USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 776 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 27 GLN :FLIP amide:sc= 0.357 F(o=-0.96,f=0.74) USER MOD Set 1.2: A 59 LYS NZ :NH3+ -165:sc= 0.385 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 44:sc= 1.15 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= -0.911 X(o=-0.91,f=-1.1) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot -158:sc= 0.0222 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 MET CE :methyl -117:sc= -3.53! (180deg=-5.96!) USER MOD Single : A 31 LYS NZ :NH3+ -163:sc= -0.0517 (180deg=-0.503) USER MOD Single : A 34 LYS NZ :NH3+ 170:sc= 1.05 (180deg=0.64) USER MOD Single : A 36 SER OG : rot 180:sc= -0.0723 USER MOD Single : A 37 GLN : amide:sc= -2.85 K(o=-2.9,f=-9.5!) USER MOD Single : A 42 LYS NZ :NH3+ -167:sc= 0.277 (180deg=0.215) USER MOD Single : A 46 ASN : amide:sc= -0.156 K(o=-0.16,f=-1.9!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -2.51! C(o=-2.5!,f=-4.1!) USER MOD Single : A 53 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.803 K(o=-0.8,f=-2.7!) USER MOD Single : A 63 SER OG : rot 38:sc= 0.747 USER MOD Single : A 66 ASN : amide:sc= -3.95! C(o=-3.9!,f=-4.6!) USER MOD Single : A 68 THR OG1 : rot 180:sc=0.000605 USER MOD Single : A 72 ASN : amide:sc= -1.37 X(o=-1.4,f=-0.99) USER MOD Single : A 74 CYS SG : rot 180:sc= -0.192 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 ASN :FLIP amide:sc= -0.151 F(o=-0.77,f=-0.15) USER MOD Single : A 84 GLN : amide:sc= -1.93! C(o=-1.9!,f=-9.8!) USER MOD Single : A 85 HIS : no HD1:sc= -5.17! C(o=-5.2!,f=-6!) USER MOD Single : A 91 TYR OH : rot 56:sc= 1.16 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 39:sc= 1.08 USER MOD Single : A 99 SER OG : rot 180:sc= -0.0132 USER MOD Single : A 100 SER OG : rot 42:sc= 0.509 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.283 37.372 -17.048 1.00 0.00 N ATOM 2 CA GLY A 1 -6.849 37.594 -17.075 1.00 0.00 C ATOM 3 C GLY A 1 -6.156 36.775 -18.146 1.00 0.00 C ATOM 4 O GLY A 1 -6.300 37.050 -19.337 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.710 37.954 -16.300 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.692 37.635 -17.967 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.475 36.368 -16.858 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.651 38.652 -17.246 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -6.427 37.345 -16.101 1.00 0.00 H new ATOM 8 N SER A 2 -5.399 35.768 -17.722 1.00 0.00 N ATOM 9 CA SER A 2 -4.676 34.910 -18.653 1.00 0.00 C ATOM 10 C SER A 2 -5.241 33.493 -18.636 1.00 0.00 C ATOM 11 O SER A 2 -5.680 33.000 -17.597 1.00 0.00 O ATOM 12 CB SER A 2 -3.187 34.882 -18.303 1.00 0.00 C ATOM 13 OG SER A 2 -2.518 33.848 -19.003 1.00 0.00 O ATOM 0 H SER A 2 -5.271 35.526 -16.739 1.00 0.00 H new ATOM 0 HA SER A 2 -4.798 35.319 -19.656 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.735 35.843 -18.548 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.065 34.737 -17.230 1.00 0.00 H new ATOM 0 HG SER A 2 -1.568 33.852 -18.763 1.00 0.00 H new ATOM 19 N SER A 3 -5.225 32.842 -19.795 1.00 0.00 N ATOM 20 CA SER A 3 -5.739 31.483 -19.916 1.00 0.00 C ATOM 21 C SER A 3 -4.603 30.491 -20.145 1.00 0.00 C ATOM 22 O SER A 3 -4.347 30.073 -21.273 1.00 0.00 O ATOM 23 CB SER A 3 -6.746 31.396 -21.064 1.00 0.00 C ATOM 24 OG SER A 3 -8.056 31.699 -20.617 1.00 0.00 O ATOM 0 H SER A 3 -4.862 33.234 -20.664 1.00 0.00 H new ATOM 0 HA SER A 3 -6.240 31.226 -18.983 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.460 32.088 -21.856 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.727 30.394 -21.493 1.00 0.00 H new ATOM 0 HG SER A 3 -8.681 31.638 -21.370 1.00 0.00 H new ATOM 30 N GLY A 4 -3.923 30.119 -19.064 1.00 0.00 N ATOM 31 CA GLY A 4 -2.822 29.180 -19.168 1.00 0.00 C ATOM 32 C GLY A 4 -2.867 28.112 -18.092 1.00 0.00 C ATOM 33 O GLY A 4 -2.073 28.135 -17.152 1.00 0.00 O ATOM 0 H GLY A 4 -4.115 30.451 -18.119 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.845 28.705 -20.149 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.879 29.722 -19.099 1.00 0.00 H new ATOM 37 N SER A 5 -3.800 27.176 -18.229 1.00 0.00 N ATOM 38 CA SER A 5 -3.950 26.098 -17.258 1.00 0.00 C ATOM 39 C SER A 5 -3.230 24.839 -17.729 1.00 0.00 C ATOM 40 O SER A 5 -3.706 24.134 -18.618 1.00 0.00 O ATOM 41 CB SER A 5 -5.431 25.795 -17.025 1.00 0.00 C ATOM 42 OG SER A 5 -6.037 25.278 -18.197 1.00 0.00 O ATOM 0 H SER A 5 -4.464 27.142 -19.003 1.00 0.00 H new ATOM 0 HA SER A 5 -3.501 26.423 -16.319 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.535 25.077 -16.211 1.00 0.00 H new ATOM 0 HB3 SER A 5 -5.947 26.704 -16.716 1.00 0.00 H new ATOM 0 HG SER A 5 -5.443 24.616 -18.608 1.00 0.00 H new ATOM 48 N SER A 6 -2.078 24.562 -17.125 1.00 0.00 N ATOM 49 CA SER A 6 -1.288 23.390 -17.484 1.00 0.00 C ATOM 50 C SER A 6 -2.147 22.129 -17.461 1.00 0.00 C ATOM 51 O SER A 6 -2.240 21.410 -18.455 1.00 0.00 O ATOM 52 CB SER A 6 -0.105 23.233 -16.527 1.00 0.00 C ATOM 53 OG SER A 6 0.724 24.382 -16.548 1.00 0.00 O ATOM 0 H SER A 6 -1.671 25.134 -16.385 1.00 0.00 H new ATOM 0 HA SER A 6 -0.910 23.533 -18.496 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.472 23.064 -15.515 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.478 22.355 -16.805 1.00 0.00 H new ATOM 0 HG SER A 6 1.472 24.257 -15.927 1.00 0.00 H new ATOM 59 N GLY A 7 -2.773 21.868 -16.318 1.00 0.00 N ATOM 60 CA GLY A 7 -3.616 20.694 -16.186 1.00 0.00 C ATOM 61 C GLY A 7 -2.952 19.590 -15.386 1.00 0.00 C ATOM 62 O GLY A 7 -1.727 19.468 -15.355 1.00 0.00 O ATOM 0 H GLY A 7 -2.712 22.448 -15.481 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.552 20.975 -15.704 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.868 20.318 -17.178 1.00 0.00 H new ATOM 66 N PRO A 8 -3.769 18.763 -14.719 1.00 0.00 N ATOM 67 CA PRO A 8 -3.276 17.650 -13.902 1.00 0.00 C ATOM 68 C PRO A 8 -2.675 16.533 -14.747 1.00 0.00 C ATOM 69 O PRO A 8 -3.307 16.042 -15.684 1.00 0.00 O ATOM 70 CB PRO A 8 -4.531 17.158 -13.178 1.00 0.00 C ATOM 71 CG PRO A 8 -5.661 17.561 -14.061 1.00 0.00 C ATOM 72 CD PRO A 8 -5.239 18.850 -14.710 1.00 0.00 C ATOM 0 HA PRO A 8 -2.475 17.960 -13.231 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -4.507 16.078 -13.034 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -4.620 17.609 -12.190 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -5.864 16.795 -14.810 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -6.577 17.695 -13.486 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.642 18.943 -15.718 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -5.587 19.716 -14.147 1.00 0.00 H new ATOM 80 N ILE A 9 -1.453 16.134 -14.411 1.00 0.00 N ATOM 81 CA ILE A 9 -0.769 15.072 -15.139 1.00 0.00 C ATOM 82 C ILE A 9 -1.191 13.698 -14.632 1.00 0.00 C ATOM 83 O ILE A 9 -1.088 13.404 -13.441 1.00 0.00 O ATOM 84 CB ILE A 9 0.761 15.204 -15.020 1.00 0.00 C ATOM 85 CG1 ILE A 9 1.219 16.569 -15.538 1.00 0.00 C ATOM 86 CG2 ILE A 9 1.450 14.083 -15.784 1.00 0.00 C ATOM 87 CD1 ILE A 9 0.869 16.813 -16.989 1.00 0.00 C ATOM 0 H ILE A 9 -0.916 16.530 -13.639 1.00 0.00 H new ATOM 0 HA ILE A 9 -1.054 15.173 -16.186 1.00 0.00 H new ATOM 0 HB ILE A 9 1.037 15.124 -13.969 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.767 17.351 -14.927 1.00 0.00 H new ATOM 0 HG13 ILE A 9 2.299 16.652 -15.414 1.00 0.00 H new ATOM 0 HG21 ILE A 9 2.531 14.190 -15.691 1.00 0.00 H new ATOM 0 HG22 ILE A 9 1.144 13.121 -15.373 1.00 0.00 H new ATOM 0 HG23 ILE A 9 1.170 14.134 -16.836 1.00 0.00 H new ATOM 0 HD11 ILE A 9 1.224 17.799 -17.288 1.00 0.00 H new ATOM 0 HD12 ILE A 9 1.343 16.053 -17.610 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.212 16.763 -17.116 1.00 0.00 H new ATOM 99 N LYS A 10 -1.666 12.857 -15.544 1.00 0.00 N ATOM 100 CA LYS A 10 -2.101 11.510 -15.192 1.00 0.00 C ATOM 101 C LYS A 10 -1.435 10.471 -16.088 1.00 0.00 C ATOM 102 O LYS A 10 -1.555 10.524 -17.312 1.00 0.00 O ATOM 103 CB LYS A 10 -3.623 11.398 -15.307 1.00 0.00 C ATOM 104 CG LYS A 10 -4.170 11.883 -16.638 1.00 0.00 C ATOM 105 CD LYS A 10 -4.435 13.379 -16.621 1.00 0.00 C ATOM 106 CE LYS A 10 -4.318 13.982 -18.012 1.00 0.00 C ATOM 107 NZ LYS A 10 -5.510 13.678 -18.851 1.00 0.00 N ATOM 0 H LYS A 10 -1.760 13.084 -16.534 1.00 0.00 H new ATOM 0 HA LYS A 10 -1.805 11.317 -14.161 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -3.914 10.358 -15.161 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -4.083 11.973 -14.503 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -3.461 11.647 -17.431 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -5.094 11.352 -16.868 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -5.432 13.568 -16.224 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.727 13.867 -15.951 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -4.197 15.062 -17.930 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -3.423 13.597 -18.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -5.391 14.107 -19.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -5.611 12.648 -18.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -6.362 14.067 -18.398 1.00 0.00 H new ATOM 121 N VAL A 11 -0.734 9.526 -15.470 1.00 0.00 N ATOM 122 CA VAL A 11 -0.051 8.473 -16.212 1.00 0.00 C ATOM 123 C VAL A 11 -0.320 7.104 -15.596 1.00 0.00 C ATOM 124 O VAL A 11 -0.202 6.923 -14.384 1.00 0.00 O ATOM 125 CB VAL A 11 1.470 8.713 -16.257 1.00 0.00 C ATOM 126 CG1 VAL A 11 1.807 9.814 -17.250 1.00 0.00 C ATOM 127 CG2 VAL A 11 1.996 9.055 -14.871 1.00 0.00 C ATOM 0 H VAL A 11 -0.624 9.468 -14.458 1.00 0.00 H new ATOM 0 HA VAL A 11 -0.445 8.496 -17.228 1.00 0.00 H new ATOM 0 HB VAL A 11 1.956 7.796 -16.589 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.886 9.970 -17.268 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.465 9.525 -18.244 1.00 0.00 H new ATOM 0 HG13 VAL A 11 1.312 10.738 -16.951 1.00 0.00 H new ATOM 0 HG21 VAL A 11 3.072 9.221 -14.921 1.00 0.00 H new ATOM 0 HG22 VAL A 11 1.506 9.958 -14.508 1.00 0.00 H new ATOM 0 HG23 VAL A 11 1.788 8.231 -14.189 1.00 0.00 H new ATOM 137 N ASP A 12 -0.682 6.143 -16.440 1.00 0.00 N ATOM 138 CA ASP A 12 -0.966 4.789 -15.979 1.00 0.00 C ATOM 139 C ASP A 12 -0.174 3.764 -16.784 1.00 0.00 C ATOM 140 O ASP A 12 -0.676 2.686 -17.100 1.00 0.00 O ATOM 141 CB ASP A 12 -2.463 4.495 -16.087 1.00 0.00 C ATOM 142 CG ASP A 12 -2.935 4.414 -17.526 1.00 0.00 C ATOM 143 OD1 ASP A 12 -2.084 4.215 -18.418 1.00 0.00 O ATOM 144 OD2 ASP A 12 -4.154 4.550 -17.759 1.00 0.00 O ATOM 0 H ASP A 12 -0.785 6.277 -17.446 1.00 0.00 H new ATOM 0 HA ASP A 12 -0.664 4.716 -14.934 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -2.683 3.554 -15.582 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -3.022 5.274 -15.568 1.00 0.00 H new ATOM 149 N GLY A 13 1.067 4.108 -17.114 1.00 0.00 N ATOM 150 CA GLY A 13 1.908 3.208 -17.881 1.00 0.00 C ATOM 151 C GLY A 13 3.323 3.729 -18.039 1.00 0.00 C ATOM 152 O GLY A 13 4.288 2.999 -17.817 1.00 0.00 O ATOM 0 H GLY A 13 1.505 4.994 -16.864 1.00 0.00 H new ATOM 0 HA2 GLY A 13 1.935 2.235 -17.391 1.00 0.00 H new ATOM 0 HA3 GLY A 13 1.468 3.056 -18.867 1.00 0.00 H new ATOM 156 N ALA A 14 3.445 4.995 -18.425 1.00 0.00 N ATOM 157 CA ALA A 14 4.752 5.613 -18.612 1.00 0.00 C ATOM 158 C ALA A 14 5.613 5.467 -17.362 1.00 0.00 C ATOM 159 O ALA A 14 6.725 4.945 -17.420 1.00 0.00 O ATOM 160 CB ALA A 14 4.594 7.081 -18.978 1.00 0.00 C ATOM 0 H ALA A 14 2.655 5.612 -18.614 1.00 0.00 H new ATOM 0 HA ALA A 14 5.256 5.098 -19.430 1.00 0.00 H new ATOM 0 HB1 ALA A 14 5.578 7.530 -19.115 1.00 0.00 H new ATOM 0 HB2 ALA A 14 4.025 7.166 -19.904 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.066 7.601 -18.178 1.00 0.00 H new ATOM 166 N ASN A 15 5.090 5.932 -16.232 1.00 0.00 N ATOM 167 CA ASN A 15 5.812 5.854 -14.967 1.00 0.00 C ATOM 168 C ASN A 15 4.863 6.041 -13.787 1.00 0.00 C ATOM 169 O ASN A 15 3.765 6.576 -13.939 1.00 0.00 O ATOM 170 CB ASN A 15 6.916 6.912 -14.920 1.00 0.00 C ATOM 171 CG ASN A 15 8.211 6.425 -15.542 1.00 0.00 C ATOM 172 OD1 ASN A 15 8.717 5.358 -15.194 1.00 0.00 O ATOM 173 ND2 ASN A 15 8.753 7.207 -16.469 1.00 0.00 N ATOM 0 H ASN A 15 4.170 6.366 -16.166 1.00 0.00 H new ATOM 0 HA ASN A 15 6.263 4.864 -14.895 1.00 0.00 H new ATOM 0 HB2 ASN A 15 6.580 7.808 -15.442 1.00 0.00 H new ATOM 0 HB3 ASN A 15 7.098 7.197 -13.884 1.00 0.00 H new ATOM 0 HD21 ASN A 15 9.623 6.931 -16.924 1.00 0.00 H new ATOM 0 HD22 ASN A 15 8.299 8.083 -16.726 1.00 0.00 H new ATOM 180 N ILE A 16 5.295 5.596 -12.612 1.00 0.00 N ATOM 181 CA ILE A 16 4.486 5.715 -11.406 1.00 0.00 C ATOM 182 C ILE A 16 4.975 6.861 -10.526 1.00 0.00 C ATOM 183 O ILE A 16 6.130 6.882 -10.103 1.00 0.00 O ATOM 184 CB ILE A 16 4.501 4.412 -10.586 1.00 0.00 C ATOM 185 CG1 ILE A 16 3.969 3.249 -11.427 1.00 0.00 C ATOM 186 CG2 ILE A 16 3.678 4.575 -9.317 1.00 0.00 C ATOM 187 CD1 ILE A 16 4.182 1.894 -10.788 1.00 0.00 C ATOM 0 H ILE A 16 6.201 5.150 -12.470 1.00 0.00 H new ATOM 0 HA ILE A 16 3.466 5.919 -11.731 1.00 0.00 H new ATOM 0 HB ILE A 16 5.530 4.190 -10.302 1.00 0.00 H new ATOM 0 HG12 ILE A 16 2.903 3.396 -11.602 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.457 3.263 -12.402 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.698 3.645 -8.748 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.097 5.380 -8.713 1.00 0.00 H new ATOM 0 HG23 ILE A 16 2.648 4.817 -9.580 1.00 0.00 H new ATOM 0 HD11 ILE A 16 3.781 1.117 -11.439 1.00 0.00 H new ATOM 0 HD12 ILE A 16 5.248 1.726 -10.638 1.00 0.00 H new ATOM 0 HD13 ILE A 16 3.671 1.861 -9.826 1.00 0.00 H new ATOM 199 N ASN A 17 4.087 7.812 -10.255 1.00 0.00 N ATOM 200 CA ASN A 17 4.428 8.961 -9.424 1.00 0.00 C ATOM 201 C ASN A 17 4.112 8.685 -7.957 1.00 0.00 C ATOM 202 O ASN A 17 2.962 8.788 -7.529 1.00 0.00 O ATOM 203 CB ASN A 17 3.666 10.202 -9.896 1.00 0.00 C ATOM 204 CG ASN A 17 4.291 11.489 -9.393 1.00 0.00 C ATOM 205 OD1 ASN A 17 5.285 11.965 -9.941 1.00 0.00 O ATOM 206 ND2 ASN A 17 3.708 12.059 -8.345 1.00 0.00 N ATOM 0 H ASN A 17 3.127 7.810 -10.598 1.00 0.00 H new ATOM 0 HA ASN A 17 5.499 9.141 -9.519 1.00 0.00 H new ATOM 0 HB2 ASN A 17 3.639 10.216 -10.986 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.633 10.144 -9.552 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.083 12.927 -7.962 1.00 0.00 H new ATOM 0 HD22 ASN A 17 2.885 11.629 -7.923 1.00 0.00 H new ATOM 213 N ILE A 18 5.141 8.334 -7.192 1.00 0.00 N ATOM 214 CA ILE A 18 4.974 8.045 -5.773 1.00 0.00 C ATOM 215 C ILE A 18 4.938 9.329 -4.951 1.00 0.00 C ATOM 216 O ILE A 18 5.758 10.227 -5.145 1.00 0.00 O ATOM 217 CB ILE A 18 6.104 7.142 -5.246 1.00 0.00 C ATOM 218 CG1 ILE A 18 6.310 5.948 -6.180 1.00 0.00 C ATOM 219 CG2 ILE A 18 5.790 6.669 -3.835 1.00 0.00 C ATOM 220 CD1 ILE A 18 5.156 4.970 -6.175 1.00 0.00 C ATOM 0 H ILE A 18 6.099 8.243 -7.531 1.00 0.00 H new ATOM 0 HA ILE A 18 4.023 7.522 -5.667 1.00 0.00 H new ATOM 0 HB ILE A 18 7.027 7.721 -5.217 1.00 0.00 H new ATOM 0 HG12 ILE A 18 6.461 6.314 -7.196 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.221 5.424 -5.891 1.00 0.00 H new ATOM 0 HG21 ILE A 18 6.598 6.032 -3.477 1.00 0.00 H new ATOM 0 HG22 ILE A 18 5.689 7.531 -3.176 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.858 6.104 -3.840 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.371 4.150 -6.860 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.018 4.576 -5.168 1.00 0.00 H new ATOM 0 HD13 ILE A 18 4.246 5.479 -6.493 1.00 0.00 H new ATOM 232 N THR A 19 3.984 9.409 -4.029 1.00 0.00 N ATOM 233 CA THR A 19 3.841 10.581 -3.176 1.00 0.00 C ATOM 234 C THR A 19 3.688 10.182 -1.713 1.00 0.00 C ATOM 235 O THR A 19 3.246 9.076 -1.405 1.00 0.00 O ATOM 236 CB THR A 19 2.628 11.435 -3.592 1.00 0.00 C ATOM 237 OG1 THR A 19 1.440 10.637 -3.578 1.00 0.00 O ATOM 238 CG2 THR A 19 2.833 12.025 -4.980 1.00 0.00 C ATOM 0 H THR A 19 3.298 8.675 -3.854 1.00 0.00 H new ATOM 0 HA THR A 19 4.750 11.171 -3.296 1.00 0.00 H new ATOM 0 HB THR A 19 2.524 12.252 -2.878 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.673 11.187 -3.842 1.00 0.00 H new ATOM 0 HG21 THR A 19 1.964 12.624 -5.253 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.722 12.655 -4.980 1.00 0.00 H new ATOM 0 HG23 THR A 19 2.959 11.219 -5.703 1.00 0.00 H new ATOM 246 N ALA A 20 4.057 11.090 -0.815 1.00 0.00 N ATOM 247 CA ALA A 20 3.958 10.832 0.616 1.00 0.00 C ATOM 248 C ALA A 20 2.605 10.225 0.973 1.00 0.00 C ATOM 249 O ALA A 20 2.515 9.347 1.831 1.00 0.00 O ATOM 250 CB ALA A 20 4.185 12.116 1.401 1.00 0.00 C ATOM 0 H ALA A 20 4.427 12.010 -1.053 1.00 0.00 H new ATOM 0 HA ALA A 20 4.732 10.113 0.884 1.00 0.00 H new ATOM 0 HB1 ALA A 20 4.108 11.908 2.468 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.177 12.508 1.178 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.432 12.852 1.120 1.00 0.00 H new ATOM 256 N ALA A 21 1.556 10.699 0.309 1.00 0.00 N ATOM 257 CA ALA A 21 0.208 10.202 0.555 1.00 0.00 C ATOM 258 C ALA A 21 0.192 8.680 0.646 1.00 0.00 C ATOM 259 O ALA A 21 -0.581 8.102 1.410 1.00 0.00 O ATOM 260 CB ALA A 21 -0.738 10.677 -0.537 1.00 0.00 C ATOM 0 H ALA A 21 1.614 11.427 -0.403 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.130 10.601 1.511 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.741 10.298 -0.340 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.758 11.767 -0.552 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.394 10.307 -1.503 1.00 0.00 H new ATOM 266 N ILE A 22 1.050 8.036 -0.139 1.00 0.00 N ATOM 267 CA ILE A 22 1.134 6.581 -0.147 1.00 0.00 C ATOM 268 C ILE A 22 1.035 6.017 1.267 1.00 0.00 C ATOM 269 O ILE A 22 0.405 4.983 1.491 1.00 0.00 O ATOM 270 CB ILE A 22 2.448 6.097 -0.789 1.00 0.00 C ATOM 271 CG1 ILE A 22 2.409 4.581 -0.999 1.00 0.00 C ATOM 272 CG2 ILE A 22 3.636 6.487 0.077 1.00 0.00 C ATOM 273 CD1 ILE A 22 3.312 4.103 -2.114 1.00 0.00 C ATOM 0 H ILE A 22 1.697 8.499 -0.777 1.00 0.00 H new ATOM 0 HA ILE A 22 0.294 6.219 -0.740 1.00 0.00 H new ATOM 0 HB ILE A 22 2.560 6.577 -1.761 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.697 4.086 -0.071 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.385 4.279 -1.217 1.00 0.00 H new ATOM 0 HG21 ILE A 22 4.557 6.138 -0.390 1.00 0.00 H new ATOM 0 HG22 ILE A 22 3.670 7.572 0.181 1.00 0.00 H new ATOM 0 HG23 ILE A 22 3.533 6.031 1.062 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.234 3.020 -2.206 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.011 4.570 -3.052 1.00 0.00 H new ATOM 0 HD13 ILE A 22 4.343 4.374 -1.889 1.00 0.00 H new ATOM 285 N TYR A 23 1.658 6.705 2.217 1.00 0.00 N ATOM 286 CA TYR A 23 1.641 6.272 3.610 1.00 0.00 C ATOM 287 C TYR A 23 0.220 6.282 4.165 1.00 0.00 C ATOM 288 O TYR A 23 -0.230 5.306 4.767 1.00 0.00 O ATOM 289 CB TYR A 23 2.537 7.176 4.457 1.00 0.00 C ATOM 290 CG TYR A 23 3.992 7.143 4.047 1.00 0.00 C ATOM 291 CD1 TYR A 23 4.737 5.975 4.148 1.00 0.00 C ATOM 292 CD2 TYR A 23 4.622 8.281 3.556 1.00 0.00 C ATOM 293 CE1 TYR A 23 6.066 5.940 3.775 1.00 0.00 C ATOM 294 CE2 TYR A 23 5.951 8.255 3.179 1.00 0.00 C ATOM 295 CZ TYR A 23 6.669 7.083 3.291 1.00 0.00 C ATOM 296 OH TYR A 23 7.993 7.052 2.917 1.00 0.00 O ATOM 0 H TYR A 23 2.181 7.564 2.049 1.00 0.00 H new ATOM 0 HA TYR A 23 2.022 5.252 3.652 1.00 0.00 H new ATOM 0 HB2 TYR A 23 2.172 8.201 4.389 1.00 0.00 H new ATOM 0 HB3 TYR A 23 2.456 6.877 5.502 1.00 0.00 H new ATOM 0 HD1 TYR A 23 4.268 5.078 4.525 1.00 0.00 H new ATOM 0 HD2 TYR A 23 4.063 9.201 3.468 1.00 0.00 H new ATOM 0 HE1 TYR A 23 6.630 5.023 3.862 1.00 0.00 H new ATOM 0 HE2 TYR A 23 6.425 9.148 2.799 1.00 0.00 H new ATOM 0 HH TYR A 23 8.360 7.961 2.937 1.00 0.00 H new ATOM 306 N ASP A 24 -0.482 7.390 3.957 1.00 0.00 N ATOM 307 CA ASP A 24 -1.853 7.528 4.434 1.00 0.00 C ATOM 308 C ASP A 24 -2.746 6.440 3.844 1.00 0.00 C ATOM 309 O ASP A 24 -3.471 5.759 4.568 1.00 0.00 O ATOM 310 CB ASP A 24 -2.405 8.908 4.076 1.00 0.00 C ATOM 311 CG ASP A 24 -2.085 9.951 5.128 1.00 0.00 C ATOM 312 OD1 ASP A 24 -0.944 10.459 5.132 1.00 0.00 O ATOM 313 OD2 ASP A 24 -2.975 10.259 5.949 1.00 0.00 O ATOM 0 H ASP A 24 -0.124 8.206 3.461 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.846 7.419 5.519 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.992 9.224 3.118 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.486 8.842 3.951 1.00 0.00 H new ATOM 318 N GLU A 25 -2.687 6.285 2.525 1.00 0.00 N ATOM 319 CA GLU A 25 -3.492 5.281 1.839 1.00 0.00 C ATOM 320 C GLU A 25 -3.319 3.910 2.485 1.00 0.00 C ATOM 321 O GLU A 25 -4.286 3.167 2.658 1.00 0.00 O ATOM 322 CB GLU A 25 -3.108 5.213 0.359 1.00 0.00 C ATOM 323 CG GLU A 25 -3.178 6.554 -0.351 1.00 0.00 C ATOM 324 CD GLU A 25 -3.517 6.419 -1.823 1.00 0.00 C ATOM 325 OE1 GLU A 25 -4.065 5.365 -2.210 1.00 0.00 O ATOM 326 OE2 GLU A 25 -3.235 7.365 -2.587 1.00 0.00 O ATOM 0 H GLU A 25 -2.091 6.841 1.911 1.00 0.00 H new ATOM 0 HA GLU A 25 -4.539 5.572 1.923 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -2.096 4.818 0.273 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -3.769 4.509 -0.147 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -3.927 7.179 0.135 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -2.221 7.066 -0.248 1.00 0.00 H new ATOM 333 N ILE A 26 -2.081 3.580 2.837 1.00 0.00 N ATOM 334 CA ILE A 26 -1.780 2.299 3.463 1.00 0.00 C ATOM 335 C ILE A 26 -2.507 2.155 4.796 1.00 0.00 C ATOM 336 O ILE A 26 -3.021 1.085 5.121 1.00 0.00 O ATOM 337 CB ILE A 26 -0.268 2.126 3.695 1.00 0.00 C ATOM 338 CG1 ILE A 26 0.475 2.096 2.358 1.00 0.00 C ATOM 339 CG2 ILE A 26 0.005 0.856 4.487 1.00 0.00 C ATOM 340 CD1 ILE A 26 1.913 2.557 2.454 1.00 0.00 C ATOM 0 H ILE A 26 -1.270 4.183 2.699 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.124 1.525 2.778 1.00 0.00 H new ATOM 0 HB ILE A 26 0.095 2.976 4.272 1.00 0.00 H new ATOM 0 HG12 ILE A 26 0.453 1.081 1.962 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.053 2.728 1.644 1.00 0.00 H new ATOM 0 HG21 ILE A 26 1.078 0.748 4.643 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.498 0.914 5.452 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.370 -0.005 3.934 1.00 0.00 H new ATOM 0 HD11 ILE A 26 2.377 2.509 1.469 1.00 0.00 H new ATOM 0 HD12 ILE A 26 1.942 3.583 2.819 1.00 0.00 H new ATOM 0 HD13 ILE A 26 2.457 1.911 3.143 1.00 0.00 H new ATOM 352 N GLN A 27 -2.547 3.241 5.563 1.00 0.00 N ATOM 353 CA GLN A 27 -3.212 3.235 6.860 1.00 0.00 C ATOM 354 C GLN A 27 -4.695 2.913 6.710 1.00 0.00 C ATOM 355 O GLN A 27 -5.202 1.980 7.333 1.00 0.00 O ATOM 356 CB GLN A 27 -3.040 4.589 7.551 1.00 0.00 C ATOM 357 CG GLN A 27 -1.587 4.979 7.771 1.00 0.00 C ATOM 358 CD GLN A 27 -1.428 6.078 8.804 1.00 0.00 C ATOM 359 OE1 GLN A 27 -1.452 7.325 8.350 1.00 0.00 O flip ATOM 360 NE2 GLN A 27 -1.285 5.808 9.997 1.00 0.00 N flip ATOM 0 H GLN A 27 -2.127 4.135 5.308 1.00 0.00 H new ATOM 0 HA GLN A 27 -2.751 2.461 7.473 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -3.527 5.358 6.952 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -3.551 4.564 8.514 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -1.023 4.102 8.089 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -1.156 5.309 6.826 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -1.273 4.835 10.302 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -1.179 6.558 10.680 1.00 0.00 H new ATOM 369 N GLN A 28 -5.384 3.690 5.880 1.00 0.00 N ATOM 370 CA GLN A 28 -6.809 3.486 5.650 1.00 0.00 C ATOM 371 C GLN A 28 -7.066 2.140 4.982 1.00 0.00 C ATOM 372 O GLN A 28 -7.894 1.356 5.443 1.00 0.00 O ATOM 373 CB GLN A 28 -7.374 4.615 4.785 1.00 0.00 C ATOM 374 CG GLN A 28 -7.351 5.973 5.467 1.00 0.00 C ATOM 375 CD GLN A 28 -8.193 7.004 4.742 1.00 0.00 C ATOM 376 OE1 GLN A 28 -9.411 7.063 4.918 1.00 0.00 O ATOM 377 NE2 GLN A 28 -7.548 7.824 3.920 1.00 0.00 N ATOM 0 H GLN A 28 -4.979 4.466 5.356 1.00 0.00 H new ATOM 0 HA GLN A 28 -7.312 3.492 6.617 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -6.802 4.673 3.859 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.401 4.373 4.511 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -7.713 5.868 6.490 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -6.322 6.327 5.528 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -6.538 7.740 3.804 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -8.063 8.538 3.404 1.00 0.00 H new ATOM 386 N GLU A 29 -6.350 1.880 3.892 1.00 0.00 N ATOM 387 CA GLU A 29 -6.502 0.628 3.160 1.00 0.00 C ATOM 388 C GLU A 29 -6.581 -0.557 4.118 1.00 0.00 C ATOM 389 O GLU A 29 -7.301 -1.524 3.869 1.00 0.00 O ATOM 390 CB GLU A 29 -5.336 0.435 2.188 1.00 0.00 C ATOM 391 CG GLU A 29 -5.605 -0.606 1.114 1.00 0.00 C ATOM 392 CD GLU A 29 -6.699 -0.183 0.153 1.00 0.00 C ATOM 393 OE1 GLU A 29 -7.880 -0.189 0.559 1.00 0.00 O ATOM 394 OE2 GLU A 29 -6.374 0.154 -1.005 1.00 0.00 O ATOM 0 H GLU A 29 -5.660 2.519 3.497 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.433 0.678 2.595 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -5.111 1.388 1.710 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -4.449 0.143 2.751 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.688 -0.792 0.555 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -5.886 -1.547 1.587 1.00 0.00 H new ATOM 401 N MET A 30 -5.836 -0.474 5.216 1.00 0.00 N ATOM 402 CA MET A 30 -5.822 -1.538 6.212 1.00 0.00 C ATOM 403 C MET A 30 -7.173 -1.646 6.911 1.00 0.00 C ATOM 404 O MET A 30 -7.906 -2.618 6.722 1.00 0.00 O ATOM 405 CB MET A 30 -4.720 -1.287 7.243 1.00 0.00 C ATOM 406 CG MET A 30 -3.384 -1.907 6.867 1.00 0.00 C ATOM 407 SD MET A 30 -2.112 -1.623 8.114 1.00 0.00 S ATOM 408 CE MET A 30 -1.576 0.030 7.680 1.00 0.00 C ATOM 0 H MET A 30 -5.234 0.319 5.438 1.00 0.00 H new ATOM 0 HA MET A 30 -5.622 -2.479 5.699 1.00 0.00 H new ATOM 0 HB2 MET A 30 -4.590 -0.212 7.369 1.00 0.00 H new ATOM 0 HB3 MET A 30 -5.038 -1.685 8.207 1.00 0.00 H new ATOM 0 HG2 MET A 30 -3.513 -2.980 6.723 1.00 0.00 H new ATOM 0 HG3 MET A 30 -3.052 -1.495 5.914 1.00 0.00 H new ATOM 0 HE1 MET A 30 -0.529 0.006 7.379 1.00 0.00 H new ATOM 0 HE2 MET A 30 -2.182 0.404 6.855 1.00 0.00 H new ATOM 0 HE3 MET A 30 -1.691 0.688 8.542 1.00 0.00 H new ATOM 418 N LYS A 31 -7.498 -0.643 7.720 1.00 0.00 N ATOM 419 CA LYS A 31 -8.761 -0.624 8.447 1.00 0.00 C ATOM 420 C LYS A 31 -9.936 -0.862 7.504 1.00 0.00 C ATOM 421 O LYS A 31 -11.040 -1.188 7.941 1.00 0.00 O ATOM 422 CB LYS A 31 -8.937 0.713 9.171 1.00 0.00 C ATOM 423 CG LYS A 31 -9.751 1.727 8.385 1.00 0.00 C ATOM 424 CD LYS A 31 -11.228 1.645 8.733 1.00 0.00 C ATOM 425 CE LYS A 31 -11.590 2.603 9.857 1.00 0.00 C ATOM 426 NZ LYS A 31 -11.348 2.002 11.198 1.00 0.00 N ATOM 0 H LYS A 31 -6.903 0.168 7.888 1.00 0.00 H new ATOM 0 HA LYS A 31 -8.740 -1.428 9.182 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -9.422 0.536 10.131 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -7.954 1.134 9.383 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.382 2.731 8.593 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -9.617 1.553 7.317 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.824 1.876 7.850 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -11.477 0.626 9.028 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -11.005 3.517 9.758 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -12.639 2.885 9.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.861 2.547 11.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.684 1.018 11.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -10.330 2.021 11.408 1.00 0.00 H new ATOM 440 N ARG A 32 -9.691 -0.698 6.208 1.00 0.00 N ATOM 441 CA ARG A 32 -10.728 -0.895 5.203 1.00 0.00 C ATOM 442 C ARG A 32 -10.775 -2.350 4.747 1.00 0.00 C ATOM 443 O ARG A 32 -11.839 -2.875 4.421 1.00 0.00 O ATOM 444 CB ARG A 32 -10.484 0.019 4.001 1.00 0.00 C ATOM 445 CG ARG A 32 -11.759 0.450 3.294 1.00 0.00 C ATOM 446 CD ARG A 32 -12.295 1.756 3.860 1.00 0.00 C ATOM 447 NE ARG A 32 -13.570 2.132 3.254 1.00 0.00 N ATOM 448 CZ ARG A 32 -14.381 3.053 3.762 1.00 0.00 C ATOM 449 NH1 ARG A 32 -14.052 3.688 4.878 1.00 0.00 N ATOM 450 NH2 ARG A 32 -15.524 3.341 3.152 1.00 0.00 N ATOM 0 H ARG A 32 -8.783 -0.429 5.830 1.00 0.00 H new ATOM 0 HA ARG A 32 -11.688 -0.643 5.654 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -9.945 0.906 4.334 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -9.840 -0.496 3.288 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -11.564 0.567 2.228 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.514 -0.329 3.396 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -12.421 1.659 4.938 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -11.566 2.549 3.694 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.853 1.662 2.394 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -13.174 3.470 5.349 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -14.677 4.395 5.266 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.780 2.855 2.293 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -16.146 4.048 3.543 1.00 0.00 H new ATOM 464 N ALA A 33 -9.613 -2.996 4.728 1.00 0.00 N ATOM 465 CA ALA A 33 -9.522 -4.391 4.314 1.00 0.00 C ATOM 466 C ALA A 33 -9.525 -5.323 5.521 1.00 0.00 C ATOM 467 O ALA A 33 -9.612 -6.542 5.377 1.00 0.00 O ATOM 468 CB ALA A 33 -8.270 -4.612 3.478 1.00 0.00 C ATOM 0 H ALA A 33 -8.723 -2.576 4.994 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.397 -4.622 3.707 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -8.214 -5.658 3.176 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -8.308 -3.979 2.591 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -7.389 -4.358 4.068 1.00 0.00 H new ATOM 474 N LYS A 34 -9.429 -4.741 6.712 1.00 0.00 N ATOM 475 CA LYS A 34 -9.422 -5.519 7.946 1.00 0.00 C ATOM 476 C LYS A 34 -8.107 -6.274 8.105 1.00 0.00 C ATOM 477 O LYS A 34 -8.089 -7.427 8.536 1.00 0.00 O ATOM 478 CB LYS A 34 -10.593 -6.504 7.958 1.00 0.00 C ATOM 479 CG LYS A 34 -11.877 -5.931 7.384 1.00 0.00 C ATOM 480 CD LYS A 34 -12.536 -4.961 8.350 1.00 0.00 C ATOM 481 CE LYS A 34 -12.059 -3.535 8.120 1.00 0.00 C ATOM 482 NZ LYS A 34 -12.915 -2.817 7.134 1.00 0.00 N ATOM 0 H LYS A 34 -9.355 -3.733 6.849 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.527 -4.828 8.783 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.316 -7.392 7.390 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.775 -6.826 8.983 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -11.661 -5.421 6.445 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -12.568 -6.742 7.154 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -13.619 -5.007 8.232 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.314 -5.259 9.375 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.062 -2.994 9.066 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -11.029 -3.549 7.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -12.667 -1.807 7.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.762 -3.216 6.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.915 -2.926 7.398 1.00 0.00 H new ATOM 496 N VAL A 35 -7.006 -5.616 7.755 1.00 0.00 N ATOM 497 CA VAL A 35 -5.685 -6.225 7.862 1.00 0.00 C ATOM 498 C VAL A 35 -4.781 -5.418 8.787 1.00 0.00 C ATOM 499 O VAL A 35 -5.128 -4.312 9.201 1.00 0.00 O ATOM 500 CB VAL A 35 -5.011 -6.348 6.483 1.00 0.00 C ATOM 501 CG1 VAL A 35 -5.942 -7.029 5.492 1.00 0.00 C ATOM 502 CG2 VAL A 35 -4.586 -4.979 5.974 1.00 0.00 C ATOM 0 H VAL A 35 -7.003 -4.662 7.395 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.829 -7.222 8.278 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.118 -6.964 6.588 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -5.448 -7.107 4.523 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -6.191 -8.027 5.853 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -6.855 -6.442 5.388 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.111 -5.085 4.998 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -5.462 -4.336 5.884 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.880 -4.534 6.675 1.00 0.00 H new ATOM 512 N SER A 36 -3.620 -5.979 9.108 1.00 0.00 N ATOM 513 CA SER A 36 -2.666 -5.313 9.988 1.00 0.00 C ATOM 514 C SER A 36 -1.420 -4.890 9.216 1.00 0.00 C ATOM 515 O SER A 36 -1.092 -5.469 8.181 1.00 0.00 O ATOM 516 CB SER A 36 -2.275 -6.236 11.143 1.00 0.00 C ATOM 517 OG SER A 36 -1.069 -5.809 11.752 1.00 0.00 O ATOM 0 H SER A 36 -3.317 -6.893 8.772 1.00 0.00 H new ATOM 0 HA SER A 36 -3.143 -4.420 10.392 1.00 0.00 H new ATOM 0 HB2 SER A 36 -3.074 -6.254 11.884 1.00 0.00 H new ATOM 0 HB3 SER A 36 -2.159 -7.255 10.775 1.00 0.00 H new ATOM 0 HG SER A 36 -0.842 -6.415 12.488 1.00 0.00 H new ATOM 523 N GLN A 37 -0.731 -3.875 9.729 1.00 0.00 N ATOM 524 CA GLN A 37 0.479 -3.373 9.089 1.00 0.00 C ATOM 525 C GLN A 37 1.376 -4.523 8.642 1.00 0.00 C ATOM 526 O GLN A 37 2.088 -4.416 7.644 1.00 0.00 O ATOM 527 CB GLN A 37 1.244 -2.456 10.044 1.00 0.00 C ATOM 528 CG GLN A 37 0.349 -1.717 11.026 1.00 0.00 C ATOM 529 CD GLN A 37 0.909 -0.366 11.423 1.00 0.00 C ATOM 530 OE1 GLN A 37 1.928 0.077 10.893 1.00 0.00 O ATOM 531 NE2 GLN A 37 0.244 0.298 12.362 1.00 0.00 N ATOM 0 H GLN A 37 -0.990 -3.385 10.585 1.00 0.00 H new ATOM 0 HA GLN A 37 0.184 -2.803 8.208 1.00 0.00 H new ATOM 0 HB2 GLN A 37 1.969 -3.049 10.601 1.00 0.00 H new ATOM 0 HB3 GLN A 37 1.809 -1.728 9.461 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -0.637 -1.581 10.582 1.00 0.00 H new ATOM 0 HG3 GLN A 37 0.215 -2.327 11.919 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -0.596 -0.107 12.775 1.00 0.00 H new ATOM 0 HE22 GLN A 37 0.574 1.213 12.670 1.00 0.00 H new ATOM 540 N ALA A 38 1.336 -5.622 9.388 1.00 0.00 N ATOM 541 CA ALA A 38 2.144 -6.792 9.067 1.00 0.00 C ATOM 542 C ALA A 38 1.636 -7.482 7.806 1.00 0.00 C ATOM 543 O ALA A 38 2.422 -7.912 6.961 1.00 0.00 O ATOM 544 CB ALA A 38 2.151 -7.765 10.237 1.00 0.00 C ATOM 0 H ALA A 38 0.753 -5.727 10.218 1.00 0.00 H new ATOM 0 HA ALA A 38 3.164 -6.458 8.880 1.00 0.00 H new ATOM 0 HB1 ALA A 38 2.758 -8.634 9.984 1.00 0.00 H new ATOM 0 HB2 ALA A 38 2.569 -7.274 11.116 1.00 0.00 H new ATOM 0 HB3 ALA A 38 1.131 -8.085 10.451 1.00 0.00 H new ATOM 550 N LEU A 39 0.317 -7.585 7.685 1.00 0.00 N ATOM 551 CA LEU A 39 -0.297 -8.224 6.526 1.00 0.00 C ATOM 552 C LEU A 39 -0.154 -7.350 5.284 1.00 0.00 C ATOM 553 O LEU A 39 0.493 -7.738 4.310 1.00 0.00 O ATOM 554 CB LEU A 39 -1.776 -8.505 6.798 1.00 0.00 C ATOM 555 CG LEU A 39 -2.544 -9.203 5.675 1.00 0.00 C ATOM 556 CD1 LEU A 39 -1.804 -10.450 5.216 1.00 0.00 C ATOM 557 CD2 LEU A 39 -3.953 -9.555 6.131 1.00 0.00 C ATOM 0 H LEU A 39 -0.348 -7.234 8.375 1.00 0.00 H new ATOM 0 HA LEU A 39 0.219 -9.167 6.346 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.850 -9.118 7.697 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -2.271 -7.559 7.016 1.00 0.00 H new ATOM 0 HG LEU A 39 -2.617 -8.517 4.831 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.366 -10.933 4.417 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.816 -10.172 4.849 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.699 -11.140 6.053 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.485 -10.051 5.319 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -3.901 -10.222 6.992 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -4.483 -8.644 6.409 1.00 0.00 H new ATOM 569 N PHE A 40 -0.761 -6.169 5.324 1.00 0.00 N ATOM 570 CA PHE A 40 -0.700 -5.239 4.202 1.00 0.00 C ATOM 571 C PHE A 40 0.716 -5.158 3.639 1.00 0.00 C ATOM 572 O PHE A 40 0.908 -5.046 2.429 1.00 0.00 O ATOM 573 CB PHE A 40 -1.168 -3.849 4.638 1.00 0.00 C ATOM 574 CG PHE A 40 -1.028 -2.806 3.567 1.00 0.00 C ATOM 575 CD1 PHE A 40 0.218 -2.300 3.233 1.00 0.00 C ATOM 576 CD2 PHE A 40 -2.142 -2.332 2.893 1.00 0.00 C ATOM 577 CE1 PHE A 40 0.349 -1.339 2.248 1.00 0.00 C ATOM 578 CE2 PHE A 40 -2.017 -1.372 1.907 1.00 0.00 C ATOM 579 CZ PHE A 40 -0.769 -0.876 1.583 1.00 0.00 C ATOM 0 H PHE A 40 -1.301 -5.833 6.121 1.00 0.00 H new ATOM 0 HA PHE A 40 -1.363 -5.609 3.420 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -2.213 -3.906 4.944 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -0.596 -3.539 5.512 1.00 0.00 H new ATOM 0 HD1 PHE A 40 1.096 -2.660 3.748 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -3.120 -2.718 3.141 1.00 0.00 H new ATOM 0 HE1 PHE A 40 1.325 -0.951 1.999 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -2.894 -1.010 1.390 1.00 0.00 H new ATOM 0 HZ PHE A 40 -0.668 -0.128 0.811 1.00 0.00 H new ATOM 589 N ALA A 41 1.703 -5.215 4.527 1.00 0.00 N ATOM 590 CA ALA A 41 3.101 -5.149 4.119 1.00 0.00 C ATOM 591 C ALA A 41 3.585 -6.499 3.598 1.00 0.00 C ATOM 592 O ALA A 41 4.513 -6.568 2.792 1.00 0.00 O ATOM 593 CB ALA A 41 3.969 -4.688 5.281 1.00 0.00 C ATOM 0 H ALA A 41 1.561 -5.307 5.533 1.00 0.00 H new ATOM 0 HA ALA A 41 3.183 -4.425 3.308 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.010 -4.643 4.962 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.646 -3.699 5.606 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.873 -5.391 6.108 1.00 0.00 H new ATOM 599 N LYS A 42 2.951 -7.569 4.064 1.00 0.00 N ATOM 600 CA LYS A 42 3.316 -8.918 3.646 1.00 0.00 C ATOM 601 C LYS A 42 2.656 -9.272 2.317 1.00 0.00 C ATOM 602 O LYS A 42 3.161 -10.105 1.564 1.00 0.00 O ATOM 603 CB LYS A 42 2.910 -9.933 4.716 1.00 0.00 C ATOM 604 CG LYS A 42 3.314 -11.360 4.385 1.00 0.00 C ATOM 605 CD LYS A 42 2.234 -12.076 3.592 1.00 0.00 C ATOM 606 CE LYS A 42 2.797 -13.265 2.830 1.00 0.00 C ATOM 607 NZ LYS A 42 3.046 -14.429 3.724 1.00 0.00 N ATOM 0 H LYS A 42 2.181 -7.529 4.732 1.00 0.00 H new ATOM 0 HA LYS A 42 4.398 -8.951 3.515 1.00 0.00 H new ATOM 0 HB2 LYS A 42 3.362 -9.647 5.666 1.00 0.00 H new ATOM 0 HB3 LYS A 42 1.829 -9.892 4.852 1.00 0.00 H new ATOM 0 HG2 LYS A 42 4.242 -11.353 3.813 1.00 0.00 H new ATOM 0 HG3 LYS A 42 3.512 -11.906 5.307 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.449 -12.415 4.268 1.00 0.00 H new ATOM 0 HD3 LYS A 42 1.773 -11.379 2.892 1.00 0.00 H new ATOM 0 HE2 LYS A 42 2.101 -13.554 2.043 1.00 0.00 H new ATOM 0 HE3 LYS A 42 3.728 -12.976 2.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 3.626 -15.133 3.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 3.548 -14.110 4.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 2.139 -14.858 3.996 1.00 0.00 H new ATOM 621 N VAL A 43 1.525 -8.633 2.034 1.00 0.00 N ATOM 622 CA VAL A 43 0.798 -8.878 0.794 1.00 0.00 C ATOM 623 C VAL A 43 1.053 -7.771 -0.222 1.00 0.00 C ATOM 624 O VAL A 43 0.735 -7.912 -1.402 1.00 0.00 O ATOM 625 CB VAL A 43 -0.718 -8.990 1.046 1.00 0.00 C ATOM 626 CG1 VAL A 43 -1.034 -10.239 1.855 1.00 0.00 C ATOM 627 CG2 VAL A 43 -1.234 -7.744 1.750 1.00 0.00 C ATOM 0 H VAL A 43 1.092 -7.942 2.647 1.00 0.00 H new ATOM 0 HA VAL A 43 1.164 -9.824 0.394 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.224 -9.072 0.084 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -2.109 -10.301 2.023 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -0.701 -11.121 1.308 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -0.519 -10.191 2.814 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.306 -7.840 1.920 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.724 -7.629 2.706 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -1.042 -6.869 1.129 1.00 0.00 H new ATOM 637 N ALA A 44 1.630 -6.668 0.245 1.00 0.00 N ATOM 638 CA ALA A 44 1.930 -5.537 -0.623 1.00 0.00 C ATOM 639 C ALA A 44 3.402 -5.528 -1.024 1.00 0.00 C ATOM 640 O ALA A 44 3.734 -5.627 -2.204 1.00 0.00 O ATOM 641 CB ALA A 44 1.561 -4.231 0.065 1.00 0.00 C ATOM 0 H ALA A 44 1.899 -6.534 1.220 1.00 0.00 H new ATOM 0 HA ALA A 44 1.334 -5.639 -1.530 1.00 0.00 H new ATOM 0 HB1 ALA A 44 1.791 -3.395 -0.595 1.00 0.00 H new ATOM 0 HB2 ALA A 44 0.496 -4.230 0.296 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.132 -4.132 0.988 1.00 0.00 H new ATOM 647 N ALA A 45 4.279 -5.409 -0.033 1.00 0.00 N ATOM 648 CA ALA A 45 5.715 -5.388 -0.283 1.00 0.00 C ATOM 649 C ALA A 45 6.367 -6.697 0.152 1.00 0.00 C ATOM 650 O ALA A 45 7.559 -6.910 -0.065 1.00 0.00 O ATOM 651 CB ALA A 45 6.359 -4.211 0.435 1.00 0.00 C ATOM 0 H ALA A 45 4.020 -5.326 0.950 1.00 0.00 H new ATOM 0 HA ALA A 45 5.870 -5.274 -1.356 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.431 -4.208 0.239 1.00 0.00 H new ATOM 0 HB2 ALA A 45 5.921 -3.281 0.073 1.00 0.00 H new ATOM 0 HB3 ALA A 45 6.186 -4.300 1.507 1.00 0.00 H new ATOM 657 N ASN A 46 5.576 -7.569 0.769 1.00 0.00 N ATOM 658 CA ASN A 46 6.077 -8.857 1.236 1.00 0.00 C ATOM 659 C ASN A 46 7.163 -8.668 2.291 1.00 0.00 C ATOM 660 O ASN A 46 8.017 -9.534 2.481 1.00 0.00 O ATOM 661 CB ASN A 46 6.628 -9.670 0.062 1.00 0.00 C ATOM 662 CG ASN A 46 6.713 -11.151 0.374 1.00 0.00 C ATOM 663 OD1 ASN A 46 6.103 -11.632 1.329 1.00 0.00 O ATOM 664 ND2 ASN A 46 7.473 -11.883 -0.433 1.00 0.00 N ATOM 0 H ASN A 46 4.587 -7.408 0.957 1.00 0.00 H new ATOM 0 HA ASN A 46 5.246 -9.400 1.687 1.00 0.00 H new ATOM 0 HB2 ASN A 46 5.991 -9.521 -0.810 1.00 0.00 H new ATOM 0 HB3 ASN A 46 7.619 -9.299 -0.200 1.00 0.00 H new ATOM 0 HD21 ASN A 46 7.569 -12.886 -0.273 1.00 0.00 H new ATOM 0 HD22 ASN A 46 7.961 -11.442 -1.213 1.00 0.00 H new ATOM 671 N LYS A 47 7.123 -7.530 2.976 1.00 0.00 N ATOM 672 CA LYS A 47 8.100 -7.227 4.014 1.00 0.00 C ATOM 673 C LYS A 47 7.531 -7.515 5.399 1.00 0.00 C ATOM 674 O LYS A 47 6.394 -7.969 5.531 1.00 0.00 O ATOM 675 CB LYS A 47 8.532 -5.761 3.924 1.00 0.00 C ATOM 676 CG LYS A 47 9.684 -5.524 2.963 1.00 0.00 C ATOM 677 CD LYS A 47 11.028 -5.691 3.652 1.00 0.00 C ATOM 678 CE LYS A 47 12.091 -4.802 3.024 1.00 0.00 C ATOM 679 NZ LYS A 47 13.414 -4.967 3.687 1.00 0.00 N ATOM 0 H LYS A 47 6.424 -6.802 2.830 1.00 0.00 H new ATOM 0 HA LYS A 47 8.969 -7.867 3.857 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.679 -5.158 3.611 1.00 0.00 H new ATOM 0 HB3 LYS A 47 8.821 -5.414 4.916 1.00 0.00 H new ATOM 0 HG2 LYS A 47 9.613 -6.222 2.129 1.00 0.00 H new ATOM 0 HG3 LYS A 47 9.610 -4.520 2.546 1.00 0.00 H new ATOM 0 HD2 LYS A 47 10.928 -5.449 4.710 1.00 0.00 H new ATOM 0 HD3 LYS A 47 11.342 -6.733 3.592 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.184 -5.040 1.964 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.779 -3.760 3.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 14.111 -4.345 3.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 13.332 -4.716 4.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 13.724 -5.956 3.601 1.00 0.00 H new ATOM 693 N SER A 48 8.327 -7.248 6.429 1.00 0.00 N ATOM 694 CA SER A 48 7.903 -7.482 7.805 1.00 0.00 C ATOM 695 C SER A 48 7.266 -6.229 8.397 1.00 0.00 C ATOM 696 O SER A 48 7.632 -5.108 8.044 1.00 0.00 O ATOM 697 CB SER A 48 9.093 -7.916 8.661 1.00 0.00 C ATOM 698 OG SER A 48 9.513 -9.227 8.325 1.00 0.00 O ATOM 0 H SER A 48 9.270 -6.869 6.337 1.00 0.00 H new ATOM 0 HA SER A 48 7.159 -8.279 7.800 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.919 -7.219 8.520 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.819 -7.878 9.715 1.00 0.00 H new ATOM 0 HG SER A 48 10.276 -9.480 8.885 1.00 0.00 H new ATOM 704 N GLN A 49 6.311 -6.428 9.299 1.00 0.00 N ATOM 705 CA GLN A 49 5.622 -5.314 9.940 1.00 0.00 C ATOM 706 C GLN A 49 6.595 -4.184 10.260 1.00 0.00 C ATOM 707 O GLN A 49 6.381 -3.037 9.868 1.00 0.00 O ATOM 708 CB GLN A 49 4.929 -5.784 11.220 1.00 0.00 C ATOM 709 CG GLN A 49 3.788 -4.881 11.662 1.00 0.00 C ATOM 710 CD GLN A 49 2.904 -5.528 12.709 1.00 0.00 C ATOM 711 OE1 GLN A 49 3.172 -6.640 13.165 1.00 0.00 O ATOM 712 NE2 GLN A 49 1.841 -4.833 13.098 1.00 0.00 N ATOM 0 H GLN A 49 5.997 -7.350 9.603 1.00 0.00 H new ATOM 0 HA GLN A 49 4.871 -4.937 9.246 1.00 0.00 H new ATOM 0 HB2 GLN A 49 4.544 -6.792 11.066 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.666 -5.843 12.021 1.00 0.00 H new ATOM 0 HG2 GLN A 49 4.198 -3.953 12.061 1.00 0.00 H new ATOM 0 HG3 GLN A 49 3.183 -4.615 10.795 1.00 0.00 H new ATOM 0 HE21 GLN A 49 1.656 -3.915 12.694 1.00 0.00 H new ATOM 0 HE22 GLN A 49 1.210 -5.217 13.801 1.00 0.00 H new ATOM 721 N GLY A 50 7.665 -4.516 10.976 1.00 0.00 N ATOM 722 CA GLY A 50 8.655 -3.517 11.337 1.00 0.00 C ATOM 723 C GLY A 50 8.998 -2.598 10.182 1.00 0.00 C ATOM 724 O GLY A 50 9.218 -1.402 10.376 1.00 0.00 O ATOM 0 H GLY A 50 7.864 -5.458 11.312 1.00 0.00 H new ATOM 0 HA2 GLY A 50 8.280 -2.923 12.171 1.00 0.00 H new ATOM 0 HA3 GLY A 50 9.561 -4.016 11.682 1.00 0.00 H new ATOM 728 N TRP A 51 9.047 -3.156 8.978 1.00 0.00 N ATOM 729 CA TRP A 51 9.369 -2.378 7.787 1.00 0.00 C ATOM 730 C TRP A 51 8.212 -1.461 7.407 1.00 0.00 C ATOM 731 O TRP A 51 8.420 -0.369 6.876 1.00 0.00 O ATOM 732 CB TRP A 51 9.704 -3.307 6.620 1.00 0.00 C ATOM 733 CG TRP A 51 10.043 -2.576 5.357 1.00 0.00 C ATOM 734 CD1 TRP A 51 11.292 -2.270 4.897 1.00 0.00 C ATOM 735 CD2 TRP A 51 9.121 -2.058 4.392 1.00 0.00 C ATOM 736 NE1 TRP A 51 11.202 -1.593 3.705 1.00 0.00 N ATOM 737 CE2 TRP A 51 9.880 -1.451 3.373 1.00 0.00 C ATOM 738 CE3 TRP A 51 7.727 -2.050 4.289 1.00 0.00 C ATOM 739 CZ2 TRP A 51 9.291 -0.842 2.268 1.00 0.00 C ATOM 740 CZ3 TRP A 51 7.144 -1.445 3.192 1.00 0.00 C ATOM 741 CH2 TRP A 51 7.925 -0.848 2.193 1.00 0.00 C ATOM 0 H TRP A 51 8.868 -4.144 8.800 1.00 0.00 H new ATOM 0 HA TRP A 51 10.239 -1.761 8.011 1.00 0.00 H new ATOM 0 HB2 TRP A 51 10.544 -3.942 6.900 1.00 0.00 H new ATOM 0 HB3 TRP A 51 8.855 -3.965 6.434 1.00 0.00 H new ATOM 0 HD1 TRP A 51 12.215 -2.523 5.397 1.00 0.00 H new ATOM 0 HE1 TRP A 51 11.991 -1.251 3.156 1.00 0.00 H new ATOM 0 HE3 TRP A 51 7.117 -2.508 5.053 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 9.891 -0.381 1.497 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 6.068 -1.432 3.103 1.00 0.00 H new ATOM 0 HH2 TRP A 51 7.439 -0.384 1.348 1.00 0.00 H new ATOM 752 N LEU A 52 6.992 -1.909 7.683 1.00 0.00 N ATOM 753 CA LEU A 52 5.801 -1.128 7.369 1.00 0.00 C ATOM 754 C LEU A 52 5.528 -0.092 8.455 1.00 0.00 C ATOM 755 O LEU A 52 5.476 1.108 8.183 1.00 0.00 O ATOM 756 CB LEU A 52 4.590 -2.049 7.211 1.00 0.00 C ATOM 757 CG LEU A 52 3.326 -1.404 6.641 1.00 0.00 C ATOM 758 CD1 LEU A 52 2.895 -0.225 7.498 1.00 0.00 C ATOM 759 CD2 LEU A 52 3.554 -0.965 5.202 1.00 0.00 C ATOM 0 H LEU A 52 6.802 -2.809 8.124 1.00 0.00 H new ATOM 0 HA LEU A 52 5.977 -0.605 6.429 1.00 0.00 H new ATOM 0 HB2 LEU A 52 4.873 -2.880 6.565 1.00 0.00 H new ATOM 0 HB3 LEU A 52 4.350 -2.471 8.187 1.00 0.00 H new ATOM 0 HG LEU A 52 2.527 -2.145 6.652 1.00 0.00 H new ATOM 0 HD11 LEU A 52 1.994 0.221 7.077 1.00 0.00 H new ATOM 0 HD12 LEU A 52 2.690 -0.568 8.512 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.692 0.519 7.521 1.00 0.00 H new ATOM 0 HD21 LEU A 52 2.644 -0.508 4.812 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.367 -0.240 5.167 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.814 -1.832 4.594 1.00 0.00 H new ATOM 771 N CYS A 53 5.357 -0.564 9.685 1.00 0.00 N ATOM 772 CA CYS A 53 5.091 0.322 10.813 1.00 0.00 C ATOM 773 C CYS A 53 5.961 1.572 10.740 1.00 0.00 C ATOM 774 O CYS A 53 5.466 2.692 10.861 1.00 0.00 O ATOM 775 CB CYS A 53 5.339 -0.410 12.133 1.00 0.00 C ATOM 776 SG CYS A 53 4.349 0.204 13.516 1.00 0.00 S ATOM 0 H CYS A 53 5.398 -1.554 9.926 1.00 0.00 H new ATOM 0 HA CYS A 53 4.045 0.626 10.765 1.00 0.00 H new ATOM 0 HB2 CYS A 53 5.129 -1.470 11.993 1.00 0.00 H new ATOM 0 HB3 CYS A 53 6.395 -0.325 12.390 1.00 0.00 H new ATOM 0 HG CYS A 53 4.628 -0.479 14.586 1.00 0.00 H new ATOM 782 N GLU A 54 7.260 1.372 10.542 1.00 0.00 N ATOM 783 CA GLU A 54 8.199 2.485 10.455 1.00 0.00 C ATOM 784 C GLU A 54 7.759 3.487 9.393 1.00 0.00 C ATOM 785 O GLU A 54 7.624 4.680 9.666 1.00 0.00 O ATOM 786 CB GLU A 54 9.605 1.971 10.136 1.00 0.00 C ATOM 787 CG GLU A 54 10.173 1.049 11.202 1.00 0.00 C ATOM 788 CD GLU A 54 11.274 0.152 10.671 1.00 0.00 C ATOM 789 OE1 GLU A 54 11.268 -0.139 9.457 1.00 0.00 O ATOM 790 OE2 GLU A 54 12.142 -0.258 11.470 1.00 0.00 O ATOM 0 H GLU A 54 7.686 0.451 10.439 1.00 0.00 H new ATOM 0 HA GLU A 54 8.215 2.990 11.421 1.00 0.00 H new ATOM 0 HB2 GLU A 54 9.581 1.441 9.184 1.00 0.00 H new ATOM 0 HB3 GLU A 54 10.274 2.822 10.010 1.00 0.00 H new ATOM 0 HG2 GLU A 54 10.563 1.648 12.025 1.00 0.00 H new ATOM 0 HG3 GLU A 54 9.371 0.432 11.608 1.00 0.00 H new ATOM 797 N LEU A 55 7.536 2.994 8.179 1.00 0.00 N ATOM 798 CA LEU A 55 7.110 3.846 7.074 1.00 0.00 C ATOM 799 C LEU A 55 6.036 4.829 7.526 1.00 0.00 C ATOM 800 O LEU A 55 6.065 6.006 7.165 1.00 0.00 O ATOM 801 CB LEU A 55 6.583 2.991 5.920 1.00 0.00 C ATOM 802 CG LEU A 55 7.610 2.580 4.865 1.00 0.00 C ATOM 803 CD1 LEU A 55 8.946 2.257 5.518 1.00 0.00 C ATOM 804 CD2 LEU A 55 7.105 1.389 4.064 1.00 0.00 C ATOM 0 H LEU A 55 7.643 2.009 7.935 1.00 0.00 H new ATOM 0 HA LEU A 55 7.975 4.415 6.732 1.00 0.00 H new ATOM 0 HB2 LEU A 55 6.139 2.087 6.337 1.00 0.00 H new ATOM 0 HB3 LEU A 55 5.782 3.540 5.424 1.00 0.00 H new ATOM 0 HG LEU A 55 7.755 3.417 4.182 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.665 1.966 4.752 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.315 3.136 6.047 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.817 1.437 6.224 1.00 0.00 H new ATOM 0 HD21 LEU A 55 7.849 1.110 3.318 1.00 0.00 H new ATOM 0 HD22 LEU A 55 6.931 0.547 4.734 1.00 0.00 H new ATOM 0 HD23 LEU A 55 6.173 1.655 3.565 1.00 0.00 H new ATOM 816 N LEU A 56 5.090 4.340 8.321 1.00 0.00 N ATOM 817 CA LEU A 56 4.007 5.176 8.825 1.00 0.00 C ATOM 818 C LEU A 56 4.491 6.066 9.966 1.00 0.00 C ATOM 819 O LEU A 56 3.917 7.122 10.229 1.00 0.00 O ATOM 820 CB LEU A 56 2.843 4.305 9.302 1.00 0.00 C ATOM 821 CG LEU A 56 2.477 3.124 8.403 1.00 0.00 C ATOM 822 CD1 LEU A 56 1.283 2.371 8.969 1.00 0.00 C ATOM 823 CD2 LEU A 56 2.186 3.601 6.987 1.00 0.00 C ATOM 0 H LEU A 56 5.052 3.369 8.630 1.00 0.00 H new ATOM 0 HA LEU A 56 3.665 5.814 8.010 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.085 3.920 10.293 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.963 4.938 9.412 1.00 0.00 H new ATOM 0 HG LEU A 56 3.327 2.442 8.368 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.038 1.534 8.315 1.00 0.00 H new ATOM 0 HD12 LEU A 56 1.527 1.996 9.963 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.427 3.043 9.035 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.927 2.747 6.361 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.353 4.304 7.004 1.00 0.00 H new ATOM 0 HD23 LEU A 56 3.069 4.094 6.581 1.00 0.00 H new ATOM 835 N ARG A 57 5.553 5.632 10.638 1.00 0.00 N ATOM 836 CA ARG A 57 6.115 6.389 11.749 1.00 0.00 C ATOM 837 C ARG A 57 6.951 7.561 11.241 1.00 0.00 C ATOM 838 O ARG A 57 6.680 8.717 11.567 1.00 0.00 O ATOM 839 CB ARG A 57 6.974 5.481 12.630 1.00 0.00 C ATOM 840 CG ARG A 57 7.809 6.235 13.652 1.00 0.00 C ATOM 841 CD ARG A 57 8.622 5.286 14.518 1.00 0.00 C ATOM 842 NE ARG A 57 8.849 5.824 15.856 1.00 0.00 N ATOM 843 CZ ARG A 57 9.574 5.207 16.783 1.00 0.00 C ATOM 844 NH1 ARG A 57 10.139 4.037 16.517 1.00 0.00 N ATOM 845 NH2 ARG A 57 9.735 5.761 17.978 1.00 0.00 N ATOM 0 H ARG A 57 6.041 4.760 10.432 1.00 0.00 H new ATOM 0 HA ARG A 57 5.289 6.783 12.341 1.00 0.00 H new ATOM 0 HB2 ARG A 57 6.326 4.777 13.152 1.00 0.00 H new ATOM 0 HB3 ARG A 57 7.637 4.894 11.994 1.00 0.00 H new ATOM 0 HG2 ARG A 57 8.479 6.924 13.138 1.00 0.00 H new ATOM 0 HG3 ARG A 57 7.156 6.837 14.284 1.00 0.00 H new ATOM 0 HD2 ARG A 57 8.103 4.331 14.595 1.00 0.00 H new ATOM 0 HD3 ARG A 57 9.581 5.090 14.039 1.00 0.00 H new ATOM 0 HE ARG A 57 8.428 6.723 16.092 1.00 0.00 H new ATOM 0 HH11 ARG A 57 10.017 3.609 15.599 1.00 0.00 H new ATOM 0 HH12 ARG A 57 10.695 3.565 17.230 1.00 0.00 H new ATOM 0 HH21 ARG A 57 9.302 6.661 18.185 1.00 0.00 H new ATOM 0 HH22 ARG A 57 10.292 5.287 18.689 1.00 0.00 H new ATOM 859 N TRP A 58 7.966 7.253 10.443 1.00 0.00 N ATOM 860 CA TRP A 58 8.842 8.281 9.890 1.00 0.00 C ATOM 861 C TRP A 58 8.176 8.990 8.716 1.00 0.00 C ATOM 862 O TRP A 58 8.216 10.216 8.615 1.00 0.00 O ATOM 863 CB TRP A 58 10.168 7.663 9.443 1.00 0.00 C ATOM 864 CG TRP A 58 10.859 6.893 10.527 1.00 0.00 C ATOM 865 CD1 TRP A 58 10.736 5.558 10.790 1.00 0.00 C ATOM 866 CD2 TRP A 58 11.780 7.411 11.493 1.00 0.00 C ATOM 867 NE1 TRP A 58 11.524 5.215 11.862 1.00 0.00 N ATOM 868 CE2 TRP A 58 12.176 6.334 12.311 1.00 0.00 C ATOM 869 CE3 TRP A 58 12.311 8.678 11.746 1.00 0.00 C ATOM 870 CZ2 TRP A 58 13.075 6.489 13.362 1.00 0.00 C ATOM 871 CZ3 TRP A 58 13.203 8.831 12.790 1.00 0.00 C ATOM 872 CH2 TRP A 58 13.578 7.741 13.587 1.00 0.00 C ATOM 0 H TRP A 58 8.204 6.301 10.164 1.00 0.00 H new ATOM 0 HA TRP A 58 9.037 9.016 10.671 1.00 0.00 H new ATOM 0 HB2 TRP A 58 9.985 7.001 8.597 1.00 0.00 H new ATOM 0 HB3 TRP A 58 10.829 8.455 9.091 1.00 0.00 H new ATOM 0 HD1 TRP A 58 10.111 4.873 10.236 1.00 0.00 H new ATOM 0 HE1 TRP A 58 11.610 4.279 12.259 1.00 0.00 H new ATOM 0 HE3 TRP A 58 12.029 9.523 11.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 13.365 5.651 13.978 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 13.618 9.807 12.995 1.00 0.00 H new ATOM 0 HH2 TRP A 58 14.278 7.893 14.395 1.00 0.00 H new ATOM 883 N LYS A 59 7.563 8.212 7.831 1.00 0.00 N ATOM 884 CA LYS A 59 6.886 8.765 6.664 1.00 0.00 C ATOM 885 C LYS A 59 7.822 9.672 5.871 1.00 0.00 C ATOM 886 O LYS A 59 7.449 10.780 5.488 1.00 0.00 O ATOM 887 CB LYS A 59 5.643 9.548 7.093 1.00 0.00 C ATOM 888 CG LYS A 59 4.558 8.678 7.704 1.00 0.00 C ATOM 889 CD LYS A 59 3.263 9.451 7.892 1.00 0.00 C ATOM 890 CE LYS A 59 2.060 8.522 7.931 1.00 0.00 C ATOM 891 NZ LYS A 59 0.832 9.183 7.407 1.00 0.00 N ATOM 0 H LYS A 59 7.521 7.195 7.900 1.00 0.00 H new ATOM 0 HA LYS A 59 6.583 7.936 6.024 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.935 10.311 7.815 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.235 10.069 6.227 1.00 0.00 H new ATOM 0 HG2 LYS A 59 4.378 7.815 7.063 1.00 0.00 H new ATOM 0 HG3 LYS A 59 4.897 8.294 8.666 1.00 0.00 H new ATOM 0 HD2 LYS A 59 3.311 10.024 8.818 1.00 0.00 H new ATOM 0 HD3 LYS A 59 3.144 10.168 7.079 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.271 7.629 7.342 1.00 0.00 H new ATOM 0 HE3 LYS A 59 1.887 8.194 8.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -0.004 8.627 7.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 0.756 10.140 7.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 0.886 9.244 6.370 1.00 0.00 H new ATOM 905 N GLU A 60 9.038 9.193 5.629 1.00 0.00 N ATOM 906 CA GLU A 60 10.026 9.961 4.881 1.00 0.00 C ATOM 907 C GLU A 60 9.436 10.478 3.571 1.00 0.00 C ATOM 908 O GLU A 60 8.263 10.256 3.277 1.00 0.00 O ATOM 909 CB GLU A 60 11.261 9.105 4.593 1.00 0.00 C ATOM 910 CG GLU A 60 12.383 9.297 5.600 1.00 0.00 C ATOM 911 CD GLU A 60 13.174 8.026 5.842 1.00 0.00 C ATOM 912 OE1 GLU A 60 13.217 7.172 4.931 1.00 0.00 O ATOM 913 OE2 GLU A 60 13.749 7.885 6.941 1.00 0.00 O ATOM 0 H GLU A 60 9.362 8.277 5.940 1.00 0.00 H new ATOM 0 HA GLU A 60 10.320 10.816 5.490 1.00 0.00 H new ATOM 0 HB2 GLU A 60 10.970 8.055 4.582 1.00 0.00 H new ATOM 0 HB3 GLU A 60 11.634 9.343 3.597 1.00 0.00 H new ATOM 0 HG2 GLU A 60 13.056 10.077 5.244 1.00 0.00 H new ATOM 0 HG3 GLU A 60 11.963 9.645 6.544 1.00 0.00 H new ATOM 920 N ASN A 61 10.260 11.170 2.790 1.00 0.00 N ATOM 921 CA ASN A 61 9.820 11.719 1.513 1.00 0.00 C ATOM 922 C ASN A 61 10.214 10.800 0.361 1.00 0.00 C ATOM 923 O ASN A 61 11.394 10.597 0.071 1.00 0.00 O ATOM 924 CB ASN A 61 10.421 13.110 1.299 1.00 0.00 C ATOM 925 CG ASN A 61 10.643 13.424 -0.168 1.00 0.00 C ATOM 926 OD1 ASN A 61 9.818 13.090 -1.018 1.00 0.00 O ATOM 927 ND2 ASN A 61 11.763 14.071 -0.471 1.00 0.00 N ATOM 0 H ASN A 61 11.235 11.363 3.019 1.00 0.00 H new ATOM 0 HA ASN A 61 8.733 11.799 1.535 1.00 0.00 H new ATOM 0 HB2 ASN A 61 9.759 13.860 1.732 1.00 0.00 H new ATOM 0 HB3 ASN A 61 11.370 13.178 1.830 1.00 0.00 H new ATOM 0 HD21 ASN A 61 11.967 14.310 -1.441 1.00 0.00 H new ATOM 0 HD22 ASN A 61 12.419 14.328 0.267 1.00 0.00 H new ATOM 934 N PRO A 62 9.204 10.231 -0.314 1.00 0.00 N ATOM 935 CA PRO A 62 9.420 9.325 -1.446 1.00 0.00 C ATOM 936 C PRO A 62 9.961 10.050 -2.674 1.00 0.00 C ATOM 937 O PRO A 62 9.562 11.177 -2.967 1.00 0.00 O ATOM 938 CB PRO A 62 8.022 8.769 -1.727 1.00 0.00 C ATOM 939 CG PRO A 62 7.089 9.811 -1.211 1.00 0.00 C ATOM 940 CD PRO A 62 7.774 10.428 -0.024 1.00 0.00 C ATOM 0 HA PRO A 62 10.161 8.559 -1.219 1.00 0.00 H new ATOM 0 HB2 PRO A 62 7.872 8.596 -2.793 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.867 7.815 -1.224 1.00 0.00 H new ATOM 0 HG2 PRO A 62 6.880 10.561 -1.974 1.00 0.00 H new ATOM 0 HG3 PRO A 62 6.133 9.372 -0.925 1.00 0.00 H new ATOM 0 HD2 PRO A 62 7.527 11.485 0.078 1.00 0.00 H new ATOM 0 HD3 PRO A 62 7.482 9.941 0.906 1.00 0.00 H new ATOM 948 N SER A 63 10.872 9.396 -3.388 1.00 0.00 N ATOM 949 CA SER A 63 11.470 9.981 -4.582 1.00 0.00 C ATOM 950 C SER A 63 12.136 8.907 -5.437 1.00 0.00 C ATOM 951 O SER A 63 12.484 7.826 -4.961 1.00 0.00 O ATOM 952 CB SER A 63 12.495 11.048 -4.195 1.00 0.00 C ATOM 953 OG SER A 63 11.888 12.325 -4.095 1.00 0.00 O ATOM 0 H SER A 63 11.212 8.462 -3.160 1.00 0.00 H new ATOM 0 HA SER A 63 10.675 10.446 -5.166 1.00 0.00 H new ATOM 0 HB2 SER A 63 12.956 10.785 -3.243 1.00 0.00 H new ATOM 0 HB3 SER A 63 13.292 11.078 -4.938 1.00 0.00 H new ATOM 0 HG SER A 63 10.993 12.232 -3.706 1.00 0.00 H new ATOM 959 N PRO A 64 12.318 9.210 -6.731 1.00 0.00 N ATOM 960 CA PRO A 64 12.943 8.285 -7.681 1.00 0.00 C ATOM 961 C PRO A 64 14.433 8.100 -7.414 1.00 0.00 C ATOM 962 O PRO A 64 15.111 7.356 -8.121 1.00 0.00 O ATOM 963 CB PRO A 64 12.723 8.964 -9.035 1.00 0.00 C ATOM 964 CG PRO A 64 12.589 10.413 -8.715 1.00 0.00 C ATOM 965 CD PRO A 64 11.927 10.480 -7.367 1.00 0.00 C ATOM 0 HA PRO A 64 12.516 7.284 -7.616 1.00 0.00 H new ATOM 0 HB2 PRO A 64 13.560 8.783 -9.709 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.829 8.583 -9.528 1.00 0.00 H new ATOM 0 HG2 PRO A 64 13.564 10.900 -8.696 1.00 0.00 H new ATOM 0 HG3 PRO A 64 11.992 10.926 -9.469 1.00 0.00 H new ATOM 0 HD2 PRO A 64 12.272 11.340 -6.792 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.844 10.569 -7.455 1.00 0.00 H new ATOM 973 N GLU A 65 14.935 8.781 -6.389 1.00 0.00 N ATOM 974 CA GLU A 65 16.346 8.691 -6.030 1.00 0.00 C ATOM 975 C GLU A 65 16.586 7.543 -5.053 1.00 0.00 C ATOM 976 O GLU A 65 17.566 6.809 -5.172 1.00 0.00 O ATOM 977 CB GLU A 65 16.823 10.007 -5.414 1.00 0.00 C ATOM 978 CG GLU A 65 17.127 11.085 -6.441 1.00 0.00 C ATOM 979 CD GLU A 65 18.142 12.096 -5.943 1.00 0.00 C ATOM 980 OE1 GLU A 65 18.940 11.744 -5.049 1.00 0.00 O ATOM 981 OE2 GLU A 65 18.138 13.238 -6.447 1.00 0.00 O ATOM 0 H GLU A 65 14.386 9.401 -5.793 1.00 0.00 H new ATOM 0 HA GLU A 65 16.915 8.497 -6.939 1.00 0.00 H new ATOM 0 HB2 GLU A 65 16.060 10.375 -4.728 1.00 0.00 H new ATOM 0 HB3 GLU A 65 17.719 9.818 -4.822 1.00 0.00 H new ATOM 0 HG2 GLU A 65 17.502 10.618 -7.352 1.00 0.00 H new ATOM 0 HG3 GLU A 65 16.204 11.602 -6.704 1.00 0.00 H new ATOM 988 N ASN A 66 15.684 7.396 -4.089 1.00 0.00 N ATOM 989 CA ASN A 66 15.798 6.338 -3.091 1.00 0.00 C ATOM 990 C ASN A 66 15.316 5.005 -3.653 1.00 0.00 C ATOM 991 O ASN A 66 14.121 4.811 -3.882 1.00 0.00 O ATOM 992 CB ASN A 66 14.992 6.699 -1.841 1.00 0.00 C ATOM 993 CG ASN A 66 15.445 5.926 -0.618 1.00 0.00 C ATOM 994 OD1 ASN A 66 16.181 4.945 -0.727 1.00 0.00 O ATOM 995 ND2 ASN A 66 15.007 6.366 0.556 1.00 0.00 N ATOM 0 H ASN A 66 14.866 7.995 -3.977 1.00 0.00 H new ATOM 0 HA ASN A 66 16.850 6.239 -2.822 1.00 0.00 H new ATOM 0 HB2 ASN A 66 15.086 7.768 -1.647 1.00 0.00 H new ATOM 0 HB3 ASN A 66 13.936 6.500 -2.023 1.00 0.00 H new ATOM 0 HD21 ASN A 66 15.279 5.887 1.414 1.00 0.00 H new ATOM 0 HD22 ASN A 66 14.398 7.183 0.600 1.00 0.00 H new ATOM 1002 N ARG A 67 16.253 4.088 -3.874 1.00 0.00 N ATOM 1003 CA ARG A 67 15.923 2.773 -4.410 1.00 0.00 C ATOM 1004 C ARG A 67 15.177 1.936 -3.376 1.00 0.00 C ATOM 1005 O ARG A 67 13.983 1.668 -3.521 1.00 0.00 O ATOM 1006 CB ARG A 67 17.195 2.045 -4.849 1.00 0.00 C ATOM 1007 CG ARG A 67 17.758 2.545 -6.170 1.00 0.00 C ATOM 1008 CD ARG A 67 17.143 1.811 -7.351 1.00 0.00 C ATOM 1009 NE ARG A 67 17.180 2.611 -8.572 1.00 0.00 N ATOM 1010 CZ ARG A 67 16.342 2.439 -9.589 1.00 0.00 C ATOM 1011 NH1 ARG A 67 15.406 1.502 -9.530 1.00 0.00 N ATOM 1012 NH2 ARG A 67 16.438 3.207 -10.667 1.00 0.00 N ATOM 0 H ARG A 67 17.246 4.232 -3.690 1.00 0.00 H new ATOM 0 HA ARG A 67 15.275 2.913 -5.275 1.00 0.00 H new ATOM 0 HB2 ARG A 67 17.954 2.158 -4.075 1.00 0.00 H new ATOM 0 HB3 ARG A 67 16.983 0.979 -4.934 1.00 0.00 H new ATOM 0 HG2 ARG A 67 17.569 3.614 -6.266 1.00 0.00 H new ATOM 0 HG3 ARG A 67 18.840 2.411 -6.180 1.00 0.00 H new ATOM 0 HD2 ARG A 67 17.678 0.875 -7.514 1.00 0.00 H new ATOM 0 HD3 ARG A 67 16.110 1.552 -7.119 1.00 0.00 H new ATOM 0 HE ARG A 67 17.888 3.342 -8.649 1.00 0.00 H new ATOM 0 HH11 ARG A 67 15.328 0.911 -8.702 1.00 0.00 H new ATOM 0 HH12 ARG A 67 14.764 1.372 -10.312 1.00 0.00 H new ATOM 0 HH21 ARG A 67 17.156 3.930 -10.716 1.00 0.00 H new ATOM 0 HH22 ARG A 67 15.794 3.074 -11.447 1.00 0.00 H new ATOM 1026 N THR A 68 15.887 1.524 -2.330 1.00 0.00 N ATOM 1027 CA THR A 68 15.293 0.716 -1.273 1.00 0.00 C ATOM 1028 C THR A 68 13.901 1.220 -0.911 1.00 0.00 C ATOM 1029 O THR A 68 13.026 0.441 -0.533 1.00 0.00 O ATOM 1030 CB THR A 68 16.171 0.713 -0.007 1.00 0.00 C ATOM 1031 OG1 THR A 68 17.522 0.381 -0.348 1.00 0.00 O ATOM 1032 CG2 THR A 68 15.642 -0.280 1.016 1.00 0.00 C ATOM 0 H THR A 68 16.875 1.737 -2.193 1.00 0.00 H new ATOM 0 HA THR A 68 15.219 -0.301 -1.657 1.00 0.00 H new ATOM 0 HB THR A 68 16.142 1.711 0.431 1.00 0.00 H new ATOM 0 HG1 THR A 68 18.074 0.383 0.462 1.00 0.00 H new ATOM 0 HG21 THR A 68 16.278 -0.264 1.901 1.00 0.00 H new ATOM 0 HG22 THR A 68 14.624 -0.007 1.296 1.00 0.00 H new ATOM 0 HG23 THR A 68 15.644 -1.281 0.586 1.00 0.00 H new ATOM 1040 N LEU A 69 13.702 2.528 -1.031 1.00 0.00 N ATOM 1041 CA LEU A 69 12.414 3.138 -0.717 1.00 0.00 C ATOM 1042 C LEU A 69 11.502 3.143 -1.940 1.00 0.00 C ATOM 1043 O LEU A 69 10.489 2.445 -1.974 1.00 0.00 O ATOM 1044 CB LEU A 69 12.614 4.567 -0.209 1.00 0.00 C ATOM 1045 CG LEU A 69 11.581 5.072 0.798 1.00 0.00 C ATOM 1046 CD1 LEU A 69 11.487 4.128 1.986 1.00 0.00 C ATOM 1047 CD2 LEU A 69 11.929 6.480 1.259 1.00 0.00 C ATOM 0 H LEU A 69 14.416 3.187 -1.343 1.00 0.00 H new ATOM 0 HA LEU A 69 11.940 2.545 0.065 1.00 0.00 H new ATOM 0 HB2 LEU A 69 13.601 4.634 0.249 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.615 5.239 -1.067 1.00 0.00 H new ATOM 0 HG LEU A 69 10.608 5.102 0.307 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.747 4.504 2.692 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.189 3.138 1.641 1.00 0.00 H new ATOM 0 HD13 LEU A 69 12.458 4.064 2.478 1.00 0.00 H new ATOM 0 HD21 LEU A 69 11.183 6.823 1.975 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.911 6.476 1.732 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.943 7.151 0.400 1.00 0.00 H new ATOM 1059 N TRP A 70 11.870 3.933 -2.942 1.00 0.00 N ATOM 1060 CA TRP A 70 11.086 4.028 -4.168 1.00 0.00 C ATOM 1061 C TRP A 70 10.637 2.648 -4.635 1.00 0.00 C ATOM 1062 O TRP A 70 9.460 2.432 -4.921 1.00 0.00 O ATOM 1063 CB TRP A 70 11.900 4.712 -5.267 1.00 0.00 C ATOM 1064 CG TRP A 70 11.087 5.067 -6.475 1.00 0.00 C ATOM 1065 CD1 TRP A 70 11.005 4.365 -7.644 1.00 0.00 C ATOM 1066 CD2 TRP A 70 10.242 6.212 -6.633 1.00 0.00 C ATOM 1067 NE1 TRP A 70 10.161 5.004 -8.519 1.00 0.00 N ATOM 1068 CE2 TRP A 70 9.679 6.140 -7.923 1.00 0.00 C ATOM 1069 CE3 TRP A 70 9.905 7.291 -5.811 1.00 0.00 C ATOM 1070 CZ2 TRP A 70 8.800 7.105 -8.406 1.00 0.00 C ATOM 1071 CZ3 TRP A 70 9.033 8.248 -6.293 1.00 0.00 C ATOM 1072 CH2 TRP A 70 8.487 8.150 -7.580 1.00 0.00 C ATOM 0 H TRP A 70 12.706 4.517 -2.930 1.00 0.00 H new ATOM 0 HA TRP A 70 10.199 4.626 -3.957 1.00 0.00 H new ATOM 0 HB2 TRP A 70 12.353 5.618 -4.864 1.00 0.00 H new ATOM 0 HB3 TRP A 70 12.716 4.055 -5.567 1.00 0.00 H new ATOM 0 HD1 TRP A 70 11.527 3.442 -7.850 1.00 0.00 H new ATOM 0 HE1 TRP A 70 9.930 4.685 -9.460 1.00 0.00 H new ATOM 0 HE3 TRP A 70 10.319 7.375 -4.817 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 8.380 7.032 -9.398 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 8.767 9.087 -5.667 1.00 0.00 H new ATOM 0 HH2 TRP A 70 7.806 8.914 -7.926 1.00 0.00 H new ATOM 1083 N GLU A 71 11.583 1.717 -4.710 1.00 0.00 N ATOM 1084 CA GLU A 71 11.284 0.357 -5.144 1.00 0.00 C ATOM 1085 C GLU A 71 10.079 -0.201 -4.391 1.00 0.00 C ATOM 1086 O GLU A 71 9.007 -0.386 -4.964 1.00 0.00 O ATOM 1087 CB GLU A 71 12.498 -0.549 -4.931 1.00 0.00 C ATOM 1088 CG GLU A 71 13.667 -0.226 -5.845 1.00 0.00 C ATOM 1089 CD GLU A 71 14.505 -1.446 -6.174 1.00 0.00 C ATOM 1090 OE1 GLU A 71 14.050 -2.278 -6.986 1.00 0.00 O ATOM 1091 OE2 GLU A 71 15.617 -1.569 -5.618 1.00 0.00 O ATOM 0 H GLU A 71 12.562 1.879 -4.476 1.00 0.00 H new ATOM 0 HA GLU A 71 11.045 0.386 -6.207 1.00 0.00 H new ATOM 0 HB2 GLU A 71 12.825 -0.466 -3.894 1.00 0.00 H new ATOM 0 HB3 GLU A 71 12.199 -1.585 -5.090 1.00 0.00 H new ATOM 0 HG2 GLU A 71 13.290 0.211 -6.770 1.00 0.00 H new ATOM 0 HG3 GLU A 71 14.297 0.526 -5.370 1.00 0.00 H new ATOM 1098 N ASN A 72 10.267 -0.468 -3.102 1.00 0.00 N ATOM 1099 CA ASN A 72 9.197 -1.007 -2.270 1.00 0.00 C ATOM 1100 C ASN A 72 7.922 -0.183 -2.423 1.00 0.00 C ATOM 1101 O ASN A 72 6.858 -0.718 -2.738 1.00 0.00 O ATOM 1102 CB ASN A 72 9.628 -1.032 -0.802 1.00 0.00 C ATOM 1103 CG ASN A 72 10.758 -2.011 -0.548 1.00 0.00 C ATOM 1104 OD1 ASN A 72 10.795 -3.096 -1.128 1.00 0.00 O ATOM 1105 ND2 ASN A 72 11.685 -1.631 0.323 1.00 0.00 N ATOM 0 H ASN A 72 11.149 -0.320 -2.612 1.00 0.00 H new ATOM 0 HA ASN A 72 8.992 -2.026 -2.599 1.00 0.00 H new ATOM 0 HB2 ASN A 72 9.942 -0.033 -0.501 1.00 0.00 H new ATOM 0 HB3 ASN A 72 8.774 -1.298 -0.180 1.00 0.00 H new ATOM 0 HD21 ASN A 72 12.469 -2.248 0.535 1.00 0.00 H new ATOM 0 HD22 ASN A 72 11.613 -0.722 0.780 1.00 0.00 H new ATOM 1112 N LEU A 73 8.036 1.122 -2.199 1.00 0.00 N ATOM 1113 CA LEU A 73 6.893 2.021 -2.313 1.00 0.00 C ATOM 1114 C LEU A 73 6.242 1.902 -3.687 1.00 0.00 C ATOM 1115 O LEU A 73 5.080 2.270 -3.868 1.00 0.00 O ATOM 1116 CB LEU A 73 7.329 3.466 -2.065 1.00 0.00 C ATOM 1117 CG LEU A 73 7.512 3.870 -0.602 1.00 0.00 C ATOM 1118 CD1 LEU A 73 7.710 5.374 -0.484 1.00 0.00 C ATOM 1119 CD2 LEU A 73 6.318 3.422 0.229 1.00 0.00 C ATOM 0 H LEU A 73 8.909 1.581 -1.937 1.00 0.00 H new ATOM 0 HA LEU A 73 6.160 1.735 -1.559 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.270 3.635 -2.588 1.00 0.00 H new ATOM 0 HB3 LEU A 73 6.590 4.130 -2.515 1.00 0.00 H new ATOM 0 HG LEU A 73 8.404 3.375 -0.218 1.00 0.00 H new ATOM 0 HD11 LEU A 73 7.839 5.643 0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 73 8.596 5.669 -1.046 1.00 0.00 H new ATOM 0 HD13 LEU A 73 6.837 5.889 -0.886 1.00 0.00 H new ATOM 0 HD21 LEU A 73 6.466 3.718 1.268 1.00 0.00 H new ATOM 0 HD22 LEU A 73 5.411 3.889 -0.156 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.221 2.338 0.171 1.00 0.00 H new ATOM 1131 N CYS A 74 6.996 1.386 -4.651 1.00 0.00 N ATOM 1132 CA CYS A 74 6.491 1.217 -6.009 1.00 0.00 C ATOM 1133 C CYS A 74 5.469 0.087 -6.073 1.00 0.00 C ATOM 1134 O CYS A 74 4.374 0.255 -6.610 1.00 0.00 O ATOM 1135 CB CYS A 74 7.645 0.934 -6.972 1.00 0.00 C ATOM 1136 SG CYS A 74 7.275 1.318 -8.700 1.00 0.00 S ATOM 0 H CYS A 74 7.959 1.077 -4.518 1.00 0.00 H new ATOM 0 HA CYS A 74 5.999 2.143 -6.306 1.00 0.00 H new ATOM 0 HB2 CYS A 74 8.514 1.513 -6.660 1.00 0.00 H new ATOM 0 HB3 CYS A 74 7.918 -0.118 -6.895 1.00 0.00 H new ATOM 0 HG CYS A 74 8.312 1.048 -9.436 1.00 0.00 H new ATOM 1142 N THR A 75 5.836 -1.067 -5.523 1.00 0.00 N ATOM 1143 CA THR A 75 4.953 -2.226 -5.520 1.00 0.00 C ATOM 1144 C THR A 75 3.709 -1.968 -4.678 1.00 0.00 C ATOM 1145 O THR A 75 2.600 -2.345 -5.059 1.00 0.00 O ATOM 1146 CB THR A 75 5.671 -3.478 -4.983 1.00 0.00 C ATOM 1147 OG1 THR A 75 5.125 -4.655 -5.590 1.00 0.00 O ATOM 1148 CG2 THR A 75 5.537 -3.573 -3.471 1.00 0.00 C ATOM 0 H THR A 75 6.739 -1.223 -5.074 1.00 0.00 H new ATOM 0 HA THR A 75 4.658 -2.401 -6.555 1.00 0.00 H new ATOM 0 HB THR A 75 6.729 -3.398 -5.234 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.588 -5.446 -5.244 1.00 0.00 H new ATOM 0 HG21 THR A 75 6.052 -4.465 -3.115 1.00 0.00 H new ATOM 0 HG22 THR A 75 5.980 -2.690 -3.010 1.00 0.00 H new ATOM 0 HG23 THR A 75 4.482 -3.632 -3.202 1.00 0.00 H new ATOM 1156 N ILE A 76 3.899 -1.323 -3.532 1.00 0.00 N ATOM 1157 CA ILE A 76 2.791 -1.013 -2.637 1.00 0.00 C ATOM 1158 C ILE A 76 1.818 -0.034 -3.285 1.00 0.00 C ATOM 1159 O ILE A 76 0.617 -0.068 -3.018 1.00 0.00 O ATOM 1160 CB ILE A 76 3.291 -0.417 -1.308 1.00 0.00 C ATOM 1161 CG1 ILE A 76 4.370 -1.313 -0.696 1.00 0.00 C ATOM 1162 CG2 ILE A 76 2.132 -0.237 -0.339 1.00 0.00 C ATOM 1163 CD1 ILE A 76 4.833 -0.855 0.670 1.00 0.00 C ATOM 0 H ILE A 76 4.810 -1.005 -3.201 1.00 0.00 H new ATOM 0 HA ILE A 76 2.277 -1.953 -2.435 1.00 0.00 H new ATOM 0 HB ILE A 76 3.728 0.562 -1.507 1.00 0.00 H new ATOM 0 HG12 ILE A 76 3.985 -2.330 -0.618 1.00 0.00 H new ATOM 0 HG13 ILE A 76 5.227 -1.347 -1.369 1.00 0.00 H new ATOM 0 HG21 ILE A 76 2.501 0.185 0.596 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.394 0.437 -0.775 1.00 0.00 H new ATOM 0 HG23 ILE A 76 1.669 -1.204 -0.142 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.598 -1.537 1.042 1.00 0.00 H new ATOM 0 HD12 ILE A 76 5.248 0.150 0.595 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.987 -0.848 1.357 1.00 0.00 H new ATOM 1175 N ARG A 77 2.345 0.836 -4.141 1.00 0.00 N ATOM 1176 CA ARG A 77 1.522 1.825 -4.829 1.00 0.00 C ATOM 1177 C ARG A 77 0.589 1.152 -5.831 1.00 0.00 C ATOM 1178 O ARG A 77 -0.547 1.584 -6.023 1.00 0.00 O ATOM 1179 CB ARG A 77 2.407 2.846 -5.545 1.00 0.00 C ATOM 1180 CG ARG A 77 1.640 3.769 -6.477 1.00 0.00 C ATOM 1181 CD ARG A 77 1.088 4.977 -5.735 1.00 0.00 C ATOM 1182 NE ARG A 77 0.259 5.816 -6.597 1.00 0.00 N ATOM 1183 CZ ARG A 77 -0.036 7.083 -6.325 1.00 0.00 C ATOM 1184 NH1 ARG A 77 0.428 7.652 -5.221 1.00 0.00 N ATOM 1185 NH2 ARG A 77 -0.796 7.781 -7.158 1.00 0.00 N ATOM 0 H ARG A 77 3.337 0.876 -4.375 1.00 0.00 H new ATOM 0 HA ARG A 77 0.916 2.340 -4.084 1.00 0.00 H new ATOM 0 HB2 ARG A 77 2.929 3.447 -4.801 1.00 0.00 H new ATOM 0 HB3 ARG A 77 3.168 2.316 -6.118 1.00 0.00 H new ATOM 0 HG2 ARG A 77 2.296 4.103 -7.281 1.00 0.00 H new ATOM 0 HG3 ARG A 77 0.821 3.220 -6.941 1.00 0.00 H new ATOM 0 HD2 ARG A 77 0.499 4.641 -4.882 1.00 0.00 H new ATOM 0 HD3 ARG A 77 1.914 5.568 -5.339 1.00 0.00 H new ATOM 0 HE ARG A 77 -0.114 5.407 -7.454 1.00 0.00 H new ATOM 0 HH11 ARG A 77 1.013 7.117 -4.579 1.00 0.00 H new ATOM 0 HH12 ARG A 77 0.200 8.625 -5.014 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -1.154 7.345 -8.008 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -1.022 8.753 -6.949 1.00 0.00 H new ATOM 1199 N ARG A 78 1.078 0.093 -6.469 1.00 0.00 N ATOM 1200 CA ARG A 78 0.289 -0.637 -7.453 1.00 0.00 C ATOM 1201 C ARG A 78 -0.815 -1.443 -6.775 1.00 0.00 C ATOM 1202 O ARG A 78 -1.881 -1.663 -7.351 1.00 0.00 O ATOM 1203 CB ARG A 78 1.187 -1.569 -8.268 1.00 0.00 C ATOM 1204 CG ARG A 78 1.892 -0.879 -9.425 1.00 0.00 C ATOM 1205 CD ARG A 78 3.079 -1.690 -9.919 1.00 0.00 C ATOM 1206 NE ARG A 78 2.672 -2.757 -10.830 1.00 0.00 N ATOM 1207 CZ ARG A 78 2.297 -3.965 -10.426 1.00 0.00 C ATOM 1208 NH1 ARG A 78 2.277 -4.259 -9.133 1.00 0.00 N ATOM 1209 NH2 ARG A 78 1.940 -4.883 -11.315 1.00 0.00 N ATOM 0 H ARG A 78 2.017 -0.278 -6.322 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.173 0.089 -8.122 1.00 0.00 H new ATOM 0 HB2 ARG A 78 1.935 -2.008 -7.608 1.00 0.00 H new ATOM 0 HB3 ARG A 78 0.585 -2.390 -8.658 1.00 0.00 H new ATOM 0 HG2 ARG A 78 1.188 -0.728 -10.243 1.00 0.00 H new ATOM 0 HG3 ARG A 78 2.231 0.108 -9.109 1.00 0.00 H new ATOM 0 HD2 ARG A 78 3.783 -1.030 -10.425 1.00 0.00 H new ATOM 0 HD3 ARG A 78 3.603 -2.122 -9.066 1.00 0.00 H new ATOM 0 HE ARG A 78 2.676 -2.563 -11.831 1.00 0.00 H new ATOM 0 HH11 ARG A 78 2.550 -3.556 -8.446 1.00 0.00 H new ATOM 0 HH12 ARG A 78 1.988 -5.188 -8.826 1.00 0.00 H new ATOM 0 HH21 ARG A 78 1.953 -4.661 -12.311 1.00 0.00 H new ATOM 0 HH22 ARG A 78 1.652 -5.810 -11.003 1.00 0.00 H new ATOM 1223 N PHE A 79 -0.553 -1.881 -5.548 1.00 0.00 N ATOM 1224 CA PHE A 79 -1.524 -2.663 -4.792 1.00 0.00 C ATOM 1225 C PHE A 79 -2.781 -1.846 -4.510 1.00 0.00 C ATOM 1226 O PHE A 79 -3.897 -2.287 -4.786 1.00 0.00 O ATOM 1227 CB PHE A 79 -0.909 -3.144 -3.475 1.00 0.00 C ATOM 1228 CG PHE A 79 -1.739 -4.176 -2.767 1.00 0.00 C ATOM 1229 CD1 PHE A 79 -2.999 -3.859 -2.286 1.00 0.00 C ATOM 1230 CD2 PHE A 79 -1.260 -5.463 -2.583 1.00 0.00 C ATOM 1231 CE1 PHE A 79 -3.765 -4.806 -1.633 1.00 0.00 C ATOM 1232 CE2 PHE A 79 -2.022 -6.414 -1.931 1.00 0.00 C ATOM 1233 CZ PHE A 79 -3.276 -6.086 -1.457 1.00 0.00 C ATOM 0 H PHE A 79 0.324 -1.708 -5.056 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.802 -3.528 -5.393 1.00 0.00 H new ATOM 0 HB2 PHE A 79 0.079 -3.559 -3.675 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -0.768 -2.288 -2.815 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.387 -2.860 -2.423 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -0.280 -5.726 -2.953 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -4.745 -4.546 -1.261 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.636 -7.413 -1.793 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.874 -6.829 -0.949 1.00 0.00 H new ATOM 1243 N LEU A 80 -2.591 -0.652 -3.959 1.00 0.00 N ATOM 1244 CA LEU A 80 -3.709 0.229 -3.639 1.00 0.00 C ATOM 1245 C LEU A 80 -4.548 0.518 -4.880 1.00 0.00 C ATOM 1246 O LEU A 80 -5.769 0.640 -4.801 1.00 0.00 O ATOM 1247 CB LEU A 80 -3.196 1.540 -3.040 1.00 0.00 C ATOM 1248 CG LEU A 80 -2.232 1.406 -1.860 1.00 0.00 C ATOM 1249 CD1 LEU A 80 -1.683 2.768 -1.463 1.00 0.00 C ATOM 1250 CD2 LEU A 80 -2.925 0.744 -0.678 1.00 0.00 C ATOM 0 H LEU A 80 -1.674 -0.272 -3.725 1.00 0.00 H new ATOM 0 HA LEU A 80 -4.339 -0.276 -2.907 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.699 2.106 -3.827 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -4.054 2.129 -2.717 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.398 0.775 -2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.999 2.654 -0.622 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.150 3.206 -2.307 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -2.506 3.422 -1.175 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.224 0.657 0.152 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.778 1.349 -0.371 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.270 -0.249 -0.968 1.00 0.00 H new ATOM 1262 N ASN A 81 -3.882 0.624 -6.026 1.00 0.00 N ATOM 1263 CA ASN A 81 -4.566 0.897 -7.284 1.00 0.00 C ATOM 1264 C ASN A 81 -5.631 -0.159 -7.565 1.00 0.00 C ATOM 1265 O ASN A 81 -6.642 0.119 -8.212 1.00 0.00 O ATOM 1266 CB ASN A 81 -3.560 0.942 -8.436 1.00 0.00 C ATOM 1267 CG ASN A 81 -3.010 2.336 -8.670 1.00 0.00 C ATOM 1268 OD1 ASN A 81 -1.688 2.452 -8.703 1.00 0.00 O flip ATOM 1269 ND2 ASN A 81 -3.766 3.296 -8.819 1.00 0.00 N flip ATOM 0 H ASN A 81 -2.870 0.525 -6.109 1.00 0.00 H new ATOM 0 HA ASN A 81 -5.055 1.867 -7.199 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.736 0.261 -8.222 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -4.040 0.586 -9.348 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -4.776 3.159 -8.786 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -3.382 4.228 -8.976 1.00 0.00 H new ATOM 1276 N LEU A 82 -5.398 -1.371 -7.073 1.00 0.00 N ATOM 1277 CA LEU A 82 -6.337 -2.470 -7.270 1.00 0.00 C ATOM 1278 C LEU A 82 -7.699 -2.137 -6.668 1.00 0.00 C ATOM 1279 O LEU A 82 -7.806 -1.417 -5.675 1.00 0.00 O ATOM 1280 CB LEU A 82 -5.790 -3.753 -6.643 1.00 0.00 C ATOM 1281 CG LEU A 82 -4.482 -4.283 -7.233 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -3.963 -5.455 -6.414 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -4.679 -4.692 -8.686 1.00 0.00 C ATOM 0 H LEU A 82 -4.567 -1.617 -6.535 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.461 -2.621 -8.342 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -5.640 -3.578 -5.578 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.548 -4.531 -6.735 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.741 -3.485 -7.198 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.032 -5.819 -6.849 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.783 -5.131 -5.389 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.702 -6.256 -6.417 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.738 -5.067 -9.089 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.436 -5.474 -8.744 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.004 -3.828 -9.266 1.00 0.00 H new ATOM 1295 N PRO A 83 -8.764 -2.675 -7.279 1.00 0.00 N ATOM 1296 CA PRO A 83 -10.138 -2.451 -6.819 1.00 0.00 C ATOM 1297 C PRO A 83 -10.425 -3.147 -5.493 1.00 0.00 C ATOM 1298 O PRO A 83 -9.832 -4.180 -5.183 1.00 0.00 O ATOM 1299 CB PRO A 83 -10.990 -3.058 -7.937 1.00 0.00 C ATOM 1300 CG PRO A 83 -10.111 -4.080 -8.571 1.00 0.00 C ATOM 1301 CD PRO A 83 -8.710 -3.543 -8.468 1.00 0.00 C ATOM 0 HA PRO A 83 -10.340 -1.396 -6.636 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -11.900 -3.509 -7.541 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -11.298 -2.299 -8.657 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -10.199 -5.040 -8.062 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -10.391 -4.244 -9.612 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -7.980 -4.344 -8.348 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -8.427 -2.985 -9.360 1.00 0.00 H new ATOM 1309 N GLN A 84 -11.339 -2.574 -4.716 1.00 0.00 N ATOM 1310 CA GLN A 84 -11.704 -3.141 -3.423 1.00 0.00 C ATOM 1311 C GLN A 84 -11.955 -4.641 -3.536 1.00 0.00 C ATOM 1312 O GLN A 84 -11.514 -5.420 -2.691 1.00 0.00 O ATOM 1313 CB GLN A 84 -12.948 -2.444 -2.870 1.00 0.00 C ATOM 1314 CG GLN A 84 -13.197 -2.721 -1.396 1.00 0.00 C ATOM 1315 CD GLN A 84 -12.039 -2.289 -0.518 1.00 0.00 C ATOM 1316 OE1 GLN A 84 -10.978 -2.914 -0.518 1.00 0.00 O ATOM 1317 NE2 GLN A 84 -12.237 -1.215 0.237 1.00 0.00 N ATOM 0 H GLN A 84 -11.839 -1.719 -4.959 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.872 -2.982 -2.738 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -12.847 -1.369 -3.017 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -13.818 -2.764 -3.443 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -14.101 -2.201 -1.080 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.377 -3.787 -1.256 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -13.132 -0.727 0.205 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -11.494 -0.877 0.849 1.00 0.00 H new ATOM 1326 N HIS A 85 -12.666 -5.038 -4.587 1.00 0.00 N ATOM 1327 CA HIS A 85 -12.976 -6.446 -4.811 1.00 0.00 C ATOM 1328 C HIS A 85 -11.698 -7.263 -4.978 1.00 0.00 C ATOM 1329 O HIS A 85 -11.672 -8.457 -4.681 1.00 0.00 O ATOM 1330 CB HIS A 85 -13.861 -6.604 -6.048 1.00 0.00 C ATOM 1331 CG HIS A 85 -13.089 -6.798 -7.317 1.00 0.00 C ATOM 1332 ND1 HIS A 85 -12.820 -5.773 -8.198 1.00 0.00 N ATOM 1333 CD2 HIS A 85 -12.527 -7.908 -7.849 1.00 0.00 C ATOM 1334 CE1 HIS A 85 -12.127 -6.244 -9.219 1.00 0.00 C ATOM 1335 NE2 HIS A 85 -11.935 -7.537 -9.032 1.00 0.00 N ATOM 0 H HIS A 85 -13.038 -4.406 -5.296 1.00 0.00 H new ATOM 0 HA HIS A 85 -13.513 -6.818 -3.939 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -14.525 -7.456 -5.903 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -14.492 -5.721 -6.148 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -12.541 -8.900 -7.423 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -11.777 -5.669 -10.064 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -11.430 -8.159 -9.663 1.00 0.00 H new ATOM 1344 N GLU A 86 -10.642 -6.612 -5.456 1.00 0.00 N ATOM 1345 CA GLU A 86 -9.363 -7.280 -5.663 1.00 0.00 C ATOM 1346 C GLU A 86 -8.571 -7.355 -4.361 1.00 0.00 C ATOM 1347 O GLU A 86 -8.356 -8.437 -3.815 1.00 0.00 O ATOM 1348 CB GLU A 86 -8.546 -6.546 -6.728 1.00 0.00 C ATOM 1349 CG GLU A 86 -8.787 -7.056 -8.139 1.00 0.00 C ATOM 1350 CD GLU A 86 -7.836 -8.172 -8.527 1.00 0.00 C ATOM 1351 OE1 GLU A 86 -6.680 -7.868 -8.890 1.00 0.00 O ATOM 1352 OE2 GLU A 86 -8.248 -9.349 -8.466 1.00 0.00 O ATOM 0 H GLU A 86 -10.647 -5.623 -5.707 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.564 -8.295 -6.005 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -8.785 -5.483 -6.689 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -7.486 -6.643 -6.492 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -9.813 -7.413 -8.222 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -8.679 -6.231 -8.843 1.00 0.00 H new ATOM 1359 N ARG A 87 -8.139 -6.198 -3.870 1.00 0.00 N ATOM 1360 CA ARG A 87 -7.370 -6.132 -2.634 1.00 0.00 C ATOM 1361 C ARG A 87 -7.970 -7.047 -1.571 1.00 0.00 C ATOM 1362 O ARG A 87 -7.250 -7.774 -0.885 1.00 0.00 O ATOM 1363 CB ARG A 87 -7.320 -4.694 -2.115 1.00 0.00 C ATOM 1364 CG ARG A 87 -6.702 -3.713 -3.098 1.00 0.00 C ATOM 1365 CD ARG A 87 -6.368 -2.389 -2.428 1.00 0.00 C ATOM 1366 NE ARG A 87 -7.478 -1.444 -2.500 1.00 0.00 N ATOM 1367 CZ ARG A 87 -8.498 -1.442 -1.650 1.00 0.00 C ATOM 1368 NH1 ARG A 87 -8.549 -2.332 -0.668 1.00 0.00 N ATOM 1369 NH2 ARG A 87 -9.471 -0.549 -1.780 1.00 0.00 N ATOM 0 H ARG A 87 -8.309 -5.293 -4.310 1.00 0.00 H new ATOM 0 HA ARG A 87 -6.356 -6.469 -2.849 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.332 -4.367 -1.877 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -6.751 -4.672 -1.186 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -5.797 -4.145 -3.524 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -7.392 -3.540 -3.924 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -6.110 -2.566 -1.384 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -5.490 -1.953 -2.904 1.00 0.00 H new ATOM 0 HE ARG A 87 -7.470 -0.747 -3.244 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -7.803 -3.020 -0.564 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -9.334 -2.328 -0.016 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -9.436 0.137 -2.534 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -10.254 -0.549 -1.126 1.00 0.00 H new ATOM 1383 N ASP A 88 -9.291 -7.006 -1.439 1.00 0.00 N ATOM 1384 CA ASP A 88 -9.988 -7.831 -0.460 1.00 0.00 C ATOM 1385 C ASP A 88 -9.666 -9.308 -0.666 1.00 0.00 C ATOM 1386 O ASP A 88 -9.444 -10.045 0.295 1.00 0.00 O ATOM 1387 CB ASP A 88 -11.498 -7.608 -0.556 1.00 0.00 C ATOM 1388 CG ASP A 88 -12.246 -8.186 0.630 1.00 0.00 C ATOM 1389 OD1 ASP A 88 -11.908 -7.825 1.777 1.00 0.00 O ATOM 1390 OD2 ASP A 88 -13.168 -8.999 0.412 1.00 0.00 O ATOM 0 H ASP A 88 -9.901 -6.410 -1.998 1.00 0.00 H new ATOM 0 HA ASP A 88 -9.647 -7.538 0.533 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -11.701 -6.539 -0.624 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -11.872 -8.062 -1.474 1.00 0.00 H new ATOM 1395 N VAL A 89 -9.642 -9.733 -1.925 1.00 0.00 N ATOM 1396 CA VAL A 89 -9.347 -11.122 -2.257 1.00 0.00 C ATOM 1397 C VAL A 89 -7.957 -11.519 -1.772 1.00 0.00 C ATOM 1398 O VAL A 89 -7.777 -12.581 -1.174 1.00 0.00 O ATOM 1399 CB VAL A 89 -9.439 -11.368 -3.775 1.00 0.00 C ATOM 1400 CG1 VAL A 89 -9.138 -12.823 -4.100 1.00 0.00 C ATOM 1401 CG2 VAL A 89 -10.811 -10.969 -4.296 1.00 0.00 C ATOM 0 H VAL A 89 -9.823 -9.136 -2.732 1.00 0.00 H new ATOM 0 HA VAL A 89 -10.094 -11.734 -1.752 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.692 -10.749 -4.272 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -9.208 -12.977 -5.177 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -8.132 -13.071 -3.763 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -9.859 -13.465 -3.594 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -10.859 -11.149 -5.370 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -11.577 -11.560 -3.794 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -10.982 -9.911 -4.098 1.00 0.00 H new ATOM 1411 N ILE A 90 -6.977 -10.661 -2.033 1.00 0.00 N ATOM 1412 CA ILE A 90 -5.604 -10.921 -1.622 1.00 0.00 C ATOM 1413 C ILE A 90 -5.515 -11.155 -0.118 1.00 0.00 C ATOM 1414 O ILE A 90 -4.950 -12.151 0.334 1.00 0.00 O ATOM 1415 CB ILE A 90 -4.671 -9.758 -2.006 1.00 0.00 C ATOM 1416 CG1 ILE A 90 -4.647 -9.573 -3.524 1.00 0.00 C ATOM 1417 CG2 ILE A 90 -3.267 -10.008 -1.476 1.00 0.00 C ATOM 1418 CD1 ILE A 90 -4.276 -8.172 -3.957 1.00 0.00 C ATOM 0 H ILE A 90 -7.109 -9.779 -2.528 1.00 0.00 H new ATOM 0 HA ILE A 90 -5.283 -11.821 -2.147 1.00 0.00 H new ATOM 0 HB ILE A 90 -5.052 -8.843 -1.554 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -3.937 -10.278 -3.956 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -5.629 -9.821 -3.928 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -2.619 -9.177 -1.756 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -3.298 -10.094 -0.390 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.876 -10.932 -1.902 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -4.279 -8.115 -5.045 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -4.999 -7.463 -3.554 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.282 -7.927 -3.584 1.00 0.00 H new ATOM 1430 N TYR A 91 -6.079 -10.231 0.653 1.00 0.00 N ATOM 1431 CA TYR A 91 -6.063 -10.336 2.107 1.00 0.00 C ATOM 1432 C TYR A 91 -6.730 -11.628 2.567 1.00 0.00 C ATOM 1433 O TYR A 91 -6.208 -12.336 3.428 1.00 0.00 O ATOM 1434 CB TYR A 91 -6.771 -9.133 2.733 1.00 0.00 C ATOM 1435 CG TYR A 91 -6.235 -7.801 2.259 1.00 0.00 C ATOM 1436 CD1 TYR A 91 -4.875 -7.523 2.297 1.00 0.00 C ATOM 1437 CD2 TYR A 91 -7.090 -6.820 1.771 1.00 0.00 C ATOM 1438 CE1 TYR A 91 -4.381 -6.307 1.865 1.00 0.00 C ATOM 1439 CE2 TYR A 91 -6.606 -5.602 1.335 1.00 0.00 C ATOM 1440 CZ TYR A 91 -5.250 -5.350 1.385 1.00 0.00 C ATOM 1441 OH TYR A 91 -4.763 -4.138 0.953 1.00 0.00 O ATOM 0 H TYR A 91 -6.553 -9.402 0.295 1.00 0.00 H new ATOM 0 HA TYR A 91 -5.023 -10.349 2.434 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -7.835 -9.189 2.504 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -6.674 -9.189 3.817 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -4.191 -8.271 2.671 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -8.152 -7.013 1.732 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -3.320 -6.107 1.903 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -7.285 -4.851 0.957 1.00 0.00 H new ATOM 0 HH TYR A 91 -4.092 -4.285 0.254 1.00 0.00 H new ATOM 1451 N GLU A 92 -7.887 -11.929 1.986 1.00 0.00 N ATOM 1452 CA GLU A 92 -8.626 -13.136 2.337 1.00 0.00 C ATOM 1453 C GLU A 92 -7.777 -14.382 2.100 1.00 0.00 C ATOM 1454 O GLU A 92 -7.510 -15.148 3.026 1.00 0.00 O ATOM 1455 CB GLU A 92 -9.918 -13.225 1.523 1.00 0.00 C ATOM 1456 CG GLU A 92 -10.983 -12.232 1.960 1.00 0.00 C ATOM 1457 CD GLU A 92 -12.390 -12.745 1.725 1.00 0.00 C ATOM 1458 OE1 GLU A 92 -12.710 -13.089 0.568 1.00 0.00 O ATOM 1459 OE2 GLU A 92 -13.172 -12.801 2.697 1.00 0.00 O ATOM 0 H GLU A 92 -8.333 -11.354 1.271 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.875 -13.083 3.397 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -9.687 -13.058 0.471 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -10.320 -14.235 1.604 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -10.854 -12.009 3.019 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -10.846 -11.296 1.418 1.00 0.00 H new ATOM 1466 N GLU A 93 -7.357 -14.577 0.854 1.00 0.00 N ATOM 1467 CA GLU A 93 -6.539 -15.730 0.496 1.00 0.00 C ATOM 1468 C GLU A 93 -5.308 -15.824 1.393 1.00 0.00 C ATOM 1469 O GLU A 93 -4.946 -16.906 1.854 1.00 0.00 O ATOM 1470 CB GLU A 93 -6.109 -15.643 -0.970 1.00 0.00 C ATOM 1471 CG GLU A 93 -7.266 -15.746 -1.950 1.00 0.00 C ATOM 1472 CD GLU A 93 -7.582 -17.179 -2.331 1.00 0.00 C ATOM 1473 OE1 GLU A 93 -6.676 -18.033 -2.234 1.00 0.00 O ATOM 1474 OE2 GLU A 93 -8.736 -17.446 -2.726 1.00 0.00 O ATOM 0 H GLU A 93 -7.569 -13.952 0.076 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.141 -16.628 0.638 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.589 -14.699 -1.132 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.395 -16.440 -1.179 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.152 -15.287 -1.510 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -7.027 -15.179 -2.850 1.00 0.00 H new ATOM 1481 N GLU A 94 -4.671 -14.683 1.636 1.00 0.00 N ATOM 1482 CA GLU A 94 -3.481 -14.637 2.477 1.00 0.00 C ATOM 1483 C GLU A 94 -3.807 -15.064 3.905 1.00 0.00 C ATOM 1484 O GLU A 94 -3.381 -16.125 4.360 1.00 0.00 O ATOM 1485 CB GLU A 94 -2.883 -13.229 2.477 1.00 0.00 C ATOM 1486 CG GLU A 94 -1.676 -13.080 3.388 1.00 0.00 C ATOM 1487 CD GLU A 94 -0.501 -13.928 2.943 1.00 0.00 C ATOM 1488 OE1 GLU A 94 -0.123 -13.841 1.756 1.00 0.00 O ATOM 1489 OE2 GLU A 94 0.041 -14.679 3.780 1.00 0.00 O ATOM 0 H GLU A 94 -4.959 -13.779 1.263 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.750 -15.334 2.066 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -2.594 -12.966 1.459 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -3.650 -12.518 2.784 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.374 -12.033 3.416 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.956 -13.358 4.404 1.00 0.00 H new ATOM 1496 N SER A 95 -4.565 -14.228 4.607 1.00 0.00 N ATOM 1497 CA SER A 95 -4.945 -14.515 5.986 1.00 0.00 C ATOM 1498 C SER A 95 -6.414 -14.919 6.071 1.00 0.00 C ATOM 1499 O SER A 95 -7.276 -14.302 5.446 1.00 0.00 O ATOM 1500 CB SER A 95 -4.687 -13.295 6.873 1.00 0.00 C ATOM 1501 OG SER A 95 -4.493 -13.679 8.223 1.00 0.00 O ATOM 0 H SER A 95 -4.928 -13.347 4.244 1.00 0.00 H new ATOM 0 HA SER A 95 -4.336 -15.347 6.340 1.00 0.00 H new ATOM 0 HB2 SER A 95 -3.808 -12.760 6.514 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.530 -12.607 6.805 1.00 0.00 H new ATOM 0 HG SER A 95 -4.328 -12.882 8.769 1.00 0.00 H new ATOM 1507 N SER A 96 -6.690 -15.960 6.850 1.00 0.00 N ATOM 1508 CA SER A 96 -8.053 -16.450 7.015 1.00 0.00 C ATOM 1509 C SER A 96 -8.407 -16.584 8.493 1.00 0.00 C ATOM 1510 O SER A 96 -8.058 -17.570 9.140 1.00 0.00 O ATOM 1511 CB SER A 96 -8.221 -17.801 6.315 1.00 0.00 C ATOM 1512 OG SER A 96 -7.386 -18.785 6.900 1.00 0.00 O ATOM 0 H SER A 96 -5.988 -16.480 7.376 1.00 0.00 H new ATOM 0 HA SER A 96 -8.730 -15.726 6.561 1.00 0.00 H new ATOM 0 HB2 SER A 96 -9.262 -18.119 6.377 1.00 0.00 H new ATOM 0 HB3 SER A 96 -7.981 -17.698 5.257 1.00 0.00 H new ATOM 0 HG SER A 96 -7.364 -18.659 7.872 1.00 0.00 H new ATOM 1518 N GLY A 97 -9.103 -15.581 9.022 1.00 0.00 N ATOM 1519 CA GLY A 97 -9.493 -15.605 10.419 1.00 0.00 C ATOM 1520 C GLY A 97 -10.929 -16.051 10.613 1.00 0.00 C ATOM 1521 O GLY A 97 -11.777 -15.886 9.736 1.00 0.00 O ATOM 0 H GLY A 97 -9.403 -14.753 8.507 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -8.831 -16.276 10.966 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -9.364 -14.611 10.846 1.00 0.00 H new ATOM 1525 N PRO A 98 -11.219 -16.632 11.786 1.00 0.00 N ATOM 1526 CA PRO A 98 -12.562 -17.117 12.120 1.00 0.00 C ATOM 1527 C PRO A 98 -13.554 -15.978 12.328 1.00 0.00 C ATOM 1528 O PRO A 98 -14.746 -16.123 12.058 1.00 0.00 O ATOM 1529 CB PRO A 98 -12.347 -17.885 13.426 1.00 0.00 C ATOM 1530 CG PRO A 98 -11.132 -17.272 14.031 1.00 0.00 C ATOM 1531 CD PRO A 98 -10.258 -16.862 12.878 1.00 0.00 C ATOM 0 HA PRO A 98 -12.988 -17.722 11.320 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -13.209 -17.791 14.087 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -12.203 -18.949 13.240 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -11.394 -16.412 14.647 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -10.617 -17.982 14.678 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -9.687 -15.962 13.107 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -9.538 -17.640 12.623 1.00 0.00 H new ATOM 1539 N SER A 99 -13.054 -14.844 12.810 1.00 0.00 N ATOM 1540 CA SER A 99 -13.897 -13.681 13.057 1.00 0.00 C ATOM 1541 C SER A 99 -14.276 -12.996 11.748 1.00 0.00 C ATOM 1542 O SER A 99 -13.672 -11.995 11.361 1.00 0.00 O ATOM 1543 CB SER A 99 -13.179 -12.690 13.976 1.00 0.00 C ATOM 1544 OG SER A 99 -13.881 -11.461 14.048 1.00 0.00 O ATOM 0 H SER A 99 -12.069 -14.707 13.037 1.00 0.00 H new ATOM 0 HA SER A 99 -14.810 -14.022 13.545 1.00 0.00 H new ATOM 0 HB2 SER A 99 -13.085 -13.118 14.974 1.00 0.00 H new ATOM 0 HB3 SER A 99 -12.168 -12.514 13.608 1.00 0.00 H new ATOM 0 HG SER A 99 -13.403 -10.846 14.642 1.00 0.00 H new ATOM 1550 N SER A 100 -15.280 -13.542 11.070 1.00 0.00 N ATOM 1551 CA SER A 100 -15.737 -12.987 9.801 1.00 0.00 C ATOM 1552 C SER A 100 -16.289 -11.578 9.993 1.00 0.00 C ATOM 1553 O SER A 100 -17.398 -11.396 10.495 1.00 0.00 O ATOM 1554 CB SER A 100 -16.809 -13.887 9.184 1.00 0.00 C ATOM 1555 OG SER A 100 -17.870 -14.116 10.095 1.00 0.00 O ATOM 0 H SER A 100 -15.793 -14.368 11.378 1.00 0.00 H new ATOM 0 HA SER A 100 -14.883 -12.935 9.126 1.00 0.00 H new ATOM 0 HB2 SER A 100 -17.198 -13.425 8.277 1.00 0.00 H new ATOM 0 HB3 SER A 100 -16.365 -14.839 8.892 1.00 0.00 H new ATOM 0 HG SER A 100 -18.090 -13.281 10.558 1.00 0.00 H new ATOM 1561 N GLY A 101 -15.506 -10.582 9.588 1.00 0.00 N ATOM 1562 CA GLY A 101 -15.932 -9.201 9.723 1.00 0.00 C ATOM 1563 C GLY A 101 -14.771 -8.256 9.958 1.00 0.00 C ATOM 1564 O GLY A 101 -14.631 -7.692 11.043 1.00 0.00 O ATOM 0 H GLY A 101 -14.585 -10.707 9.169 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -16.465 -8.899 8.822 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -16.635 -9.120 10.552 1.00 0.00 H new TER 1568 GLY A 101