USER MOD reduce.3.24.130724 H: found=0, std=0, add=810, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 808 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 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 180:sc= 0 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 14 SER OG : rot 57:sc= 0.519 USER MOD Single : A 15 SER OG : rot -40:sc= 1.22 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.382 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN :FLIP amide:sc= -0.478 F(o=-2.1,f=-0.48) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot -4:sc= 0.807 USER MOD Single : A 48 THR OG1 : rot -120:sc= -1.22 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 106:sc= 0.499 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 158:sc= -0.304 (180deg=-1.08) USER MOD Single : A 71 CYS SG : rot 180:sc= -0.974 USER MOD Single : A 78 ASN : amide:sc= -1.14 K(o=-1.1,f=-7.6!) USER MOD Single : A 82 TYR OH : rot 180:sc= -0.0727 USER MOD Single : A 83 MET CE :methyl -138:sc= -0.825 (180deg=-1.67!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 92 GLN : amide:sc= -6.38! C(o=-6.4!,f=-6.6!) USER MOD Single : A 97 LYS NZ :NH3+ 157:sc= -2.06 (180deg=-3.28!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 21.342 21.061 21.623 1.00 0.00 N ATOM 2 CA GLY A 1 21.452 19.623 21.794 1.00 0.00 C ATOM 3 C GLY A 1 20.081 18.995 22.050 1.00 0.00 C ATOM 4 O GLY A 1 19.591 19.002 23.178 1.00 0.00 O ATOM 0 H1 GLY A 1 22.285 21.463 21.451 1.00 0.00 H new ATOM 0 H2 GLY A 1 20.724 21.268 20.813 1.00 0.00 H new ATOM 0 H3 GLY A 1 20.938 21.483 22.483 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.898 19.180 20.903 1.00 0.00 H new ATOM 0 HA3 GLY A 1 22.119 19.402 22.628 1.00 0.00 H new ATOM 8 N SER A 2 19.499 18.466 20.983 1.00 0.00 N ATOM 9 CA SER A 2 18.194 17.835 21.078 1.00 0.00 C ATOM 10 C SER A 2 18.340 16.408 21.610 1.00 0.00 C ATOM 11 O SER A 2 19.315 15.724 21.303 1.00 0.00 O ATOM 12 CB SER A 2 17.487 17.826 19.721 1.00 0.00 C ATOM 13 OG SER A 2 16.578 18.914 19.586 1.00 0.00 O ATOM 0 H SER A 2 19.908 18.462 20.048 1.00 0.00 H new ATOM 0 HA SER A 2 17.584 18.414 21.772 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.230 17.873 18.925 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.948 16.886 19.599 1.00 0.00 H new ATOM 0 HG SER A 2 16.148 18.874 18.706 1.00 0.00 H new ATOM 19 N SER A 3 17.356 16.001 22.398 1.00 0.00 N ATOM 20 CA SER A 3 17.363 14.667 22.976 1.00 0.00 C ATOM 21 C SER A 3 16.213 13.841 22.397 1.00 0.00 C ATOM 22 O SER A 3 15.046 14.113 22.676 1.00 0.00 O ATOM 23 CB SER A 3 17.258 14.727 24.501 1.00 0.00 C ATOM 24 OG SER A 3 18.469 15.180 25.102 1.00 0.00 O ATOM 0 H SER A 3 16.549 16.571 22.650 1.00 0.00 H new ATOM 0 HA SER A 3 18.309 14.189 22.723 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.442 15.393 24.782 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.010 13.738 24.887 1.00 0.00 H new ATOM 0 HG SER A 3 18.361 15.206 26.076 1.00 0.00 H new ATOM 30 N GLY A 4 16.582 12.848 21.601 1.00 0.00 N ATOM 31 CA GLY A 4 15.596 11.979 20.981 1.00 0.00 C ATOM 32 C GLY A 4 14.906 12.682 19.810 1.00 0.00 C ATOM 33 O GLY A 4 14.907 13.910 19.730 1.00 0.00 O ATOM 0 H GLY A 4 17.551 12.626 21.371 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.079 11.067 20.629 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.853 11.681 21.720 1.00 0.00 H new ATOM 37 N SER A 5 14.333 11.874 18.931 1.00 0.00 N ATOM 38 CA SER A 5 13.641 12.402 17.768 1.00 0.00 C ATOM 39 C SER A 5 12.159 12.608 18.089 1.00 0.00 C ATOM 40 O SER A 5 11.589 11.880 18.900 1.00 0.00 O ATOM 41 CB SER A 5 13.798 11.473 16.563 1.00 0.00 C ATOM 42 OG SER A 5 13.254 12.041 15.375 1.00 0.00 O ATOM 0 H SER A 5 14.334 10.856 19.001 1.00 0.00 H new ATOM 0 HA SER A 5 14.088 13.363 17.512 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.855 11.255 16.409 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.303 10.524 16.770 1.00 0.00 H new ATOM 0 HG SER A 5 13.376 11.418 14.629 1.00 0.00 H new ATOM 48 N SER A 6 11.577 13.604 17.437 1.00 0.00 N ATOM 49 CA SER A 6 10.173 13.915 17.643 1.00 0.00 C ATOM 50 C SER A 6 9.299 12.937 16.854 1.00 0.00 C ATOM 51 O SER A 6 9.122 13.094 15.647 1.00 0.00 O ATOM 52 CB SER A 6 9.862 15.355 17.233 1.00 0.00 C ATOM 53 OG SER A 6 10.038 16.268 18.313 1.00 0.00 O ATOM 0 H SER A 6 12.053 14.206 16.765 1.00 0.00 H new ATOM 0 HA SER A 6 9.952 13.813 18.706 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.509 15.644 16.405 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.836 15.415 16.871 1.00 0.00 H new ATOM 0 HG SER A 6 9.831 17.177 18.010 1.00 0.00 H new ATOM 59 N GLY A 7 8.777 11.951 17.568 1.00 0.00 N ATOM 60 CA GLY A 7 7.927 10.948 16.949 1.00 0.00 C ATOM 61 C GLY A 7 6.613 10.793 17.719 1.00 0.00 C ATOM 62 O GLY A 7 6.300 9.708 18.206 1.00 0.00 O ATOM 0 H GLY A 7 8.926 11.825 18.569 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.717 11.230 15.917 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.450 9.992 16.918 1.00 0.00 H new ATOM 66 N PHE A 8 5.881 11.894 17.804 1.00 0.00 N ATOM 67 CA PHE A 8 4.609 11.894 18.506 1.00 0.00 C ATOM 68 C PHE A 8 3.440 11.989 17.523 1.00 0.00 C ATOM 69 O PHE A 8 2.530 11.163 17.553 1.00 0.00 O ATOM 70 CB PHE A 8 4.598 13.126 19.413 1.00 0.00 C ATOM 71 CG PHE A 8 4.082 12.853 20.827 1.00 0.00 C ATOM 72 CD1 PHE A 8 4.921 12.350 21.772 1.00 0.00 C ATOM 73 CD2 PHE A 8 2.784 13.113 21.139 1.00 0.00 C ATOM 74 CE1 PHE A 8 4.442 12.097 23.085 1.00 0.00 C ATOM 75 CE2 PHE A 8 2.305 12.859 22.452 1.00 0.00 C ATOM 76 CZ PHE A 8 3.144 12.357 23.397 1.00 0.00 C ATOM 0 H PHE A 8 6.144 12.792 17.398 1.00 0.00 H new ATOM 0 HA PHE A 8 4.498 10.970 19.073 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.610 13.526 19.477 1.00 0.00 H new ATOM 0 HB3 PHE A 8 3.979 13.897 18.954 1.00 0.00 H new ATOM 0 HD1 PHE A 8 5.952 12.143 21.524 1.00 0.00 H new ATOM 0 HD2 PHE A 8 2.118 13.512 20.389 1.00 0.00 H new ATOM 0 HE1 PHE A 8 5.108 11.698 23.836 1.00 0.00 H new ATOM 0 HE2 PHE A 8 1.274 13.065 22.700 1.00 0.00 H new ATOM 0 HZ PHE A 8 2.780 12.165 24.395 1.00 0.00 H new ATOM 86 N PHE A 9 3.504 13.005 16.674 1.00 0.00 N ATOM 87 CA PHE A 9 2.462 13.219 15.684 1.00 0.00 C ATOM 88 C PHE A 9 2.832 12.568 14.349 1.00 0.00 C ATOM 89 O PHE A 9 4.003 12.538 13.973 1.00 0.00 O ATOM 90 CB PHE A 9 2.339 14.731 15.484 1.00 0.00 C ATOM 91 CG PHE A 9 1.044 15.164 14.793 1.00 0.00 C ATOM 92 CD1 PHE A 9 -0.142 15.064 15.450 1.00 0.00 C ATOM 93 CD2 PHE A 9 1.080 15.649 13.523 1.00 0.00 C ATOM 94 CE1 PHE A 9 -1.344 15.466 14.809 1.00 0.00 C ATOM 95 CE2 PHE A 9 -0.121 16.051 12.883 1.00 0.00 C ATOM 96 CZ PHE A 9 -1.308 15.951 13.539 1.00 0.00 C ATOM 0 H PHE A 9 4.261 13.688 16.652 1.00 0.00 H new ATOM 0 HA PHE A 9 1.527 12.776 16.026 1.00 0.00 H new ATOM 0 HB2 PHE A 9 2.402 15.222 16.455 1.00 0.00 H new ATOM 0 HB3 PHE A 9 3.187 15.079 14.895 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -0.170 14.679 16.459 1.00 0.00 H new ATOM 0 HD2 PHE A 9 2.022 15.728 13.002 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -2.287 15.387 15.330 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -0.092 16.437 11.875 1.00 0.00 H new ATOM 0 HZ PHE A 9 -2.222 16.257 13.051 1.00 0.00 H new ATOM 106 N LYS A 10 1.812 12.065 13.670 1.00 0.00 N ATOM 107 CA LYS A 10 2.016 11.416 12.386 1.00 0.00 C ATOM 108 C LYS A 10 2.887 10.173 12.579 1.00 0.00 C ATOM 109 O LYS A 10 3.746 10.143 13.459 1.00 0.00 O ATOM 110 CB LYS A 10 2.579 12.410 11.368 1.00 0.00 C ATOM 111 CG LYS A 10 1.459 13.232 10.726 1.00 0.00 C ATOM 112 CD LYS A 10 1.691 13.396 9.223 1.00 0.00 C ATOM 113 CE LYS A 10 0.382 13.711 8.497 1.00 0.00 C ATOM 114 NZ LYS A 10 -0.287 12.461 8.070 1.00 0.00 N ATOM 0 H LYS A 10 0.842 12.094 13.984 1.00 0.00 H new ATOM 0 HA LYS A 10 1.065 11.077 11.975 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.288 13.076 11.859 1.00 0.00 H new ATOM 0 HB3 LYS A 10 3.129 11.873 10.596 1.00 0.00 H new ATOM 0 HG2 LYS A 10 0.500 12.743 10.898 1.00 0.00 H new ATOM 0 HG3 LYS A 10 1.406 14.213 11.199 1.00 0.00 H new ATOM 0 HD2 LYS A 10 2.410 14.196 9.048 1.00 0.00 H new ATOM 0 HD3 LYS A 10 2.126 12.483 8.817 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -0.278 14.278 9.154 1.00 0.00 H new ATOM 0 HE3 LYS A 10 0.583 14.338 7.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -1.174 12.692 7.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 0.338 11.935 7.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -0.496 11.876 8.904 1.00 0.00 H new ATOM 128 N GLY A 11 2.635 9.178 11.742 1.00 0.00 N ATOM 129 CA GLY A 11 3.386 7.935 11.809 1.00 0.00 C ATOM 130 C GLY A 11 2.694 6.833 11.004 1.00 0.00 C ATOM 131 O GLY A 11 3.230 6.363 10.001 1.00 0.00 O ATOM 0 H GLY A 11 1.921 9.207 11.014 1.00 0.00 H new ATOM 0 HA2 GLY A 11 4.394 8.093 11.424 1.00 0.00 H new ATOM 0 HA3 GLY A 11 3.487 7.622 12.848 1.00 0.00 H new ATOM 135 N ALA A 12 1.515 6.452 11.474 1.00 0.00 N ATOM 136 CA ALA A 12 0.745 5.414 10.810 1.00 0.00 C ATOM 137 C ALA A 12 1.476 4.077 10.947 1.00 0.00 C ATOM 138 O ALA A 12 2.392 3.785 10.180 1.00 0.00 O ATOM 139 CB ALA A 12 0.513 5.805 9.350 1.00 0.00 C ATOM 0 H ALA A 12 1.074 6.844 12.306 1.00 0.00 H new ATOM 0 HA ALA A 12 -0.234 5.304 11.277 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -0.065 5.026 8.852 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -0.035 6.746 9.308 1.00 0.00 H new ATOM 0 HB3 ALA A 12 1.473 5.922 8.848 1.00 0.00 H new ATOM 145 N ALA A 13 1.044 3.300 11.930 1.00 0.00 N ATOM 146 CA ALA A 13 1.646 2.001 12.177 1.00 0.00 C ATOM 147 C ALA A 13 0.887 1.298 13.304 1.00 0.00 C ATOM 148 O ALA A 13 1.451 1.028 14.363 1.00 0.00 O ATOM 149 CB ALA A 13 3.132 2.179 12.498 1.00 0.00 C ATOM 0 H ALA A 13 0.284 3.545 12.565 1.00 0.00 H new ATOM 0 HA ALA A 13 1.577 1.372 11.290 1.00 0.00 H new ATOM 0 HB1 ALA A 13 3.583 1.204 12.683 1.00 0.00 H new ATOM 0 HB2 ALA A 13 3.632 2.656 11.655 1.00 0.00 H new ATOM 0 HB3 ALA A 13 3.240 2.804 13.385 1.00 0.00 H new ATOM 155 N SER A 14 -0.381 1.021 13.037 1.00 0.00 N ATOM 156 CA SER A 14 -1.223 0.354 14.015 1.00 0.00 C ATOM 157 C SER A 14 -2.616 0.114 13.429 1.00 0.00 C ATOM 158 O SER A 14 -3.109 0.919 12.640 1.00 0.00 O ATOM 159 CB SER A 14 -1.324 1.172 15.304 1.00 0.00 C ATOM 160 OG SER A 14 -0.500 0.641 16.339 1.00 0.00 O ATOM 0 H SER A 14 -0.845 1.246 12.157 1.00 0.00 H new ATOM 0 HA SER A 14 -0.768 -0.606 14.260 1.00 0.00 H new ATOM 0 HB2 SER A 14 -1.034 2.203 15.103 1.00 0.00 H new ATOM 0 HB3 SER A 14 -2.361 1.192 15.640 1.00 0.00 H new ATOM 0 HG SER A 14 0.430 0.606 16.031 1.00 0.00 H new ATOM 166 N SER A 15 -3.211 -0.997 13.837 1.00 0.00 N ATOM 167 CA SER A 15 -4.538 -1.353 13.363 1.00 0.00 C ATOM 168 C SER A 15 -4.549 -1.408 11.834 1.00 0.00 C ATOM 169 O SER A 15 -3.607 -0.955 11.186 1.00 0.00 O ATOM 170 CB SER A 15 -5.588 -0.361 13.866 1.00 0.00 C ATOM 171 OG SER A 15 -5.681 0.788 13.028 1.00 0.00 O ATOM 0 H SER A 15 -2.799 -1.663 14.491 1.00 0.00 H new ATOM 0 HA SER A 15 -4.790 -2.337 13.758 1.00 0.00 H new ATOM 0 HB2 SER A 15 -6.559 -0.854 13.914 1.00 0.00 H new ATOM 0 HB3 SER A 15 -5.337 -0.051 14.880 1.00 0.00 H new ATOM 0 HG SER A 15 -4.783 1.061 12.746 1.00 0.00 H new ATOM 177 N VAL A 16 -5.625 -1.968 11.301 1.00 0.00 N ATOM 178 CA VAL A 16 -5.772 -2.089 9.861 1.00 0.00 C ATOM 179 C VAL A 16 -7.140 -1.546 9.444 1.00 0.00 C ATOM 180 O VAL A 16 -8.156 -1.883 10.051 1.00 0.00 O ATOM 181 CB VAL A 16 -5.548 -3.540 9.432 1.00 0.00 C ATOM 182 CG1 VAL A 16 -6.327 -4.504 10.329 1.00 0.00 C ATOM 183 CG2 VAL A 16 -5.918 -3.740 7.961 1.00 0.00 C ATOM 0 H VAL A 16 -6.404 -2.343 11.842 1.00 0.00 H new ATOM 0 HA VAL A 16 -5.017 -1.493 9.349 1.00 0.00 H new ATOM 0 HB VAL A 16 -4.487 -3.762 9.544 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -6.150 -5.529 10.002 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -5.995 -4.390 11.361 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.392 -4.281 10.264 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -5.749 -4.780 7.682 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -6.969 -3.490 7.813 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -5.300 -3.093 7.339 1.00 0.00 H new ATOM 193 N LEU A 17 -7.123 -0.716 8.412 1.00 0.00 N ATOM 194 CA LEU A 17 -8.350 -0.124 7.908 1.00 0.00 C ATOM 195 C LEU A 17 -9.126 -1.172 7.108 1.00 0.00 C ATOM 196 O LEU A 17 -8.605 -2.248 6.818 1.00 0.00 O ATOM 197 CB LEU A 17 -8.045 1.150 7.118 1.00 0.00 C ATOM 198 CG LEU A 17 -7.519 2.334 7.932 1.00 0.00 C ATOM 199 CD1 LEU A 17 -6.612 3.225 7.081 1.00 0.00 C ATOM 200 CD2 LEU A 17 -8.670 3.122 8.560 1.00 0.00 C ATOM 0 H LEU A 17 -6.279 -0.439 7.911 1.00 0.00 H new ATOM 0 HA LEU A 17 -8.990 0.186 8.734 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -7.312 0.910 6.348 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -8.955 1.463 6.605 1.00 0.00 H new ATOM 0 HG LEU A 17 -6.912 1.944 8.749 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.252 4.059 7.684 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.763 2.643 6.722 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -7.174 3.609 6.230 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.269 3.958 9.133 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -9.323 3.501 7.774 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -9.240 2.469 9.221 1.00 0.00 H new ATOM 212 N GLU A 18 -10.359 -0.822 6.773 1.00 0.00 N ATOM 213 CA GLU A 18 -11.212 -1.719 6.012 1.00 0.00 C ATOM 214 C GLU A 18 -11.445 -1.164 4.605 1.00 0.00 C ATOM 215 O GLU A 18 -11.988 -0.072 4.447 1.00 0.00 O ATOM 216 CB GLU A 18 -12.539 -1.958 6.734 1.00 0.00 C ATOM 217 CG GLU A 18 -13.600 -2.492 5.770 1.00 0.00 C ATOM 218 CD GLU A 18 -14.521 -3.495 6.468 1.00 0.00 C ATOM 219 OE1 GLU A 18 -13.973 -4.436 7.083 1.00 0.00 O ATOM 220 OE2 GLU A 18 -15.751 -3.299 6.371 1.00 0.00 O ATOM 0 H GLU A 18 -10.788 0.071 7.015 1.00 0.00 H new ATOM 0 HA GLU A 18 -10.707 -2.681 5.923 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -12.392 -2.668 7.548 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.886 -1.027 7.182 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -14.190 -1.664 5.378 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -13.115 -2.970 4.919 1.00 0.00 H new ATOM 227 N LEU A 19 -11.024 -1.942 3.619 1.00 0.00 N ATOM 228 CA LEU A 19 -11.180 -1.542 2.231 1.00 0.00 C ATOM 229 C LEU A 19 -12.668 -1.362 1.921 1.00 0.00 C ATOM 230 O LEU A 19 -13.511 -1.504 2.805 1.00 0.00 O ATOM 231 CB LEU A 19 -10.475 -2.534 1.305 1.00 0.00 C ATOM 232 CG LEU A 19 -8.949 -2.435 1.253 1.00 0.00 C ATOM 233 CD1 LEU A 19 -8.506 -1.125 0.599 1.00 0.00 C ATOM 234 CD2 LEU A 19 -8.340 -2.616 2.645 1.00 0.00 C ATOM 0 H LEU A 19 -10.575 -2.848 3.754 1.00 0.00 H new ATOM 0 HA LEU A 19 -10.698 -0.580 2.055 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -10.743 -3.544 1.615 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -10.863 -2.397 0.296 1.00 0.00 H new ATOM 0 HG LEU A 19 -8.575 -3.248 0.630 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -7.417 -1.080 0.575 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -8.894 -1.077 -0.419 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -8.891 -0.283 1.174 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -7.255 -2.541 2.580 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -8.718 -1.840 3.311 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -8.613 -3.596 3.037 1.00 0.00 H new ATOM 246 N THR A 20 -12.944 -1.051 0.663 1.00 0.00 N ATOM 247 CA THR A 20 -14.315 -0.850 0.226 1.00 0.00 C ATOM 248 C THR A 20 -14.482 -1.297 -1.228 1.00 0.00 C ATOM 249 O THR A 20 -13.497 -1.553 -1.920 1.00 0.00 O ATOM 250 CB THR A 20 -14.674 0.619 0.455 1.00 0.00 C ATOM 251 OG1 THR A 20 -14.025 1.306 -0.611 1.00 0.00 O ATOM 252 CG2 THR A 20 -14.024 1.190 1.717 1.00 0.00 C ATOM 0 H THR A 20 -12.242 -0.933 -0.067 1.00 0.00 H new ATOM 0 HA THR A 20 -15.008 -1.462 0.803 1.00 0.00 H new ATOM 0 HB THR A 20 -15.757 0.721 0.526 1.00 0.00 H new ATOM 0 HG1 THR A 20 -14.207 2.266 -0.540 1.00 0.00 H new ATOM 0 HG21 THR A 20 -14.311 2.235 1.833 1.00 0.00 H new ATOM 0 HG22 THR A 20 -14.358 0.623 2.586 1.00 0.00 H new ATOM 0 HG23 THR A 20 -12.940 1.119 1.632 1.00 0.00 H new ATOM 260 N GLU A 21 -15.735 -1.376 -1.649 1.00 0.00 N ATOM 261 CA GLU A 21 -16.044 -1.787 -3.008 1.00 0.00 C ATOM 262 C GLU A 21 -15.133 -1.063 -4.001 1.00 0.00 C ATOM 263 O GLU A 21 -14.689 -1.652 -4.986 1.00 0.00 O ATOM 264 CB GLU A 21 -17.518 -1.539 -3.335 1.00 0.00 C ATOM 265 CG GLU A 21 -18.061 -2.619 -4.273 1.00 0.00 C ATOM 266 CD GLU A 21 -19.062 -2.029 -5.267 1.00 0.00 C ATOM 267 OE1 GLU A 21 -18.624 -1.188 -6.083 1.00 0.00 O ATOM 268 OE2 GLU A 21 -20.243 -2.431 -5.190 1.00 0.00 O ATOM 0 H GLU A 21 -16.549 -1.162 -1.073 1.00 0.00 H new ATOM 0 HA GLU A 21 -15.863 -2.859 -3.093 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -18.101 -1.525 -2.414 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -17.631 -0.559 -3.799 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -17.237 -3.084 -4.814 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -18.542 -3.404 -3.690 1.00 0.00 H new ATOM 275 N ALA A 22 -14.881 0.205 -3.709 1.00 0.00 N ATOM 276 CA ALA A 22 -14.031 1.015 -4.564 1.00 0.00 C ATOM 277 C ALA A 22 -12.565 0.775 -4.194 1.00 0.00 C ATOM 278 O ALA A 22 -11.783 0.305 -5.018 1.00 0.00 O ATOM 279 CB ALA A 22 -14.431 2.486 -4.434 1.00 0.00 C ATOM 0 H ALA A 22 -15.251 0.691 -2.892 1.00 0.00 H new ATOM 0 HA ALA A 22 -14.158 0.733 -5.609 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -13.793 3.094 -5.075 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -15.471 2.608 -4.735 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -14.314 2.805 -3.398 1.00 0.00 H new ATOM 285 N GLU A 23 -12.239 1.108 -2.954 1.00 0.00 N ATOM 286 CA GLU A 23 -10.882 0.935 -2.465 1.00 0.00 C ATOM 287 C GLU A 23 -10.326 -0.419 -2.912 1.00 0.00 C ATOM 288 O GLU A 23 -9.225 -0.492 -3.456 1.00 0.00 O ATOM 289 CB GLU A 23 -10.825 1.075 -0.943 1.00 0.00 C ATOM 290 CG GLU A 23 -10.383 2.482 -0.537 1.00 0.00 C ATOM 291 CD GLU A 23 -10.688 2.749 0.938 1.00 0.00 C ATOM 292 OE1 GLU A 23 -10.629 1.772 1.716 1.00 0.00 O ATOM 293 OE2 GLU A 23 -10.974 3.924 1.255 1.00 0.00 O ATOM 0 H GLU A 23 -12.891 1.497 -2.273 1.00 0.00 H new ATOM 0 HA GLU A 23 -10.260 1.721 -2.892 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -11.806 0.861 -0.518 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.133 0.340 -0.532 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -9.314 2.597 -0.718 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.893 3.220 -1.157 1.00 0.00 H new ATOM 300 N LEU A 24 -11.112 -1.456 -2.666 1.00 0.00 N ATOM 301 CA LEU A 24 -10.712 -2.803 -3.037 1.00 0.00 C ATOM 302 C LEU A 24 -10.095 -2.780 -4.437 1.00 0.00 C ATOM 303 O LEU A 24 -8.986 -3.272 -4.639 1.00 0.00 O ATOM 304 CB LEU A 24 -11.890 -3.769 -2.900 1.00 0.00 C ATOM 305 CG LEU A 24 -12.070 -4.417 -1.526 1.00 0.00 C ATOM 306 CD1 LEU A 24 -13.274 -5.361 -1.518 1.00 0.00 C ATOM 307 CD2 LEU A 24 -10.787 -5.120 -1.079 1.00 0.00 C ATOM 0 H LEU A 24 -12.024 -1.391 -2.214 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.945 -3.173 -2.356 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.805 -3.232 -3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.773 -4.560 -3.640 1.00 0.00 H new ATOM 0 HG LEU A 24 -12.274 -3.629 -0.801 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -13.379 -5.808 -0.530 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -14.177 -4.801 -1.761 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -13.125 -6.147 -2.258 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -10.942 -5.572 -0.099 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.527 -5.896 -1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -9.976 -4.394 -1.019 1.00 0.00 H new ATOM 319 N VAL A 25 -10.841 -2.204 -5.368 1.00 0.00 N ATOM 320 CA VAL A 25 -10.381 -2.110 -6.743 1.00 0.00 C ATOM 321 C VAL A 25 -9.018 -1.417 -6.775 1.00 0.00 C ATOM 322 O VAL A 25 -8.078 -1.916 -7.391 1.00 0.00 O ATOM 323 CB VAL A 25 -11.433 -1.401 -7.599 1.00 0.00 C ATOM 324 CG1 VAL A 25 -10.920 -1.177 -9.024 1.00 0.00 C ATOM 325 CG2 VAL A 25 -12.750 -2.179 -7.606 1.00 0.00 C ATOM 0 H VAL A 25 -11.761 -1.798 -5.197 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.249 -3.104 -7.170 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.624 -0.424 -7.154 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.687 -0.672 -9.611 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -10.021 -0.562 -8.994 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.687 -2.138 -9.482 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.480 -1.653 -8.222 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -12.582 -3.176 -8.014 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.128 -2.263 -6.587 1.00 0.00 H new ATOM 335 N THR A 26 -8.954 -0.276 -6.103 1.00 0.00 N ATOM 336 CA THR A 26 -7.721 0.491 -6.046 1.00 0.00 C ATOM 337 C THR A 26 -6.598 -0.349 -5.436 1.00 0.00 C ATOM 338 O THR A 26 -5.467 -0.324 -5.918 1.00 0.00 O ATOM 339 CB THR A 26 -8.003 1.782 -5.275 1.00 0.00 C ATOM 340 OG1 THR A 26 -8.547 2.661 -6.256 1.00 0.00 O ATOM 341 CG2 THR A 26 -6.721 2.481 -4.817 1.00 0.00 C ATOM 0 H THR A 26 -9.736 0.135 -5.594 1.00 0.00 H new ATOM 0 HA THR A 26 -7.376 0.761 -7.044 1.00 0.00 H new ATOM 0 HB THR A 26 -8.625 1.559 -4.408 1.00 0.00 H new ATOM 0 HG1 THR A 26 -8.760 3.523 -5.841 1.00 0.00 H new ATOM 0 HG21 THR A 26 -6.977 3.391 -4.275 1.00 0.00 H new ATOM 0 HG22 THR A 26 -6.157 1.815 -4.163 1.00 0.00 H new ATOM 0 HG23 THR A 26 -6.114 2.735 -5.686 1.00 0.00 H new ATOM 349 N ALA A 27 -6.949 -1.074 -4.384 1.00 0.00 N ATOM 350 CA ALA A 27 -5.985 -1.920 -3.702 1.00 0.00 C ATOM 351 C ALA A 27 -5.460 -2.976 -4.677 1.00 0.00 C ATOM 352 O ALA A 27 -4.302 -3.382 -4.594 1.00 0.00 O ATOM 353 CB ALA A 27 -6.635 -2.542 -2.465 1.00 0.00 C ATOM 0 H ALA A 27 -7.888 -1.093 -3.987 1.00 0.00 H new ATOM 0 HA ALA A 27 -5.133 -1.332 -3.361 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -5.911 -3.177 -1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -6.964 -1.751 -1.791 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -7.493 -3.142 -2.768 1.00 0.00 H new ATOM 359 N GLU A 28 -6.338 -3.390 -5.580 1.00 0.00 N ATOM 360 CA GLU A 28 -5.977 -4.391 -6.570 1.00 0.00 C ATOM 361 C GLU A 28 -5.090 -3.772 -7.651 1.00 0.00 C ATOM 362 O GLU A 28 -4.222 -4.443 -8.207 1.00 0.00 O ATOM 363 CB GLU A 28 -7.225 -5.029 -7.183 1.00 0.00 C ATOM 364 CG GLU A 28 -7.749 -6.166 -6.303 1.00 0.00 C ATOM 365 CD GLU A 28 -7.664 -7.508 -7.033 1.00 0.00 C ATOM 366 OE1 GLU A 28 -6.595 -7.764 -7.627 1.00 0.00 O ATOM 367 OE2 GLU A 28 -8.671 -8.247 -6.979 1.00 0.00 O ATOM 0 H GLU A 28 -7.298 -3.051 -5.647 1.00 0.00 H new ATOM 0 HA GLU A 28 -5.412 -5.180 -6.073 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -8.001 -4.273 -7.307 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.991 -5.412 -8.177 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.171 -6.213 -5.380 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.783 -5.966 -6.021 1.00 0.00 H new ATOM 374 N ALA A 29 -5.338 -2.498 -7.918 1.00 0.00 N ATOM 375 CA ALA A 29 -4.572 -1.781 -8.923 1.00 0.00 C ATOM 376 C ALA A 29 -3.110 -1.695 -8.479 1.00 0.00 C ATOM 377 O ALA A 29 -2.203 -1.735 -9.309 1.00 0.00 O ATOM 378 CB ALA A 29 -5.194 -0.401 -9.151 1.00 0.00 C ATOM 0 H ALA A 29 -6.059 -1.944 -7.456 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.597 -2.311 -9.875 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -4.619 0.137 -9.905 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -6.222 -0.517 -9.493 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -5.184 0.161 -8.217 1.00 0.00 H new ATOM 384 N VAL A 30 -2.928 -1.579 -7.172 1.00 0.00 N ATOM 385 CA VAL A 30 -1.592 -1.487 -6.609 1.00 0.00 C ATOM 386 C VAL A 30 -0.934 -2.869 -6.639 1.00 0.00 C ATOM 387 O VAL A 30 0.242 -2.993 -6.977 1.00 0.00 O ATOM 388 CB VAL A 30 -1.657 -0.887 -5.203 1.00 0.00 C ATOM 389 CG1 VAL A 30 -0.382 -1.197 -4.415 1.00 0.00 C ATOM 390 CG2 VAL A 30 -1.913 0.620 -5.262 1.00 0.00 C ATOM 0 H VAL A 30 -3.683 -1.547 -6.487 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.972 -0.818 -7.205 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.494 -1.349 -4.680 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.454 -0.759 -3.419 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.261 -2.277 -4.329 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.479 -0.776 -4.935 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.955 1.022 -4.250 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -1.106 1.105 -5.812 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.861 0.809 -5.767 1.00 0.00 H new ATOM 400 N ARG A 31 -1.722 -3.872 -6.281 1.00 0.00 N ATOM 401 CA ARG A 31 -1.231 -5.239 -6.264 1.00 0.00 C ATOM 402 C ARG A 31 -0.635 -5.607 -7.624 1.00 0.00 C ATOM 403 O ARG A 31 0.386 -6.289 -7.694 1.00 0.00 O ATOM 404 CB ARG A 31 -2.353 -6.223 -5.924 1.00 0.00 C ATOM 405 CG ARG A 31 -1.846 -7.337 -5.006 1.00 0.00 C ATOM 406 CD ARG A 31 -3.012 -8.101 -4.376 1.00 0.00 C ATOM 407 NE ARG A 31 -3.931 -7.157 -3.701 1.00 0.00 N ATOM 408 CZ ARG A 31 -5.118 -7.504 -3.185 1.00 0.00 C ATOM 409 NH1 ARG A 31 -5.537 -8.774 -3.261 1.00 0.00 N ATOM 410 NH2 ARG A 31 -5.885 -6.580 -2.591 1.00 0.00 N ATOM 0 H ARG A 31 -2.697 -3.765 -6.001 1.00 0.00 H new ATOM 0 HA ARG A 31 -0.460 -5.304 -5.496 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -3.172 -5.692 -5.439 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -2.752 -6.656 -6.841 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.220 -8.025 -5.575 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -1.220 -6.911 -4.222 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.549 -8.658 -5.143 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.635 -8.830 -3.658 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.643 -6.182 -3.624 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -4.952 -9.478 -3.712 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.441 -9.037 -2.868 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -5.565 -5.613 -2.532 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -6.789 -6.843 -2.198 1.00 0.00 H new ATOM 424 N SER A 32 -1.298 -5.139 -8.671 1.00 0.00 N ATOM 425 CA SER A 32 -0.846 -5.410 -10.025 1.00 0.00 C ATOM 426 C SER A 32 0.558 -4.837 -10.232 1.00 0.00 C ATOM 427 O SER A 32 1.350 -5.387 -10.997 1.00 0.00 O ATOM 428 CB SER A 32 -1.814 -4.826 -11.056 1.00 0.00 C ATOM 429 OG SER A 32 -1.454 -5.182 -12.388 1.00 0.00 O ATOM 0 H SER A 32 -2.145 -4.574 -8.609 1.00 0.00 H new ATOM 0 HA SER A 32 -0.816 -6.490 -10.166 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.824 -5.180 -10.846 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.831 -3.740 -10.963 1.00 0.00 H new ATOM 0 HG SER A 32 -2.097 -4.791 -13.016 1.00 0.00 H new ATOM 435 N VAL A 33 0.824 -3.741 -9.538 1.00 0.00 N ATOM 436 CA VAL A 33 2.118 -3.088 -9.637 1.00 0.00 C ATOM 437 C VAL A 33 3.201 -4.031 -9.109 1.00 0.00 C ATOM 438 O VAL A 33 4.146 -4.360 -9.824 1.00 0.00 O ATOM 439 CB VAL A 33 2.085 -1.745 -8.904 1.00 0.00 C ATOM 440 CG1 VAL A 33 3.403 -0.989 -9.084 1.00 0.00 C ATOM 441 CG2 VAL A 33 0.898 -0.898 -9.367 1.00 0.00 C ATOM 0 H VAL A 33 0.165 -3.288 -8.904 1.00 0.00 H new ATOM 0 HA VAL A 33 2.356 -2.868 -10.678 1.00 0.00 H new ATOM 0 HB VAL A 33 1.958 -1.946 -7.840 1.00 0.00 H new ATOM 0 HG11 VAL A 33 3.353 -0.038 -8.553 1.00 0.00 H new ATOM 0 HG12 VAL A 33 4.222 -1.586 -8.683 1.00 0.00 H new ATOM 0 HG13 VAL A 33 3.574 -0.804 -10.144 1.00 0.00 H new ATOM 0 HG21 VAL A 33 0.897 0.051 -8.831 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.981 -0.710 -10.438 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -0.031 -1.431 -9.163 1.00 0.00 H new ATOM 451 N TRP A 34 3.029 -4.438 -7.860 1.00 0.00 N ATOM 452 CA TRP A 34 3.979 -5.336 -7.227 1.00 0.00 C ATOM 453 C TRP A 34 4.225 -6.510 -8.177 1.00 0.00 C ATOM 454 O TRP A 34 5.370 -6.840 -8.478 1.00 0.00 O ATOM 455 CB TRP A 34 3.484 -5.776 -5.848 1.00 0.00 C ATOM 456 CG TRP A 34 3.563 -4.683 -4.780 1.00 0.00 C ATOM 457 CD1 TRP A 34 3.293 -3.377 -4.915 1.00 0.00 C ATOM 458 CD2 TRP A 34 3.950 -4.855 -3.401 1.00 0.00 C ATOM 459 NE1 TRP A 34 3.477 -2.698 -3.728 1.00 0.00 N ATOM 460 CE2 TRP A 34 3.890 -3.625 -2.778 1.00 0.00 C ATOM 461 CE3 TRP A 34 4.339 -6.011 -2.702 1.00 0.00 C ATOM 462 CZ2 TRP A 34 4.204 -3.433 -1.427 1.00 0.00 C ATOM 463 CZ3 TRP A 34 4.650 -5.803 -1.353 1.00 0.00 C ATOM 464 CH2 TRP A 34 4.594 -4.571 -0.711 1.00 0.00 C ATOM 0 H TRP A 34 2.245 -4.162 -7.269 1.00 0.00 H new ATOM 0 HA TRP A 34 4.927 -4.829 -7.047 1.00 0.00 H new ATOM 0 HB2 TRP A 34 2.450 -6.111 -5.934 1.00 0.00 H new ATOM 0 HB3 TRP A 34 4.071 -6.634 -5.519 1.00 0.00 H new ATOM 0 HD1 TRP A 34 2.972 -2.915 -5.837 1.00 0.00 H new ATOM 0 HE1 TRP A 34 3.336 -1.699 -3.576 1.00 0.00 H new ATOM 0 HE3 TRP A 34 4.394 -6.983 -3.169 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 4.148 -2.460 -0.962 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 4.955 -6.660 -0.770 1.00 0.00 H new ATOM 0 HH2 TRP A 34 4.850 -4.492 0.335 1.00 0.00 H new ATOM 475 N GLN A 35 3.130 -7.109 -8.621 1.00 0.00 N ATOM 476 CA GLN A 35 3.211 -8.239 -9.531 1.00 0.00 C ATOM 477 C GLN A 35 4.122 -7.904 -10.714 1.00 0.00 C ATOM 478 O GLN A 35 5.150 -8.550 -10.912 1.00 0.00 O ATOM 479 CB GLN A 35 1.820 -8.658 -10.011 1.00 0.00 C ATOM 480 CG GLN A 35 1.261 -9.792 -9.149 1.00 0.00 C ATOM 481 CD GLN A 35 1.627 -11.158 -9.735 1.00 0.00 C ATOM 482 OE1 GLN A 35 2.855 -11.566 -9.428 1.00 0.00 O flip ATOM 483 NE2 GLN A 35 0.847 -11.798 -10.420 1.00 0.00 N flip ATOM 0 H GLN A 35 2.181 -6.833 -8.367 1.00 0.00 H new ATOM 0 HA GLN A 35 3.643 -9.083 -8.993 1.00 0.00 H new ATOM 0 HB2 GLN A 35 1.146 -7.802 -9.974 1.00 0.00 H new ATOM 0 HB3 GLN A 35 1.872 -8.979 -11.051 1.00 0.00 H new ATOM 0 HG2 GLN A 35 1.653 -9.710 -8.135 1.00 0.00 H new ATOM 0 HG3 GLN A 35 0.177 -9.701 -9.080 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -0.082 -11.426 -10.618 1.00 0.00 H new ATOM 0 HE22 GLN A 35 1.124 -12.705 -10.795 1.00 0.00 H new ATOM 492 N ARG A 36 3.711 -6.896 -11.468 1.00 0.00 N ATOM 493 CA ARG A 36 4.477 -6.467 -12.626 1.00 0.00 C ATOM 494 C ARG A 36 5.938 -6.231 -12.238 1.00 0.00 C ATOM 495 O ARG A 36 6.848 -6.723 -12.903 1.00 0.00 O ATOM 496 CB ARG A 36 3.901 -5.182 -13.223 1.00 0.00 C ATOM 497 CG ARG A 36 2.717 -5.487 -14.143 1.00 0.00 C ATOM 498 CD ARG A 36 2.040 -4.198 -14.613 1.00 0.00 C ATOM 499 NE ARG A 36 1.498 -4.379 -15.978 1.00 0.00 N ATOM 500 CZ ARG A 36 0.692 -3.500 -16.588 1.00 0.00 C ATOM 501 NH1 ARG A 36 0.328 -2.375 -15.959 1.00 0.00 N ATOM 502 NH2 ARG A 36 0.248 -3.747 -17.828 1.00 0.00 N ATOM 0 H ARG A 36 2.857 -6.364 -11.300 1.00 0.00 H new ATOM 0 HA ARG A 36 4.419 -7.258 -13.373 1.00 0.00 H new ATOM 0 HB2 ARG A 36 3.581 -4.516 -12.422 1.00 0.00 H new ATOM 0 HB3 ARG A 36 4.676 -4.658 -13.783 1.00 0.00 H new ATOM 0 HG2 ARG A 36 3.060 -6.057 -15.006 1.00 0.00 H new ATOM 0 HG3 ARG A 36 1.994 -6.110 -13.617 1.00 0.00 H new ATOM 0 HD2 ARG A 36 1.237 -3.928 -13.927 1.00 0.00 H new ATOM 0 HD3 ARG A 36 2.757 -3.377 -14.603 1.00 0.00 H new ATOM 0 HE ARG A 36 1.754 -5.226 -16.486 1.00 0.00 H new ATOM 0 HH11 ARG A 36 0.665 -2.187 -15.015 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -0.286 -1.706 -16.424 1.00 0.00 H new ATOM 0 HH21 ARG A 36 0.524 -4.604 -18.307 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -0.366 -3.078 -18.293 1.00 0.00 H new ATOM 516 N ILE A 37 6.117 -5.477 -11.164 1.00 0.00 N ATOM 517 CA ILE A 37 7.452 -5.169 -10.679 1.00 0.00 C ATOM 518 C ILE A 37 8.171 -6.470 -10.316 1.00 0.00 C ATOM 519 O ILE A 37 9.059 -6.916 -11.041 1.00 0.00 O ATOM 520 CB ILE A 37 7.386 -4.162 -9.529 1.00 0.00 C ATOM 521 CG1 ILE A 37 6.893 -2.800 -10.022 1.00 0.00 C ATOM 522 CG2 ILE A 37 8.734 -4.059 -8.812 1.00 0.00 C ATOM 523 CD1 ILE A 37 7.021 -1.741 -8.924 1.00 0.00 C ATOM 0 H ILE A 37 5.360 -5.070 -10.615 1.00 0.00 H new ATOM 0 HA ILE A 37 8.039 -4.687 -11.461 1.00 0.00 H new ATOM 0 HB ILE A 37 6.661 -4.523 -8.800 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.469 -2.495 -10.896 1.00 0.00 H new ATOM 0 HG13 ILE A 37 5.853 -2.878 -10.338 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.659 -3.337 -7.999 1.00 0.00 H new ATOM 0 HG22 ILE A 37 9.006 -5.034 -8.407 1.00 0.00 H new ATOM 0 HG23 ILE A 37 9.498 -3.733 -9.518 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.664 -0.782 -9.300 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.424 -2.037 -8.061 1.00 0.00 H new ATOM 0 HD13 ILE A 37 8.066 -1.648 -8.628 1.00 0.00 H new ATOM 535 N LEU A 38 7.759 -7.043 -9.195 1.00 0.00 N ATOM 536 CA LEU A 38 8.353 -8.284 -8.727 1.00 0.00 C ATOM 537 C LEU A 38 8.129 -9.378 -9.773 1.00 0.00 C ATOM 538 O LEU A 38 7.000 -9.818 -9.985 1.00 0.00 O ATOM 539 CB LEU A 38 7.820 -8.643 -7.339 1.00 0.00 C ATOM 540 CG LEU A 38 8.051 -7.602 -6.241 1.00 0.00 C ATOM 541 CD1 LEU A 38 7.060 -7.788 -5.091 1.00 0.00 C ATOM 542 CD2 LEU A 38 9.502 -7.630 -5.757 1.00 0.00 C ATOM 0 H LEU A 38 7.021 -6.671 -8.597 1.00 0.00 H new ATOM 0 HA LEU A 38 9.431 -8.170 -8.610 1.00 0.00 H new ATOM 0 HB2 LEU A 38 6.748 -8.825 -7.419 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.280 -9.580 -7.026 1.00 0.00 H new ATOM 0 HG LEU A 38 7.871 -6.614 -6.664 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.246 -7.036 -4.325 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.042 -7.679 -5.466 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.184 -8.782 -4.661 1.00 0.00 H new ATOM 0 HD21 LEU A 38 9.640 -6.881 -4.977 1.00 0.00 H new ATOM 0 HD22 LEU A 38 9.733 -8.617 -5.357 1.00 0.00 H new ATOM 0 HD23 LEU A 38 10.168 -7.412 -6.592 1.00 0.00 H new ATOM 554 N PRO A 39 9.252 -9.796 -10.417 1.00 0.00 N ATOM 555 CA PRO A 39 9.189 -10.829 -11.437 1.00 0.00 C ATOM 556 C PRO A 39 8.995 -12.210 -10.806 1.00 0.00 C ATOM 557 O PRO A 39 7.916 -12.793 -10.900 1.00 0.00 O ATOM 558 CB PRO A 39 10.495 -10.705 -12.204 1.00 0.00 C ATOM 559 CG PRO A 39 11.436 -9.923 -11.302 1.00 0.00 C ATOM 560 CD PRO A 39 10.605 -9.297 -10.193 1.00 0.00 C ATOM 0 HA PRO A 39 8.337 -10.709 -12.106 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.905 -11.687 -12.438 1.00 0.00 H new ATOM 0 HB3 PRO A 39 10.344 -10.189 -13.152 1.00 0.00 H new ATOM 0 HG2 PRO A 39 12.198 -10.580 -10.883 1.00 0.00 H new ATOM 0 HG3 PRO A 39 11.957 -9.152 -11.870 1.00 0.00 H new ATOM 0 HD2 PRO A 39 10.976 -9.586 -9.209 1.00 0.00 H new ATOM 0 HD3 PRO A 39 10.638 -8.209 -10.239 1.00 0.00 H new ATOM 568 N LYS A 40 10.057 -12.692 -10.177 1.00 0.00 N ATOM 569 CA LYS A 40 10.017 -13.993 -9.532 1.00 0.00 C ATOM 570 C LYS A 40 8.663 -14.175 -8.843 1.00 0.00 C ATOM 571 O LYS A 40 8.066 -15.248 -8.913 1.00 0.00 O ATOM 572 CB LYS A 40 11.213 -14.162 -8.592 1.00 0.00 C ATOM 573 CG LYS A 40 12.469 -14.559 -9.369 1.00 0.00 C ATOM 574 CD LYS A 40 12.462 -16.054 -9.695 1.00 0.00 C ATOM 575 CE LYS A 40 13.057 -16.316 -11.080 1.00 0.00 C ATOM 576 NZ LYS A 40 12.220 -17.279 -11.831 1.00 0.00 N ATOM 0 H LYS A 40 10.950 -12.205 -10.100 1.00 0.00 H new ATOM 0 HA LYS A 40 10.108 -14.788 -10.272 1.00 0.00 H new ATOM 0 HB2 LYS A 40 11.392 -13.231 -8.055 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.988 -14.923 -7.844 1.00 0.00 H new ATOM 0 HG2 LYS A 40 12.528 -13.982 -10.292 1.00 0.00 H new ATOM 0 HG3 LYS A 40 13.356 -14.315 -8.784 1.00 0.00 H new ATOM 0 HD2 LYS A 40 13.033 -16.597 -8.942 1.00 0.00 H new ATOM 0 HD3 LYS A 40 11.441 -16.434 -9.656 1.00 0.00 H new ATOM 0 HE2 LYS A 40 13.130 -15.380 -11.634 1.00 0.00 H new ATOM 0 HE3 LYS A 40 14.070 -16.707 -10.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.638 -17.445 -12.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.171 -18.177 -11.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.261 -16.892 -11.944 1.00 0.00 H new ATOM 590 N VAL A 41 8.219 -13.109 -8.192 1.00 0.00 N ATOM 591 CA VAL A 41 6.946 -13.137 -7.491 1.00 0.00 C ATOM 592 C VAL A 41 5.828 -13.454 -8.486 1.00 0.00 C ATOM 593 O VAL A 41 5.564 -12.672 -9.398 1.00 0.00 O ATOM 594 CB VAL A 41 6.730 -11.818 -6.747 1.00 0.00 C ATOM 595 CG1 VAL A 41 5.363 -11.795 -6.060 1.00 0.00 C ATOM 596 CG2 VAL A 41 7.854 -11.565 -5.741 1.00 0.00 C ATOM 0 H VAL A 41 8.718 -12.221 -8.135 1.00 0.00 H new ATOM 0 HA VAL A 41 6.942 -13.924 -6.737 1.00 0.00 H new ATOM 0 HB VAL A 41 6.750 -11.012 -7.480 1.00 0.00 H new ATOM 0 HG11 VAL A 41 5.234 -10.847 -5.538 1.00 0.00 H new ATOM 0 HG12 VAL A 41 4.578 -11.907 -6.808 1.00 0.00 H new ATOM 0 HG13 VAL A 41 5.302 -12.615 -5.344 1.00 0.00 H new ATOM 0 HG21 VAL A 41 7.676 -10.621 -5.226 1.00 0.00 H new ATOM 0 HG22 VAL A 41 7.880 -12.376 -5.013 1.00 0.00 H new ATOM 0 HG23 VAL A 41 8.808 -11.517 -6.266 1.00 0.00 H new ATOM 606 N LEU A 42 5.200 -14.602 -8.276 1.00 0.00 N ATOM 607 CA LEU A 42 4.116 -15.031 -9.143 1.00 0.00 C ATOM 608 C LEU A 42 2.791 -14.489 -8.603 1.00 0.00 C ATOM 609 O LEU A 42 1.922 -14.084 -9.373 1.00 0.00 O ATOM 610 CB LEU A 42 4.135 -16.551 -9.312 1.00 0.00 C ATOM 611 CG LEU A 42 5.062 -17.094 -10.402 1.00 0.00 C ATOM 612 CD1 LEU A 42 5.984 -18.181 -9.846 1.00 0.00 C ATOM 613 CD2 LEU A 42 4.261 -17.584 -11.609 1.00 0.00 C ATOM 0 H LEU A 42 5.421 -15.248 -7.518 1.00 0.00 H new ATOM 0 HA LEU A 42 4.244 -14.620 -10.144 1.00 0.00 H new ATOM 0 HB2 LEU A 42 4.424 -16.999 -8.361 1.00 0.00 H new ATOM 0 HB3 LEU A 42 3.120 -16.885 -9.526 1.00 0.00 H new ATOM 0 HG LEU A 42 5.697 -16.279 -10.747 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.632 -18.550 -10.641 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.594 -17.765 -9.044 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.384 -19.003 -9.457 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.944 -17.965 -12.369 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.584 -18.380 -11.298 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.683 -16.757 -12.022 1.00 0.00 H new ATOM 625 N GLU A 43 2.680 -14.497 -7.283 1.00 0.00 N ATOM 626 CA GLU A 43 1.476 -14.011 -6.630 1.00 0.00 C ATOM 627 C GLU A 43 1.836 -13.027 -5.516 1.00 0.00 C ATOM 628 O GLU A 43 2.798 -13.242 -4.780 1.00 0.00 O ATOM 629 CB GLU A 43 0.640 -15.172 -6.087 1.00 0.00 C ATOM 630 CG GLU A 43 -0.537 -14.658 -5.256 1.00 0.00 C ATOM 631 CD GLU A 43 -1.853 -15.287 -5.720 1.00 0.00 C ATOM 632 OE1 GLU A 43 -1.944 -16.531 -5.647 1.00 0.00 O ATOM 633 OE2 GLU A 43 -2.737 -14.508 -6.138 1.00 0.00 O ATOM 0 H GLU A 43 3.404 -14.832 -6.648 1.00 0.00 H new ATOM 0 HA GLU A 43 0.872 -13.486 -7.370 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.269 -15.776 -6.915 1.00 0.00 H new ATOM 0 HB3 GLU A 43 1.266 -15.821 -5.475 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -0.371 -14.888 -4.203 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -0.599 -13.573 -5.339 1.00 0.00 H new ATOM 640 N VAL A 44 1.046 -11.968 -5.427 1.00 0.00 N ATOM 641 CA VAL A 44 1.270 -10.949 -4.415 1.00 0.00 C ATOM 642 C VAL A 44 0.068 -10.904 -3.469 1.00 0.00 C ATOM 643 O VAL A 44 -1.054 -10.641 -3.898 1.00 0.00 O ATOM 644 CB VAL A 44 1.557 -9.603 -5.082 1.00 0.00 C ATOM 645 CG1 VAL A 44 1.182 -8.442 -4.158 1.00 0.00 C ATOM 646 CG2 VAL A 44 3.020 -9.507 -5.517 1.00 0.00 C ATOM 0 H VAL A 44 0.249 -11.793 -6.039 1.00 0.00 H new ATOM 0 HA VAL A 44 2.147 -11.192 -3.815 1.00 0.00 H new ATOM 0 HB VAL A 44 0.937 -9.534 -5.976 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.396 -7.497 -4.656 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.119 -8.495 -3.920 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.763 -8.507 -3.238 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.197 -8.540 -5.988 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.666 -9.609 -4.645 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.241 -10.303 -6.228 1.00 0.00 H new ATOM 656 N GLU A 45 0.345 -11.164 -2.200 1.00 0.00 N ATOM 657 CA GLU A 45 -0.699 -11.156 -1.189 1.00 0.00 C ATOM 658 C GLU A 45 -0.497 -9.984 -0.226 1.00 0.00 C ATOM 659 O GLU A 45 0.355 -9.127 -0.456 1.00 0.00 O ATOM 660 CB GLU A 45 -0.742 -12.485 -0.434 1.00 0.00 C ATOM 661 CG GLU A 45 0.625 -12.817 0.170 1.00 0.00 C ATOM 662 CD GLU A 45 1.274 -13.996 -0.557 1.00 0.00 C ATOM 663 OE1 GLU A 45 1.908 -13.739 -1.603 1.00 0.00 O ATOM 664 OE2 GLU A 45 1.120 -15.129 -0.050 1.00 0.00 O ATOM 0 H GLU A 45 1.277 -11.382 -1.848 1.00 0.00 H new ATOM 0 HA GLU A 45 -1.660 -11.029 -1.688 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -1.490 -12.434 0.357 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -1.048 -13.282 -1.111 1.00 0.00 H new ATOM 0 HG2 GLU A 45 1.275 -11.945 0.108 1.00 0.00 H new ATOM 0 HG3 GLU A 45 0.511 -13.055 1.227 1.00 0.00 H new ATOM 671 N ASP A 46 -1.295 -9.985 0.832 1.00 0.00 N ATOM 672 CA ASP A 46 -1.214 -8.932 1.830 1.00 0.00 C ATOM 673 C ASP A 46 -0.014 -9.192 2.743 1.00 0.00 C ATOM 674 O ASP A 46 0.432 -8.296 3.458 1.00 0.00 O ATOM 675 CB ASP A 46 -2.472 -8.902 2.701 1.00 0.00 C ATOM 676 CG ASP A 46 -2.591 -10.050 3.706 1.00 0.00 C ATOM 677 OD1 ASP A 46 -2.931 -11.165 3.255 1.00 0.00 O ATOM 678 OD2 ASP A 46 -2.339 -9.786 4.901 1.00 0.00 O ATOM 0 H ASP A 46 -2.000 -10.698 1.020 1.00 0.00 H new ATOM 0 HA ASP A 46 -1.112 -7.980 1.309 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.496 -7.958 3.246 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -3.346 -8.917 2.050 1.00 0.00 H new ATOM 683 N SER A 47 0.476 -10.422 2.687 1.00 0.00 N ATOM 684 CA SER A 47 1.616 -10.811 3.500 1.00 0.00 C ATOM 685 C SER A 47 2.894 -10.774 2.660 1.00 0.00 C ATOM 686 O SER A 47 3.986 -11.009 3.174 1.00 0.00 O ATOM 687 CB SER A 47 1.415 -12.204 4.100 1.00 0.00 C ATOM 688 OG SER A 47 2.611 -12.709 4.688 1.00 0.00 O ATOM 0 H SER A 47 0.104 -11.162 2.091 1.00 0.00 H new ATOM 0 HA SER A 47 1.708 -10.101 4.322 1.00 0.00 H new ATOM 0 HB2 SER A 47 0.629 -12.164 4.854 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.076 -12.888 3.322 1.00 0.00 H new ATOM 0 HG SER A 47 3.346 -12.082 4.523 1.00 0.00 H new ATOM 694 N THR A 48 2.715 -10.477 1.381 1.00 0.00 N ATOM 695 CA THR A 48 3.840 -10.407 0.465 1.00 0.00 C ATOM 696 C THR A 48 4.782 -9.269 0.863 1.00 0.00 C ATOM 697 O THR A 48 4.344 -8.260 1.414 1.00 0.00 O ATOM 698 CB THR A 48 3.286 -10.268 -0.955 1.00 0.00 C ATOM 699 OG1 THR A 48 3.013 -11.609 -1.353 1.00 0.00 O ATOM 700 CG2 THR A 48 4.344 -9.792 -1.953 1.00 0.00 C ATOM 0 H THR A 48 1.808 -10.282 0.958 1.00 0.00 H new ATOM 0 HA THR A 48 4.441 -11.315 0.508 1.00 0.00 H new ATOM 0 HB THR A 48 2.450 -9.569 -0.951 1.00 0.00 H new ATOM 0 HG1 THR A 48 3.540 -11.827 -2.150 1.00 0.00 H new ATOM 0 HG21 THR A 48 3.898 -9.710 -2.944 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.723 -8.818 -1.644 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.165 -10.508 -1.982 1.00 0.00 H new ATOM 708 N ASP A 49 6.058 -9.469 0.568 1.00 0.00 N ATOM 709 CA ASP A 49 7.065 -8.472 0.889 1.00 0.00 C ATOM 710 C ASP A 49 7.562 -7.821 -0.404 1.00 0.00 C ATOM 711 O ASP A 49 7.509 -8.431 -1.471 1.00 0.00 O ATOM 712 CB ASP A 49 8.267 -9.109 1.589 1.00 0.00 C ATOM 713 CG ASP A 49 8.401 -10.621 1.398 1.00 0.00 C ATOM 714 OD1 ASP A 49 8.667 -11.026 0.246 1.00 0.00 O ATOM 715 OD2 ASP A 49 8.232 -11.337 2.408 1.00 0.00 O ATOM 0 H ASP A 49 6.418 -10.307 0.110 1.00 0.00 H new ATOM 0 HA ASP A 49 6.611 -7.735 1.551 1.00 0.00 H new ATOM 0 HB2 ASP A 49 9.176 -8.630 1.225 1.00 0.00 H new ATOM 0 HB3 ASP A 49 8.201 -8.897 2.656 1.00 0.00 H new ATOM 720 N PHE A 50 8.033 -6.590 -0.266 1.00 0.00 N ATOM 721 CA PHE A 50 8.538 -5.849 -1.409 1.00 0.00 C ATOM 722 C PHE A 50 10.023 -6.139 -1.638 1.00 0.00 C ATOM 723 O PHE A 50 10.399 -6.696 -2.668 1.00 0.00 O ATOM 724 CB PHE A 50 8.363 -4.363 -1.092 1.00 0.00 C ATOM 725 CG PHE A 50 8.542 -3.443 -2.302 1.00 0.00 C ATOM 726 CD1 PHE A 50 7.787 -3.633 -3.417 1.00 0.00 C ATOM 727 CD2 PHE A 50 9.455 -2.437 -2.262 1.00 0.00 C ATOM 728 CE1 PHE A 50 7.952 -2.779 -4.540 1.00 0.00 C ATOM 729 CE2 PHE A 50 9.621 -1.583 -3.385 1.00 0.00 C ATOM 730 CZ PHE A 50 8.866 -1.773 -4.500 1.00 0.00 C ATOM 0 H PHE A 50 8.075 -6.087 0.621 1.00 0.00 H new ATOM 0 HA PHE A 50 7.996 -6.139 -2.309 1.00 0.00 H new ATOM 0 HB2 PHE A 50 7.369 -4.206 -0.673 1.00 0.00 H new ATOM 0 HB3 PHE A 50 9.081 -4.079 -0.323 1.00 0.00 H new ATOM 0 HD1 PHE A 50 7.062 -4.433 -3.449 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.054 -2.287 -1.376 1.00 0.00 H new ATOM 0 HE1 PHE A 50 7.352 -2.929 -5.425 1.00 0.00 H new ATOM 0 HE2 PHE A 50 10.346 -0.783 -3.353 1.00 0.00 H new ATOM 0 HZ PHE A 50 8.992 -1.124 -5.354 1.00 0.00 H new ATOM 740 N PHE A 51 10.826 -5.748 -0.659 1.00 0.00 N ATOM 741 CA PHE A 51 12.262 -5.959 -0.740 1.00 0.00 C ATOM 742 C PHE A 51 12.593 -7.450 -0.824 1.00 0.00 C ATOM 743 O PHE A 51 13.227 -7.896 -1.779 1.00 0.00 O ATOM 744 CB PHE A 51 12.871 -5.384 0.540 1.00 0.00 C ATOM 745 CG PHE A 51 12.418 -3.958 0.859 1.00 0.00 C ATOM 746 CD1 PHE A 51 12.545 -2.979 -0.075 1.00 0.00 C ATOM 747 CD2 PHE A 51 11.887 -3.671 2.078 1.00 0.00 C ATOM 748 CE1 PHE A 51 12.124 -1.655 0.221 1.00 0.00 C ATOM 749 CE2 PHE A 51 11.466 -2.347 2.375 1.00 0.00 C ATOM 750 CZ PHE A 51 11.593 -1.368 1.440 1.00 0.00 C ATOM 0 H PHE A 51 10.510 -5.287 0.194 1.00 0.00 H new ATOM 0 HA PHE A 51 12.660 -5.476 -1.632 1.00 0.00 H new ATOM 0 HB2 PHE A 51 12.611 -6.032 1.377 1.00 0.00 H new ATOM 0 HB3 PHE A 51 13.957 -5.398 0.451 1.00 0.00 H new ATOM 0 HD1 PHE A 51 12.966 -3.208 -1.043 1.00 0.00 H new ATOM 0 HD2 PHE A 51 11.785 -4.449 2.820 1.00 0.00 H new ATOM 0 HE1 PHE A 51 12.225 -0.877 -0.521 1.00 0.00 H new ATOM 0 HE2 PHE A 51 11.045 -2.118 3.343 1.00 0.00 H new ATOM 0 HZ PHE A 51 11.272 -0.362 1.665 1.00 0.00 H new ATOM 760 N LYS A 52 12.149 -8.180 0.189 1.00 0.00 N ATOM 761 CA LYS A 52 12.390 -9.612 0.242 1.00 0.00 C ATOM 762 C LYS A 52 12.118 -10.222 -1.135 1.00 0.00 C ATOM 763 O LYS A 52 12.981 -10.891 -1.703 1.00 0.00 O ATOM 764 CB LYS A 52 11.577 -10.251 1.369 1.00 0.00 C ATOM 765 CG LYS A 52 12.196 -9.943 2.734 1.00 0.00 C ATOM 766 CD LYS A 52 11.350 -8.925 3.502 1.00 0.00 C ATOM 767 CE LYS A 52 11.712 -8.922 4.989 1.00 0.00 C ATOM 768 NZ LYS A 52 12.645 -7.815 5.293 1.00 0.00 N ATOM 0 H LYS A 52 11.624 -7.806 0.980 1.00 0.00 H new ATOM 0 HA LYS A 52 13.434 -9.814 0.480 1.00 0.00 H new ATOM 0 HB2 LYS A 52 10.552 -9.880 1.338 1.00 0.00 H new ATOM 0 HB3 LYS A 52 11.530 -11.330 1.222 1.00 0.00 H new ATOM 0 HG2 LYS A 52 12.282 -10.862 3.314 1.00 0.00 H new ATOM 0 HG3 LYS A 52 13.206 -9.555 2.600 1.00 0.00 H new ATOM 0 HD2 LYS A 52 11.504 -7.930 3.085 1.00 0.00 H new ATOM 0 HD3 LYS A 52 10.293 -9.161 3.382 1.00 0.00 H new ATOM 0 HE2 LYS A 52 10.808 -8.819 5.589 1.00 0.00 H new ATOM 0 HE3 LYS A 52 12.168 -9.874 5.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 12.880 -7.828 6.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 13.514 -7.930 4.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 12.197 -6.908 5.053 1.00 0.00 H new ATOM 782 N SER A 53 10.916 -9.970 -1.632 1.00 0.00 N ATOM 783 CA SER A 53 10.520 -10.486 -2.931 1.00 0.00 C ATOM 784 C SER A 53 11.669 -10.328 -3.929 1.00 0.00 C ATOM 785 O SER A 53 12.265 -11.316 -4.356 1.00 0.00 O ATOM 786 CB SER A 53 9.267 -9.775 -3.447 1.00 0.00 C ATOM 787 OG SER A 53 8.072 -10.416 -3.011 1.00 0.00 O ATOM 0 H SER A 53 10.203 -9.415 -1.158 1.00 0.00 H new ATOM 0 HA SER A 53 10.285 -11.545 -2.822 1.00 0.00 H new ATOM 0 HB2 SER A 53 9.270 -8.741 -3.103 1.00 0.00 H new ATOM 0 HB3 SER A 53 9.288 -9.749 -4.536 1.00 0.00 H new ATOM 0 HG SER A 53 7.653 -9.881 -2.305 1.00 0.00 H new ATOM 793 N GLY A 54 11.945 -9.078 -4.272 1.00 0.00 N ATOM 794 CA GLY A 54 13.012 -8.779 -5.212 1.00 0.00 C ATOM 795 C GLY A 54 12.942 -7.322 -5.675 1.00 0.00 C ATOM 796 O GLY A 54 13.149 -7.030 -6.851 1.00 0.00 O ATOM 0 H GLY A 54 11.448 -8.261 -3.916 1.00 0.00 H new ATOM 0 HA2 GLY A 54 13.978 -8.970 -4.744 1.00 0.00 H new ATOM 0 HA3 GLY A 54 12.939 -9.442 -6.074 1.00 0.00 H new ATOM 800 N ALA A 55 12.650 -6.446 -4.724 1.00 0.00 N ATOM 801 CA ALA A 55 12.551 -5.027 -5.019 1.00 0.00 C ATOM 802 C ALA A 55 13.908 -4.364 -4.779 1.00 0.00 C ATOM 803 O ALA A 55 14.540 -4.592 -3.748 1.00 0.00 O ATOM 804 CB ALA A 55 11.440 -4.406 -4.170 1.00 0.00 C ATOM 0 H ALA A 55 12.479 -6.692 -3.749 1.00 0.00 H new ATOM 0 HA ALA A 55 12.289 -4.870 -6.065 1.00 0.00 H new ATOM 0 HB1 ALA A 55 11.365 -3.341 -4.391 1.00 0.00 H new ATOM 0 HB2 ALA A 55 10.492 -4.892 -4.400 1.00 0.00 H new ATOM 0 HB3 ALA A 55 11.670 -4.542 -3.113 1.00 0.00 H new ATOM 810 N ALA A 56 14.317 -3.557 -5.747 1.00 0.00 N ATOM 811 CA ALA A 56 15.588 -2.859 -5.653 1.00 0.00 C ATOM 812 C ALA A 56 15.351 -1.448 -5.112 1.00 0.00 C ATOM 813 O ALA A 56 14.219 -1.079 -4.805 1.00 0.00 O ATOM 814 CB ALA A 56 16.268 -2.851 -7.024 1.00 0.00 C ATOM 0 H ALA A 56 13.790 -3.371 -6.601 1.00 0.00 H new ATOM 0 HA ALA A 56 16.256 -3.370 -4.960 1.00 0.00 H new ATOM 0 HB1 ALA A 56 17.222 -2.328 -6.954 1.00 0.00 H new ATOM 0 HB2 ALA A 56 16.440 -3.877 -7.351 1.00 0.00 H new ATOM 0 HB3 ALA A 56 15.627 -2.343 -7.745 1.00 0.00 H new ATOM 820 N SER A 57 16.439 -0.698 -5.011 1.00 0.00 N ATOM 821 CA SER A 57 16.364 0.665 -4.511 1.00 0.00 C ATOM 822 C SER A 57 15.612 1.547 -5.510 1.00 0.00 C ATOM 823 O SER A 57 15.140 2.627 -5.156 1.00 0.00 O ATOM 824 CB SER A 57 17.760 1.232 -4.248 1.00 0.00 C ATOM 825 OG SER A 57 18.546 1.289 -5.435 1.00 0.00 O ATOM 0 H SER A 57 17.377 -1.008 -5.267 1.00 0.00 H new ATOM 0 HA SER A 57 15.822 0.654 -3.565 1.00 0.00 H new ATOM 0 HB2 SER A 57 17.671 2.232 -3.824 1.00 0.00 H new ATOM 0 HB3 SER A 57 18.268 0.615 -3.506 1.00 0.00 H new ATOM 0 HG SER A 57 19.429 1.658 -5.225 1.00 0.00 H new ATOM 831 N VAL A 58 15.525 1.056 -6.737 1.00 0.00 N ATOM 832 CA VAL A 58 14.838 1.786 -7.789 1.00 0.00 C ATOM 833 C VAL A 58 13.347 1.446 -7.750 1.00 0.00 C ATOM 834 O VAL A 58 12.503 2.312 -7.974 1.00 0.00 O ATOM 835 CB VAL A 58 15.486 1.487 -9.142 1.00 0.00 C ATOM 836 CG1 VAL A 58 17.011 1.451 -9.025 1.00 0.00 C ATOM 837 CG2 VAL A 58 14.950 0.179 -9.728 1.00 0.00 C ATOM 0 H VAL A 58 15.919 0.161 -7.027 1.00 0.00 H new ATOM 0 HA VAL A 58 14.929 2.861 -7.631 1.00 0.00 H new ATOM 0 HB VAL A 58 15.222 2.294 -9.825 1.00 0.00 H new ATOM 0 HG11 VAL A 58 17.446 1.237 -10.001 1.00 0.00 H new ATOM 0 HG12 VAL A 58 17.372 2.417 -8.671 1.00 0.00 H new ATOM 0 HG13 VAL A 58 17.303 0.674 -8.319 1.00 0.00 H new ATOM 0 HG21 VAL A 58 15.426 -0.011 -10.690 1.00 0.00 H new ATOM 0 HG22 VAL A 58 15.170 -0.642 -9.046 1.00 0.00 H new ATOM 0 HG23 VAL A 58 13.872 0.257 -9.866 1.00 0.00 H new ATOM 847 N ASP A 59 13.068 0.182 -7.466 1.00 0.00 N ATOM 848 CA ASP A 59 11.694 -0.283 -7.395 1.00 0.00 C ATOM 849 C ASP A 59 10.909 0.601 -6.424 1.00 0.00 C ATOM 850 O ASP A 59 9.765 0.963 -6.694 1.00 0.00 O ATOM 851 CB ASP A 59 11.625 -1.723 -6.884 1.00 0.00 C ATOM 852 CG ASP A 59 10.234 -2.359 -6.925 1.00 0.00 C ATOM 853 OD1 ASP A 59 9.374 -1.796 -7.636 1.00 0.00 O ATOM 854 OD2 ASP A 59 10.063 -3.394 -6.245 1.00 0.00 O ATOM 0 H ASP A 59 13.771 -0.534 -7.282 1.00 0.00 H new ATOM 0 HA ASP A 59 11.271 -0.236 -8.398 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.305 -2.335 -7.476 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.988 -1.746 -5.856 1.00 0.00 H new ATOM 859 N VAL A 60 11.556 0.924 -5.314 1.00 0.00 N ATOM 860 CA VAL A 60 10.934 1.759 -4.301 1.00 0.00 C ATOM 861 C VAL A 60 10.312 2.987 -4.970 1.00 0.00 C ATOM 862 O VAL A 60 9.146 3.301 -4.738 1.00 0.00 O ATOM 863 CB VAL A 60 11.954 2.120 -3.220 1.00 0.00 C ATOM 864 CG1 VAL A 60 11.358 3.100 -2.207 1.00 0.00 C ATOM 865 CG2 VAL A 60 12.481 0.864 -2.522 1.00 0.00 C ATOM 0 H VAL A 60 12.505 0.622 -5.094 1.00 0.00 H new ATOM 0 HA VAL A 60 10.130 1.218 -3.802 1.00 0.00 H new ATOM 0 HB VAL A 60 12.796 2.612 -3.706 1.00 0.00 H new ATOM 0 HG11 VAL A 60 12.105 3.340 -1.450 1.00 0.00 H new ATOM 0 HG12 VAL A 60 11.055 4.013 -2.719 1.00 0.00 H new ATOM 0 HG13 VAL A 60 10.490 2.646 -1.729 1.00 0.00 H new ATOM 0 HG21 VAL A 60 13.204 1.149 -1.758 1.00 0.00 H new ATOM 0 HG22 VAL A 60 11.652 0.332 -2.056 1.00 0.00 H new ATOM 0 HG23 VAL A 60 12.963 0.216 -3.254 1.00 0.00 H new ATOM 875 N VAL A 61 11.120 3.649 -5.786 1.00 0.00 N ATOM 876 CA VAL A 61 10.664 4.835 -6.490 1.00 0.00 C ATOM 877 C VAL A 61 9.624 4.433 -7.538 1.00 0.00 C ATOM 878 O VAL A 61 8.671 5.170 -7.787 1.00 0.00 O ATOM 879 CB VAL A 61 11.859 5.580 -7.088 1.00 0.00 C ATOM 880 CG1 VAL A 61 11.430 6.929 -7.668 1.00 0.00 C ATOM 881 CG2 VAL A 61 12.969 5.758 -6.051 1.00 0.00 C ATOM 0 H VAL A 61 12.087 3.386 -5.975 1.00 0.00 H new ATOM 0 HA VAL A 61 10.179 5.526 -5.800 1.00 0.00 H new ATOM 0 HB VAL A 61 12.256 4.976 -7.904 1.00 0.00 H new ATOM 0 HG11 VAL A 61 12.298 7.438 -8.087 1.00 0.00 H new ATOM 0 HG12 VAL A 61 10.690 6.769 -8.452 1.00 0.00 H new ATOM 0 HG13 VAL A 61 10.995 7.543 -6.879 1.00 0.00 H new ATOM 0 HG21 VAL A 61 13.806 6.290 -6.502 1.00 0.00 H new ATOM 0 HG22 VAL A 61 12.588 6.331 -5.205 1.00 0.00 H new ATOM 0 HG23 VAL A 61 13.304 4.780 -5.706 1.00 0.00 H new ATOM 891 N ARG A 62 9.843 3.266 -8.125 1.00 0.00 N ATOM 892 CA ARG A 62 8.937 2.757 -9.141 1.00 0.00 C ATOM 893 C ARG A 62 7.539 2.558 -8.553 1.00 0.00 C ATOM 894 O ARG A 62 6.583 3.201 -8.984 1.00 0.00 O ATOM 895 CB ARG A 62 9.438 1.428 -9.710 1.00 0.00 C ATOM 896 CG ARG A 62 9.213 1.359 -11.221 1.00 0.00 C ATOM 897 CD ARG A 62 9.906 0.136 -11.824 1.00 0.00 C ATOM 898 NE ARG A 62 9.005 -0.533 -12.788 1.00 0.00 N ATOM 899 CZ ARG A 62 9.388 -1.511 -13.621 1.00 0.00 C ATOM 900 NH1 ARG A 62 10.657 -1.940 -13.612 1.00 0.00 N ATOM 901 NH2 ARG A 62 8.501 -2.060 -14.462 1.00 0.00 N ATOM 0 H ARG A 62 10.635 2.658 -7.917 1.00 0.00 H new ATOM 0 HA ARG A 62 8.895 3.491 -9.946 1.00 0.00 H new ATOM 0 HB2 ARG A 62 10.499 1.312 -9.491 1.00 0.00 H new ATOM 0 HB3 ARG A 62 8.920 0.602 -9.223 1.00 0.00 H new ATOM 0 HG2 ARG A 62 8.144 1.316 -11.431 1.00 0.00 H new ATOM 0 HG3 ARG A 62 9.594 2.266 -11.691 1.00 0.00 H new ATOM 0 HD2 ARG A 62 10.826 0.439 -12.324 1.00 0.00 H new ATOM 0 HD3 ARG A 62 10.187 -0.560 -11.033 1.00 0.00 H new ATOM 0 HE ARG A 62 8.031 -0.231 -12.821 1.00 0.00 H new ATOM 0 HH11 ARG A 62 11.332 -1.523 -12.971 1.00 0.00 H new ATOM 0 HH12 ARG A 62 10.948 -2.684 -14.246 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.535 -1.734 -14.468 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.792 -2.804 -15.096 1.00 0.00 H new ATOM 915 N LEU A 63 7.464 1.664 -7.577 1.00 0.00 N ATOM 916 CA LEU A 63 6.198 1.372 -6.926 1.00 0.00 C ATOM 917 C LEU A 63 5.524 2.684 -6.520 1.00 0.00 C ATOM 918 O LEU A 63 4.344 2.891 -6.798 1.00 0.00 O ATOM 919 CB LEU A 63 6.406 0.402 -5.761 1.00 0.00 C ATOM 920 CG LEU A 63 5.415 0.523 -4.602 1.00 0.00 C ATOM 921 CD1 LEU A 63 4.005 0.127 -5.042 1.00 0.00 C ATOM 922 CD2 LEU A 63 5.886 -0.285 -3.391 1.00 0.00 C ATOM 0 H LEU A 63 8.259 1.133 -7.222 1.00 0.00 H new ATOM 0 HA LEU A 63 5.523 0.866 -7.616 1.00 0.00 H new ATOM 0 HB2 LEU A 63 6.359 -0.616 -6.149 1.00 0.00 H new ATOM 0 HB3 LEU A 63 7.413 0.547 -5.369 1.00 0.00 H new ATOM 0 HG LEU A 63 5.374 1.568 -4.296 1.00 0.00 H new ATOM 0 HD11 LEU A 63 3.321 0.222 -4.199 1.00 0.00 H new ATOM 0 HD12 LEU A 63 3.679 0.782 -5.850 1.00 0.00 H new ATOM 0 HD13 LEU A 63 4.009 -0.906 -5.391 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.164 -0.182 -2.581 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.974 -1.336 -3.667 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.856 0.086 -3.061 1.00 0.00 H new ATOM 934 N VAL A 64 6.302 3.536 -5.869 1.00 0.00 N ATOM 935 CA VAL A 64 5.794 4.822 -5.422 1.00 0.00 C ATOM 936 C VAL A 64 5.336 5.634 -6.636 1.00 0.00 C ATOM 937 O VAL A 64 4.270 6.246 -6.611 1.00 0.00 O ATOM 938 CB VAL A 64 6.855 5.542 -4.587 1.00 0.00 C ATOM 939 CG1 VAL A 64 6.325 6.876 -4.059 1.00 0.00 C ATOM 940 CG2 VAL A 64 7.346 4.655 -3.442 1.00 0.00 C ATOM 0 H VAL A 64 7.281 3.361 -5.640 1.00 0.00 H new ATOM 0 HA VAL A 64 4.927 4.687 -4.775 1.00 0.00 H new ATOM 0 HB VAL A 64 7.705 5.753 -5.235 1.00 0.00 H new ATOM 0 HG11 VAL A 64 7.099 7.367 -3.469 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.048 7.515 -4.897 1.00 0.00 H new ATOM 0 HG13 VAL A 64 5.450 6.698 -3.434 1.00 0.00 H new ATOM 0 HG21 VAL A 64 8.099 5.190 -2.864 1.00 0.00 H new ATOM 0 HG22 VAL A 64 6.507 4.398 -2.795 1.00 0.00 H new ATOM 0 HG23 VAL A 64 7.782 3.743 -3.850 1.00 0.00 H new ATOM 950 N GLU A 65 6.166 5.613 -7.669 1.00 0.00 N ATOM 951 CA GLU A 65 5.859 6.340 -8.889 1.00 0.00 C ATOM 952 C GLU A 65 4.599 5.770 -9.544 1.00 0.00 C ATOM 953 O GLU A 65 3.750 6.521 -10.021 1.00 0.00 O ATOM 954 CB GLU A 65 7.042 6.308 -9.858 1.00 0.00 C ATOM 955 CG GLU A 65 8.103 7.338 -9.464 1.00 0.00 C ATOM 956 CD GLU A 65 8.080 8.539 -10.411 1.00 0.00 C ATOM 957 OE1 GLU A 65 8.617 8.390 -11.530 1.00 0.00 O ATOM 958 OE2 GLU A 65 7.525 9.579 -9.995 1.00 0.00 O ATOM 0 H GLU A 65 7.050 5.104 -7.686 1.00 0.00 H new ATOM 0 HA GLU A 65 5.671 7.382 -8.630 1.00 0.00 H new ATOM 0 HB2 GLU A 65 7.483 5.311 -9.866 1.00 0.00 H new ATOM 0 HB3 GLU A 65 6.693 6.510 -10.871 1.00 0.00 H new ATOM 0 HG2 GLU A 65 7.928 7.673 -8.442 1.00 0.00 H new ATOM 0 HG3 GLU A 65 9.089 6.875 -9.483 1.00 0.00 H new ATOM 965 N GLU A 66 4.517 4.448 -9.545 1.00 0.00 N ATOM 966 CA GLU A 66 3.375 3.769 -10.133 1.00 0.00 C ATOM 967 C GLU A 66 2.091 4.155 -9.396 1.00 0.00 C ATOM 968 O GLU A 66 1.145 4.650 -10.007 1.00 0.00 O ATOM 969 CB GLU A 66 3.576 2.252 -10.127 1.00 0.00 C ATOM 970 CG GLU A 66 4.689 1.843 -11.093 1.00 0.00 C ATOM 971 CD GLU A 66 4.265 0.642 -11.941 1.00 0.00 C ATOM 972 OE1 GLU A 66 3.389 0.842 -12.810 1.00 0.00 O ATOM 973 OE2 GLU A 66 4.827 -0.448 -11.702 1.00 0.00 O ATOM 0 H GLU A 66 5.223 3.828 -9.148 1.00 0.00 H new ATOM 0 HA GLU A 66 3.284 4.086 -11.172 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.823 1.918 -9.119 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.646 1.757 -10.407 1.00 0.00 H new ATOM 0 HG2 GLU A 66 4.938 2.682 -11.743 1.00 0.00 H new ATOM 0 HG3 GLU A 66 5.590 1.596 -10.532 1.00 0.00 H new ATOM 980 N VAL A 67 2.099 3.914 -8.093 1.00 0.00 N ATOM 981 CA VAL A 67 0.947 4.230 -7.266 1.00 0.00 C ATOM 982 C VAL A 67 0.633 5.722 -7.386 1.00 0.00 C ATOM 983 O VAL A 67 -0.494 6.145 -7.130 1.00 0.00 O ATOM 984 CB VAL A 67 1.201 3.786 -5.824 1.00 0.00 C ATOM 985 CG1 VAL A 67 0.009 4.128 -4.927 1.00 0.00 C ATOM 986 CG2 VAL A 67 1.525 2.293 -5.758 1.00 0.00 C ATOM 0 H VAL A 67 2.885 3.503 -7.590 1.00 0.00 H new ATOM 0 HA VAL A 67 0.068 3.684 -7.610 1.00 0.00 H new ATOM 0 HB VAL A 67 2.068 4.333 -5.454 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.215 3.802 -3.908 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.156 5.205 -4.937 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.882 3.621 -5.297 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.701 2.004 -4.722 1.00 0.00 H new ATOM 0 HG22 VAL A 67 0.687 1.721 -6.157 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.418 2.088 -6.348 1.00 0.00 H new ATOM 996 N LYS A 68 1.648 6.479 -7.775 1.00 0.00 N ATOM 997 CA LYS A 68 1.494 7.915 -7.932 1.00 0.00 C ATOM 998 C LYS A 68 0.485 8.197 -9.048 1.00 0.00 C ATOM 999 O LYS A 68 -0.355 9.085 -8.920 1.00 0.00 O ATOM 1000 CB LYS A 68 2.855 8.579 -8.152 1.00 0.00 C ATOM 1001 CG LYS A 68 3.208 9.504 -6.985 1.00 0.00 C ATOM 1002 CD LYS A 68 4.548 9.109 -6.359 1.00 0.00 C ATOM 1003 CE LYS A 68 5.305 10.342 -5.862 1.00 0.00 C ATOM 1004 NZ LYS A 68 6.551 9.941 -5.171 1.00 0.00 N ATOM 0 H LYS A 68 2.581 6.125 -7.986 1.00 0.00 H new ATOM 0 HA LYS A 68 1.093 8.357 -7.020 1.00 0.00 H new ATOM 0 HB2 LYS A 68 3.624 7.814 -8.260 1.00 0.00 H new ATOM 0 HB3 LYS A 68 2.840 9.149 -9.081 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.256 10.535 -7.335 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.423 9.460 -6.230 1.00 0.00 H new ATOM 0 HD2 LYS A 68 4.378 8.423 -5.529 1.00 0.00 H new ATOM 0 HD3 LYS A 68 5.154 8.577 -7.093 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.542 10.994 -6.703 1.00 0.00 H new ATOM 0 HE3 LYS A 68 4.673 10.915 -5.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 7.220 10.738 -5.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 6.333 9.672 -4.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 6.977 9.132 -5.666 1.00 0.00 H new ATOM 1018 N GLU A 69 0.602 7.423 -10.117 1.00 0.00 N ATOM 1019 CA GLU A 69 -0.289 7.578 -11.254 1.00 0.00 C ATOM 1020 C GLU A 69 -1.694 7.088 -10.898 1.00 0.00 C ATOM 1021 O GLU A 69 -2.675 7.505 -11.512 1.00 0.00 O ATOM 1022 CB GLU A 69 0.254 6.841 -12.480 1.00 0.00 C ATOM 1023 CG GLU A 69 1.691 7.268 -12.784 1.00 0.00 C ATOM 1024 CD GLU A 69 1.743 8.195 -14.000 1.00 0.00 C ATOM 1025 OE1 GLU A 69 1.418 9.388 -13.818 1.00 0.00 O ATOM 1026 OE2 GLU A 69 2.106 7.689 -15.084 1.00 0.00 O ATOM 0 H GLU A 69 1.300 6.687 -10.220 1.00 0.00 H new ATOM 0 HA GLU A 69 -0.347 8.637 -11.504 1.00 0.00 H new ATOM 0 HB2 GLU A 69 0.219 5.765 -12.307 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.380 7.046 -13.342 1.00 0.00 H new ATOM 0 HG2 GLU A 69 2.114 7.776 -11.917 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.305 6.386 -12.968 1.00 0.00 H new ATOM 1033 N LEU A 70 -1.747 6.210 -9.907 1.00 0.00 N ATOM 1034 CA LEU A 70 -3.015 5.660 -9.461 1.00 0.00 C ATOM 1035 C LEU A 70 -3.875 6.781 -8.874 1.00 0.00 C ATOM 1036 O LEU A 70 -5.038 6.935 -9.245 1.00 0.00 O ATOM 1037 CB LEU A 70 -2.785 4.493 -8.498 1.00 0.00 C ATOM 1038 CG LEU A 70 -2.537 3.129 -9.145 1.00 0.00 C ATOM 1039 CD1 LEU A 70 -2.355 2.044 -8.082 1.00 0.00 C ATOM 1040 CD2 LEU A 70 -3.651 2.781 -10.135 1.00 0.00 C ATOM 0 H LEU A 70 -0.931 5.866 -9.400 1.00 0.00 H new ATOM 0 HA LEU A 70 -3.566 5.243 -10.304 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -1.931 4.733 -7.865 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -3.653 4.411 -7.844 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.608 3.183 -9.712 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.180 1.084 -8.568 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -1.501 2.292 -7.451 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.254 1.982 -7.468 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.450 1.807 -10.581 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.607 2.751 -9.612 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -3.691 3.537 -10.919 1.00 0.00 H new ATOM 1052 N CYS A 71 -3.270 7.535 -7.968 1.00 0.00 N ATOM 1053 CA CYS A 71 -3.966 8.637 -7.326 1.00 0.00 C ATOM 1054 C CYS A 71 -3.627 9.924 -8.081 1.00 0.00 C ATOM 1055 O CYS A 71 -4.123 10.996 -7.741 1.00 0.00 O ATOM 1056 CB CYS A 71 -3.615 8.738 -5.840 1.00 0.00 C ATOM 1057 SG CYS A 71 -4.991 9.525 -4.925 1.00 0.00 S ATOM 0 H CYS A 71 -2.305 7.404 -7.663 1.00 0.00 H new ATOM 0 HA CYS A 71 -5.042 8.465 -7.367 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -3.419 7.745 -5.436 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -2.702 9.320 -5.712 1.00 0.00 H new ATOM 0 HG CYS A 71 -4.684 9.604 -3.664 1.00 0.00 H new ATOM 1063 N ASP A 72 -2.784 9.774 -9.093 1.00 0.00 N ATOM 1064 CA ASP A 72 -2.374 10.911 -9.899 1.00 0.00 C ATOM 1065 C ASP A 72 -1.645 11.923 -9.012 1.00 0.00 C ATOM 1066 O ASP A 72 -2.161 13.009 -8.751 1.00 0.00 O ATOM 1067 CB ASP A 72 -3.583 11.611 -10.521 1.00 0.00 C ATOM 1068 CG ASP A 72 -3.268 12.912 -11.261 1.00 0.00 C ATOM 1069 OD1 ASP A 72 -2.514 12.831 -12.255 1.00 0.00 O ATOM 1070 OD2 ASP A 72 -3.787 13.958 -10.817 1.00 0.00 O ATOM 0 H ASP A 72 -2.374 8.883 -9.373 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.723 10.544 -10.693 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -4.064 10.923 -11.216 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -4.305 11.825 -9.733 1.00 0.00 H new ATOM 1075 N GLY A 73 -0.458 11.532 -8.574 1.00 0.00 N ATOM 1076 CA GLY A 73 0.346 12.391 -7.722 1.00 0.00 C ATOM 1077 C GLY A 73 0.160 12.031 -6.247 1.00 0.00 C ATOM 1078 O GLY A 73 0.076 12.913 -5.394 1.00 0.00 O ATOM 0 H GLY A 73 -0.033 10.631 -8.793 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.397 12.296 -7.993 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.068 13.432 -7.884 1.00 0.00 H new ATOM 1082 N LEU A 74 0.100 10.732 -5.991 1.00 0.00 N ATOM 1083 CA LEU A 74 -0.075 10.244 -4.634 1.00 0.00 C ATOM 1084 C LEU A 74 1.060 10.774 -3.756 1.00 0.00 C ATOM 1085 O LEU A 74 2.227 10.711 -4.138 1.00 0.00 O ATOM 1086 CB LEU A 74 -0.199 8.719 -4.625 1.00 0.00 C ATOM 1087 CG LEU A 74 -0.389 8.070 -3.253 1.00 0.00 C ATOM 1088 CD1 LEU A 74 -1.680 8.555 -2.591 1.00 0.00 C ATOM 1089 CD2 LEU A 74 -0.336 6.544 -3.356 1.00 0.00 C ATOM 0 H LEU A 74 0.170 10.003 -6.701 1.00 0.00 H new ATOM 0 HA LEU A 74 -1.007 10.619 -4.211 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -1.042 8.439 -5.257 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.696 8.299 -5.083 1.00 0.00 H new ATOM 0 HG LEU A 74 0.437 8.378 -2.612 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.791 8.078 -1.617 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.639 9.637 -2.463 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -2.531 8.296 -3.221 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -0.474 6.108 -2.367 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -1.128 6.196 -4.019 1.00 0.00 H new ATOM 0 HD23 LEU A 74 0.631 6.240 -3.755 1.00 0.00 H new ATOM 1101 N GLU A 75 0.677 11.285 -2.595 1.00 0.00 N ATOM 1102 CA GLU A 75 1.648 11.826 -1.659 1.00 0.00 C ATOM 1103 C GLU A 75 2.414 10.692 -0.974 1.00 0.00 C ATOM 1104 O GLU A 75 2.362 10.552 0.247 1.00 0.00 O ATOM 1105 CB GLU A 75 0.971 12.731 -0.628 1.00 0.00 C ATOM 1106 CG GLU A 75 0.753 14.137 -1.191 1.00 0.00 C ATOM 1107 CD GLU A 75 -0.082 14.988 -0.232 1.00 0.00 C ATOM 1108 OE1 GLU A 75 0.450 15.308 0.853 1.00 0.00 O ATOM 1109 OE2 GLU A 75 -1.233 15.300 -0.606 1.00 0.00 O ATOM 0 H GLU A 75 -0.292 11.336 -2.281 1.00 0.00 H new ATOM 0 HA GLU A 75 2.360 12.435 -2.216 1.00 0.00 H new ATOM 0 HB2 GLU A 75 0.014 12.301 -0.334 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.585 12.787 0.271 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.716 14.617 -1.364 1.00 0.00 H new ATOM 0 HG3 GLU A 75 0.251 14.072 -2.156 1.00 0.00 H new ATOM 1116 N LEU A 76 3.108 9.913 -1.790 1.00 0.00 N ATOM 1117 CA LEU A 76 3.884 8.796 -1.279 1.00 0.00 C ATOM 1118 C LEU A 76 5.371 9.155 -1.312 1.00 0.00 C ATOM 1119 O LEU A 76 5.801 9.954 -2.142 1.00 0.00 O ATOM 1120 CB LEU A 76 3.544 7.513 -2.041 1.00 0.00 C ATOM 1121 CG LEU A 76 3.924 6.202 -1.350 1.00 0.00 C ATOM 1122 CD1 LEU A 76 3.009 5.927 -0.156 1.00 0.00 C ATOM 1123 CD2 LEU A 76 3.932 5.040 -2.346 1.00 0.00 C ATOM 0 H LEU A 76 3.149 10.033 -2.802 1.00 0.00 H new ATOM 0 HA LEU A 76 3.626 8.599 -0.238 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.471 7.502 -2.233 1.00 0.00 H new ATOM 0 HB3 LEU A 76 4.041 7.547 -3.010 1.00 0.00 H new ATOM 0 HG LEU A 76 4.938 6.301 -0.962 1.00 0.00 H new ATOM 0 HD11 LEU A 76 3.300 4.989 0.317 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.097 6.740 0.565 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.976 5.855 -0.498 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.205 4.120 -1.829 1.00 0.00 H new ATOM 0 HD22 LEU A 76 2.940 4.929 -2.784 1.00 0.00 H new ATOM 0 HD23 LEU A 76 4.657 5.242 -3.135 1.00 0.00 H new ATOM 1135 N GLU A 77 6.114 8.548 -0.399 1.00 0.00 N ATOM 1136 CA GLU A 77 7.544 8.794 -0.313 1.00 0.00 C ATOM 1137 C GLU A 77 8.292 7.487 -0.045 1.00 0.00 C ATOM 1138 O GLU A 77 7.747 6.570 0.567 1.00 0.00 O ATOM 1139 CB GLU A 77 7.857 9.836 0.762 1.00 0.00 C ATOM 1140 CG GLU A 77 6.756 9.878 1.823 1.00 0.00 C ATOM 1141 CD GLU A 77 7.003 11.006 2.826 1.00 0.00 C ATOM 1142 OE1 GLU A 77 6.657 12.157 2.483 1.00 0.00 O ATOM 1143 OE2 GLU A 77 7.533 10.692 3.914 1.00 0.00 O ATOM 0 H GLU A 77 5.753 7.886 0.288 1.00 0.00 H new ATOM 0 HA GLU A 77 7.883 9.194 -1.269 1.00 0.00 H new ATOM 0 HB2 GLU A 77 8.812 9.602 1.233 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.961 10.819 0.302 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.788 10.020 1.342 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.715 8.923 2.347 1.00 0.00 H new ATOM 1150 N ASN A 78 9.530 7.443 -0.517 1.00 0.00 N ATOM 1151 CA ASN A 78 10.359 6.264 -0.335 1.00 0.00 C ATOM 1152 C ASN A 78 10.260 5.795 1.118 1.00 0.00 C ATOM 1153 O ASN A 78 10.356 4.601 1.397 1.00 0.00 O ATOM 1154 CB ASN A 78 11.827 6.571 -0.634 1.00 0.00 C ATOM 1155 CG ASN A 78 12.005 7.047 -2.078 1.00 0.00 C ATOM 1156 OD1 ASN A 78 12.065 6.266 -3.013 1.00 0.00 O ATOM 1157 ND2 ASN A 78 12.085 8.369 -2.206 1.00 0.00 N ATOM 0 H ASN A 78 9.978 8.205 -1.025 1.00 0.00 H new ATOM 0 HA ASN A 78 10.005 5.494 -1.021 1.00 0.00 H new ATOM 0 HB2 ASN A 78 12.189 7.337 0.052 1.00 0.00 H new ATOM 0 HB3 ASN A 78 12.431 5.679 -0.464 1.00 0.00 H new ATOM 0 HD21 ASN A 78 12.204 8.786 -3.129 1.00 0.00 H new ATOM 0 HD22 ASN A 78 12.027 8.966 -1.381 1.00 0.00 H new ATOM 1164 N GLU A 79 10.071 6.760 2.006 1.00 0.00 N ATOM 1165 CA GLU A 79 9.958 6.461 3.423 1.00 0.00 C ATOM 1166 C GLU A 79 8.792 5.503 3.673 1.00 0.00 C ATOM 1167 O GLU A 79 8.956 4.480 4.335 1.00 0.00 O ATOM 1168 CB GLU A 79 9.799 7.743 4.243 1.00 0.00 C ATOM 1169 CG GLU A 79 10.946 7.901 5.243 1.00 0.00 C ATOM 1170 CD GLU A 79 10.420 8.313 6.620 1.00 0.00 C ATOM 1171 OE1 GLU A 79 9.702 9.334 6.671 1.00 0.00 O ATOM 1172 OE2 GLU A 79 10.749 7.596 7.590 1.00 0.00 O ATOM 0 H GLU A 79 9.993 7.750 1.771 1.00 0.00 H new ATOM 0 HA GLU A 79 10.878 5.974 3.745 1.00 0.00 H new ATOM 0 HB2 GLU A 79 9.772 8.605 3.576 1.00 0.00 H new ATOM 0 HB3 GLU A 79 8.848 7.723 4.775 1.00 0.00 H new ATOM 0 HG2 GLU A 79 11.494 6.962 5.325 1.00 0.00 H new ATOM 0 HG3 GLU A 79 11.650 8.650 4.879 1.00 0.00 H new ATOM 1179 N ASP A 80 7.641 5.868 3.129 1.00 0.00 N ATOM 1180 CA ASP A 80 6.448 5.053 3.284 1.00 0.00 C ATOM 1181 C ASP A 80 6.781 3.599 2.944 1.00 0.00 C ATOM 1182 O ASP A 80 6.405 2.685 3.676 1.00 0.00 O ATOM 1183 CB ASP A 80 5.337 5.517 2.339 1.00 0.00 C ATOM 1184 CG ASP A 80 4.648 6.822 2.743 1.00 0.00 C ATOM 1185 OD1 ASP A 80 4.316 6.941 3.942 1.00 0.00 O ATOM 1186 OD2 ASP A 80 4.468 7.670 1.843 1.00 0.00 O ATOM 0 H ASP A 80 7.509 6.717 2.580 1.00 0.00 H new ATOM 0 HA ASP A 80 6.107 5.147 4.315 1.00 0.00 H new ATOM 0 HB2 ASP A 80 5.757 5.639 1.341 1.00 0.00 H new ATOM 0 HB3 ASP A 80 4.584 4.731 2.274 1.00 0.00 H new ATOM 1191 N VAL A 81 7.483 3.430 1.833 1.00 0.00 N ATOM 1192 CA VAL A 81 7.871 2.103 1.387 1.00 0.00 C ATOM 1193 C VAL A 81 8.771 1.458 2.443 1.00 0.00 C ATOM 1194 O VAL A 81 8.602 0.285 2.775 1.00 0.00 O ATOM 1195 CB VAL A 81 8.530 2.185 0.009 1.00 0.00 C ATOM 1196 CG1 VAL A 81 8.903 0.793 -0.504 1.00 0.00 C ATOM 1197 CG2 VAL A 81 7.627 2.914 -0.988 1.00 0.00 C ATOM 0 H VAL A 81 7.793 4.191 1.228 1.00 0.00 H new ATOM 0 HA VAL A 81 6.993 1.466 1.275 1.00 0.00 H new ATOM 0 HB VAL A 81 9.450 2.761 0.111 1.00 0.00 H new ATOM 0 HG11 VAL A 81 9.370 0.880 -1.485 1.00 0.00 H new ATOM 0 HG12 VAL A 81 9.601 0.325 0.190 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.004 0.181 -0.583 1.00 0.00 H new ATOM 0 HG21 VAL A 81 8.119 2.958 -1.960 1.00 0.00 H new ATOM 0 HG22 VAL A 81 6.683 2.378 -1.084 1.00 0.00 H new ATOM 0 HG23 VAL A 81 7.435 3.926 -0.632 1.00 0.00 H new ATOM 1207 N TYR A 82 9.707 2.252 2.941 1.00 0.00 N ATOM 1208 CA TYR A 82 10.634 1.773 3.953 1.00 0.00 C ATOM 1209 C TYR A 82 9.901 1.438 5.253 1.00 0.00 C ATOM 1210 O TYR A 82 10.463 0.794 6.138 1.00 0.00 O ATOM 1211 CB TYR A 82 11.607 2.924 4.212 1.00 0.00 C ATOM 1212 CG TYR A 82 12.400 3.359 2.977 1.00 0.00 C ATOM 1213 CD1 TYR A 82 12.536 2.499 1.907 1.00 0.00 C ATOM 1214 CD2 TYR A 82 12.978 4.611 2.934 1.00 0.00 C ATOM 1215 CE1 TYR A 82 13.282 2.908 0.745 1.00 0.00 C ATOM 1216 CE2 TYR A 82 13.724 5.020 1.772 1.00 0.00 C ATOM 1217 CZ TYR A 82 13.840 4.148 0.735 1.00 0.00 C ATOM 1218 OH TYR A 82 14.544 4.535 -0.362 1.00 0.00 O ATOM 0 H TYR A 82 9.844 3.224 2.663 1.00 0.00 H new ATOM 0 HA TYR A 82 11.138 0.868 3.614 1.00 0.00 H new ATOM 0 HB2 TYR A 82 11.049 3.779 4.592 1.00 0.00 H new ATOM 0 HB3 TYR A 82 12.306 2.626 4.994 1.00 0.00 H new ATOM 0 HD1 TYR A 82 12.083 1.519 1.941 1.00 0.00 H new ATOM 0 HD2 TYR A 82 12.871 5.284 3.772 1.00 0.00 H new ATOM 0 HE1 TYR A 82 13.396 2.245 -0.100 1.00 0.00 H new ATOM 0 HE2 TYR A 82 14.181 5.997 1.725 1.00 0.00 H new ATOM 0 HH TYR A 82 14.884 5.445 -0.229 1.00 0.00 H new ATOM 1228 N MET A 83 8.658 1.890 5.328 1.00 0.00 N ATOM 1229 CA MET A 83 7.842 1.646 6.505 1.00 0.00 C ATOM 1230 C MET A 83 6.955 0.414 6.313 1.00 0.00 C ATOM 1231 O MET A 83 6.855 -0.429 7.203 1.00 0.00 O ATOM 1232 CB MET A 83 6.966 2.869 6.782 1.00 0.00 C ATOM 1233 CG MET A 83 7.116 3.335 8.231 1.00 0.00 C ATOM 1234 SD MET A 83 6.911 1.953 9.342 1.00 0.00 S ATOM 1235 CE MET A 83 8.588 1.773 9.926 1.00 0.00 C ATOM 0 H MET A 83 8.196 2.424 4.592 1.00 0.00 H new ATOM 0 HA MET A 83 8.504 1.464 7.351 1.00 0.00 H new ATOM 0 HB2 MET A 83 7.241 3.678 6.106 1.00 0.00 H new ATOM 0 HB3 MET A 83 5.923 2.626 6.581 1.00 0.00 H new ATOM 0 HG2 MET A 83 8.097 3.787 8.377 1.00 0.00 H new ATOM 0 HG3 MET A 83 6.375 4.103 8.453 1.00 0.00 H new ATOM 0 HE1 MET A 83 8.847 0.715 9.968 1.00 0.00 H new ATOM 0 HE2 MET A 83 9.267 2.287 9.246 1.00 0.00 H new ATOM 0 HE3 MET A 83 8.675 2.207 10.922 1.00 0.00 H new ATOM 1245 N ALA A 84 6.333 0.350 5.145 1.00 0.00 N ATOM 1246 CA ALA A 84 5.457 -0.764 4.824 1.00 0.00 C ATOM 1247 C ALA A 84 6.065 -1.571 3.675 1.00 0.00 C ATOM 1248 O ALA A 84 5.721 -1.359 2.513 1.00 0.00 O ATOM 1249 CB ALA A 84 4.060 -0.236 4.490 1.00 0.00 C ATOM 0 H ALA A 84 6.418 1.051 4.409 1.00 0.00 H new ATOM 0 HA ALA A 84 5.357 -1.432 5.680 1.00 0.00 H new ATOM 0 HB1 ALA A 84 3.403 -1.072 4.249 1.00 0.00 H new ATOM 0 HB2 ALA A 84 3.660 0.304 5.348 1.00 0.00 H new ATOM 0 HB3 ALA A 84 4.120 0.436 3.634 1.00 0.00 H new ATOM 1255 N SER A 85 6.959 -2.478 4.039 1.00 0.00 N ATOM 1256 CA SER A 85 7.619 -3.317 3.053 1.00 0.00 C ATOM 1257 C SER A 85 6.636 -4.356 2.509 1.00 0.00 C ATOM 1258 O SER A 85 6.770 -4.807 1.373 1.00 0.00 O ATOM 1259 CB SER A 85 8.845 -4.009 3.651 1.00 0.00 C ATOM 1260 OG SER A 85 8.488 -4.968 4.642 1.00 0.00 O ATOM 0 H SER A 85 7.242 -2.651 5.004 1.00 0.00 H new ATOM 0 HA SER A 85 7.957 -2.682 2.234 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.407 -4.501 2.857 1.00 0.00 H new ATOM 0 HB3 SER A 85 9.504 -3.261 4.092 1.00 0.00 H new ATOM 0 HG SER A 85 9.299 -5.388 4.998 1.00 0.00 H new ATOM 1266 N THR A 86 5.670 -4.705 3.346 1.00 0.00 N ATOM 1267 CA THR A 86 4.665 -5.683 2.963 1.00 0.00 C ATOM 1268 C THR A 86 3.445 -4.984 2.360 1.00 0.00 C ATOM 1269 O THR A 86 3.050 -3.912 2.816 1.00 0.00 O ATOM 1270 CB THR A 86 4.335 -6.528 4.194 1.00 0.00 C ATOM 1271 OG1 THR A 86 4.332 -5.592 5.268 1.00 0.00 O ATOM 1272 CG2 THR A 86 5.457 -7.504 4.553 1.00 0.00 C ATOM 0 H THR A 86 5.562 -4.328 4.288 1.00 0.00 H new ATOM 0 HA THR A 86 5.037 -6.349 2.184 1.00 0.00 H new ATOM 0 HB THR A 86 3.414 -7.084 4.016 1.00 0.00 H new ATOM 0 HG1 THR A 86 4.125 -6.056 6.106 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.171 -8.079 5.434 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.630 -8.182 3.718 1.00 0.00 H new ATOM 0 HG23 THR A 86 6.370 -6.947 4.764 1.00 0.00 H new ATOM 1280 N PHE A 87 2.880 -5.621 1.344 1.00 0.00 N ATOM 1281 CA PHE A 87 1.713 -5.074 0.674 1.00 0.00 C ATOM 1282 C PHE A 87 0.582 -4.811 1.671 1.00 0.00 C ATOM 1283 O PHE A 87 0.128 -3.677 1.814 1.00 0.00 O ATOM 1284 CB PHE A 87 1.249 -6.121 -0.341 1.00 0.00 C ATOM 1285 CG PHE A 87 0.179 -5.615 -1.311 1.00 0.00 C ATOM 1286 CD1 PHE A 87 0.539 -4.874 -2.393 1.00 0.00 C ATOM 1287 CD2 PHE A 87 -1.131 -5.908 -1.092 1.00 0.00 C ATOM 1288 CE1 PHE A 87 -0.454 -4.404 -3.294 1.00 0.00 C ATOM 1289 CE2 PHE A 87 -2.123 -5.438 -1.993 1.00 0.00 C ATOM 1290 CZ PHE A 87 -1.764 -4.697 -3.075 1.00 0.00 C ATOM 0 H PHE A 87 3.209 -6.511 0.969 1.00 0.00 H new ATOM 0 HA PHE A 87 1.967 -4.128 0.196 1.00 0.00 H new ATOM 0 HB2 PHE A 87 2.111 -6.464 -0.913 1.00 0.00 H new ATOM 0 HB3 PHE A 87 0.858 -6.985 0.196 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.579 -4.643 -2.567 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -1.417 -6.498 -0.233 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -0.169 -3.814 -4.153 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.163 -5.669 -1.819 1.00 0.00 H new ATOM 0 HZ PHE A 87 -2.519 -4.341 -3.760 1.00 0.00 H new ATOM 1300 N GLY A 88 0.160 -5.877 2.334 1.00 0.00 N ATOM 1301 CA GLY A 88 -0.909 -5.775 3.313 1.00 0.00 C ATOM 1302 C GLY A 88 -0.825 -4.455 4.081 1.00 0.00 C ATOM 1303 O GLY A 88 -1.751 -3.647 4.037 1.00 0.00 O ATOM 0 H GLY A 88 0.539 -6.816 2.213 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.874 -5.847 2.812 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.849 -6.610 4.011 1.00 0.00 H new ATOM 1307 N ASP A 89 0.295 -4.277 4.767 1.00 0.00 N ATOM 1308 CA ASP A 89 0.512 -3.068 5.544 1.00 0.00 C ATOM 1309 C ASP A 89 0.439 -1.852 4.618 1.00 0.00 C ATOM 1310 O ASP A 89 -0.379 -0.957 4.826 1.00 0.00 O ATOM 1311 CB ASP A 89 1.892 -3.078 6.204 1.00 0.00 C ATOM 1312 CG ASP A 89 1.907 -2.672 7.679 1.00 0.00 C ATOM 1313 OD1 ASP A 89 1.213 -3.355 8.462 1.00 0.00 O ATOM 1314 OD2 ASP A 89 2.611 -1.687 7.989 1.00 0.00 O ATOM 0 H ASP A 89 1.061 -4.949 4.801 1.00 0.00 H new ATOM 0 HA ASP A 89 -0.256 -3.020 6.316 1.00 0.00 H new ATOM 0 HB2 ASP A 89 2.314 -4.079 6.114 1.00 0.00 H new ATOM 0 HB3 ASP A 89 2.547 -2.405 5.651 1.00 0.00 H new ATOM 1319 N PHE A 90 1.306 -1.858 3.616 1.00 0.00 N ATOM 1320 CA PHE A 90 1.351 -0.767 2.658 1.00 0.00 C ATOM 1321 C PHE A 90 -0.060 -0.320 2.271 1.00 0.00 C ATOM 1322 O PHE A 90 -0.399 0.856 2.396 1.00 0.00 O ATOM 1323 CB PHE A 90 2.066 -1.294 1.413 1.00 0.00 C ATOM 1324 CG PHE A 90 2.252 -0.247 0.312 1.00 0.00 C ATOM 1325 CD1 PHE A 90 3.315 0.600 0.353 1.00 0.00 C ATOM 1326 CD2 PHE A 90 1.355 -0.164 -0.706 1.00 0.00 C ATOM 1327 CE1 PHE A 90 3.488 1.572 -0.668 1.00 0.00 C ATOM 1328 CE2 PHE A 90 1.528 0.807 -1.727 1.00 0.00 C ATOM 1329 CZ PHE A 90 2.591 1.655 -1.687 1.00 0.00 C ATOM 0 H PHE A 90 1.983 -2.602 3.447 1.00 0.00 H new ATOM 0 HA PHE A 90 1.868 0.089 3.092 1.00 0.00 H new ATOM 0 HB2 PHE A 90 3.044 -1.678 1.703 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.500 -2.134 1.010 1.00 0.00 H new ATOM 0 HD1 PHE A 90 4.028 0.534 1.162 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.511 -0.837 -0.738 1.00 0.00 H new ATOM 0 HE1 PHE A 90 4.332 2.245 -0.635 1.00 0.00 H new ATOM 0 HE2 PHE A 90 0.815 0.873 -2.536 1.00 0.00 H new ATOM 0 HZ PHE A 90 2.723 2.394 -2.464 1.00 0.00 H new ATOM 1339 N ILE A 91 -0.845 -1.282 1.807 1.00 0.00 N ATOM 1340 CA ILE A 91 -2.211 -1.002 1.400 1.00 0.00 C ATOM 1341 C ILE A 91 -2.866 -0.078 2.429 1.00 0.00 C ATOM 1342 O ILE A 91 -3.365 0.991 2.080 1.00 0.00 O ATOM 1343 CB ILE A 91 -2.979 -2.305 1.168 1.00 0.00 C ATOM 1344 CG1 ILE A 91 -2.499 -3.004 -0.106 1.00 0.00 C ATOM 1345 CG2 ILE A 91 -4.488 -2.057 1.153 1.00 0.00 C ATOM 1346 CD1 ILE A 91 -2.761 -2.136 -1.339 1.00 0.00 C ATOM 0 H ILE A 91 -0.560 -2.256 1.704 1.00 0.00 H new ATOM 0 HA ILE A 91 -2.223 -0.477 0.445 1.00 0.00 H new ATOM 0 HB ILE A 91 -2.773 -2.977 2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -1.433 -3.219 -0.028 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -3.010 -3.961 -0.215 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -5.010 -2.999 0.986 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -4.797 -1.635 2.109 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.734 -1.359 0.352 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.411 -2.656 -2.231 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -3.830 -1.943 -1.428 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -2.229 -1.190 -1.238 1.00 0.00 H new ATOM 1358 N GLN A 92 -2.843 -0.523 3.676 1.00 0.00 N ATOM 1359 CA GLN A 92 -3.428 0.250 4.758 1.00 0.00 C ATOM 1360 C GLN A 92 -2.932 1.697 4.705 1.00 0.00 C ATOM 1361 O GLN A 92 -3.726 2.633 4.783 1.00 0.00 O ATOM 1362 CB GLN A 92 -3.122 -0.386 6.115 1.00 0.00 C ATOM 1363 CG GLN A 92 -3.290 -1.905 6.059 1.00 0.00 C ATOM 1364 CD GLN A 92 -4.450 -2.295 5.140 1.00 0.00 C ATOM 1365 OE1 GLN A 92 -4.265 -2.801 4.046 1.00 0.00 O ATOM 1366 NE2 GLN A 92 -5.652 -2.032 5.645 1.00 0.00 N ATOM 0 H GLN A 92 -2.428 -1.410 3.962 1.00 0.00 H new ATOM 0 HA GLN A 92 -4.511 0.253 4.632 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -2.103 -0.140 6.414 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -3.786 0.029 6.873 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -2.368 -2.363 5.701 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -3.470 -2.292 7.062 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -5.735 -1.607 6.568 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -6.490 -2.256 5.109 1.00 0.00 H new ATOM 1375 N LEU A 93 -1.621 1.834 4.573 1.00 0.00 N ATOM 1376 CA LEU A 93 -1.009 3.150 4.509 1.00 0.00 C ATOM 1377 C LEU A 93 -1.502 3.877 3.256 1.00 0.00 C ATOM 1378 O LEU A 93 -1.871 5.048 3.319 1.00 0.00 O ATOM 1379 CB LEU A 93 0.515 3.038 4.596 1.00 0.00 C ATOM 1380 CG LEU A 93 1.310 4.050 3.768 1.00 0.00 C ATOM 1381 CD1 LEU A 93 2.501 4.591 4.561 1.00 0.00 C ATOM 1382 CD2 LEU A 93 1.738 3.447 2.429 1.00 0.00 C ATOM 0 H LEU A 93 -0.966 1.055 4.509 1.00 0.00 H new ATOM 0 HA LEU A 93 -1.310 3.752 5.366 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.808 3.143 5.641 1.00 0.00 H new ATOM 0 HB3 LEU A 93 0.804 2.035 4.283 1.00 0.00 H new ATOM 0 HG LEU A 93 0.660 4.896 3.546 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.049 5.308 3.950 1.00 0.00 H new ATOM 0 HD12 LEU A 93 2.143 5.084 5.465 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.161 3.767 4.834 1.00 0.00 H new ATOM 0 HD21 LEU A 93 2.301 4.187 1.860 1.00 0.00 H new ATOM 0 HD22 LEU A 93 2.364 2.573 2.607 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.854 3.151 1.864 1.00 0.00 H new ATOM 1394 N LEU A 94 -1.492 3.151 2.148 1.00 0.00 N ATOM 1395 CA LEU A 94 -1.934 3.711 0.882 1.00 0.00 C ATOM 1396 C LEU A 94 -3.380 4.192 1.019 1.00 0.00 C ATOM 1397 O LEU A 94 -3.668 5.370 0.817 1.00 0.00 O ATOM 1398 CB LEU A 94 -1.724 2.706 -0.251 1.00 0.00 C ATOM 1399 CG LEU A 94 -2.632 2.872 -1.472 1.00 0.00 C ATOM 1400 CD1 LEU A 94 -2.129 3.997 -2.379 1.00 0.00 C ATOM 1401 CD2 LEU A 94 -2.782 1.551 -2.228 1.00 0.00 C ATOM 0 H LEU A 94 -1.185 2.180 2.100 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.332 4.581 0.619 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.688 2.773 -0.582 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.867 1.702 0.149 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.625 3.157 -1.123 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.791 4.095 -3.239 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.116 4.934 -1.823 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.121 3.765 -2.722 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.432 1.697 -3.091 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.803 1.211 -2.565 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.219 0.802 -1.568 1.00 0.00 H new ATOM 1413 N VAL A 95 -4.251 3.254 1.362 1.00 0.00 N ATOM 1414 CA VAL A 95 -5.661 3.567 1.528 1.00 0.00 C ATOM 1415 C VAL A 95 -5.800 4.874 2.310 1.00 0.00 C ATOM 1416 O VAL A 95 -6.634 5.715 1.978 1.00 0.00 O ATOM 1417 CB VAL A 95 -6.382 2.392 2.192 1.00 0.00 C ATOM 1418 CG1 VAL A 95 -7.817 2.771 2.564 1.00 0.00 C ATOM 1419 CG2 VAL A 95 -6.357 1.154 1.295 1.00 0.00 C ATOM 0 H VAL A 95 -4.008 2.278 1.529 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.137 3.717 0.559 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.850 2.148 3.111 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.308 1.919 3.034 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -7.803 3.611 3.259 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.364 3.054 1.664 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.876 0.334 1.792 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.853 1.379 0.351 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.324 0.865 1.102 1.00 0.00 H new ATOM 1429 N ARG A 96 -4.970 5.005 3.335 1.00 0.00 N ATOM 1430 CA ARG A 96 -4.990 6.195 4.167 1.00 0.00 C ATOM 1431 C ARG A 96 -4.695 7.437 3.323 1.00 0.00 C ATOM 1432 O ARG A 96 -5.423 8.427 3.393 1.00 0.00 O ATOM 1433 CB ARG A 96 -3.960 6.097 5.294 1.00 0.00 C ATOM 1434 CG ARG A 96 -4.646 6.067 6.662 1.00 0.00 C ATOM 1435 CD ARG A 96 -3.615 6.007 7.791 1.00 0.00 C ATOM 1436 NE ARG A 96 -4.278 6.231 9.094 1.00 0.00 N ATOM 1437 CZ ARG A 96 -3.642 6.641 10.200 1.00 0.00 C ATOM 1438 NH1 ARG A 96 -2.323 6.875 10.167 1.00 0.00 N ATOM 1439 NH2 ARG A 96 -4.325 6.817 11.340 1.00 0.00 N ATOM 0 H ARG A 96 -4.279 4.306 3.608 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.985 6.276 4.605 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -3.359 5.197 5.165 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -3.278 6.946 5.243 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -5.269 6.954 6.780 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -5.307 5.203 6.722 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.117 5.037 7.789 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -2.844 6.761 7.631 1.00 0.00 H new ATOM 0 HE ARG A 96 -5.282 6.063 9.155 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -1.803 6.741 9.300 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -1.839 7.187 11.009 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -5.329 6.639 11.366 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -3.841 7.129 12.182 1.00 0.00 H new ATOM 1453 N LYS A 97 -3.626 7.345 2.545 1.00 0.00 N ATOM 1454 CA LYS A 97 -3.227 8.449 1.690 1.00 0.00 C ATOM 1455 C LYS A 97 -4.309 8.690 0.635 1.00 0.00 C ATOM 1456 O LYS A 97 -4.585 9.832 0.273 1.00 0.00 O ATOM 1457 CB LYS A 97 -1.839 8.194 1.098 1.00 0.00 C ATOM 1458 CG LYS A 97 -0.772 8.165 2.195 1.00 0.00 C ATOM 1459 CD LYS A 97 0.205 7.007 1.980 1.00 0.00 C ATOM 1460 CE LYS A 97 1.384 7.097 2.950 1.00 0.00 C ATOM 1461 NZ LYS A 97 2.198 8.300 2.667 1.00 0.00 N ATOM 0 H LYS A 97 -3.025 6.523 2.489 1.00 0.00 H new ATOM 0 HA LYS A 97 -3.138 9.367 2.271 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.838 7.246 0.559 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -1.600 8.973 0.374 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -0.227 9.109 2.202 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -1.250 8.066 3.170 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.314 6.058 2.119 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.572 7.022 0.954 1.00 0.00 H new ATOM 0 HE2 LYS A 97 1.017 7.132 3.976 1.00 0.00 H new ATOM 0 HE3 LYS A 97 2.003 6.204 2.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 2.730 8.567 3.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 2.863 8.095 1.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 1.574 9.084 2.389 1.00 0.00 H new ATOM 1475 N LEU A 98 -4.894 7.594 0.173 1.00 0.00 N ATOM 1476 CA LEU A 98 -5.940 7.672 -0.832 1.00 0.00 C ATOM 1477 C LEU A 98 -7.163 8.372 -0.236 1.00 0.00 C ATOM 1478 O LEU A 98 -7.633 9.373 -0.775 1.00 0.00 O ATOM 1479 CB LEU A 98 -6.242 6.283 -1.399 1.00 0.00 C ATOM 1480 CG LEU A 98 -5.131 5.643 -2.234 1.00 0.00 C ATOM 1481 CD1 LEU A 98 -5.666 4.463 -3.047 1.00 0.00 C ATOM 1482 CD2 LEU A 98 -4.441 6.683 -3.119 1.00 0.00 C ATOM 0 H LEU A 98 -4.663 6.648 0.476 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.610 8.273 -1.680 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.475 5.616 -0.569 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -7.139 6.351 -2.015 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.377 5.249 -1.553 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.856 4.027 -3.631 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.073 3.710 -2.372 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.451 4.810 -3.718 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.656 6.201 -3.702 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.172 7.129 -3.794 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.003 7.461 -2.493 1.00 0.00 H new ATOM 1494 N ARG A 99 -7.643 7.817 0.867 1.00 0.00 N ATOM 1495 CA ARG A 99 -8.803 8.376 1.542 1.00 0.00 C ATOM 1496 C ARG A 99 -8.660 9.894 1.672 1.00 0.00 C ATOM 1497 O ARG A 99 -9.564 10.640 1.298 1.00 0.00 O ATOM 1498 CB ARG A 99 -8.977 7.766 2.934 1.00 0.00 C ATOM 1499 CG ARG A 99 -9.804 6.480 2.869 1.00 0.00 C ATOM 1500 CD ARG A 99 -9.468 5.552 4.038 1.00 0.00 C ATOM 1501 NE ARG A 99 -10.115 4.236 3.841 1.00 0.00 N ATOM 1502 CZ ARG A 99 -10.414 3.390 4.837 1.00 0.00 C ATOM 1503 NH1 ARG A 99 -10.127 3.718 6.104 1.00 0.00 N ATOM 1504 NH2 ARG A 99 -11.001 2.216 4.565 1.00 0.00 N ATOM 0 H ARG A 99 -7.250 6.987 1.310 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.682 8.140 0.942 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.999 7.553 3.366 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -9.466 8.485 3.591 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -10.866 6.725 2.888 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -9.612 5.967 1.926 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -8.388 5.428 4.116 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -9.806 5.996 4.974 1.00 0.00 H new ATOM 0 HE ARG A 99 -10.348 3.955 2.888 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -9.681 4.612 6.311 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -10.355 3.074 6.862 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -11.220 1.967 3.600 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -11.229 1.572 5.323 1.00 0.00 H new ATOM 1518 N GLY A 100 -7.519 10.306 2.204 1.00 0.00 N ATOM 1519 CA GLY A 100 -7.247 11.721 2.388 1.00 0.00 C ATOM 1520 C GLY A 100 -7.188 12.079 3.875 1.00 0.00 C ATOM 1521 O GLY A 100 -8.076 12.757 4.389 1.00 0.00 O ATOM 0 H GLY A 100 -6.772 9.684 2.514 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -6.302 11.978 1.910 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -8.022 12.311 1.899 1.00 0.00 H new ATOM 1525 N ASP A 101 -6.133 11.607 4.523 1.00 0.00 N ATOM 1526 CA ASP A 101 -5.947 11.869 5.940 1.00 0.00 C ATOM 1527 C ASP A 101 -7.122 11.279 6.722 1.00 0.00 C ATOM 1528 O ASP A 101 -8.174 10.999 6.150 1.00 0.00 O ATOM 1529 CB ASP A 101 -5.900 13.373 6.221 1.00 0.00 C ATOM 1530 CG ASP A 101 -5.742 13.750 7.695 1.00 0.00 C ATOM 1531 OD1 ASP A 101 -4.914 13.094 8.363 1.00 0.00 O ATOM 1532 OD2 ASP A 101 -6.452 14.687 8.120 1.00 0.00 O ATOM 0 H ASP A 101 -5.398 11.045 4.093 1.00 0.00 H new ATOM 0 HA ASP A 101 -5.004 11.415 6.246 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -5.072 13.807 5.660 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -6.815 13.827 5.841 1.00 0.00 H new ATOM 1537 N ASP A 102 -6.903 11.108 8.017 1.00 0.00 N ATOM 1538 CA ASP A 102 -7.931 10.556 8.884 1.00 0.00 C ATOM 1539 C ASP A 102 -8.705 11.700 9.542 1.00 0.00 C ATOM 1540 O ASP A 102 -8.110 12.675 9.997 1.00 0.00 O ATOM 1541 CB ASP A 102 -7.316 9.701 9.993 1.00 0.00 C ATOM 1542 CG ASP A 102 -6.434 8.549 9.509 1.00 0.00 C ATOM 1543 OD1 ASP A 102 -5.286 8.841 9.110 1.00 0.00 O ATOM 1544 OD2 ASP A 102 -6.928 7.401 9.548 1.00 0.00 O ATOM 0 H ASP A 102 -6.029 11.342 8.488 1.00 0.00 H new ATOM 0 HA ASP A 102 -8.589 9.936 8.275 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -6.722 10.346 10.641 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -8.121 9.291 10.603 1.00 0.00 H new ATOM 1549 N GLU A 103 -10.020 11.541 9.572 1.00 0.00 N ATOM 1550 CA GLU A 103 -10.882 12.549 10.167 1.00 0.00 C ATOM 1551 C GLU A 103 -10.615 12.655 11.670 1.00 0.00 C ATOM 1552 O GLU A 103 -11.054 11.804 12.443 1.00 0.00 O ATOM 1553 CB GLU A 103 -12.355 12.242 9.892 1.00 0.00 C ATOM 1554 CG GLU A 103 -12.905 13.141 8.783 1.00 0.00 C ATOM 1555 CD GLU A 103 -14.230 13.781 9.202 1.00 0.00 C ATOM 1556 OE1 GLU A 103 -15.163 13.006 9.507 1.00 0.00 O ATOM 1557 OE2 GLU A 103 -14.281 15.030 9.209 1.00 0.00 O ATOM 0 H GLU A 103 -10.510 10.730 9.194 1.00 0.00 H new ATOM 0 HA GLU A 103 -10.654 13.511 9.708 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -12.465 11.196 9.605 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -12.936 12.385 10.803 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -12.179 13.920 8.548 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -13.051 12.556 7.875 1.00 0.00 H new ATOM 1564 N GLU A 104 -9.898 13.706 12.038 1.00 0.00 N ATOM 1565 CA GLU A 104 -9.568 13.934 13.435 1.00 0.00 C ATOM 1566 C GLU A 104 -8.766 15.228 13.586 1.00 0.00 C ATOM 1567 O GLU A 104 -8.154 15.699 12.629 1.00 0.00 O ATOM 1568 CB GLU A 104 -8.803 12.744 14.019 1.00 0.00 C ATOM 1569 CG GLU A 104 -7.429 12.600 13.362 1.00 0.00 C ATOM 1570 CD GLU A 104 -6.313 12.651 14.408 1.00 0.00 C ATOM 1571 OE1 GLU A 104 -5.883 13.782 14.724 1.00 0.00 O ATOM 1572 OE2 GLU A 104 -5.916 11.559 14.869 1.00 0.00 O ATOM 0 H GLU A 104 -9.536 14.409 11.394 1.00 0.00 H new ATOM 0 HA GLU A 104 -10.497 14.037 13.996 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.684 12.876 15.094 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.378 11.830 13.872 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.379 11.657 12.818 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -7.285 13.397 12.633 1.00 0.00 H new ATOM 1579 N SER A 105 -8.796 15.767 14.796 1.00 0.00 N ATOM 1580 CA SER A 105 -8.079 16.998 15.085 1.00 0.00 C ATOM 1581 C SER A 105 -7.156 16.796 16.288 1.00 0.00 C ATOM 1582 O SER A 105 -7.557 16.208 17.291 1.00 0.00 O ATOM 1583 CB SER A 105 -9.050 18.151 15.349 1.00 0.00 C ATOM 1584 OG SER A 105 -8.625 19.360 14.725 1.00 0.00 O ATOM 0 H SER A 105 -9.305 15.374 15.588 1.00 0.00 H new ATOM 0 HA SER A 105 -7.478 17.257 14.213 1.00 0.00 H new ATOM 0 HB2 SER A 105 -10.040 17.882 14.982 1.00 0.00 H new ATOM 0 HB3 SER A 105 -9.141 18.310 16.424 1.00 0.00 H new ATOM 0 HG SER A 105 -9.272 20.071 14.915 1.00 0.00 H new ATOM 1590 N GLY A 106 -5.936 17.295 16.147 1.00 0.00 N ATOM 1591 CA GLY A 106 -4.953 17.176 17.210 1.00 0.00 C ATOM 1592 C GLY A 106 -5.192 18.225 18.298 1.00 0.00 C ATOM 1593 O GLY A 106 -5.763 19.282 18.032 1.00 0.00 O ATOM 0 H GLY A 106 -5.607 17.782 15.313 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -5.002 16.178 17.645 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -3.951 17.296 16.798 1.00 0.00 H new ATOM 1597 N PRO A 107 -4.731 17.888 19.533 1.00 0.00 N ATOM 1598 CA PRO A 107 -4.890 18.788 20.662 1.00 0.00 C ATOM 1599 C PRO A 107 -3.904 19.955 20.575 1.00 0.00 C ATOM 1600 O PRO A 107 -3.101 20.163 21.484 1.00 0.00 O ATOM 1601 CB PRO A 107 -4.675 17.919 21.891 1.00 0.00 C ATOM 1602 CG PRO A 107 -3.950 16.677 21.401 1.00 0.00 C ATOM 1603 CD PRO A 107 -4.051 16.645 19.884 1.00 0.00 C ATOM 0 HA PRO A 107 -5.873 19.258 20.690 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -4.086 18.444 22.643 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.626 17.658 22.356 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -2.906 16.696 21.714 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -4.395 15.780 21.832 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -3.065 16.589 19.422 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -4.613 15.776 19.543 1.00 0.00 H new ATOM 1611 N SER A 108 -3.997 20.686 19.474 1.00 0.00 N ATOM 1612 CA SER A 108 -3.124 21.826 19.257 1.00 0.00 C ATOM 1613 C SER A 108 -1.660 21.385 19.325 1.00 0.00 C ATOM 1614 O SER A 108 -1.370 20.231 19.636 1.00 0.00 O ATOM 1615 CB SER A 108 -3.394 22.930 20.281 1.00 0.00 C ATOM 1616 OG SER A 108 -4.197 23.976 19.740 1.00 0.00 O ATOM 0 H SER A 108 -4.664 20.511 18.723 1.00 0.00 H new ATOM 0 HA SER A 108 -3.329 22.230 18.266 1.00 0.00 H new ATOM 0 HB2 SER A 108 -3.893 22.503 21.151 1.00 0.00 H new ATOM 0 HB3 SER A 108 -2.446 23.343 20.627 1.00 0.00 H new ATOM 0 HG SER A 108 -4.348 24.660 20.425 1.00 0.00 H new ATOM 1622 N SER A 109 -0.777 22.328 19.029 1.00 0.00 N ATOM 1623 CA SER A 109 0.649 22.051 19.053 1.00 0.00 C ATOM 1624 C SER A 109 1.435 23.359 19.161 1.00 0.00 C ATOM 1625 O SER A 109 2.162 23.573 20.130 1.00 0.00 O ATOM 1626 CB SER A 109 1.081 21.274 17.808 1.00 0.00 C ATOM 1627 OG SER A 109 2.266 20.517 18.034 1.00 0.00 O ATOM 0 H SER A 109 -1.022 23.284 18.771 1.00 0.00 H new ATOM 0 HA SER A 109 0.862 21.433 19.926 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.277 20.605 17.501 1.00 0.00 H new ATOM 0 HB3 SER A 109 1.247 21.970 16.986 1.00 0.00 H new ATOM 0 HG SER A 109 2.507 20.035 17.216 1.00 0.00 H new ATOM 1633 N GLY A 110 1.262 24.201 18.153 1.00 0.00 N ATOM 1634 CA GLY A 110 1.945 25.483 18.122 1.00 0.00 C ATOM 1635 C GLY A 110 1.385 26.429 19.187 1.00 0.00 C ATOM 1636 O GLY A 110 0.346 27.054 18.981 1.00 0.00 O ATOM 0 H GLY A 110 0.658 24.020 17.351 1.00 0.00 H new ATOM 0 HA2 GLY A 110 3.012 25.335 18.287 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.835 25.934 17.136 1.00 0.00 H new TER 1640 GLY A 110