1.248 -11.243 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.076 -0.301 -10.985 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.248 -1.827 -13.279 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.031 -2.438 -11.622 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.651 -2.419 -12.358 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.942 -0.077 -8.553 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.596 -0.066 -7.227 1.00 0.00 C ATOM 1513 C TYR A 99 -5.716 0.981 -7.244 1.00 0.00 C ATOM 1514 O TYR A 99 -6.545 0.987 -8.131 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.485 0.310 -6.239 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.822 -0.211 -4.856 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -5.148 -0.520 -4.522 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.805 -0.382 -3.904 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.456 -1.001 -3.241 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -3.115 -0.862 -2.626 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.440 -1.173 -2.294 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.745 -1.649 -1.035 1.00 0.00 O ATOM 0 H TYR A 99 -3.755 0.845 -8.947 1.00 0.00 H new ATOM 0 HA TYR A 99 -5.048 -1.020 -6.954 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.535 -0.107 -6.572 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.365 1.393 -6.209 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -5.933 -0.388 -5.252 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.783 -0.143 -4.158 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.478 -1.239 -2.985 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.331 -0.993 -1.895 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.713 -1.785 -0.962 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.746 1.877 -6.296 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.821 2.918 -6.313 1.00 0.00 C ATOM 1534 C HIS A 100 -6.292 4.203 -6.953 1.00 0.00 C ATOM 1535 O HIS A 100 -5.213 4.235 -7.508 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.237 3.171 -4.853 1.00 0.00 C ATOM 1537 CG HIS A 100 -6.057 3.032 -3.933 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -5.683 1.798 -3.392 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -5.143 3.943 -3.458 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -4.585 1.998 -2.636 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.240 3.274 -2.660 1.00 0.00 N ATOM 0 H HIS A 100 -5.086 1.937 -5.521 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.678 2.585 -6.898 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -7.662 4.170 -4.759 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -8.015 2.465 -4.564 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -6.156 0.907 -3.542 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -5.134 5.001 -3.673 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.062 1.227 -2.089 1.00 0.00 H new ATOM 1549 N SER A 101 -7.050 5.259 -6.890 1.00 0.00 N ATOM 1550 CA SER A 101 -6.603 6.542 -7.502 1.00 0.00 C ATOM 1551 C SER A 101 -5.765 7.345 -6.503 1.00 0.00 C ATOM 1552 O SER A 101 -5.444 8.495 -6.731 1.00 0.00 O ATOM 1553 CB SER A 101 -7.898 7.282 -7.839 1.00 0.00 C ATOM 1554 OG SER A 101 -8.436 7.851 -6.653 1.00 0.00 O ATOM 0 H SER A 101 -7.964 5.291 -6.439 1.00 0.00 H new ATOM 0 HA SER A 101 -5.977 6.388 -8.381 1.00 0.00 H new ATOM 0 HB2 SER A 101 -7.704 8.062 -8.575 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.617 6.595 -8.285 1.00 0.00 H new ATOM 0 HG SER A 101 -9.265 8.328 -6.866 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.412 6.751 -5.393 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.602 7.492 -4.381 1.00 0.00 C ATOM 1562 C ALA A 102 -3.210 6.866 -4.215 1.00 0.00 C ATOM 1563 O ALA A 102 -2.289 7.513 -3.755 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.394 7.390 -3.078 1.00 0.00 C ATOM 0 H ALA A 102 -5.648 5.790 -5.144 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.438 8.527 -4.683 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.859 7.913 -2.285 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.376 7.843 -3.213 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.512 6.341 -2.805 1.00 0.00 H new ATOM 1570 N GLU A 103 -3.039 5.620 -4.572 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.692 4.991 -4.409 1.00 0.00 C ATOM 1572 C GLU A 103 -0.618 5.845 -5.086 1.00 0.00 C ATOM 1573 O GLU A 103 -0.772 6.278 -6.210 1.00 0.00 O ATOM 1574 CB GLU A 103 -1.776 3.626 -5.097 1.00 0.00 C ATOM 1575 CG GLU A 103 -2.512 3.759 -6.432 1.00 0.00 C ATOM 1576 CD GLU A 103 -1.876 2.821 -7.462 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -1.443 1.749 -7.072 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -1.830 3.192 -8.624 1.00 0.00 O ATOM 0 H GLU A 103 -3.762 5.017 -4.964 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.425 4.899 -3.356 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -0.774 3.230 -5.262 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.297 2.917 -4.454 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -3.566 3.514 -6.304 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -2.464 4.789 -6.785 1.00 0.00 H new ATOM 1585 N LEU A 104 0.476 6.074 -4.417 1.00 0.00 N ATOM 1586 CA LEU A 104 1.564 6.883 -5.030 1.00 0.00 C ATOM 1587 C LEU A 104 2.418 5.984 -5.923 1.00 0.00 C ATOM 1588 O LEU A 104 2.452 4.782 -5.756 1.00 0.00 O ATOM 1589 CB LEU A 104 2.392 7.409 -3.856 1.00 0.00 C ATOM 1590 CG LEU A 104 2.203 8.921 -3.720 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.728 9.232 -3.465 1.00 0.00 C ATOM 1592 CD2 LEU A 104 3.042 9.430 -2.543 1.00 0.00 C ATOM 0 H LEU A 104 0.664 5.736 -3.473 1.00 0.00 H new ATOM 0 HA LEU A 104 1.183 7.698 -5.645 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.089 6.912 -2.935 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.446 7.178 -4.011 1.00 0.00 H new ATOM 0 HG LEU A 104 2.522 9.413 -4.639 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.595 10.309 -3.368 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.129 8.866 -4.299 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.407 8.743 -2.546 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.911 10.507 -2.442 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.719 8.937 -1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.094 9.208 -2.723 1.00 0.00 H new ATOM 1604 N HIS A 105 3.111 6.555 -6.863 1.00 0.00 N ATOM 1605 CA HIS A 105 3.966 5.725 -7.757 1.00 0.00 C ATOM 1606 C HIS A 105 5.438 6.052 -7.519 1.00 0.00 C ATOM 1607 O HIS A 105 5.802 7.190 -7.293 1.00 0.00 O ATOM 1608 CB HIS A 105 3.569 6.108 -9.181 1.00 0.00 C ATOM 1609 CG HIS A 105 2.122 5.781 -9.420 1.00 0.00 C ATOM 1610 ND1 HIS A 105 1.412 6.323 -10.480 1.00 0.00 N ATOM 1611 CD2 HIS A 105 1.241 4.969 -8.752 1.00 0.00 C ATOM 1612 CE1 HIS A 105 0.160 5.833 -10.420 1.00 0.00 C ATOM 1613 NE2 HIS A 105 0.002 5.002 -9.386 1.00 0.00 N ATOM 0 H HIS A 105 3.124 7.557 -7.053 1.00 0.00 H new ATOM 0 HA HIS A 105 3.830 4.659 -7.573 1.00 0.00 H new ATOM 0 HB2 HIS A 105 3.740 7.173 -9.341 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.194 5.574 -9.897 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.473 4.392 -7.869 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -0.622 6.081 -11.122 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -0.844 4.500 -9.119 1.00 0.00 H new ATOM 1621 N LEU A 106 6.287 5.067 -7.578 1.00 0.00 N ATOM 1622 CA LEU A 106 7.737 5.328 -7.368 1.00 0.00 C ATOM 1623 C LEU A 106 8.550 4.583 -8.427 1.00 0.00 C ATOM 1624 O LEU A 106 8.271 3.448 -8.753 1.00 0.00 O ATOM 1625 CB LEU A 106 8.045 4.805 -5.962 1.00 0.00 C ATOM 1626 CG LEU A 106 9.516 5.060 -5.635 1.00 0.00 C ATOM 1627 CD1 LEU A 106 9.802 6.560 -5.723 1.00 0.00 C ATOM 1628 CD2 LEU A 106 9.813 4.572 -4.215 1.00 0.00 C ATOM 0 H LEU A 106 6.041 4.094 -7.762 1.00 0.00 H new ATOM 0 HA LEU A 106 7.991 6.384 -7.457 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.407 5.301 -5.230 1.00 0.00 H new ATOM 0 HB3 LEU A 106 7.828 3.738 -5.903 1.00 0.00 H new ATOM 0 HG LEU A 106 10.145 4.524 -6.345 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.851 6.745 -5.490 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.587 6.913 -6.732 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.173 7.093 -5.010 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.862 4.753 -3.980 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.184 5.111 -3.506 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.605 3.504 -4.146 1.00 0.00 H new ATOM 1640 N GLY A 107 9.545 5.219 -8.975 1.00 0.00 N ATOM 1641 CA GLY A 107 10.368 4.553 -10.023 1.00 0.00 C ATOM 1642 C GLY A 107 11.194 3.431 -9.396 1.00 0.00 C ATOM 1643 O GLY A 107 11.622 3.520 -8.263 1.00 0.00 O ATOM 0 H GLY A 107 9.825 6.172 -8.743 1.00 0.00 H new ATOM 0 HA2 GLY A 107 9.723 4.150 -10.803 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.027 5.280 -10.498 1.00 0.00 H new ATOM 1647 N ILE A 108 11.436 2.380 -10.133 1.00 0.00 N ATOM 1648 CA ILE A 108 12.243 1.265 -9.597 1.00 0.00 C ATOM 1649 C ILE A 108 13.623 1.787 -9.190 1.00 0.00 C ATOM 1650 O ILE A 108 14.189 1.375 -8.197 1.00 0.00 O ATOM 1651 CB ILE A 108 12.339 0.292 -10.768 1.00 0.00 C ATOM 1652 CG1 ILE A 108 10.969 -0.347 -11.018 1.00 0.00 C ATOM 1653 CG2 ILE A 108 13.350 -0.785 -10.437 1.00 0.00 C ATOM 1654 CD1 ILE A 108 10.940 -0.975 -12.414 1.00 0.00 C ATOM 0 H ILE A 108 11.104 2.253 -11.089 1.00 0.00 H new ATOM 0 HA ILE A 108 11.815 0.796 -8.711 1.00 0.00 H new ATOM 0 HB ILE A 108 12.654 0.826 -11.664 1.00 0.00 H new ATOM 0 HG12 ILE A 108 10.768 -1.107 -10.263 1.00 0.00 H new ATOM 0 HG13 ILE A 108 10.185 0.405 -10.930 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.423 -1.484 -11.270 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.324 -0.328 -10.260 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.032 -1.320 -9.542 1.00 0.00 H new ATOM 0 HD11 ILE A 108 9.964 -1.429 -12.589 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.121 -0.205 -13.163 1.00 0.00 H new ATOM 0 HD13 ILE A 108 11.714 -1.740 -12.485 1.00 0.00 H new ATOM 1666 N HIS A 109 14.153 2.710 -9.945 1.00 0.00 N ATOM 1667 CA HIS A 109 15.484 3.289 -9.604 1.00 0.00 C ATOM 1668 C HIS A 109 15.305 4.416 -8.584 1.00 0.00 C ATOM 1669 O HIS A 109 16.245 5.096 -8.223 1.00 0.00 O ATOM 1670 CB HIS A 109 16.037 3.848 -10.920 1.00 0.00 C ATOM 1671 CG HIS A 109 16.722 2.750 -11.686 1.00 0.00 C ATOM 1672 ND1 HIS A 109 16.095 1.549 -11.973 1.00 0.00 N ATOM 1673 CD2 HIS A 109 17.977 2.659 -12.233 1.00 0.00 C ATOM 1674 CE1 HIS A 109 16.966 0.793 -12.666 1.00 0.00 C ATOM 1675 NE2 HIS A 109 18.129 1.421 -12.852 1.00 0.00 N ATOM 0 H HIS A 109 13.720 3.090 -10.787 1.00 0.00 H new ATOM 0 HA HIS A 109 16.157 2.550 -9.168 1.00 0.00 H new ATOM 0 HB2 HIS A 109 15.228 4.271 -11.516 1.00 0.00 H new ATOM 0 HB3 HIS A 109 16.739 4.656 -10.717 1.00 0.00 H new ATOM 0 HD2 HIS A 109 18.732 3.430 -12.190 1.00 0.00 H new ATOM 0 HE1 HIS A 109 16.750 -0.201 -13.028 1.00 0.00 H new ATOM 0 HE2 HIS A 109 18.952 1.070 -13.342 1.00 0.00 H new ATOM 1683 N GLN A 110 14.101 4.621 -8.120 1.00 0.00 N ATOM 1684 CA GLN A 110 13.864 5.705 -7.129 1.00 0.00 C ATOM 1685 C GLN A 110 13.552 5.118 -5.753 1.00 0.00 C ATOM 1686 O GLN A 110 12.874 5.730 -4.953 1.00 0.00 O ATOM 1687 CB GLN A 110 12.642 6.467 -7.641 1.00 0.00 C ATOM 1688 CG GLN A 110 12.951 7.119 -8.990 1.00 0.00 C ATOM 1689 CD GLN A 110 11.825 8.096 -9.338 1.00 0.00 C ATOM 1690 OE1 GLN A 110 11.324 8.792 -8.477 1.00 0.00 O ATOM 1691 NE2 GLN A 110 11.401 8.179 -10.570 1.00 0.00 N ATOM 0 H GLN A 110 13.275 4.085 -8.385 1.00 0.00 H new ATOM 0 HA GLN A 110 14.741 6.343 -7.024 1.00 0.00 H new ATOM 0 HB2 GLN A 110 11.797 5.786 -7.743 1.00 0.00 H new ATOM 0 HB3 GLN A 110 12.351 7.230 -6.919 1.00 0.00 H new ATOM 0 HG2 GLN A 110 13.905 7.644 -8.945 1.00 0.00 H new ATOM 0 HG3 GLN A 110 13.042 6.358 -9.765 1.00 0.00 H new ATOM 0 HE21 GLN A 110 11.820 7.596 -11.294 1.00 0.00 H new ATOM 0 HE22 GLN A 110 10.650 8.827 -10.808 1.00 0.00 H new ATOM 1700 N LEU A 111 14.019 3.939 -5.462 1.00 0.00 N ATOM 1701 CA LEU A 111 13.708 3.353 -4.131 1.00 0.00 C ATOM 1702 C LEU A 111 14.461 4.118 -3.049 1.00 0.00 C ATOM 1703 O LEU A 111 15.626 3.896 -2.794 1.00 0.00 O ATOM 1704 CB LEU A 111 14.157 1.890 -4.212 1.00 0.00 C ATOM 1705 CG LEU A 111 13.099 1.008 -4.920 1.00 0.00 C ATOM 1706 CD1 LEU A 111 12.500 0.026 -3.912 1.00 0.00 C ATOM 1707 CD2 LEU A 111 11.962 1.851 -5.514 1.00 0.00 C ATOM 0 H LEU A 111 14.594 3.363 -6.077 1.00 0.00 H new ATOM 0 HA LEU A 111 12.650 3.415 -3.878 1.00 0.00 H new ATOM 0 HB2 LEU A 111 15.103 1.828 -4.751 1.00 0.00 H new ATOM 0 HB3 LEU A 111 14.337 1.508 -3.207 1.00 0.00 H new ATOM 0 HG LEU A 111 13.599 0.478 -5.731 1.00 0.00 H new ATOM 0 HD11 LEU A 111 11.755 -0.596 -4.408 1.00 0.00 H new ATOM 0 HD12 LEU A 111 13.290 -0.607 -3.507 1.00 0.00 H new ATOM 0 HD13 LEU A 111 12.028 0.580 -3.101 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.240 1.196 -6.002 1.00 0.00 H new ATOM 0 HD22 LEU A 111 11.467 2.407 -4.718 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.370 2.549 -6.245 1.00 0.00 H new ATOM 1719 N GLU A 112 13.776 5.030 -2.429 1.00 0.00 N ATOM 1720 CA GLU A 112 14.379 5.873 -1.361 1.00 0.00 C ATOM 1721 C GLU A 112 13.364 6.949 -0.971 1.00 0.00 C ATOM 1722 O GLU A 112 13.353 7.448 0.136 1.00 0.00 O ATOM 1723 CB GLU A 112 15.607 6.516 -2.005 1.00 0.00 C ATOM 1724 CG GLU A 112 15.172 7.246 -3.272 1.00 0.00 C ATOM 1725 CD GLU A 112 16.401 7.632 -4.098 1.00 0.00 C ATOM 1726 OE1 GLU A 112 17.002 8.648 -3.790 1.00 0.00 O ATOM 1727 OE2 GLU A 112 16.719 6.908 -5.027 1.00 0.00 O ATOM 0 H GLU A 112 12.795 5.234 -2.622 1.00 0.00 H new ATOM 0 HA GLU A 112 14.647 5.309 -0.467 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.076 7.213 -1.310 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.350 5.755 -2.244 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.512 6.609 -3.861 1.00 0.00 H new ATOM 0 HG3 GLU A 112 14.603 8.139 -3.011 1.00 0.00 H new ATOM 1734 N GLN A 113 12.506 7.298 -1.897 1.00 0.00 N ATOM 1735 CA GLN A 113 11.468 8.332 -1.629 1.00 0.00 C ATOM 1736 C GLN A 113 10.276 7.707 -0.895 1.00 0.00 C ATOM 1737 O GLN A 113 9.317 8.373 -0.571 1.00 0.00 O ATOM 1738 CB GLN A 113 11.059 8.817 -3.021 1.00 0.00 C ATOM 1739 CG GLN A 113 12.200 9.644 -3.620 1.00 0.00 C ATOM 1740 CD GLN A 113 11.952 9.873 -5.112 1.00 0.00 C ATOM 1741 OE1 GLN A 113 10.915 10.373 -5.499 1.00 0.00 O ATOM 1742 NE2 GLN A 113 12.871 9.527 -5.973 1.00 0.00 N ATOM 0 H GLN A 113 12.483 6.904 -2.837 1.00 0.00 H new ATOM 0 HA GLN A 113 11.828 9.144 -0.997 1.00 0.00 H new ATOM 0 HB2 GLN A 113 10.834 7.966 -3.664 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.152 9.418 -2.958 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.276 10.601 -3.104 1.00 0.00 H new ATOM 0 HG3 GLN A 113 13.149 9.128 -3.476 1.00 0.00 H new ATOM 0 HE21 GLN A 113 13.742 9.107 -5.648 1.00 0.00 H new ATOM 0 HE22 GLN A 113 12.718 9.677 -6.970 1.00 0.00 H new ATOM 1751 N LEU A 114 10.333 6.428 -0.637 1.00 0.00 N ATOM 1752 CA LEU A 114 9.208 5.740 0.064 1.00 0.00 C ATOM 1753 C LEU A 114 8.754 6.489 1.321 1.00 0.00 C ATOM 1754 O LEU A 114 7.572 6.633 1.533 1.00 0.00 O ATOM 1755 CB LEU A 114 9.754 4.366 0.426 1.00 0.00 C ATOM 1756 CG LEU A 114 9.699 3.469 -0.806 1.00 0.00 C ATOM 1757 CD1 LEU A 114 11.118 3.122 -1.243 1.00 0.00 C ATOM 1758 CD2 LEU A 114 8.939 2.186 -0.471 1.00 0.00 C ATOM 0 H LEU A 114 11.117 5.824 -0.884 1.00 0.00 H new ATOM 0 HA LEU A 114 8.325 5.689 -0.573 1.00 0.00 H new ATOM 0 HB2 LEU A 114 10.780 4.451 0.784 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.169 3.930 1.236 1.00 0.00 H new ATOM 0 HG LEU A 114 9.187 3.991 -1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 114 11.081 2.481 -2.124 1.00 0.00 H new ATOM 0 HD12 LEU A 114 11.659 4.037 -1.483 1.00 0.00 H new ATOM 0 HD13 LEU A 114 11.630 2.599 -0.435 1.00 0.00 H new ATOM 0 HD21 LEU A 114 8.900 1.546 -1.352 1.00 0.00 H new ATOM 0 HD22 LEU A 114 9.449 1.661 0.337 1.00 0.00 H new ATOM 0 HD23 LEU A 114 7.925 2.435 -0.158 1.00 0.00 H new ATOM 1770 N PRO A 115 9.676 6.949 2.128 1.00 0.00 N ATOM 1771 CA PRO A 115 9.267 7.685 3.347 1.00 0.00 C ATOM 1772 C PRO A 115 8.567 8.978 2.944 1.00 0.00 C ATOM 1773 O PRO A 115 7.402 9.177 3.226 1.00 0.00 O ATOM 1774 CB PRO A 115 10.582 7.932 4.083 1.00 0.00 C ATOM 1775 CG PRO A 115 11.630 7.859 3.021 1.00 0.00 C ATOM 1776 CD PRO A 115 11.137 6.857 2.007 1.00 0.00 C ATOM 0 HA PRO A 115 8.559 7.149 3.979 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.584 8.905 4.575 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.750 7.183 4.857 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.785 8.834 2.560 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.587 7.549 3.440 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.474 7.104 1.000 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.497 5.852 2.226 1.00 0.00 H new ATOM 1784 N TYR A 116 9.250 9.842 2.251 1.00 0.00 N ATOM 1785 CA TYR A 116 8.594 11.096 1.799 1.00 0.00 C ATOM 1786 C TYR A 116 7.367 10.717 0.959 1.00 0.00 C ATOM 1787 O TYR A 116 6.371 11.413 0.939 1.00 0.00 O ATOM 1788 CB TYR A 116 9.683 11.832 0.991 1.00 0.00 C ATOM 1789 CG TYR A 116 9.249 12.053 -0.439 1.00 0.00 C ATOM 1790 CD1 TYR A 116 8.130 12.843 -0.717 1.00 0.00 C ATOM 1791 CD2 TYR A 116 9.967 11.463 -1.483 1.00 0.00 C ATOM 1792 CE1 TYR A 116 7.728 13.042 -2.043 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.568 11.662 -2.809 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.447 12.453 -3.089 1.00 0.00 C ATOM 1795 OH TYR A 116 8.046 12.651 -4.394 1.00 0.00 O ATOM 0 H TYR A 116 10.227 9.735 1.980 1.00 0.00 H new ATOM 0 HA TYR A 116 8.230 11.738 2.601 1.00 0.00 H new ATOM 0 HB2 TYR A 116 9.901 12.792 1.460 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.606 11.252 1.008 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.576 13.299 0.090 1.00 0.00 H new ATOM 0 HD2 TYR A 116 10.831 10.853 -1.266 1.00 0.00 H new ATOM 0 HE1 TYR A 116 6.862 13.651 -2.259 1.00 0.00 H new ATOM 0 HE2 TYR A 116 10.124 11.206 -3.615 1.00 0.00 H new ATOM 0 HH TYR A 116 8.767 12.383 -5.002 1.00 0.00 H new ATOM 1805 N GLN A 117 7.430 9.594 0.292 1.00 0.00 N ATOM 1806 CA GLN A 117 6.265 9.135 -0.518 1.00 0.00 C ATOM 1807 C GLN A 117 5.184 8.616 0.424 1.00 0.00 C ATOM 1808 O GLN A 117 4.012 8.863 0.240 1.00 0.00 O ATOM 1809 CB GLN A 117 6.807 8.015 -1.405 1.00 0.00 C ATOM 1810 CG GLN A 117 7.683 8.616 -2.506 1.00 0.00 C ATOM 1811 CD GLN A 117 6.799 9.119 -3.645 1.00 0.00 C ATOM 1812 OE1 GLN A 117 5.682 8.668 -3.807 1.00 0.00 O ATOM 1813 NE2 GLN A 117 7.254 10.039 -4.448 1.00 0.00 N ATOM 0 H GLN A 117 8.240 8.974 0.274 1.00 0.00 H new ATOM 0 HA GLN A 117 5.822 9.929 -1.120 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.387 7.311 -0.807 1.00 0.00 H new ATOM 0 HB3 GLN A 117 5.983 7.455 -1.846 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.278 9.436 -2.104 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.382 7.867 -2.878 1.00 0.00 H new ATOM 0 HE21 GLN A 117 8.191 10.417 -4.311 1.00 0.00 H new ATOM 0 HE22 GLN A 117 6.673 10.381 -5.213 1.00 0.00 H new ATOM 1822 N VAL A 118 5.582 7.918 1.449 1.00 0.00 N ATOM 1823 CA VAL A 118 4.596 7.401 2.432 1.00 0.00 C ATOM 1824 C VAL A 118 3.821 8.592 3.003 1.00 0.00 C ATOM 1825 O VAL A 118 2.607 8.586 3.057 1.00 0.00 O ATOM 1826 CB VAL A 118 5.455 6.706 3.498 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.758 6.732 4.861 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.694 5.252 3.085 1.00 0.00 C ATOM 0 H VAL A 118 6.554 7.683 1.648 1.00 0.00 H new ATOM 0 HA VAL A 118 3.861 6.711 2.017 1.00 0.00 H new ATOM 0 HB VAL A 118 6.403 7.237 3.580 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.385 6.234 5.600 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.591 7.765 5.164 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.801 6.215 4.790 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.304 4.755 3.840 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.737 4.737 2.995 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.211 5.227 2.126 1.00 0.00 H new ATOM 1838 N ASP A 119 4.514 9.631 3.393 1.00 0.00 N ATOM 1839 CA ASP A 119 3.807 10.832 3.917 1.00 0.00 C ATOM 1840 C ASP A 119 2.919 11.395 2.808 1.00 0.00 C ATOM 1841 O ASP A 119 1.736 11.608 2.987 1.00 0.00 O ATOM 1842 CB ASP A 119 4.912 11.833 4.267 1.00 0.00 C ATOM 1843 CG ASP A 119 5.727 11.318 5.454 1.00 0.00 C ATOM 1844 OD1 ASP A 119 5.122 10.881 6.419 1.00 0.00 O ATOM 1845 OD2 ASP A 119 6.943 11.372 5.380 1.00 0.00 O ATOM 0 H ASP A 119 5.532 9.698 3.371 1.00 0.00 H new ATOM 0 HA ASP A 119 3.180 10.613 4.782 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.563 11.984 3.406 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.474 12.801 4.509 1.00 0.00 H new ATOM 1850 N ALA A 120 3.485 11.616 1.651 1.00 0.00 N ATOM 1851 CA ALA A 120 2.680 12.141 0.518 1.00 0.00 C ATOM 1852 C ALA A 120 1.546 11.163 0.220 1.00 0.00 C ATOM 1853 O ALA A 120 0.420 11.549 -0.025 1.00 0.00 O ATOM 1854 CB ALA A 120 3.657 12.217 -0.658 1.00 0.00 C ATOM 0 H ALA A 120 4.471 11.454 1.445 1.00 0.00 H new ATOM 0 HA ALA A 120 2.230 13.112 0.725 1.00 0.00 H new ATOM 0 HB1 ALA A 120 3.138 12.597 -1.538 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.480 12.885 -0.405 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.050 11.222 -0.870 1.00 0.00 H new ATOM 1860 N ALA A 121 1.832 9.891 0.259 1.00 0.00 N ATOM 1861 CA ALA A 121 0.771 8.887 -0.003 1.00 0.00 C ATOM 1862 C ALA A 121 -0.299 8.981 1.086 1.00 0.00 C ATOM 1863 O ALA A 121 -1.482 9.000 0.808 1.00 0.00 O ATOM 1864 CB ALA A 121 1.488 7.538 0.050 1.00 0.00 C ATOM 0 H ALA A 121 2.755 9.507 0.461 1.00 0.00 H new ATOM 0 HA ALA A 121 0.269 9.037 -0.959 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.771 6.738 -0.134 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.267 7.510 -0.712 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.937 7.403 1.034 1.00 0.00 H new ATOM 1870 N LEU A 122 0.108 9.051 2.326 1.00 0.00 N ATOM 1871 CA LEU A 122 -0.891 9.158 3.423 1.00 0.00 C ATOM 1872 C LEU A 122 -1.801 10.353 3.162 1.00 0.00 C ATOM 1873 O LEU A 122 -3.009 10.241 3.162 1.00 0.00 O ATOM 1874 CB LEU A 122 -0.070 9.389 4.694 1.00 0.00 C ATOM 1875 CG LEU A 122 0.563 8.074 5.153 1.00 0.00 C ATOM 1876 CD1 LEU A 122 1.915 8.359 5.810 1.00 0.00 C ATOM 1877 CD2 LEU A 122 -0.354 7.399 6.171 1.00 0.00 C ATOM 0 H LEU A 122 1.084 9.039 2.623 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.519 8.271 3.503 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.707 10.130 4.506 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.708 9.790 5.482 1.00 0.00 H new ATOM 0 HG LEU A 122 0.704 7.421 4.292 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.365 7.422 6.137 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.573 8.847 5.091 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.771 9.012 6.671 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.095 6.462 6.500 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.491 8.056 7.030 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -1.321 7.197 5.711 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.228 11.497 2.922 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.065 12.692 2.645 1.00 0.00 C ATOM 1891 C ALA A 123 -2.863 12.465 1.362 1.00 0.00 C ATOM 1892 O ALA A 123 -4.046 12.731 1.297 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.079 13.847 2.473 1.00 0.00 C ATOM 0 H ALA A 123 -0.220 11.655 2.906 1.00 0.00 H new ATOM 0 HA ALA A 123 -2.780 12.898 3.442 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.627 14.766 2.265 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.499 13.970 3.388 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.406 13.630 1.643 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.223 11.967 0.339 1.00 0.00 N ATOM 1900 CA GLU A 124 -2.947 11.717 -0.936 1.00 0.00 C ATOM 1901 C GLU A 124 -4.081 10.710 -0.710 1.00 0.00 C ATOM 1902 O GLU A 124 -5.144 10.828 -1.286 1.00 0.00 O ATOM 1903 CB GLU A 124 -1.898 11.148 -1.890 1.00 0.00 C ATOM 1904 CG GLU A 124 -2.468 11.118 -3.309 1.00 0.00 C ATOM 1905 CD GLU A 124 -2.537 12.544 -3.863 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -1.743 13.366 -3.433 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -3.381 12.789 -4.709 1.00 0.00 O ATOM 0 H GLU A 124 -1.232 11.724 0.333 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.403 12.623 -1.336 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.995 11.758 -1.861 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -1.614 10.143 -1.579 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -1.842 10.497 -3.950 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.462 10.670 -3.304 1.00 0.00 H new ATOM 1914 N PHE A 125 -3.870 9.717 0.120 1.00 0.00 N ATOM 1915 CA PHE A 125 -4.954 8.720 0.363 1.00 0.00 C ATOM 1916 C PHE A 125 -6.042 9.313 1.264 1.00 0.00 C ATOM 1917 O PHE A 125 -7.217 9.116 1.036 1.00 0.00 O ATOM 1918 CB PHE A 125 -4.288 7.531 1.056 1.00 0.00 C ATOM 1919 CG PHE A 125 -5.353 6.510 1.389 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -6.065 5.883 0.357 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -5.638 6.196 2.725 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -7.058 4.944 0.660 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -6.634 5.258 3.027 1.00 0.00 C ATOM 1924 CZ PHE A 125 -7.344 4.631 1.995 1.00 0.00 C ATOM 0 H PHE A 125 -3.003 9.556 0.634 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.434 8.425 -0.570 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.531 7.090 0.407 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.780 7.858 1.963 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -5.847 6.125 -0.673 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -5.090 6.677 3.522 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -7.604 4.460 -0.136 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.855 5.018 4.057 1.00 0.00 H new ATOM 0 HZ PHE A 125 -8.111 3.907 2.228 1.00 0.00 H new ATOM 1934 N LEU A 126 -5.665 10.030 2.292 1.00 0.00 N ATOM 1935 CA LEU A 126 -6.696 10.618 3.198 1.00 0.00 C ATOM 1936 C LEU A 126 -7.569 11.616 2.434 1.00 0.00 C ATOM 1937 O LEU A 126 -8.778 11.506 2.407 1.00 0.00 O ATOM 1938 CB LEU A 126 -5.905 11.338 4.289 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.145 10.321 5.140 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -4.294 11.066 6.170 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.143 9.415 5.865 1.00 0.00 C ATOM 0 H LEU A 126 -4.697 10.232 2.541 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.361 9.857 3.607 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.206 12.042 3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.581 11.918 4.917 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.503 9.714 4.501 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.749 10.346 6.781 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.586 11.715 5.655 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.940 11.668 6.809 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.601 8.690 6.472 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -6.783 10.020 6.507 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.756 8.890 5.133 1.00 0.00 H new ATOM 1953 N ARG A 127 -6.964 12.585 1.808 1.00 0.00 N ATOM 1954 CA ARG A 127 -7.757 13.584 1.041 1.00 0.00 C ATOM 1955 C ARG A 127 -8.562 12.885 -0.052 1.00 0.00 C ATOM 1956 O ARG A 127 -9.578 13.373 -0.505 1.00 0.00 O ATOM 1957 CB ARG A 127 -6.718 14.504 0.411 1.00 0.00 C ATOM 1958 CG ARG A 127 -6.592 15.782 1.236 1.00 0.00 C ATOM 1959 CD ARG A 127 -6.213 16.936 0.308 1.00 0.00 C ATOM 1960 NE ARG A 127 -5.266 17.774 1.090 1.00 0.00 N ATOM 1961 CZ ARG A 127 -4.956 18.970 0.667 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -5.535 19.457 -0.398 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -4.084 19.685 1.318 1.00 0.00 N ATOM 0 H ARG A 127 -5.954 12.729 1.794 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.463 14.124 1.672 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -5.754 13.997 0.359 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -7.006 14.747 -0.612 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -7.533 15.998 1.741 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -5.835 15.657 2.011 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -5.749 16.568 -0.607 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -7.092 17.508 0.012 1.00 0.00 H new ATOM 0 HE ARG A 127 -4.860 17.416 1.954 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -6.229 18.903 -0.899 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -5.293 20.391 -0.728 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -3.643 19.311 2.158 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -3.842 20.619 0.988 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.099 11.748 -0.485 1.00 0.00 N ATOM 1978 CA LEU A 128 -8.810 11.007 -1.561 1.00 0.00 C ATOM 1979 C LEU A 128 -9.667 9.885 -0.964 1.00 0.00 C ATOM 1980 O LEU A 128 -10.515 9.323 -1.628 1.00 0.00 O ATOM 1981 CB LEU A 128 -7.688 10.455 -2.438 1.00 0.00 C ATOM 1982 CG LEU A 128 -8.200 10.260 -3.866 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -8.301 11.618 -4.566 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -7.229 9.360 -4.630 1.00 0.00 C ATOM 0 H LEU A 128 -7.253 11.297 -0.137 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.498 11.634 -2.128 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.840 11.140 -2.435 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -7.332 9.506 -2.036 1.00 0.00 H new ATOM 0 HG LEU A 128 -9.186 9.796 -3.841 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -8.666 11.477 -5.583 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -8.992 12.259 -4.018 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.317 12.086 -4.595 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -7.590 9.218 -5.649 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -6.244 9.826 -4.655 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -7.160 8.393 -4.131 1.00 0.00 H new ATOM 1996 N ALA A 129 -9.467 9.565 0.287 1.00 0.00 N ATOM 1997 CA ALA A 129 -10.290 8.491 0.913 1.00 0.00 C ATOM 1998 C ALA A 129 -11.678 9.045 1.261 1.00 0.00 C ATOM 1999 O ALA A 129 -11.788 10.157 1.738 1.00 0.00 O ATOM 2000 CB ALA A 129 -9.542 8.093 2.189 1.00 0.00 C ATOM 0 H ALA A 129 -8.774 9.998 0.898 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.431 7.638 0.249 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.092 7.304 2.702 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.547 7.732 1.930 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -9.454 8.960 2.844 1.00 0.00 H new ATOM 2006 N PRO A 130 -12.699 8.257 1.021 1.00 0.00 N ATOM 2007 CA PRO A 130 -12.522 6.899 0.437 1.00 0.00 C ATOM 2008 C PRO A 130 -12.222 6.969 -1.069 1.00 0.00 C ATOM 2009 O PRO A 130 -13.021 7.449 -1.849 1.00 0.00 O ATOM 2010 CB PRO A 130 -13.874 6.232 0.678 1.00 0.00 C ATOM 2011 CG PRO A 130 -14.856 7.358 0.777 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.109 8.560 1.292 1.00 0.00 C ATOM 0 HA PRO A 130 -11.685 6.360 0.881 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -14.131 5.556 -0.138 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -13.863 5.638 1.592 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.298 7.569 -0.197 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -15.674 7.097 1.449 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -14.424 9.471 0.784 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -14.285 8.711 2.357 1.00 0.00 H new ATOM 2020 N VAL A 131 -11.085 6.473 -1.486 1.00 0.00 N ATOM 2021 CA VAL A 131 -10.748 6.490 -2.943 1.00 0.00 C ATOM 2022 C VAL A 131 -11.476 5.343 -3.653 1.00 0.00 C ATOM 2023 O VAL A 131 -11.870 4.374 -3.036 1.00 0.00 O ATOM 2024 CB VAL A 131 -9.235 6.284 -3.011 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -8.530 7.364 -2.194 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -8.884 4.911 -2.444 1.00 0.00 C ATOM 0 H VAL A 131 -10.376 6.057 -0.882 1.00 0.00 H new ATOM 0 HA VAL A 131 -11.049 7.419 -3.428 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.909 6.347 -4.049 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.452 7.213 -2.245 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.779 8.346 -2.597 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.856 7.305 -1.155 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.805 4.763 -2.492 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -9.213 4.851 -1.407 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.383 4.138 -3.028 1.00 0.00 H new ATOM 2036 N GLU A 132 -11.668 5.444 -4.941 1.00 0.00 N ATOM 2037 CA GLU A 132 -12.383 4.357 -5.677 1.00 0.00 C ATOM 2038 C GLU A 132 -11.440 3.187 -5.972 1.00 0.00 C ATOM 2039 O GLU A 132 -10.426 3.343 -6.622 1.00 0.00 O ATOM 2040 CB GLU A 132 -12.853 5.007 -6.982 1.00 0.00 C ATOM 2041 CG GLU A 132 -13.697 4.010 -7.782 1.00 0.00 C ATOM 2042 CD GLU A 132 -14.297 4.713 -9.004 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -14.608 5.887 -8.895 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -14.439 4.062 -10.027 1.00 0.00 O ATOM 0 H GLU A 132 -11.362 6.229 -5.516 1.00 0.00 H new ATOM 0 HA GLU A 132 -13.211 3.950 -5.096 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.438 5.901 -6.764 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.993 5.325 -7.571 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.081 3.168 -8.099 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.492 3.605 -7.155 1.00 0.00 H new ATOM 2051 N THR A 133 -11.779 2.013 -5.504 1.00 0.00 N ATOM 2052 CA THR A 133 -10.916 0.824 -5.764 1.00 0.00 C ATOM 2053 C THR A 133 -11.622 -0.146 -6.718 1.00 0.00 C ATOM 2054 O THR A 133 -12.095 -1.189 -6.317 1.00 0.00 O ATOM 2055 CB THR A 133 -10.707 0.169 -4.394 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.826 0.438 -3.560 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.436 0.723 -3.749 1.00 0.00 C ATOM 0 H THR A 133 -12.617 1.827 -4.953 1.00 0.00 H new ATOM 0 HA THR A 133 -9.970 1.100 -6.231 1.00 0.00 H new ATOM 0 HB THR A 133 -10.605 -0.909 -4.520 1.00 0.00 H new ATOM 0 HG1 THR A 133 -11.691 0.017 -2.685 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.289 0.256 -2.775 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.580 0.507 -4.388 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.532 1.802 -3.624 1.00 0.00 H new ATOM 2065 N MET A 134 -11.698 0.192 -7.976 1.00 0.00 N ATOM 2066 CA MET A 134 -12.378 -0.706 -8.954 1.00 0.00 C ATOM 2067 C MET A 134 -11.555 -1.982 -9.174 1.00 0.00 C ATOM 2068 O MET A 134 -11.995 -2.911 -9.823 1.00 0.00 O ATOM 2069 CB MET A 134 -12.459 0.121 -10.236 1.00 0.00 C ATOM 2070 CG MET A 134 -13.402 1.306 -10.013 1.00 0.00 C ATOM 2071 SD MET A 134 -15.043 0.909 -10.666 1.00 0.00 S ATOM 2072 CE MET A 134 -14.950 1.944 -12.149 1.00 0.00 C ATOM 0 H MET A 134 -11.318 1.053 -8.370 1.00 0.00 H new ATOM 0 HA MET A 134 -13.360 -1.032 -8.612 1.00 0.00 H new ATOM 0 HB2 MET A 134 -11.468 0.478 -10.516 1.00 0.00 H new ATOM 0 HB3 MET A 134 -12.820 -0.496 -11.059 1.00 0.00 H new ATOM 0 HG2 MET A 134 -13.469 1.535 -8.949 1.00 0.00 H new ATOM 0 HG3 MET A 134 -13.008 2.195 -10.507 1.00 0.00 H new ATOM 0 HE1 MET A 134 -15.518 2.860 -11.989 1.00 0.00 H new ATOM 0 HE2 MET A 134 -13.909 2.194 -12.354 1.00 0.00 H new ATOM 0 HE3 MET A 134 -15.367 1.402 -12.998 1.00 0.00 H new ATOM 2082 N ALA A 135 -10.361 -2.032 -8.641 1.00 0.00 N ATOM 2083 CA ALA A 135 -9.505 -3.244 -8.818 1.00 0.00 C ATOM 2084 C ALA A 135 -9.058 -3.366 -10.277 1.00 0.00 C ATOM 2085 O ALA A 135 -9.193 -2.394 -10.999 1.00 0.00 O ATOM 2086 CB ALA A 135 -10.389 -4.432 -8.428 1.00 0.00 C ATOM 2087 OXT ALA A 135 -8.590 -4.431 -10.645 1.00 0.00 O ATOM 0 H ALA A 135 -9.941 -1.284 -8.089 1.00 0.00 H new ATOM 0 HA ALA A 135 -8.603 -3.197 -8.208 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -9.823 -5.357 -8.535 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -10.712 -4.321 -7.393 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -11.263 -4.464 -9.079 1.00 0.00 H new TER 2093 ALA A 135