USER MOD reduce.3.24.130724 H: found=0, std=0, add=713, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 711 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 48 GLN : amide:sc= -3.36 K(o=-5.7,f=-12!) USER MOD Set 1.2: A 79 MET CE :methyl -165:sc= -2.37 (180deg=-3.52!) 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 47:sc= 0.268 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -0.0678 X(o=-0.068,f=0) USER MOD Single : A 19 TYR OH : rot 180:sc= -0.308 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= -0.262 K(o=-0.26,f=-2.5!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -88:sc= 0.122 USER MOD Single : A 49 LYS NZ :NH3+ 176:sc= -0.795 (180deg=-0.886) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -147:sc= -0.0321 (180deg=-1.48) USER MOD Single : A 62 ASN : amide:sc= 0.477 K(o=0.48,f=-2.6!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -4.99! C(o=-5!,f=-7.4!) USER MOD Single : A 75 THR OG1 : rot 20:sc= -3.27 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 177:sc= 0 (180deg=-0.0138) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 21:sc= 0.229 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.138 9.189 4.085 1.00 0.00 N ATOM 2 CA GLY A 1 25.065 8.171 3.051 1.00 0.00 C ATOM 3 C GLY A 1 25.714 8.659 1.754 1.00 0.00 C ATOM 4 O GLY A 1 26.935 8.616 1.613 1.00 0.00 O ATOM 0 H1 GLY A 1 24.691 8.834 4.954 1.00 0.00 H new ATOM 0 H2 GLY A 1 26.134 9.418 4.277 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.641 10.045 3.765 1.00 0.00 H new ATOM 0 HA2 GLY A 1 25.564 7.264 3.393 1.00 0.00 H new ATOM 0 HA3 GLY A 1 24.023 7.911 2.865 1.00 0.00 H new ATOM 8 N SER A 2 24.868 9.111 0.840 1.00 0.00 N ATOM 9 CA SER A 2 25.344 9.606 -0.440 1.00 0.00 C ATOM 10 C SER A 2 24.269 10.473 -1.098 1.00 0.00 C ATOM 11 O SER A 2 24.551 11.581 -1.552 1.00 0.00 O ATOM 12 CB SER A 2 25.736 8.453 -1.365 1.00 0.00 C ATOM 13 OG SER A 2 24.690 7.493 -1.495 1.00 0.00 O ATOM 0 H SER A 2 23.856 9.145 0.961 1.00 0.00 H new ATOM 0 HA SER A 2 26.233 10.212 -0.263 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.990 8.848 -2.349 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.630 7.965 -0.977 1.00 0.00 H new ATOM 0 HG SER A 2 24.979 6.774 -2.095 1.00 0.00 H new ATOM 19 N SER A 3 23.058 9.936 -1.130 1.00 0.00 N ATOM 20 CA SER A 3 21.939 10.647 -1.725 1.00 0.00 C ATOM 21 C SER A 3 20.916 11.008 -0.647 1.00 0.00 C ATOM 22 O SER A 3 20.844 10.352 0.391 1.00 0.00 O ATOM 23 CB SER A 3 21.280 9.813 -2.825 1.00 0.00 C ATOM 24 OG SER A 3 20.603 8.675 -2.299 1.00 0.00 O ATOM 0 H SER A 3 22.827 9.017 -0.753 1.00 0.00 H new ATOM 0 HA SER A 3 22.317 11.563 -2.178 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.573 10.433 -3.376 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.039 9.487 -3.536 1.00 0.00 H new ATOM 0 HG SER A 3 20.194 8.170 -3.032 1.00 0.00 H new ATOM 30 N GLY A 4 20.148 12.050 -0.930 1.00 0.00 N ATOM 31 CA GLY A 4 19.132 12.507 0.003 1.00 0.00 C ATOM 32 C GLY A 4 17.742 12.033 -0.427 1.00 0.00 C ATOM 33 O GLY A 4 17.461 10.835 -0.421 1.00 0.00 O ATOM 0 H GLY A 4 20.209 12.591 -1.793 1.00 0.00 H new ATOM 0 HA2 GLY A 4 19.355 12.132 1.002 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.148 13.595 0.060 1.00 0.00 H new ATOM 37 N SER A 5 16.908 12.997 -0.788 1.00 0.00 N ATOM 38 CA SER A 5 15.554 12.694 -1.219 1.00 0.00 C ATOM 39 C SER A 5 15.410 12.961 -2.719 1.00 0.00 C ATOM 40 O SER A 5 16.313 13.516 -3.343 1.00 0.00 O ATOM 41 CB SER A 5 14.529 13.514 -0.433 1.00 0.00 C ATOM 42 OG SER A 5 13.276 12.843 -0.328 1.00 0.00 O ATOM 0 H SER A 5 17.144 13.989 -0.791 1.00 0.00 H new ATOM 0 HA SER A 5 15.361 11.639 -1.024 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.916 13.717 0.565 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.384 14.478 -0.921 1.00 0.00 H new ATOM 0 HG SER A 5 12.650 13.398 0.182 1.00 0.00 H new ATOM 48 N SER A 6 14.269 12.552 -3.253 1.00 0.00 N ATOM 49 CA SER A 6 13.996 12.740 -4.668 1.00 0.00 C ATOM 50 C SER A 6 12.509 12.511 -4.948 1.00 0.00 C ATOM 51 O SER A 6 11.823 13.402 -5.446 1.00 0.00 O ATOM 52 CB SER A 6 14.848 11.800 -5.523 1.00 0.00 C ATOM 53 OG SER A 6 15.974 12.466 -6.087 1.00 0.00 O ATOM 0 H SER A 6 13.523 12.091 -2.732 1.00 0.00 H new ATOM 0 HA SER A 6 14.256 13.765 -4.934 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.189 10.964 -4.913 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.236 11.382 -6.322 1.00 0.00 H new ATOM 0 HG SER A 6 16.419 12.998 -5.395 1.00 0.00 H new ATOM 59 N GLY A 7 12.055 11.311 -4.616 1.00 0.00 N ATOM 60 CA GLY A 7 10.662 10.954 -4.826 1.00 0.00 C ATOM 61 C GLY A 7 9.955 10.698 -3.494 1.00 0.00 C ATOM 62 O GLY A 7 10.220 11.380 -2.505 1.00 0.00 O ATOM 0 H GLY A 7 12.627 10.574 -4.203 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.154 11.755 -5.363 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.601 10.063 -5.451 1.00 0.00 H new ATOM 66 N LEU A 8 9.068 9.714 -3.511 1.00 0.00 N ATOM 67 CA LEU A 8 8.321 9.360 -2.316 1.00 0.00 C ATOM 68 C LEU A 8 8.396 7.847 -2.102 1.00 0.00 C ATOM 69 O LEU A 8 7.637 7.092 -2.708 1.00 0.00 O ATOM 70 CB LEU A 8 6.891 9.898 -2.399 1.00 0.00 C ATOM 71 CG LEU A 8 6.108 9.928 -1.085 1.00 0.00 C ATOM 72 CD1 LEU A 8 6.285 11.269 -0.371 1.00 0.00 C ATOM 73 CD2 LEU A 8 4.633 9.593 -1.318 1.00 0.00 C ATOM 0 H LEU A 8 8.850 9.151 -4.333 1.00 0.00 H new ATOM 0 HA LEU A 8 8.764 9.829 -1.438 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.928 10.911 -2.800 1.00 0.00 H new ATOM 0 HB3 LEU A 8 6.337 9.291 -3.115 1.00 0.00 H new ATOM 0 HG LEU A 8 6.514 9.158 -0.428 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.718 11.263 0.560 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.341 11.428 -0.152 1.00 0.00 H new ATOM 0 HD13 LEU A 8 5.922 12.073 -1.012 1.00 0.00 H new ATOM 0 HD21 LEU A 8 4.099 9.621 -0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.198 10.323 -2.001 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.550 8.596 -1.751 1.00 0.00 H new ATOM 85 N PRO A 9 9.343 7.438 -1.216 1.00 0.00 N ATOM 86 CA PRO A 9 9.528 6.028 -0.915 1.00 0.00 C ATOM 87 C PRO A 9 8.408 5.510 -0.010 1.00 0.00 C ATOM 88 O PRO A 9 7.963 6.211 0.897 1.00 0.00 O ATOM 89 CB PRO A 9 10.901 5.940 -0.269 1.00 0.00 C ATOM 90 CG PRO A 9 11.237 7.350 0.189 1.00 0.00 C ATOM 91 CD PRO A 9 10.260 8.303 -0.479 1.00 0.00 C ATOM 0 HA PRO A 9 9.480 5.398 -1.803 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.893 5.247 0.573 1.00 0.00 H new ATOM 0 HB3 PRO A 9 11.643 5.572 -0.977 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.163 7.427 1.274 1.00 0.00 H new ATOM 0 HG3 PRO A 9 12.262 7.604 -0.080 1.00 0.00 H new ATOM 0 HD2 PRO A 9 9.729 8.906 0.257 1.00 0.00 H new ATOM 0 HD3 PRO A 9 10.775 8.994 -1.146 1.00 0.00 H new ATOM 99 N ILE A 10 7.984 4.286 -0.290 1.00 0.00 N ATOM 100 CA ILE A 10 6.924 3.665 0.487 1.00 0.00 C ATOM 101 C ILE A 10 7.369 2.267 0.922 1.00 0.00 C ATOM 102 O ILE A 10 8.130 1.607 0.217 1.00 0.00 O ATOM 103 CB ILE A 10 5.609 3.677 -0.295 1.00 0.00 C ATOM 104 CG1 ILE A 10 5.164 5.109 -0.597 1.00 0.00 C ATOM 105 CG2 ILE A 10 4.528 2.882 0.439 1.00 0.00 C ATOM 106 CD1 ILE A 10 4.224 5.147 -1.804 1.00 0.00 C ATOM 0 H ILE A 10 8.355 3.708 -1.044 1.00 0.00 H new ATOM 0 HA ILE A 10 6.732 4.236 1.396 1.00 0.00 H new ATOM 0 HB ILE A 10 5.776 3.184 -1.253 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.661 5.529 0.274 1.00 0.00 H new ATOM 0 HG13 ILE A 10 6.037 5.732 -0.792 1.00 0.00 H new ATOM 0 HG21 ILE A 10 3.604 2.906 -0.138 1.00 0.00 H new ATOM 0 HG22 ILE A 10 4.854 1.849 0.558 1.00 0.00 H new ATOM 0 HG23 ILE A 10 4.355 3.324 1.420 1.00 0.00 H new ATOM 0 HD11 ILE A 10 3.922 6.176 -1.998 1.00 0.00 H new ATOM 0 HD12 ILE A 10 4.739 4.749 -2.679 1.00 0.00 H new ATOM 0 HD13 ILE A 10 3.341 4.543 -1.597 1.00 0.00 H new ATOM 118 N ILE A 11 6.874 1.858 2.081 1.00 0.00 N ATOM 119 CA ILE A 11 7.211 0.551 2.619 1.00 0.00 C ATOM 120 C ILE A 11 5.930 -0.159 3.062 1.00 0.00 C ATOM 121 O ILE A 11 5.058 0.453 3.677 1.00 0.00 O ATOM 122 CB ILE A 11 8.257 0.681 3.728 1.00 0.00 C ATOM 123 CG1 ILE A 11 9.561 1.268 3.186 1.00 0.00 C ATOM 124 CG2 ILE A 11 8.480 -0.660 4.431 1.00 0.00 C ATOM 125 CD1 ILE A 11 10.409 1.857 4.315 1.00 0.00 C ATOM 0 H ILE A 11 6.242 2.409 2.662 1.00 0.00 H new ATOM 0 HA ILE A 11 7.671 -0.070 1.850 1.00 0.00 H new ATOM 0 HB ILE A 11 7.877 1.377 4.476 1.00 0.00 H new ATOM 0 HG12 ILE A 11 10.126 0.492 2.669 1.00 0.00 H new ATOM 0 HG13 ILE A 11 9.338 2.042 2.452 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.228 -0.540 5.215 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.543 -1.000 4.872 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.828 -1.397 3.707 1.00 0.00 H new ATOM 0 HD11 ILE A 11 11.330 2.267 3.902 1.00 0.00 H new ATOM 0 HD12 ILE A 11 9.851 2.649 4.814 1.00 0.00 H new ATOM 0 HD13 ILE A 11 10.651 1.075 5.034 1.00 0.00 H new ATOM 137 N VAL A 12 5.857 -1.440 2.731 1.00 0.00 N ATOM 138 CA VAL A 12 4.697 -2.240 3.087 1.00 0.00 C ATOM 139 C VAL A 12 5.156 -3.482 3.854 1.00 0.00 C ATOM 140 O VAL A 12 6.263 -3.973 3.643 1.00 0.00 O ATOM 141 CB VAL A 12 3.889 -2.577 1.832 1.00 0.00 C ATOM 142 CG1 VAL A 12 2.512 -3.132 2.200 1.00 0.00 C ATOM 143 CG2 VAL A 12 3.762 -1.356 0.918 1.00 0.00 C ATOM 0 H VAL A 12 6.582 -1.944 2.220 1.00 0.00 H new ATOM 0 HA VAL A 12 4.033 -1.679 3.744 1.00 0.00 H new ATOM 0 HB VAL A 12 4.427 -3.351 1.284 1.00 0.00 H new ATOM 0 HG11 VAL A 12 1.958 -3.363 1.290 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.632 -4.039 2.793 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.964 -2.390 2.780 1.00 0.00 H new ATOM 0 HG21 VAL A 12 3.183 -1.622 0.033 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.257 -0.552 1.453 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.755 -1.023 0.615 1.00 0.00 H new ATOM 153 N LYS A 13 4.280 -3.954 4.729 1.00 0.00 N ATOM 154 CA LYS A 13 4.581 -5.130 5.529 1.00 0.00 C ATOM 155 C LYS A 13 3.502 -6.189 5.296 1.00 0.00 C ATOM 156 O LYS A 13 2.361 -6.024 5.726 1.00 0.00 O ATOM 157 CB LYS A 13 4.759 -4.746 6.999 1.00 0.00 C ATOM 158 CG LYS A 13 6.143 -4.142 7.244 1.00 0.00 C ATOM 159 CD LYS A 13 6.450 -4.065 8.741 1.00 0.00 C ATOM 160 CE LYS A 13 7.152 -5.336 9.223 1.00 0.00 C ATOM 161 NZ LYS A 13 6.491 -5.864 10.438 1.00 0.00 N ATOM 0 H LYS A 13 3.362 -3.544 4.902 1.00 0.00 H new ATOM 0 HA LYS A 13 5.530 -5.568 5.221 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.990 -4.030 7.287 1.00 0.00 H new ATOM 0 HB3 LYS A 13 4.626 -5.627 7.627 1.00 0.00 H new ATOM 0 HG2 LYS A 13 6.901 -4.745 6.744 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.191 -3.144 6.807 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.080 -3.199 8.943 1.00 0.00 H new ATOM 0 HD3 LYS A 13 5.524 -3.923 9.299 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.134 -6.089 8.435 1.00 0.00 H new ATOM 0 HE3 LYS A 13 8.199 -5.122 9.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 6.980 -6.727 10.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 6.530 -5.150 11.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 5.498 -6.087 10.224 1.00 0.00 H new ATOM 175 N TRP A 14 3.900 -7.254 4.616 1.00 0.00 N ATOM 176 CA TRP A 14 2.982 -8.341 4.321 1.00 0.00 C ATOM 177 C TRP A 14 3.406 -9.556 5.147 1.00 0.00 C ATOM 178 O TRP A 14 4.458 -10.144 4.898 1.00 0.00 O ATOM 179 CB TRP A 14 2.934 -8.626 2.818 1.00 0.00 C ATOM 180 CG TRP A 14 1.808 -9.573 2.400 1.00 0.00 C ATOM 181 CD1 TRP A 14 0.569 -9.654 2.902 1.00 0.00 C ATOM 182 CD2 TRP A 14 1.870 -10.579 1.366 1.00 0.00 C ATOM 183 NE1 TRP A 14 -0.170 -10.633 2.270 1.00 0.00 N ATOM 184 CE2 TRP A 14 0.646 -11.213 1.306 1.00 0.00 C ATOM 185 CE3 TRP A 14 2.925 -10.939 0.510 1.00 0.00 C ATOM 186 CZ2 TRP A 14 0.362 -12.247 0.406 1.00 0.00 C ATOM 187 CZ3 TRP A 14 2.626 -11.975 -0.384 1.00 0.00 C ATOM 188 CH2 TRP A 14 1.399 -12.624 -0.457 1.00 0.00 C ATOM 0 H TRP A 14 4.847 -7.387 4.261 1.00 0.00 H new ATOM 0 HA TRP A 14 1.963 -8.071 4.598 1.00 0.00 H new ATOM 0 HB2 TRP A 14 2.819 -7.683 2.283 1.00 0.00 H new ATOM 0 HB3 TRP A 14 3.888 -9.053 2.509 1.00 0.00 H new ATOM 0 HD1 TRP A 14 0.195 -9.031 3.701 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -1.137 -10.885 2.473 1.00 0.00 H new ATOM 0 HE3 TRP A 14 3.890 -10.455 0.539 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -0.605 -12.728 0.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 3.403 -12.292 -1.064 1.00 0.00 H new ATOM 0 HH2 TRP A 14 1.246 -13.415 -1.176 1.00 0.00 H new ATOM 199 N GLY A 15 2.566 -9.898 6.113 1.00 0.00 N ATOM 200 CA GLY A 15 2.841 -11.033 6.977 1.00 0.00 C ATOM 201 C GLY A 15 4.186 -10.867 7.689 1.00 0.00 C ATOM 202 O GLY A 15 4.246 -10.322 8.790 1.00 0.00 O ATOM 0 H GLY A 15 1.694 -9.409 6.316 1.00 0.00 H new ATOM 0 HA2 GLY A 15 2.045 -11.134 7.715 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.848 -11.950 6.388 1.00 0.00 H new ATOM 206 N GLY A 16 5.231 -11.347 7.031 1.00 0.00 N ATOM 207 CA GLY A 16 6.570 -11.259 7.587 1.00 0.00 C ATOM 208 C GLY A 16 7.573 -10.793 6.529 1.00 0.00 C ATOM 209 O GLY A 16 8.754 -11.129 6.598 1.00 0.00 O ATOM 0 H GLY A 16 5.177 -11.798 6.118 1.00 0.00 H new ATOM 0 HA2 GLY A 16 6.574 -10.565 8.428 1.00 0.00 H new ATOM 0 HA3 GLY A 16 6.871 -12.232 7.975 1.00 0.00 H new ATOM 213 N GLN A 17 7.065 -10.026 5.576 1.00 0.00 N ATOM 214 CA GLN A 17 7.902 -9.510 4.505 1.00 0.00 C ATOM 215 C GLN A 17 7.688 -8.004 4.343 1.00 0.00 C ATOM 216 O GLN A 17 6.594 -7.499 4.590 1.00 0.00 O ATOM 217 CB GLN A 17 7.629 -10.248 3.193 1.00 0.00 C ATOM 218 CG GLN A 17 8.372 -11.584 3.150 1.00 0.00 C ATOM 219 CD GLN A 17 9.559 -11.521 2.187 1.00 0.00 C ATOM 220 OE1 GLN A 17 9.567 -12.129 1.129 1.00 0.00 O ATOM 221 NE2 GLN A 17 10.560 -10.754 2.611 1.00 0.00 N ATOM 0 H GLN A 17 6.085 -9.749 5.523 1.00 0.00 H new ATOM 0 HA GLN A 17 8.945 -9.682 4.770 1.00 0.00 H new ATOM 0 HB2 GLN A 17 6.558 -10.420 3.084 1.00 0.00 H new ATOM 0 HB3 GLN A 17 7.939 -9.628 2.352 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.723 -11.841 4.149 1.00 0.00 H new ATOM 0 HG3 GLN A 17 7.689 -12.374 2.839 1.00 0.00 H new ATOM 0 HE21 GLN A 17 10.489 -10.272 3.507 1.00 0.00 H new ATOM 0 HE22 GLN A 17 11.398 -10.648 2.040 1.00 0.00 H new ATOM 230 N GLU A 18 8.750 -7.329 3.929 1.00 0.00 N ATOM 231 CA GLU A 18 8.692 -5.891 3.731 1.00 0.00 C ATOM 232 C GLU A 18 8.933 -5.548 2.259 1.00 0.00 C ATOM 233 O GLU A 18 9.902 -6.012 1.660 1.00 0.00 O ATOM 234 CB GLU A 18 9.697 -5.172 4.633 1.00 0.00 C ATOM 235 CG GLU A 18 9.217 -5.156 6.085 1.00 0.00 C ATOM 236 CD GLU A 18 10.374 -5.428 7.049 1.00 0.00 C ATOM 237 OE1 GLU A 18 11.170 -6.340 6.737 1.00 0.00 O ATOM 238 OE2 GLU A 18 10.437 -4.717 8.075 1.00 0.00 O ATOM 0 H GLU A 18 9.656 -7.751 3.725 1.00 0.00 H new ATOM 0 HA GLU A 18 7.695 -5.546 4.006 1.00 0.00 H new ATOM 0 HB2 GLU A 18 10.666 -5.668 4.572 1.00 0.00 H new ATOM 0 HB3 GLU A 18 9.840 -4.150 4.282 1.00 0.00 H new ATOM 0 HG2 GLU A 18 8.769 -4.189 6.313 1.00 0.00 H new ATOM 0 HG3 GLU A 18 8.440 -5.908 6.223 1.00 0.00 H new ATOM 245 N TYR A 19 8.035 -4.737 1.719 1.00 0.00 N ATOM 246 CA TYR A 19 8.138 -4.327 0.329 1.00 0.00 C ATOM 247 C TYR A 19 8.405 -2.824 0.219 1.00 0.00 C ATOM 248 O TYR A 19 7.772 -2.026 0.909 1.00 0.00 O ATOM 249 CB TYR A 19 6.780 -4.639 -0.305 1.00 0.00 C ATOM 250 CG TYR A 19 6.479 -6.134 -0.424 1.00 0.00 C ATOM 251 CD1 TYR A 19 6.138 -6.861 0.698 1.00 0.00 C ATOM 252 CD2 TYR A 19 6.548 -6.756 -1.654 1.00 0.00 C ATOM 253 CE1 TYR A 19 5.854 -8.268 0.586 1.00 0.00 C ATOM 254 CE2 TYR A 19 6.264 -8.163 -1.767 1.00 0.00 C ATOM 255 CZ TYR A 19 5.931 -8.850 -0.641 1.00 0.00 C ATOM 256 OH TYR A 19 5.663 -10.179 -0.748 1.00 0.00 O ATOM 0 H TYR A 19 7.233 -4.353 2.219 1.00 0.00 H new ATOM 0 HA TYR A 19 8.959 -4.847 -0.164 1.00 0.00 H new ATOM 0 HB2 TYR A 19 5.997 -4.167 0.288 1.00 0.00 H new ATOM 0 HB3 TYR A 19 6.742 -4.191 -1.298 1.00 0.00 H new ATOM 0 HD1 TYR A 19 6.084 -6.374 1.661 1.00 0.00 H new ATOM 0 HD2 TYR A 19 6.815 -6.187 -2.532 1.00 0.00 H new ATOM 0 HE1 TYR A 19 5.586 -8.848 1.457 1.00 0.00 H new ATOM 0 HE2 TYR A 19 6.314 -8.662 -2.724 1.00 0.00 H new ATOM 0 HH TYR A 19 5.756 -10.457 -1.683 1.00 0.00 H new ATOM 266 N SER A 20 9.342 -2.484 -0.653 1.00 0.00 N ATOM 267 CA SER A 20 9.700 -1.091 -0.862 1.00 0.00 C ATOM 268 C SER A 20 9.168 -0.611 -2.213 1.00 0.00 C ATOM 269 O SER A 20 9.165 -1.364 -3.186 1.00 0.00 O ATOM 270 CB SER A 20 11.216 -0.896 -0.788 1.00 0.00 C ATOM 271 OG SER A 20 11.879 -1.423 -1.934 1.00 0.00 O ATOM 0 H SER A 20 9.865 -3.149 -1.223 1.00 0.00 H new ATOM 0 HA SER A 20 9.245 -0.498 -0.069 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.441 0.167 -0.696 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.601 -1.382 0.109 1.00 0.00 H new ATOM 0 HG SER A 20 12.844 -1.277 -1.849 1.00 0.00 H new ATOM 277 N VAL A 21 8.732 0.640 -2.231 1.00 0.00 N ATOM 278 CA VAL A 21 8.199 1.229 -3.447 1.00 0.00 C ATOM 279 C VAL A 21 8.799 2.624 -3.639 1.00 0.00 C ATOM 280 O VAL A 21 8.623 3.501 -2.794 1.00 0.00 O ATOM 281 CB VAL A 21 6.670 1.239 -3.398 1.00 0.00 C ATOM 282 CG1 VAL A 21 6.089 2.058 -4.552 1.00 0.00 C ATOM 283 CG2 VAL A 21 6.113 -0.186 -3.402 1.00 0.00 C ATOM 0 H VAL A 21 8.737 1.262 -1.423 1.00 0.00 H new ATOM 0 HA VAL A 21 8.479 0.631 -4.314 1.00 0.00 H new ATOM 0 HB VAL A 21 6.368 1.715 -2.465 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.001 2.048 -4.493 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.447 3.085 -4.485 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.405 1.625 -5.501 1.00 0.00 H new ATOM 0 HG21 VAL A 21 5.024 -0.151 -3.367 1.00 0.00 H new ATOM 0 HG22 VAL A 21 6.430 -0.698 -4.310 1.00 0.00 H new ATOM 0 HG23 VAL A 21 6.487 -0.725 -2.532 1.00 0.00 H new ATOM 293 N THR A 22 9.497 2.785 -4.754 1.00 0.00 N ATOM 294 CA THR A 22 10.124 4.057 -5.066 1.00 0.00 C ATOM 295 C THR A 22 10.041 4.338 -6.568 1.00 0.00 C ATOM 296 O THR A 22 10.971 4.892 -7.152 1.00 0.00 O ATOM 297 CB THR A 22 11.558 4.021 -4.534 1.00 0.00 C ATOM 298 OG1 THR A 22 12.128 2.870 -5.149 1.00 0.00 O ATOM 299 CG2 THR A 22 11.619 3.713 -3.036 1.00 0.00 C ATOM 0 H THR A 22 9.642 2.055 -5.452 1.00 0.00 H new ATOM 0 HA THR A 22 9.603 4.883 -4.582 1.00 0.00 H new ATOM 0 HB THR A 22 12.041 4.979 -4.727 1.00 0.00 H new ATOM 0 HG1 THR A 22 13.059 2.772 -4.860 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.659 3.699 -2.709 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.076 4.480 -2.484 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.166 2.740 -2.846 1.00 0.00 H new ATOM 307 N THR A 23 8.918 3.943 -7.150 1.00 0.00 N ATOM 308 CA THR A 23 8.701 4.146 -8.573 1.00 0.00 C ATOM 309 C THR A 23 7.640 5.223 -8.802 1.00 0.00 C ATOM 310 O THR A 23 7.786 6.065 -9.687 1.00 0.00 O ATOM 311 CB THR A 23 8.340 2.794 -9.192 1.00 0.00 C ATOM 312 OG1 THR A 23 9.578 2.090 -9.236 1.00 0.00 O ATOM 313 CG2 THR A 23 7.928 2.915 -10.661 1.00 0.00 C ATOM 0 H THR A 23 8.149 3.484 -6.662 1.00 0.00 H new ATOM 0 HA THR A 23 9.602 4.514 -9.063 1.00 0.00 H new ATOM 0 HB THR A 23 7.529 2.339 -8.623 1.00 0.00 H new ATOM 0 HG1 THR A 23 9.435 1.201 -9.623 1.00 0.00 H new ATOM 0 HG21 THR A 23 7.682 1.928 -11.052 1.00 0.00 H new ATOM 0 HG22 THR A 23 7.057 3.565 -10.742 1.00 0.00 H new ATOM 0 HG23 THR A 23 8.751 3.339 -11.236 1.00 0.00 H new ATOM 321 N LEU A 24 6.595 5.162 -7.990 1.00 0.00 N ATOM 322 CA LEU A 24 5.509 6.122 -8.094 1.00 0.00 C ATOM 323 C LEU A 24 5.725 7.242 -7.075 1.00 0.00 C ATOM 324 O LEU A 24 6.529 7.102 -6.154 1.00 0.00 O ATOM 325 CB LEU A 24 4.157 5.418 -7.957 1.00 0.00 C ATOM 326 CG LEU A 24 4.088 4.293 -6.922 1.00 0.00 C ATOM 327 CD1 LEU A 24 2.714 4.249 -6.251 1.00 0.00 C ATOM 328 CD2 LEU A 24 4.464 2.949 -7.549 1.00 0.00 C ATOM 0 H LEU A 24 6.477 4.463 -7.257 1.00 0.00 H new ATOM 0 HA LEU A 24 5.503 6.585 -9.081 1.00 0.00 H new ATOM 0 HB2 LEU A 24 3.405 6.165 -7.703 1.00 0.00 H new ATOM 0 HB3 LEU A 24 3.883 5.008 -8.929 1.00 0.00 H new ATOM 0 HG LEU A 24 4.820 4.500 -6.141 1.00 0.00 H new ATOM 0 HD11 LEU A 24 2.692 3.441 -5.520 1.00 0.00 H new ATOM 0 HD12 LEU A 24 2.524 5.198 -5.749 1.00 0.00 H new ATOM 0 HD13 LEU A 24 1.946 4.077 -7.005 1.00 0.00 H new ATOM 0 HD21 LEU A 24 4.407 2.166 -6.793 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.773 2.720 -8.361 1.00 0.00 H new ATOM 0 HD23 LEU A 24 5.480 3.002 -7.941 1.00 0.00 H new ATOM 340 N SER A 25 4.995 8.329 -7.274 1.00 0.00 N ATOM 341 CA SER A 25 5.097 9.473 -6.383 1.00 0.00 C ATOM 342 C SER A 25 3.699 9.973 -6.012 1.00 0.00 C ATOM 343 O SER A 25 2.703 9.312 -6.299 1.00 0.00 O ATOM 344 CB SER A 25 5.911 10.599 -7.024 1.00 0.00 C ATOM 345 OG SER A 25 5.202 11.232 -8.086 1.00 0.00 O ATOM 0 H SER A 25 4.330 8.442 -8.039 1.00 0.00 H new ATOM 0 HA SER A 25 5.615 9.157 -5.478 1.00 0.00 H new ATOM 0 HB2 SER A 25 6.165 11.340 -6.266 1.00 0.00 H new ATOM 0 HB3 SER A 25 6.850 10.197 -7.404 1.00 0.00 H new ATOM 0 HG SER A 25 5.754 11.946 -8.468 1.00 0.00 H new ATOM 351 N GLU A 26 3.671 11.137 -5.379 1.00 0.00 N ATOM 352 CA GLU A 26 2.412 11.734 -4.966 1.00 0.00 C ATOM 353 C GLU A 26 1.453 11.827 -6.154 1.00 0.00 C ATOM 354 O GLU A 26 0.264 11.544 -6.020 1.00 0.00 O ATOM 355 CB GLU A 26 2.639 13.109 -4.335 1.00 0.00 C ATOM 356 CG GLU A 26 3.541 13.005 -3.104 1.00 0.00 C ATOM 357 CD GLU A 26 4.622 14.088 -3.124 1.00 0.00 C ATOM 358 OE1 GLU A 26 5.359 14.135 -4.132 1.00 0.00 O ATOM 359 OE2 GLU A 26 4.687 14.844 -2.130 1.00 0.00 O ATOM 0 H GLU A 26 4.500 11.682 -5.142 1.00 0.00 H new ATOM 0 HA GLU A 26 1.959 11.093 -4.209 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.092 13.778 -5.066 1.00 0.00 H new ATOM 0 HB3 GLU A 26 1.681 13.546 -4.053 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.941 13.102 -2.199 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.008 12.021 -3.073 1.00 0.00 H new ATOM 366 N ASP A 27 2.007 12.224 -7.291 1.00 0.00 N ATOM 367 CA ASP A 27 1.215 12.358 -8.502 1.00 0.00 C ATOM 368 C ASP A 27 0.380 11.092 -8.702 1.00 0.00 C ATOM 369 O ASP A 27 -0.844 11.162 -8.806 1.00 0.00 O ATOM 370 CB ASP A 27 2.112 12.532 -9.729 1.00 0.00 C ATOM 371 CG ASP A 27 1.534 13.421 -10.832 1.00 0.00 C ATOM 372 OD1 ASP A 27 0.805 14.370 -10.472 1.00 0.00 O ATOM 373 OD2 ASP A 27 1.833 13.130 -12.010 1.00 0.00 O ATOM 0 H ASP A 27 2.994 12.457 -7.399 1.00 0.00 H new ATOM 0 HA ASP A 27 0.578 13.236 -8.394 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.065 12.952 -9.407 1.00 0.00 H new ATOM 0 HB3 ASP A 27 2.322 11.548 -10.149 1.00 0.00 H new ATOM 378 N ASP A 28 1.074 9.965 -8.751 1.00 0.00 N ATOM 379 CA ASP A 28 0.411 8.685 -8.937 1.00 0.00 C ATOM 380 C ASP A 28 -0.721 8.549 -7.918 1.00 0.00 C ATOM 381 O ASP A 28 -0.698 9.192 -6.869 1.00 0.00 O ATOM 382 CB ASP A 28 1.384 7.524 -8.721 1.00 0.00 C ATOM 383 CG ASP A 28 2.463 7.376 -9.796 1.00 0.00 C ATOM 384 OD1 ASP A 28 3.212 8.358 -9.987 1.00 0.00 O ATOM 385 OD2 ASP A 28 2.514 6.284 -10.402 1.00 0.00 O ATOM 0 H ASP A 28 2.089 9.911 -8.665 1.00 0.00 H new ATOM 0 HA ASP A 28 0.028 8.649 -9.957 1.00 0.00 H new ATOM 0 HB2 ASP A 28 1.871 7.653 -7.754 1.00 0.00 H new ATOM 0 HB3 ASP A 28 0.814 6.596 -8.670 1.00 0.00 H new ATOM 390 N THR A 29 -1.685 7.707 -8.260 1.00 0.00 N ATOM 391 CA THR A 29 -2.824 7.479 -7.388 1.00 0.00 C ATOM 392 C THR A 29 -2.653 6.167 -6.619 1.00 0.00 C ATOM 393 O THR A 29 -1.830 5.330 -6.988 1.00 0.00 O ATOM 394 CB THR A 29 -4.092 7.519 -8.244 1.00 0.00 C ATOM 395 OG1 THR A 29 -3.829 8.538 -9.205 1.00 0.00 O ATOM 396 CG2 THR A 29 -5.305 8.040 -7.471 1.00 0.00 C ATOM 0 H THR A 29 -1.700 7.174 -9.130 1.00 0.00 H new ATOM 0 HA THR A 29 -2.902 8.258 -6.629 1.00 0.00 H new ATOM 0 HB THR A 29 -4.306 6.520 -8.623 1.00 0.00 H new ATOM 0 HG1 THR A 29 -4.600 8.630 -9.803 1.00 0.00 H new ATOM 0 HG21 THR A 29 -6.177 8.048 -8.125 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.498 7.391 -6.616 1.00 0.00 H new ATOM 0 HG23 THR A 29 -5.105 9.053 -7.120 1.00 0.00 H new ATOM 404 N VAL A 30 -3.442 6.029 -5.564 1.00 0.00 N ATOM 405 CA VAL A 30 -3.387 4.833 -4.740 1.00 0.00 C ATOM 406 C VAL A 30 -3.432 3.597 -5.639 1.00 0.00 C ATOM 407 O VAL A 30 -2.736 2.615 -5.387 1.00 0.00 O ATOM 408 CB VAL A 30 -4.512 4.861 -3.703 1.00 0.00 C ATOM 409 CG1 VAL A 30 -4.575 3.543 -2.928 1.00 0.00 C ATOM 410 CG2 VAL A 30 -4.354 6.049 -2.753 1.00 0.00 C ATOM 0 H VAL A 30 -4.123 6.725 -5.261 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.451 4.795 -4.183 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.455 4.983 -4.235 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.383 3.589 -2.197 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.759 2.722 -3.621 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.629 3.378 -2.413 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.167 6.045 -2.027 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.400 5.973 -2.231 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.382 6.977 -3.323 1.00 0.00 H new ATOM 420 N LEU A 31 -4.259 3.685 -6.671 1.00 0.00 N ATOM 421 CA LEU A 31 -4.405 2.585 -7.609 1.00 0.00 C ATOM 422 C LEU A 31 -3.020 2.135 -8.080 1.00 0.00 C ATOM 423 O LEU A 31 -2.677 0.959 -7.976 1.00 0.00 O ATOM 424 CB LEU A 31 -5.346 2.975 -8.751 1.00 0.00 C ATOM 425 CG LEU A 31 -5.636 1.885 -9.784 1.00 0.00 C ATOM 426 CD1 LEU A 31 -6.738 0.944 -9.293 1.00 0.00 C ATOM 427 CD2 LEU A 31 -5.968 2.495 -11.147 1.00 0.00 C ATOM 0 H LEU A 31 -4.835 4.501 -6.878 1.00 0.00 H new ATOM 0 HA LEU A 31 -4.871 1.728 -7.122 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.293 3.300 -8.320 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.920 3.834 -9.269 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.734 1.286 -9.911 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -6.925 0.178 -10.046 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -6.424 0.470 -8.363 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -7.652 1.513 -9.119 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -6.170 1.698 -11.863 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -6.847 3.132 -11.056 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -5.123 3.090 -11.495 1.00 0.00 H new ATOM 439 N ASP A 32 -2.262 3.096 -8.588 1.00 0.00 N ATOM 440 CA ASP A 32 -0.923 2.814 -9.075 1.00 0.00 C ATOM 441 C ASP A 32 -0.188 1.939 -8.057 1.00 0.00 C ATOM 442 O ASP A 32 0.377 0.907 -8.414 1.00 0.00 O ATOM 443 CB ASP A 32 -0.120 4.104 -9.256 1.00 0.00 C ATOM 444 CG ASP A 32 -0.599 5.010 -10.392 1.00 0.00 C ATOM 445 OD1 ASP A 32 -0.334 4.645 -11.558 1.00 0.00 O ATOM 446 OD2 ASP A 32 -1.219 6.046 -10.069 1.00 0.00 O ATOM 0 H ASP A 32 -2.550 4.071 -8.673 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.014 2.307 -10.036 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.152 4.668 -8.324 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.923 3.843 -9.435 1.00 0.00 H new ATOM 451 N LEU A 33 -0.220 2.384 -6.810 1.00 0.00 N ATOM 452 CA LEU A 33 0.435 1.654 -5.738 1.00 0.00 C ATOM 453 C LEU A 33 -0.153 0.245 -5.652 1.00 0.00 C ATOM 454 O LEU A 33 0.581 -0.741 -5.686 1.00 0.00 O ATOM 455 CB LEU A 33 0.350 2.437 -4.426 1.00 0.00 C ATOM 456 CG LEU A 33 1.284 1.974 -3.306 1.00 0.00 C ATOM 457 CD1 LEU A 33 2.743 2.284 -3.645 1.00 0.00 C ATOM 458 CD2 LEU A 33 0.867 2.574 -1.962 1.00 0.00 C ATOM 0 H LEU A 33 -0.689 3.241 -6.518 1.00 0.00 H new ATOM 0 HA LEU A 33 1.499 1.543 -5.948 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.561 3.485 -4.637 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -0.676 2.385 -4.061 1.00 0.00 H new ATOM 0 HG LEU A 33 1.199 0.891 -3.215 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.385 1.945 -2.832 1.00 0.00 H new ATOM 0 HD12 LEU A 33 3.020 1.770 -4.565 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.865 3.359 -3.779 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.547 2.229 -1.183 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.905 3.662 -2.022 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.149 2.259 -1.722 1.00 0.00 H new ATOM 470 N LYS A 34 -1.473 0.195 -5.542 1.00 0.00 N ATOM 471 CA LYS A 34 -2.168 -1.078 -5.451 1.00 0.00 C ATOM 472 C LYS A 34 -1.758 -1.964 -6.629 1.00 0.00 C ATOM 473 O LYS A 34 -1.329 -3.100 -6.435 1.00 0.00 O ATOM 474 CB LYS A 34 -3.679 -0.857 -5.345 1.00 0.00 C ATOM 475 CG LYS A 34 -4.044 -0.195 -4.015 1.00 0.00 C ATOM 476 CD LYS A 34 -5.531 0.162 -3.970 1.00 0.00 C ATOM 477 CE LYS A 34 -6.143 -0.209 -2.618 1.00 0.00 C ATOM 478 NZ LYS A 34 -7.597 0.069 -2.613 1.00 0.00 N ATOM 0 H LYS A 34 -2.079 1.015 -5.514 1.00 0.00 H new ATOM 0 HA LYS A 34 -1.881 -1.604 -4.541 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -4.018 -0.232 -6.171 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -4.197 -1.812 -5.434 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -3.803 -0.867 -3.192 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -3.446 0.706 -3.877 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -5.658 1.229 -4.150 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -6.059 -0.361 -4.768 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -5.968 -1.265 -2.410 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -5.656 0.357 -1.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -7.997 -0.189 -1.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.758 1.081 -2.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -8.060 -0.490 -3.358 1.00 0.00 H new ATOM 492 N GLN A 35 -1.904 -1.410 -7.823 1.00 0.00 N ATOM 493 CA GLN A 35 -1.553 -2.136 -9.032 1.00 0.00 C ATOM 494 C GLN A 35 -0.138 -2.707 -8.918 1.00 0.00 C ATOM 495 O GLN A 35 0.109 -3.846 -9.309 1.00 0.00 O ATOM 496 CB GLN A 35 -1.685 -1.242 -10.267 1.00 0.00 C ATOM 497 CG GLN A 35 -3.132 -1.205 -10.765 1.00 0.00 C ATOM 498 CD GLN A 35 -3.184 -1.094 -12.290 1.00 0.00 C ATOM 499 OE1 GLN A 35 -2.173 -1.091 -12.973 1.00 0.00 O ATOM 500 NE2 GLN A 35 -4.415 -1.002 -12.784 1.00 0.00 N ATOM 0 H GLN A 35 -2.260 -0.467 -7.980 1.00 0.00 H new ATOM 0 HA GLN A 35 -2.250 -2.966 -9.148 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -1.354 -0.232 -10.026 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -1.033 -1.611 -11.059 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -3.654 -2.107 -10.444 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -3.653 -0.359 -10.317 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -5.219 -1.011 -12.156 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -4.556 -0.923 -13.791 1.00 0.00 H new ATOM 509 N PHE A 36 0.754 -1.888 -8.379 1.00 0.00 N ATOM 510 CA PHE A 36 2.137 -2.297 -8.208 1.00 0.00 C ATOM 511 C PHE A 36 2.278 -3.285 -7.047 1.00 0.00 C ATOM 512 O PHE A 36 3.223 -4.071 -7.008 1.00 0.00 O ATOM 513 CB PHE A 36 2.940 -1.035 -7.887 1.00 0.00 C ATOM 514 CG PHE A 36 4.422 -1.129 -8.257 1.00 0.00 C ATOM 515 CD1 PHE A 36 4.792 -1.659 -9.454 1.00 0.00 C ATOM 516 CD2 PHE A 36 5.369 -0.683 -7.390 1.00 0.00 C ATOM 517 CE1 PHE A 36 6.167 -1.747 -9.797 1.00 0.00 C ATOM 518 CE2 PHE A 36 6.744 -0.771 -7.733 1.00 0.00 C ATOM 519 CZ PHE A 36 7.114 -1.301 -8.930 1.00 0.00 C ATOM 0 H PHE A 36 0.545 -0.944 -8.055 1.00 0.00 H new ATOM 0 HA PHE A 36 2.494 -2.788 -9.113 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.497 -0.191 -8.415 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.855 -0.824 -6.821 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.040 -2.013 -10.143 1.00 0.00 H new ATOM 0 HD2 PHE A 36 5.076 -0.262 -6.440 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.460 -2.168 -10.747 1.00 0.00 H new ATOM 0 HE2 PHE A 36 7.496 -0.417 -7.044 1.00 0.00 H new ATOM 0 HZ PHE A 36 8.160 -1.367 -9.191 1.00 0.00 H new ATOM 529 N LEU A 37 1.324 -3.211 -6.131 1.00 0.00 N ATOM 530 CA LEU A 37 1.329 -4.089 -4.973 1.00 0.00 C ATOM 531 C LEU A 37 0.747 -5.448 -5.366 1.00 0.00 C ATOM 532 O LEU A 37 0.905 -6.429 -4.640 1.00 0.00 O ATOM 533 CB LEU A 37 0.607 -3.428 -3.797 1.00 0.00 C ATOM 534 CG LEU A 37 1.299 -2.209 -3.185 1.00 0.00 C ATOM 535 CD1 LEU A 37 0.276 -1.233 -2.601 1.00 0.00 C ATOM 536 CD2 LEU A 37 2.343 -2.633 -2.149 1.00 0.00 C ATOM 0 H LEU A 37 0.542 -2.557 -6.167 1.00 0.00 H new ATOM 0 HA LEU A 37 2.349 -4.265 -4.633 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.387 -3.128 -4.129 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.470 -4.174 -3.014 1.00 0.00 H new ATOM 0 HG LEU A 37 1.829 -1.683 -3.979 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.795 -0.376 -2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.395 -0.894 -3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.302 -1.733 -1.824 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.820 -1.747 -1.730 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.857 -3.195 -1.352 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.097 -3.259 -2.627 1.00 0.00 H new ATOM 548 N LYS A 38 0.087 -5.464 -6.515 1.00 0.00 N ATOM 549 CA LYS A 38 -0.519 -6.687 -7.013 1.00 0.00 C ATOM 550 C LYS A 38 0.567 -7.581 -7.614 1.00 0.00 C ATOM 551 O LYS A 38 0.431 -8.803 -7.631 1.00 0.00 O ATOM 552 CB LYS A 38 -1.657 -6.364 -7.984 1.00 0.00 C ATOM 553 CG LYS A 38 -2.159 -7.631 -8.681 1.00 0.00 C ATOM 554 CD LYS A 38 -3.443 -7.353 -9.464 1.00 0.00 C ATOM 555 CE LYS A 38 -3.275 -7.720 -10.940 1.00 0.00 C ATOM 556 NZ LYS A 38 -3.849 -6.665 -11.805 1.00 0.00 N ATOM 0 H LYS A 38 -0.041 -4.649 -7.115 1.00 0.00 H new ATOM 0 HA LYS A 38 -0.976 -7.246 -6.196 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -2.478 -5.892 -7.444 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -1.312 -5.647 -8.729 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.391 -8.007 -9.357 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.342 -8.410 -7.941 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.266 -7.925 -9.035 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -3.706 -6.299 -9.375 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -2.218 -7.852 -11.170 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -3.766 -8.672 -11.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -3.727 -6.930 -12.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.862 -6.559 -11.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -3.362 -5.764 -11.624 1.00 0.00 H new ATOM 570 N THR A 39 1.621 -6.936 -8.094 1.00 0.00 N ATOM 571 CA THR A 39 2.730 -7.658 -8.694 1.00 0.00 C ATOM 572 C THR A 39 3.829 -7.904 -7.659 1.00 0.00 C ATOM 573 O THR A 39 4.530 -8.913 -7.721 1.00 0.00 O ATOM 574 CB THR A 39 3.208 -6.862 -9.911 1.00 0.00 C ATOM 575 OG1 THR A 39 3.810 -7.842 -10.752 1.00 0.00 O ATOM 576 CG2 THR A 39 4.355 -5.907 -9.572 1.00 0.00 C ATOM 0 H THR A 39 1.730 -5.922 -8.079 1.00 0.00 H new ATOM 0 HA THR A 39 2.421 -8.646 -9.034 1.00 0.00 H new ATOM 0 HB THR A 39 2.374 -6.295 -10.325 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.146 -7.412 -11.566 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.656 -5.367 -10.470 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.025 -5.196 -8.815 1.00 0.00 H new ATOM 0 HG23 THR A 39 5.202 -6.477 -9.190 1.00 0.00 H new ATOM 584 N LEU A 40 3.945 -6.966 -6.731 1.00 0.00 N ATOM 585 CA LEU A 40 4.947 -7.068 -5.684 1.00 0.00 C ATOM 586 C LEU A 40 4.682 -8.325 -4.852 1.00 0.00 C ATOM 587 O LEU A 40 5.550 -9.188 -4.731 1.00 0.00 O ATOM 588 CB LEU A 40 4.992 -5.782 -4.858 1.00 0.00 C ATOM 589 CG LEU A 40 5.903 -4.674 -5.391 1.00 0.00 C ATOM 590 CD1 LEU A 40 5.760 -3.399 -4.557 1.00 0.00 C ATOM 591 CD2 LEU A 40 7.355 -5.148 -5.469 1.00 0.00 C ATOM 0 H LEU A 40 3.361 -6.131 -6.682 1.00 0.00 H new ATOM 0 HA LEU A 40 5.941 -7.175 -6.117 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.979 -5.387 -4.782 1.00 0.00 H new ATOM 0 HB3 LEU A 40 5.313 -6.034 -3.847 1.00 0.00 H new ATOM 0 HG LEU A 40 5.589 -4.432 -6.406 1.00 0.00 H new ATOM 0 HD11 LEU A 40 6.418 -2.627 -4.957 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.727 -3.052 -4.597 1.00 0.00 H new ATOM 0 HD13 LEU A 40 6.033 -3.608 -3.523 1.00 0.00 H new ATOM 0 HD21 LEU A 40 7.981 -4.342 -5.851 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.698 -5.434 -4.475 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.422 -6.007 -6.137 1.00 0.00 H new ATOM 603 N THR A 41 3.479 -8.387 -4.300 1.00 0.00 N ATOM 604 CA THR A 41 3.088 -9.524 -3.483 1.00 0.00 C ATOM 605 C THR A 41 2.499 -10.632 -4.358 1.00 0.00 C ATOM 606 O THR A 41 2.978 -11.765 -4.337 1.00 0.00 O ATOM 607 CB THR A 41 2.124 -9.022 -2.406 1.00 0.00 C ATOM 608 OG1 THR A 41 1.153 -8.272 -3.131 1.00 0.00 O ATOM 609 CG2 THR A 41 2.770 -7.995 -1.475 1.00 0.00 C ATOM 0 H THR A 41 2.762 -7.669 -4.402 1.00 0.00 H new ATOM 0 HA THR A 41 3.950 -9.970 -2.986 1.00 0.00 H new ATOM 0 HB THR A 41 1.763 -9.867 -1.819 1.00 0.00 H new ATOM 0 HG1 THR A 41 1.457 -7.345 -3.222 1.00 0.00 H new ATOM 0 HG21 THR A 41 2.043 -7.672 -0.730 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.627 -8.446 -0.974 1.00 0.00 H new ATOM 0 HG23 THR A 41 3.101 -7.134 -2.056 1.00 0.00 H new ATOM 617 N GLY A 42 1.468 -10.267 -5.106 1.00 0.00 N ATOM 618 CA GLY A 42 0.808 -11.216 -5.986 1.00 0.00 C ATOM 619 C GLY A 42 -0.652 -11.418 -5.578 1.00 0.00 C ATOM 620 O GLY A 42 -1.201 -12.507 -5.740 1.00 0.00 O ATOM 0 H GLY A 42 1.073 -9.327 -5.121 1.00 0.00 H new ATOM 0 HA2 GLY A 42 0.856 -10.858 -7.014 1.00 0.00 H new ATOM 0 HA3 GLY A 42 1.333 -12.171 -5.956 1.00 0.00 H new ATOM 624 N VAL A 43 -1.241 -10.352 -5.056 1.00 0.00 N ATOM 625 CA VAL A 43 -2.627 -10.399 -4.624 1.00 0.00 C ATOM 626 C VAL A 43 -3.399 -9.249 -5.275 1.00 0.00 C ATOM 627 O VAL A 43 -2.843 -8.176 -5.507 1.00 0.00 O ATOM 628 CB VAL A 43 -2.700 -10.377 -3.096 1.00 0.00 C ATOM 629 CG1 VAL A 43 -4.149 -10.266 -2.617 1.00 0.00 C ATOM 630 CG2 VAL A 43 -2.018 -11.610 -2.498 1.00 0.00 C ATOM 0 H VAL A 43 -0.783 -9.450 -4.923 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.096 -11.329 -4.946 1.00 0.00 H new ATOM 0 HB VAL A 43 -2.164 -9.494 -2.747 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.172 -10.252 -1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.590 -9.346 -3.001 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.719 -11.121 -2.981 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.084 -11.571 -1.411 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.514 -12.511 -2.859 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -0.970 -11.628 -2.798 1.00 0.00 H new ATOM 640 N LEU A 44 -4.667 -9.512 -5.552 1.00 0.00 N ATOM 641 CA LEU A 44 -5.521 -8.513 -6.172 1.00 0.00 C ATOM 642 C LEU A 44 -5.477 -7.227 -5.345 1.00 0.00 C ATOM 643 O LEU A 44 -5.215 -7.266 -4.144 1.00 0.00 O ATOM 644 CB LEU A 44 -6.933 -9.066 -6.375 1.00 0.00 C ATOM 645 CG LEU A 44 -7.032 -10.396 -7.124 1.00 0.00 C ATOM 646 CD1 LEU A 44 -8.462 -10.938 -7.094 1.00 0.00 C ATOM 647 CD2 LEU A 44 -6.500 -10.262 -8.552 1.00 0.00 C ATOM 0 H LEU A 44 -5.124 -10.403 -5.359 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.155 -8.265 -7.168 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.398 -9.187 -5.397 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.518 -8.323 -6.916 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.402 -11.123 -6.612 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.504 -11.884 -7.634 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.770 -11.096 -6.060 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -9.133 -10.221 -7.567 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -6.582 -11.222 -9.062 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.084 -9.514 -9.089 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.455 -9.954 -8.523 1.00 0.00 H new ATOM 659 N PRO A 45 -5.744 -6.088 -6.039 1.00 0.00 N ATOM 660 CA PRO A 45 -5.737 -4.792 -5.381 1.00 0.00 C ATOM 661 C PRO A 45 -6.991 -4.606 -4.524 1.00 0.00 C ATOM 662 O PRO A 45 -6.905 -4.161 -3.381 1.00 0.00 O ATOM 663 CB PRO A 45 -5.632 -3.779 -6.509 1.00 0.00 C ATOM 664 CG PRO A 45 -6.051 -4.515 -7.771 1.00 0.00 C ATOM 665 CD PRO A 45 -6.058 -6.004 -7.462 1.00 0.00 C ATOM 0 HA PRO A 45 -4.907 -4.678 -4.683 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.278 -2.921 -6.325 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.615 -3.398 -6.599 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -7.039 -4.187 -8.094 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -5.361 -4.298 -8.587 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -7.029 -6.449 -7.680 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.321 -6.537 -8.062 1.00 0.00 H new ATOM 673 N GLU A 46 -8.127 -4.954 -5.111 1.00 0.00 N ATOM 674 CA GLU A 46 -9.397 -4.831 -4.416 1.00 0.00 C ATOM 675 C GLU A 46 -9.387 -5.673 -3.139 1.00 0.00 C ATOM 676 O GLU A 46 -10.068 -5.344 -2.168 1.00 0.00 O ATOM 677 CB GLU A 46 -10.561 -5.228 -5.326 1.00 0.00 C ATOM 678 CG GLU A 46 -10.419 -6.677 -5.797 1.00 0.00 C ATOM 679 CD GLU A 46 -11.589 -7.078 -6.697 1.00 0.00 C ATOM 680 OE1 GLU A 46 -12.624 -7.494 -6.131 1.00 0.00 O ATOM 681 OE2 GLU A 46 -11.423 -6.960 -7.930 1.00 0.00 O ATOM 0 H GLU A 46 -8.194 -5.321 -6.060 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.537 -3.786 -4.138 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.503 -5.106 -4.791 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.596 -4.563 -6.189 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.481 -6.797 -6.339 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.375 -7.341 -4.934 1.00 0.00 H new ATOM 688 N ARG A 47 -8.608 -6.744 -3.180 1.00 0.00 N ATOM 689 CA ARG A 47 -8.500 -7.636 -2.038 1.00 0.00 C ATOM 690 C ARG A 47 -7.438 -7.124 -1.063 1.00 0.00 C ATOM 691 O ARG A 47 -7.639 -7.154 0.150 1.00 0.00 O ATOM 692 CB ARG A 47 -8.136 -9.055 -2.480 1.00 0.00 C ATOM 693 CG ARG A 47 -9.322 -9.737 -3.164 1.00 0.00 C ATOM 694 CD ARG A 47 -9.850 -10.897 -2.318 1.00 0.00 C ATOM 695 NE ARG A 47 -11.224 -10.601 -1.854 1.00 0.00 N ATOM 696 CZ ARG A 47 -12.083 -11.527 -1.407 1.00 0.00 C ATOM 697 NH1 ARG A 47 -11.715 -12.815 -1.362 1.00 0.00 N ATOM 698 NH2 ARG A 47 -13.309 -11.166 -1.007 1.00 0.00 N ATOM 0 H ARG A 47 -8.045 -7.014 -3.987 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.471 -7.660 -1.543 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -7.288 -9.020 -3.164 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -7.824 -9.641 -1.615 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -10.118 -9.011 -3.329 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -9.019 -10.106 -4.144 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.845 -11.816 -2.903 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -9.196 -11.061 -1.462 1.00 0.00 H new ATOM 0 HE ARG A 47 -11.537 -9.630 -1.876 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -10.782 -13.090 -1.668 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -12.368 -13.520 -1.022 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -13.589 -10.186 -1.043 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -13.963 -11.871 -0.667 1.00 0.00 H new ATOM 712 N GLN A 48 -6.332 -6.667 -1.630 1.00 0.00 N ATOM 713 CA GLN A 48 -5.238 -6.149 -0.826 1.00 0.00 C ATOM 714 C GLN A 48 -5.765 -5.155 0.211 1.00 0.00 C ATOM 715 O GLN A 48 -6.468 -4.207 -0.134 1.00 0.00 O ATOM 716 CB GLN A 48 -4.166 -5.505 -1.707 1.00 0.00 C ATOM 717 CG GLN A 48 -3.078 -6.516 -2.075 1.00 0.00 C ATOM 718 CD GLN A 48 -1.851 -5.813 -2.659 1.00 0.00 C ATOM 719 OE1 GLN A 48 -0.805 -5.715 -2.039 1.00 0.00 O ATOM 720 NE2 GLN A 48 -2.037 -5.331 -3.885 1.00 0.00 N ATOM 0 H GLN A 48 -6.169 -6.644 -2.637 1.00 0.00 H new ATOM 0 HA GLN A 48 -4.775 -6.983 -0.299 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.624 -5.112 -2.615 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -3.720 -4.660 -1.183 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -2.790 -7.083 -1.190 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -3.470 -7.231 -2.798 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -2.939 -5.448 -4.348 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -1.278 -4.845 -4.362 1.00 0.00 H new ATOM 729 N LYS A 49 -5.405 -5.406 1.461 1.00 0.00 N ATOM 730 CA LYS A 49 -5.833 -4.545 2.551 1.00 0.00 C ATOM 731 C LYS A 49 -4.632 -3.754 3.072 1.00 0.00 C ATOM 732 O LYS A 49 -3.635 -4.338 3.493 1.00 0.00 O ATOM 733 CB LYS A 49 -6.547 -5.362 3.630 1.00 0.00 C ATOM 734 CG LYS A 49 -7.859 -4.693 4.045 1.00 0.00 C ATOM 735 CD LYS A 49 -7.719 -4.010 5.407 1.00 0.00 C ATOM 736 CE LYS A 49 -6.835 -2.765 5.308 1.00 0.00 C ATOM 737 NZ LYS A 49 -7.436 -1.640 6.058 1.00 0.00 N ATOM 0 H LYS A 49 -4.822 -6.193 1.744 1.00 0.00 H new ATOM 0 HA LYS A 49 -6.565 -3.818 2.198 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.749 -6.366 3.257 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -5.898 -5.469 4.499 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -8.150 -3.959 3.294 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -8.654 -5.438 4.088 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -8.704 -3.732 5.781 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.290 -4.708 6.126 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.843 -2.984 5.703 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -6.707 -2.485 4.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -6.791 -0.825 6.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.342 -1.376 5.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -7.598 -1.927 7.044 1.00 0.00 H new ATOM 751 N LEU A 50 -4.767 -2.437 3.027 1.00 0.00 N ATOM 752 CA LEU A 50 -3.705 -1.560 3.489 1.00 0.00 C ATOM 753 C LEU A 50 -3.983 -1.149 4.936 1.00 0.00 C ATOM 754 O LEU A 50 -4.910 -0.384 5.201 1.00 0.00 O ATOM 755 CB LEU A 50 -3.535 -0.375 2.535 1.00 0.00 C ATOM 756 CG LEU A 50 -3.242 -0.727 1.075 1.00 0.00 C ATOM 757 CD1 LEU A 50 -2.753 0.500 0.304 1.00 0.00 C ATOM 758 CD2 LEU A 50 -2.258 -1.894 0.979 1.00 0.00 C ATOM 0 H LEU A 50 -5.596 -1.956 2.678 1.00 0.00 H new ATOM 0 HA LEU A 50 -2.749 -2.084 3.483 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.444 0.226 2.568 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -2.725 0.252 2.907 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.172 -1.052 0.608 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -2.552 0.223 -0.731 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.519 1.275 0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -1.839 0.878 0.763 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.067 -2.124 -0.069 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.322 -1.622 1.467 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.683 -2.769 1.471 1.00 0.00 H new ATOM 770 N LEU A 51 -3.163 -1.674 5.835 1.00 0.00 N ATOM 771 CA LEU A 51 -3.309 -1.371 7.249 1.00 0.00 C ATOM 772 C LEU A 51 -2.214 -0.390 7.671 1.00 0.00 C ATOM 773 O LEU A 51 -1.029 -0.714 7.614 1.00 0.00 O ATOM 774 CB LEU A 51 -3.332 -2.660 8.073 1.00 0.00 C ATOM 775 CG LEU A 51 -4.490 -2.803 9.062 1.00 0.00 C ATOM 776 CD1 LEU A 51 -5.615 -3.654 8.469 1.00 0.00 C ATOM 777 CD2 LEU A 51 -4.001 -3.353 10.403 1.00 0.00 C ATOM 0 H LEU A 51 -2.395 -2.307 5.612 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.265 -0.882 7.438 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.360 -3.506 7.386 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.396 -2.730 8.627 1.00 0.00 H new ATOM 0 HG LEU A 51 -4.902 -1.812 9.252 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -6.426 -3.740 9.192 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -5.988 -3.182 7.560 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -5.234 -4.647 8.232 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.844 -3.445 11.088 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.548 -4.333 10.251 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -3.262 -2.674 10.827 1.00 0.00 H new ATOM 789 N GLY A 52 -2.649 0.790 8.087 1.00 0.00 N ATOM 790 CA GLY A 52 -1.721 1.821 8.519 1.00 0.00 C ATOM 791 C GLY A 52 -2.317 3.216 8.317 1.00 0.00 C ATOM 792 O GLY A 52 -2.389 4.006 9.256 1.00 0.00 O ATOM 0 H GLY A 52 -3.633 1.055 8.134 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.475 1.676 9.571 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.790 1.735 7.959 1.00 0.00 H new ATOM 796 N LEU A 53 -2.727 3.475 7.084 1.00 0.00 N ATOM 797 CA LEU A 53 -3.314 4.761 6.746 1.00 0.00 C ATOM 798 C LEU A 53 -4.824 4.595 6.563 1.00 0.00 C ATOM 799 O LEU A 53 -5.276 4.081 5.541 1.00 0.00 O ATOM 800 CB LEU A 53 -2.610 5.369 5.531 1.00 0.00 C ATOM 801 CG LEU A 53 -2.453 4.449 4.318 1.00 0.00 C ATOM 802 CD1 LEU A 53 -2.942 5.138 3.042 1.00 0.00 C ATOM 803 CD2 LEU A 53 -1.011 3.957 4.187 1.00 0.00 C ATOM 0 H LEU A 53 -2.664 2.817 6.307 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.167 5.472 7.559 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -3.163 6.255 5.221 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -1.619 5.703 5.839 1.00 0.00 H new ATOM 0 HG LEU A 53 -3.080 3.571 4.471 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -2.820 4.463 2.195 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -3.995 5.398 3.150 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.360 6.044 2.872 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.927 3.305 3.317 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.345 4.811 4.066 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.733 3.403 5.084 1.00 0.00 H new ATOM 815 N LYS A 54 -5.563 5.040 7.569 1.00 0.00 N ATOM 816 CA LYS A 54 -7.012 4.947 7.531 1.00 0.00 C ATOM 817 C LYS A 54 -7.600 6.331 7.251 1.00 0.00 C ATOM 818 O LYS A 54 -6.909 7.341 7.379 1.00 0.00 O ATOM 819 CB LYS A 54 -7.541 4.302 8.814 1.00 0.00 C ATOM 820 CG LYS A 54 -7.511 2.776 8.713 1.00 0.00 C ATOM 821 CD LYS A 54 -7.210 2.142 10.073 1.00 0.00 C ATOM 822 CE LYS A 54 -5.797 2.494 10.541 1.00 0.00 C ATOM 823 NZ LYS A 54 -5.062 1.271 10.936 1.00 0.00 N ATOM 0 H LYS A 54 -5.185 5.466 8.415 1.00 0.00 H new ATOM 0 HA LYS A 54 -7.331 4.294 6.718 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -6.939 4.626 9.663 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -8.561 4.638 9.000 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -8.470 2.414 8.343 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -6.755 2.471 7.990 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -7.937 2.487 10.808 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -7.315 1.059 10.005 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -5.260 3.006 9.743 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.848 3.183 11.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -4.105 1.528 11.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -5.567 0.798 11.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -4.997 0.627 10.122 1.00 0.00 H new ATOM 837 N VAL A 55 -8.871 6.334 6.875 1.00 0.00 N ATOM 838 CA VAL A 55 -9.560 7.578 6.575 1.00 0.00 C ATOM 839 C VAL A 55 -10.968 7.532 7.172 1.00 0.00 C ATOM 840 O VAL A 55 -11.868 6.917 6.602 1.00 0.00 O ATOM 841 CB VAL A 55 -9.558 7.827 5.066 1.00 0.00 C ATOM 842 CG1 VAL A 55 -10.484 8.989 4.701 1.00 0.00 C ATOM 843 CG2 VAL A 55 -8.138 8.076 4.553 1.00 0.00 C ATOM 0 H VAL A 55 -9.441 5.495 6.771 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.041 8.422 7.030 1.00 0.00 H new ATOM 0 HB VAL A 55 -9.938 6.929 4.578 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -10.464 9.145 3.622 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -11.501 8.756 5.015 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -10.147 9.895 5.205 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.165 8.250 3.477 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -7.719 8.950 5.052 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -7.517 7.205 4.764 1.00 0.00 H new ATOM 853 N LYS A 56 -11.115 8.191 8.312 1.00 0.00 N ATOM 854 CA LYS A 56 -12.399 8.233 8.991 1.00 0.00 C ATOM 855 C LYS A 56 -13.065 6.859 8.900 1.00 0.00 C ATOM 856 O LYS A 56 -14.198 6.744 8.436 1.00 0.00 O ATOM 857 CB LYS A 56 -13.260 9.372 8.440 1.00 0.00 C ATOM 858 CG LYS A 56 -13.428 9.248 6.925 1.00 0.00 C ATOM 859 CD LYS A 56 -14.546 10.163 6.420 1.00 0.00 C ATOM 860 CE LYS A 56 -14.956 9.792 4.994 1.00 0.00 C ATOM 861 NZ LYS A 56 -15.950 8.697 5.008 1.00 0.00 N ATOM 0 H LYS A 56 -10.367 8.700 8.782 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.262 8.451 10.050 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.238 9.358 8.920 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -12.800 10.330 8.681 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -12.492 9.505 6.430 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -13.654 8.214 6.664 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -15.409 10.088 7.082 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -14.212 11.200 6.448 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -15.374 10.664 4.491 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -14.078 9.487 4.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.217 8.458 4.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -15.539 7.860 5.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.794 9.001 5.533 1.00 0.00 H new ATOM 875 N GLY A 57 -12.332 5.851 9.350 1.00 0.00 N ATOM 876 CA GLY A 57 -12.838 4.489 9.325 1.00 0.00 C ATOM 877 C GLY A 57 -12.117 3.656 8.263 1.00 0.00 C ATOM 878 O GLY A 57 -11.183 2.919 8.575 1.00 0.00 O ATOM 0 H GLY A 57 -11.392 5.950 9.734 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -12.705 4.030 10.305 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -13.909 4.499 9.120 1.00 0.00 H new ATOM 882 N LYS A 58 -12.578 3.801 7.029 1.00 0.00 N ATOM 883 CA LYS A 58 -11.989 3.071 5.920 1.00 0.00 C ATOM 884 C LYS A 58 -10.760 3.828 5.412 1.00 0.00 C ATOM 885 O LYS A 58 -10.710 5.055 5.480 1.00 0.00 O ATOM 886 CB LYS A 58 -13.037 2.804 4.837 1.00 0.00 C ATOM 887 CG LYS A 58 -13.525 4.113 4.212 1.00 0.00 C ATOM 888 CD LYS A 58 -12.791 4.401 2.901 1.00 0.00 C ATOM 889 CE LYS A 58 -12.306 5.851 2.851 1.00 0.00 C ATOM 890 NZ LYS A 58 -12.912 6.562 1.703 1.00 0.00 N ATOM 0 H LYS A 58 -13.353 4.413 6.773 1.00 0.00 H new ATOM 0 HA LYS A 58 -11.647 2.090 6.249 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -12.611 2.164 4.064 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -13.881 2.265 5.268 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -14.598 4.054 4.027 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -13.366 4.935 4.910 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -11.941 3.726 2.800 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -13.454 4.206 2.058 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -12.566 6.360 3.779 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -11.219 5.874 2.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -12.239 7.265 1.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -13.142 5.879 0.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -13.781 7.043 2.012 1.00 0.00 H new ATOM 904 N PRO A 59 -9.772 3.044 4.902 1.00 0.00 N ATOM 905 CA PRO A 59 -8.547 3.627 4.383 1.00 0.00 C ATOM 906 C PRO A 59 -8.783 4.278 3.019 1.00 0.00 C ATOM 907 O PRO A 59 -9.805 4.032 2.379 1.00 0.00 O ATOM 908 CB PRO A 59 -7.556 2.476 4.329 1.00 0.00 C ATOM 909 CG PRO A 59 -8.389 1.206 4.376 1.00 0.00 C ATOM 910 CD PRO A 59 -9.797 1.588 4.806 1.00 0.00 C ATOM 0 HA PRO A 59 -8.167 4.434 5.010 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -6.958 2.518 3.418 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -6.862 2.519 5.168 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -8.406 0.724 3.398 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -7.957 0.491 5.076 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -10.538 1.252 4.081 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -10.057 1.132 5.762 1.00 0.00 H new ATOM 918 N ALA A 60 -7.822 5.094 2.613 1.00 0.00 N ATOM 919 CA ALA A 60 -7.913 5.781 1.336 1.00 0.00 C ATOM 920 C ALA A 60 -8.441 4.812 0.277 1.00 0.00 C ATOM 921 O ALA A 60 -8.416 3.598 0.474 1.00 0.00 O ATOM 922 CB ALA A 60 -6.545 6.359 0.969 1.00 0.00 C ATOM 0 H ALA A 60 -6.976 5.295 3.146 1.00 0.00 H new ATOM 0 HA ALA A 60 -8.613 6.614 1.397 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -6.613 6.874 0.011 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -6.229 7.063 1.739 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.817 5.551 0.896 1.00 0.00 H new ATOM 928 N GLU A 61 -8.905 5.384 -0.824 1.00 0.00 N ATOM 929 CA GLU A 61 -9.438 4.586 -1.915 1.00 0.00 C ATOM 930 C GLU A 61 -8.444 4.544 -3.077 1.00 0.00 C ATOM 931 O GLU A 61 -7.368 5.135 -2.999 1.00 0.00 O ATOM 932 CB GLU A 61 -10.796 5.121 -2.374 1.00 0.00 C ATOM 933 CG GLU A 61 -11.810 5.097 -1.229 1.00 0.00 C ATOM 934 CD GLU A 61 -13.191 4.667 -1.729 1.00 0.00 C ATOM 935 OE1 GLU A 61 -13.890 5.540 -2.287 1.00 0.00 O ATOM 936 OE2 GLU A 61 -13.516 3.475 -1.542 1.00 0.00 O ATOM 0 H GLU A 61 -8.923 6.391 -0.984 1.00 0.00 H new ATOM 0 HA GLU A 61 -9.589 3.568 -1.554 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -10.683 6.140 -2.743 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -11.166 4.520 -3.205 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -11.471 4.412 -0.452 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -11.875 6.086 -0.775 1.00 0.00 H new ATOM 943 N ASN A 62 -8.839 3.840 -4.127 1.00 0.00 N ATOM 944 CA ASN A 62 -7.996 3.713 -5.304 1.00 0.00 C ATOM 945 C ASN A 62 -8.198 4.934 -6.205 1.00 0.00 C ATOM 946 O ASN A 62 -7.394 5.188 -7.101 1.00 0.00 O ATOM 947 CB ASN A 62 -8.359 2.465 -6.110 1.00 0.00 C ATOM 948 CG ASN A 62 -9.863 2.412 -6.390 1.00 0.00 C ATOM 949 OD1 ASN A 62 -10.679 2.229 -5.502 1.00 0.00 O ATOM 950 ND2 ASN A 62 -10.181 2.580 -7.670 1.00 0.00 N ATOM 0 H ASN A 62 -9.732 3.351 -4.188 1.00 0.00 H new ATOM 0 HA ASN A 62 -6.961 3.638 -4.971 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -7.810 2.463 -7.052 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -8.056 1.573 -5.562 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -11.159 2.560 -7.959 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -9.447 2.729 -8.363 1.00 0.00 H new ATOM 957 N ASP A 63 -9.275 5.656 -5.935 1.00 0.00 N ATOM 958 CA ASP A 63 -9.592 6.844 -6.710 1.00 0.00 C ATOM 959 C ASP A 63 -9.183 8.088 -5.919 1.00 0.00 C ATOM 960 O ASP A 63 -9.664 9.187 -6.191 1.00 0.00 O ATOM 961 CB ASP A 63 -11.094 6.934 -6.989 1.00 0.00 C ATOM 962 CG ASP A 63 -11.495 6.705 -8.448 1.00 0.00 C ATOM 963 OD1 ASP A 63 -10.625 6.227 -9.207 1.00 0.00 O ATOM 964 OD2 ASP A 63 -12.663 7.012 -8.770 1.00 0.00 O ATOM 0 H ASP A 63 -9.939 5.442 -5.191 1.00 0.00 H new ATOM 0 HA ASP A 63 -9.052 6.785 -7.655 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -11.608 6.201 -6.367 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -11.447 7.918 -6.681 1.00 0.00 H new ATOM 969 N VAL A 64 -8.300 7.874 -4.955 1.00 0.00 N ATOM 970 CA VAL A 64 -7.821 8.964 -4.123 1.00 0.00 C ATOM 971 C VAL A 64 -6.320 9.155 -4.354 1.00 0.00 C ATOM 972 O VAL A 64 -5.592 8.186 -4.560 1.00 0.00 O ATOM 973 CB VAL A 64 -8.170 8.696 -2.657 1.00 0.00 C ATOM 974 CG1 VAL A 64 -7.135 9.327 -1.723 1.00 0.00 C ATOM 975 CG2 VAL A 64 -9.579 9.194 -2.330 1.00 0.00 C ATOM 0 H VAL A 64 -7.904 6.961 -4.732 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.314 9.897 -4.396 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.150 7.618 -2.499 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -7.406 9.122 -0.687 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -6.152 8.905 -1.931 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -7.108 10.405 -1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -9.802 8.992 -1.283 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -9.637 10.267 -2.513 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.303 8.679 -2.961 1.00 0.00 H new ATOM 985 N LYS A 65 -5.903 10.412 -4.313 1.00 0.00 N ATOM 986 CA LYS A 65 -4.503 10.743 -4.516 1.00 0.00 C ATOM 987 C LYS A 65 -3.728 10.474 -3.224 1.00 0.00 C ATOM 988 O LYS A 65 -4.170 10.853 -2.141 1.00 0.00 O ATOM 989 CB LYS A 65 -4.360 12.176 -5.032 1.00 0.00 C ATOM 990 CG LYS A 65 -4.041 12.191 -6.528 1.00 0.00 C ATOM 991 CD LYS A 65 -2.603 12.650 -6.778 1.00 0.00 C ATOM 992 CE LYS A 65 -2.536 13.624 -7.956 1.00 0.00 C ATOM 993 NZ LYS A 65 -2.161 14.977 -7.489 1.00 0.00 N ATOM 0 H LYS A 65 -6.510 11.213 -4.142 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.069 10.107 -5.287 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.283 12.726 -4.848 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.569 12.687 -4.483 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -4.186 11.194 -6.944 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.734 12.856 -7.044 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.210 13.130 -5.882 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.971 11.785 -6.980 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.809 13.271 -8.687 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.502 13.661 -8.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.120 15.626 -8.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -2.870 15.318 -6.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.229 14.939 -7.029 1.00 0.00 H new ATOM 1007 N LEU A 66 -2.585 9.822 -3.382 1.00 0.00 N ATOM 1008 CA LEU A 66 -1.744 9.499 -2.242 1.00 0.00 C ATOM 1009 C LEU A 66 -1.196 10.792 -1.635 1.00 0.00 C ATOM 1010 O LEU A 66 -0.951 10.861 -0.432 1.00 0.00 O ATOM 1011 CB LEU A 66 -0.658 8.499 -2.644 1.00 0.00 C ATOM 1012 CG LEU A 66 -1.149 7.131 -3.122 1.00 0.00 C ATOM 1013 CD1 LEU A 66 -0.398 6.687 -4.379 1.00 0.00 C ATOM 1014 CD2 LEU A 66 -1.055 6.093 -2.001 1.00 0.00 C ATOM 0 H LEU A 66 -2.222 9.509 -4.282 1.00 0.00 H new ATOM 0 HA LEU A 66 -2.328 9.005 -1.465 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.057 8.945 -3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.003 8.348 -1.790 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.201 7.220 -3.391 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.766 5.712 -4.698 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.560 7.414 -5.175 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.668 6.619 -4.161 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.410 5.129 -2.367 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.018 5.999 -1.678 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.670 6.410 -1.159 1.00 0.00 H new ATOM 1026 N GLY A 67 -1.019 11.784 -2.496 1.00 0.00 N ATOM 1027 CA GLY A 67 -0.505 13.070 -2.059 1.00 0.00 C ATOM 1028 C GLY A 67 -1.500 13.774 -1.135 1.00 0.00 C ATOM 1029 O GLY A 67 -1.119 14.294 -0.087 1.00 0.00 O ATOM 0 H GLY A 67 -1.223 11.722 -3.494 1.00 0.00 H new ATOM 0 HA2 GLY A 67 0.442 12.929 -1.539 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -0.302 13.698 -2.926 1.00 0.00 H new ATOM 1033 N ALA A 68 -2.756 13.768 -1.556 1.00 0.00 N ATOM 1034 CA ALA A 68 -3.809 14.399 -0.779 1.00 0.00 C ATOM 1035 C ALA A 68 -3.724 13.920 0.672 1.00 0.00 C ATOM 1036 O ALA A 68 -3.915 14.704 1.600 1.00 0.00 O ATOM 1037 CB ALA A 68 -5.167 14.093 -1.415 1.00 0.00 C ATOM 0 H ALA A 68 -3.068 13.336 -2.426 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.687 15.482 -0.776 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.957 14.566 -0.832 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.187 14.479 -2.434 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.326 13.015 -1.433 1.00 0.00 H new ATOM 1043 N LEU A 69 -3.436 12.636 0.821 1.00 0.00 N ATOM 1044 CA LEU A 69 -3.323 12.043 2.143 1.00 0.00 C ATOM 1045 C LEU A 69 -2.120 12.650 2.868 1.00 0.00 C ATOM 1046 O LEU A 69 -2.111 12.742 4.095 1.00 0.00 O ATOM 1047 CB LEU A 69 -3.275 10.517 2.044 1.00 0.00 C ATOM 1048 CG LEU A 69 -4.623 9.798 2.125 1.00 0.00 C ATOM 1049 CD1 LEU A 69 -5.468 10.344 3.277 1.00 0.00 C ATOM 1050 CD2 LEU A 69 -5.364 9.869 0.788 1.00 0.00 C ATOM 0 H LEU A 69 -3.277 11.989 0.048 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.205 12.273 2.740 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -2.798 10.249 1.101 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.636 10.141 2.843 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.435 8.745 2.334 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.421 9.816 3.312 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.938 10.198 4.218 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.649 11.408 3.123 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.319 9.350 0.873 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.540 10.912 0.524 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.762 9.395 0.013 1.00 0.00 H new ATOM 1062 N LYS A 70 -1.133 13.048 2.079 1.00 0.00 N ATOM 1063 CA LYS A 70 0.073 13.644 2.630 1.00 0.00 C ATOM 1064 C LYS A 70 0.635 12.729 3.720 1.00 0.00 C ATOM 1065 O LYS A 70 0.766 13.139 4.872 1.00 0.00 O ATOM 1066 CB LYS A 70 -0.205 15.071 3.107 1.00 0.00 C ATOM 1067 CG LYS A 70 0.285 16.096 2.082 1.00 0.00 C ATOM 1068 CD LYS A 70 1.813 16.161 2.057 1.00 0.00 C ATOM 1069 CE LYS A 70 2.303 17.139 0.988 1.00 0.00 C ATOM 1070 NZ LYS A 70 2.813 18.379 1.614 1.00 0.00 N ATOM 0 H LYS A 70 -1.143 12.970 1.062 1.00 0.00 H new ATOM 0 HA LYS A 70 0.840 13.734 1.861 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.274 15.201 3.274 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.290 15.242 4.063 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -0.087 15.832 1.092 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.120 17.079 2.323 1.00 0.00 H new ATOM 0 HD2 LYS A 70 2.183 16.470 3.035 1.00 0.00 H new ATOM 0 HD3 LYS A 70 2.220 15.169 1.861 1.00 0.00 H new ATOM 0 HE2 LYS A 70 3.090 16.674 0.395 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.488 17.378 0.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 3.142 19.032 0.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 2.052 18.830 2.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 3.604 18.148 2.248 1.00 0.00 H new ATOM 1084 N LEU A 71 0.953 11.508 3.317 1.00 0.00 N ATOM 1085 CA LEU A 71 1.499 10.532 4.245 1.00 0.00 C ATOM 1086 C LEU A 71 2.969 10.858 4.516 1.00 0.00 C ATOM 1087 O LEU A 71 3.507 11.818 3.965 1.00 0.00 O ATOM 1088 CB LEU A 71 1.270 9.111 3.725 1.00 0.00 C ATOM 1089 CG LEU A 71 -0.184 8.727 3.442 1.00 0.00 C ATOM 1090 CD1 LEU A 71 -0.301 7.958 2.125 1.00 0.00 C ATOM 1091 CD2 LEU A 71 -0.784 7.950 4.615 1.00 0.00 C ATOM 0 H LEU A 71 0.843 11.172 2.360 1.00 0.00 H new ATOM 0 HA LEU A 71 0.979 10.584 5.202 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.844 8.984 2.807 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.675 8.409 4.454 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.764 9.643 3.333 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.344 7.697 1.948 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.062 8.580 1.307 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.296 7.048 2.181 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.818 7.689 4.388 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.208 7.039 4.781 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -0.754 8.567 5.513 1.00 0.00 H new ATOM 1103 N LYS A 72 3.577 10.042 5.363 1.00 0.00 N ATOM 1104 CA LYS A 72 4.974 10.231 5.714 1.00 0.00 C ATOM 1105 C LYS A 72 5.848 9.390 4.781 1.00 0.00 C ATOM 1106 O LYS A 72 5.378 8.415 4.196 1.00 0.00 O ATOM 1107 CB LYS A 72 5.199 9.938 7.198 1.00 0.00 C ATOM 1108 CG LYS A 72 4.432 10.930 8.075 1.00 0.00 C ATOM 1109 CD LYS A 72 4.802 10.758 9.550 1.00 0.00 C ATOM 1110 CE LYS A 72 3.735 9.953 10.293 1.00 0.00 C ATOM 1111 NZ LYS A 72 4.366 8.939 11.168 1.00 0.00 N ATOM 0 H LYS A 72 3.127 9.247 5.817 1.00 0.00 H new ATOM 0 HA LYS A 72 5.265 11.272 5.572 1.00 0.00 H new ATOM 0 HB2 LYS A 72 4.877 8.922 7.425 1.00 0.00 H new ATOM 0 HB3 LYS A 72 6.263 9.993 7.426 1.00 0.00 H new ATOM 0 HG2 LYS A 72 4.654 11.949 7.757 1.00 0.00 H new ATOM 0 HG3 LYS A 72 3.360 10.782 7.946 1.00 0.00 H new ATOM 0 HD2 LYS A 72 5.765 10.253 9.631 1.00 0.00 H new ATOM 0 HD3 LYS A 72 4.915 11.737 10.017 1.00 0.00 H new ATOM 0 HE2 LYS A 72 3.116 10.623 10.890 1.00 0.00 H new ATOM 0 HE3 LYS A 72 3.075 9.464 9.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 3.627 8.401 11.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 4.938 8.290 10.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 4.977 9.413 11.864 1.00 0.00 H new ATOM 1125 N PRO A 73 7.137 9.807 4.669 1.00 0.00 N ATOM 1126 CA PRO A 73 8.081 9.103 3.818 1.00 0.00 C ATOM 1127 C PRO A 73 8.526 7.789 4.463 1.00 0.00 C ATOM 1128 O PRO A 73 8.449 7.634 5.681 1.00 0.00 O ATOM 1129 CB PRO A 73 9.227 10.079 3.609 1.00 0.00 C ATOM 1130 CG PRO A 73 9.104 11.110 4.719 1.00 0.00 C ATOM 1131 CD PRO A 73 7.729 10.957 5.348 1.00 0.00 C ATOM 0 HA PRO A 73 7.647 8.809 2.862 1.00 0.00 H new ATOM 0 HB2 PRO A 73 10.189 9.568 3.655 1.00 0.00 H new ATOM 0 HB3 PRO A 73 9.164 10.551 2.629 1.00 0.00 H new ATOM 0 HG2 PRO A 73 9.884 10.961 5.466 1.00 0.00 H new ATOM 0 HG3 PRO A 73 9.232 12.117 4.321 1.00 0.00 H new ATOM 0 HD2 PRO A 73 7.802 10.788 6.422 1.00 0.00 H new ATOM 0 HD3 PRO A 73 7.126 11.854 5.206 1.00 0.00 H new ATOM 1139 N ASN A 74 8.982 6.876 3.618 1.00 0.00 N ATOM 1140 CA ASN A 74 9.439 5.580 4.090 1.00 0.00 C ATOM 1141 C ASN A 74 8.477 5.064 5.162 1.00 0.00 C ATOM 1142 O ASN A 74 8.889 4.367 6.087 1.00 0.00 O ATOM 1143 CB ASN A 74 10.832 5.682 4.715 1.00 0.00 C ATOM 1144 CG ASN A 74 10.950 6.930 5.592 1.00 0.00 C ATOM 1145 OD1 ASN A 74 11.106 8.042 5.117 1.00 0.00 O ATOM 1146 ND2 ASN A 74 10.866 6.684 6.897 1.00 0.00 N ATOM 0 H ASN A 74 9.045 7.008 2.609 1.00 0.00 H new ATOM 0 HA ASN A 74 9.475 4.903 3.236 1.00 0.00 H new ATOM 0 HB2 ASN A 74 11.032 4.793 5.313 1.00 0.00 H new ATOM 0 HB3 ASN A 74 11.586 5.713 3.928 1.00 0.00 H new ATOM 0 HD21 ASN A 74 10.932 7.451 7.566 1.00 0.00 H new ATOM 0 HD22 ASN A 74 10.735 5.728 7.228 1.00 0.00 H new ATOM 1153 N THR A 75 7.213 5.427 5.001 1.00 0.00 N ATOM 1154 CA THR A 75 6.189 5.010 5.943 1.00 0.00 C ATOM 1155 C THR A 75 5.968 3.498 5.857 1.00 0.00 C ATOM 1156 O THR A 75 5.346 3.011 4.914 1.00 0.00 O ATOM 1157 CB THR A 75 4.925 5.825 5.660 1.00 0.00 C ATOM 1158 OG1 THR A 75 5.203 7.103 6.225 1.00 0.00 O ATOM 1159 CG2 THR A 75 3.715 5.324 6.452 1.00 0.00 C ATOM 0 H THR A 75 6.875 6.005 4.232 1.00 0.00 H new ATOM 0 HA THR A 75 6.496 5.204 6.971 1.00 0.00 H new ATOM 0 HB THR A 75 4.701 5.789 4.594 1.00 0.00 H new ATOM 0 HG1 THR A 75 6.171 7.209 6.333 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.845 5.937 6.214 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.511 4.286 6.187 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.925 5.392 7.519 1.00 0.00 H new ATOM 1167 N LYS A 76 6.492 2.798 6.852 1.00 0.00 N ATOM 1168 CA LYS A 76 6.360 1.352 6.901 1.00 0.00 C ATOM 1169 C LYS A 76 4.943 0.987 7.347 1.00 0.00 C ATOM 1170 O LYS A 76 4.648 0.975 8.541 1.00 0.00 O ATOM 1171 CB LYS A 76 7.456 0.743 7.777 1.00 0.00 C ATOM 1172 CG LYS A 76 8.844 1.182 7.305 1.00 0.00 C ATOM 1173 CD LYS A 76 9.855 1.133 8.452 1.00 0.00 C ATOM 1174 CE LYS A 76 10.487 -0.256 8.566 1.00 0.00 C ATOM 1175 NZ LYS A 76 11.787 -0.177 9.269 1.00 0.00 N ATOM 0 H LYS A 76 7.009 3.206 7.631 1.00 0.00 H new ATOM 0 HA LYS A 76 6.502 0.924 5.909 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.308 1.046 8.814 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.386 -0.344 7.750 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.178 0.535 6.494 1.00 0.00 H new ATOM 0 HG3 LYS A 76 8.792 2.194 6.904 1.00 0.00 H new ATOM 0 HD2 LYS A 76 10.633 1.878 8.288 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.360 1.390 9.389 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.815 -0.925 9.105 1.00 0.00 H new ATOM 0 HE3 LYS A 76 10.629 -0.680 7.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.203 -1.128 9.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 12.431 0.445 8.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 11.642 0.208 10.224 1.00 0.00 H new ATOM 1189 N ILE A 77 4.103 0.700 6.363 1.00 0.00 N ATOM 1190 CA ILE A 77 2.723 0.336 6.640 1.00 0.00 C ATOM 1191 C ILE A 77 2.574 -1.184 6.555 1.00 0.00 C ATOM 1192 O ILE A 77 3.468 -1.872 6.063 1.00 0.00 O ATOM 1193 CB ILE A 77 1.773 1.100 5.716 1.00 0.00 C ATOM 1194 CG1 ILE A 77 1.846 0.560 4.286 1.00 0.00 C ATOM 1195 CG2 ILE A 77 2.042 2.605 5.774 1.00 0.00 C ATOM 1196 CD1 ILE A 77 0.613 -0.283 3.954 1.00 0.00 C ATOM 0 H ILE A 77 4.351 0.712 5.374 1.00 0.00 H new ATOM 0 HA ILE A 77 2.448 0.627 7.654 1.00 0.00 H new ATOM 0 HB ILE A 77 0.754 0.941 6.069 1.00 0.00 H new ATOM 0 HG12 ILE A 77 1.923 1.390 3.584 1.00 0.00 H new ATOM 0 HG13 ILE A 77 2.746 -0.043 4.167 1.00 0.00 H new ATOM 0 HG21 ILE A 77 1.353 3.124 5.108 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.898 2.961 6.794 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.067 2.804 5.462 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.691 -0.654 2.932 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.552 -1.126 4.643 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -0.283 0.330 4.050 1.00 0.00 H new ATOM 1208 N MET A 78 1.439 -1.664 7.041 1.00 0.00 N ATOM 1209 CA MET A 78 1.162 -3.090 7.026 1.00 0.00 C ATOM 1210 C MET A 78 0.114 -3.434 5.966 1.00 0.00 C ATOM 1211 O MET A 78 -0.636 -2.564 5.524 1.00 0.00 O ATOM 1212 CB MET A 78 0.658 -3.526 8.403 1.00 0.00 C ATOM 1213 CG MET A 78 0.931 -5.013 8.641 1.00 0.00 C ATOM 1214 SD MET A 78 1.587 -5.258 10.283 1.00 0.00 S ATOM 1215 CE MET A 78 0.124 -4.935 11.253 1.00 0.00 C ATOM 0 H MET A 78 0.700 -1.090 7.448 1.00 0.00 H new ATOM 0 HA MET A 78 2.084 -3.618 6.783 1.00 0.00 H new ATOM 0 HB2 MET A 78 1.147 -2.934 9.177 1.00 0.00 H new ATOM 0 HB3 MET A 78 -0.412 -3.332 8.481 1.00 0.00 H new ATOM 0 HG2 MET A 78 0.011 -5.584 8.519 1.00 0.00 H new ATOM 0 HG3 MET A 78 1.638 -5.385 7.899 1.00 0.00 H new ATOM 0 HE1 MET A 78 0.344 -5.097 12.308 1.00 0.00 H new ATOM 0 HE2 MET A 78 -0.192 -3.903 11.102 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.675 -5.608 10.941 1.00 0.00 H new ATOM 1225 N MET A 79 0.094 -4.704 5.589 1.00 0.00 N ATOM 1226 CA MET A 79 -0.850 -5.173 4.589 1.00 0.00 C ATOM 1227 C MET A 79 -1.545 -6.456 5.051 1.00 0.00 C ATOM 1228 O MET A 79 -0.995 -7.210 5.852 1.00 0.00 O ATOM 1229 CB MET A 79 -0.113 -5.436 3.275 1.00 0.00 C ATOM 1230 CG MET A 79 -1.094 -5.799 2.159 1.00 0.00 C ATOM 1231 SD MET A 79 -1.369 -7.563 2.138 1.00 0.00 S ATOM 1232 CE MET A 79 -0.645 -7.971 0.558 1.00 0.00 C ATOM 0 H MET A 79 0.717 -5.423 5.958 1.00 0.00 H new ATOM 0 HA MET A 79 -1.608 -4.404 4.442 1.00 0.00 H new ATOM 0 HB2 MET A 79 0.456 -4.551 2.990 1.00 0.00 H new ATOM 0 HB3 MET A 79 0.604 -6.246 3.412 1.00 0.00 H new ATOM 0 HG2 MET A 79 -2.039 -5.277 2.310 1.00 0.00 H new ATOM 0 HG3 MET A 79 -0.700 -5.473 1.197 1.00 0.00 H new ATOM 0 HE1 MET A 79 -0.959 -8.972 0.261 1.00 0.00 H new ATOM 0 HE2 MET A 79 -0.975 -7.250 -0.190 1.00 0.00 H new ATOM 0 HE3 MET A 79 0.442 -7.940 0.637 1.00 0.00 H new ATOM 1242 N MET A 80 -2.743 -6.664 4.525 1.00 0.00 N ATOM 1243 CA MET A 80 -3.518 -7.842 4.873 1.00 0.00 C ATOM 1244 C MET A 80 -4.249 -8.399 3.649 1.00 0.00 C ATOM 1245 O MET A 80 -4.662 -7.642 2.771 1.00 0.00 O ATOM 1246 CB MET A 80 -4.537 -7.482 5.956 1.00 0.00 C ATOM 1247 CG MET A 80 -3.990 -7.796 7.350 1.00 0.00 C ATOM 1248 SD MET A 80 -4.959 -9.088 8.109 1.00 0.00 S ATOM 1249 CE MET A 80 -6.424 -8.164 8.540 1.00 0.00 C ATOM 0 H MET A 80 -3.196 -6.036 3.860 1.00 0.00 H new ATOM 0 HA MET A 80 -2.835 -8.606 5.244 1.00 0.00 H new ATOM 0 HB2 MET A 80 -4.785 -6.423 5.889 1.00 0.00 H new ATOM 0 HB3 MET A 80 -5.460 -8.037 5.790 1.00 0.00 H new ATOM 0 HG2 MET A 80 -2.947 -8.106 7.279 1.00 0.00 H new ATOM 0 HG3 MET A 80 -4.015 -6.900 7.970 1.00 0.00 H new ATOM 0 HE1 MET A 80 -7.141 -8.825 9.028 1.00 0.00 H new ATOM 0 HE2 MET A 80 -6.157 -7.354 9.219 1.00 0.00 H new ATOM 0 HE3 MET A 80 -6.871 -7.748 7.637 1.00 0.00 H new ATOM 1259 N GLY A 81 -4.386 -9.716 3.630 1.00 0.00 N ATOM 1260 CA GLY A 81 -5.059 -10.383 2.528 1.00 0.00 C ATOM 1261 C GLY A 81 -4.470 -11.774 2.286 1.00 0.00 C ATOM 1262 O GLY A 81 -3.755 -12.305 3.134 1.00 0.00 O ATOM 0 H GLY A 81 -4.042 -10.340 4.360 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.124 -10.468 2.746 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.966 -9.782 1.623 1.00 0.00 H new ATOM 1266 N THR A 82 -4.792 -12.324 1.125 1.00 0.00 N ATOM 1267 CA THR A 82 -4.304 -13.643 0.760 1.00 0.00 C ATOM 1268 C THR A 82 -4.145 -13.753 -0.758 1.00 0.00 C ATOM 1269 O THR A 82 -4.753 -12.988 -1.505 1.00 0.00 O ATOM 1270 CB THR A 82 -5.262 -14.681 1.348 1.00 0.00 C ATOM 1271 OG1 THR A 82 -6.474 -14.484 0.624 1.00 0.00 O ATOM 1272 CG2 THR A 82 -5.640 -14.375 2.798 1.00 0.00 C ATOM 0 H THR A 82 -5.385 -11.880 0.424 1.00 0.00 H new ATOM 0 HA THR A 82 -3.312 -13.825 1.172 1.00 0.00 H new ATOM 0 HB THR A 82 -4.804 -15.669 1.294 1.00 0.00 H new ATOM 0 HG1 THR A 82 -7.151 -15.118 0.940 1.00 0.00 H new ATOM 0 HG21 THR A 82 -6.321 -15.142 3.166 1.00 0.00 H new ATOM 0 HG22 THR A 82 -4.741 -14.363 3.414 1.00 0.00 H new ATOM 0 HG23 THR A 82 -6.128 -13.402 2.849 1.00 0.00 H new ATOM 1280 N ARG A 83 -3.326 -14.710 -1.167 1.00 0.00 N ATOM 1281 CA ARG A 83 -3.080 -14.929 -2.582 1.00 0.00 C ATOM 1282 C ARG A 83 -3.764 -16.216 -3.047 1.00 0.00 C ATOM 1283 O ARG A 83 -4.104 -17.072 -2.231 1.00 0.00 O ATOM 1284 CB ARG A 83 -1.580 -15.023 -2.873 1.00 0.00 C ATOM 1285 CG ARG A 83 -1.000 -16.335 -2.342 1.00 0.00 C ATOM 1286 CD ARG A 83 0.515 -16.231 -2.160 1.00 0.00 C ATOM 1287 NE ARG A 83 0.849 -16.168 -0.720 1.00 0.00 N ATOM 1288 CZ ARG A 83 2.093 -16.269 -0.232 1.00 0.00 C ATOM 1289 NH1 ARG A 83 3.128 -16.438 -1.066 1.00 0.00 N ATOM 1290 NH2 ARG A 83 2.302 -16.201 1.090 1.00 0.00 N ATOM 0 H ARG A 83 -2.824 -15.343 -0.544 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.491 -14.078 -3.125 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.409 -14.954 -3.947 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -1.063 -14.180 -2.414 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.468 -16.584 -1.390 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -1.232 -17.145 -3.033 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.004 -17.091 -2.618 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.890 -15.343 -2.668 1.00 0.00 H new ATOM 0 HE ARG A 83 0.084 -16.040 -0.057 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.969 -16.490 -2.072 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.075 -16.515 -0.695 1.00 0.00 H new ATOM 0 HH21 ARG A 83 1.514 -16.072 1.725 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.249 -16.278 1.461 1.00 0.00 H new ATOM 1304 N GLU A 84 -3.945 -16.314 -4.356 1.00 0.00 N ATOM 1305 CA GLU A 84 -4.582 -17.482 -4.938 1.00 0.00 C ATOM 1306 C GLU A 84 -6.080 -17.480 -4.627 1.00 0.00 C ATOM 1307 O GLU A 84 -6.504 -16.949 -3.602 1.00 0.00 O ATOM 1308 CB GLU A 84 -3.921 -18.771 -4.444 1.00 0.00 C ATOM 1309 CG GLU A 84 -3.149 -19.458 -5.572 1.00 0.00 C ATOM 1310 CD GLU A 84 -1.767 -19.911 -5.094 1.00 0.00 C ATOM 1311 OE1 GLU A 84 -1.668 -20.267 -3.900 1.00 0.00 O ATOM 1312 OE2 GLU A 84 -0.842 -19.890 -5.934 1.00 0.00 O ATOM 0 H GLU A 84 -3.661 -15.603 -5.030 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.455 -17.439 -6.020 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -3.244 -18.544 -3.621 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -4.681 -19.448 -4.054 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -3.713 -20.318 -5.932 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -3.040 -18.773 -6.413 1.00 0.00 H new ATOM 1319 N SER A 85 -6.840 -18.081 -5.531 1.00 0.00 N ATOM 1320 CA SER A 85 -8.282 -18.155 -5.366 1.00 0.00 C ATOM 1321 C SER A 85 -8.641 -19.289 -4.404 1.00 0.00 C ATOM 1322 O SER A 85 -8.014 -20.347 -4.424 1.00 0.00 O ATOM 1323 CB SER A 85 -8.980 -18.360 -6.712 1.00 0.00 C ATOM 1324 OG SER A 85 -10.371 -18.054 -6.644 1.00 0.00 O ATOM 0 H SER A 85 -6.485 -18.521 -6.380 1.00 0.00 H new ATOM 0 HA SER A 85 -8.628 -17.210 -4.948 1.00 0.00 H new ATOM 0 HB2 SER A 85 -8.507 -17.731 -7.466 1.00 0.00 H new ATOM 0 HB3 SER A 85 -8.851 -19.394 -7.034 1.00 0.00 H new ATOM 0 HG SER A 85 -10.780 -18.196 -7.523 1.00 0.00 H new ATOM 1330 N GLY A 86 -9.648 -19.029 -3.583 1.00 0.00 N ATOM 1331 CA GLY A 86 -10.097 -20.014 -2.614 1.00 0.00 C ATOM 1332 C GLY A 86 -9.565 -19.692 -1.216 1.00 0.00 C ATOM 1333 O GLY A 86 -8.569 -18.984 -1.075 1.00 0.00 O ATOM 0 H GLY A 86 -10.166 -18.150 -3.569 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -11.187 -20.040 -2.595 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -9.760 -21.006 -2.916 1.00 0.00 H new ATOM 1337 N PRO A 87 -10.271 -20.241 -0.192 1.00 0.00 N ATOM 1338 CA PRO A 87 -9.880 -20.019 1.190 1.00 0.00 C ATOM 1339 C PRO A 87 -8.645 -20.848 1.550 1.00 0.00 C ATOM 1340 O PRO A 87 -7.771 -20.382 2.279 1.00 0.00 O ATOM 1341 CB PRO A 87 -11.104 -20.391 2.010 1.00 0.00 C ATOM 1342 CG PRO A 87 -11.973 -21.244 1.099 1.00 0.00 C ATOM 1343 CD PRO A 87 -11.455 -21.085 -0.321 1.00 0.00 C ATOM 0 HA PRO A 87 -9.586 -18.987 1.383 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -10.821 -20.942 2.907 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -11.639 -19.500 2.339 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -11.935 -22.290 1.404 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -13.015 -20.931 1.163 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -11.207 -22.050 -0.762 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -12.202 -20.623 -0.966 1.00 0.00 H new ATOM 1351 N SER A 88 -8.613 -22.063 1.023 1.00 0.00 N ATOM 1352 CA SER A 88 -7.500 -22.961 1.279 1.00 0.00 C ATOM 1353 C SER A 88 -6.436 -22.800 0.192 1.00 0.00 C ATOM 1354 O SER A 88 -6.739 -22.892 -0.997 1.00 0.00 O ATOM 1355 CB SER A 88 -7.970 -24.415 1.351 1.00 0.00 C ATOM 1356 OG SER A 88 -8.476 -24.874 0.100 1.00 0.00 O ATOM 0 H SER A 88 -9.340 -22.447 0.420 1.00 0.00 H new ATOM 0 HA SER A 88 -7.066 -22.700 2.244 1.00 0.00 H new ATOM 0 HB2 SER A 88 -7.140 -25.050 1.661 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.745 -24.509 2.112 1.00 0.00 H new ATOM 0 HG SER A 88 -8.123 -24.312 -0.621 1.00 0.00 H new ATOM 1362 N SER A 89 -5.211 -22.563 0.638 1.00 0.00 N ATOM 1363 CA SER A 89 -4.101 -22.388 -0.283 1.00 0.00 C ATOM 1364 C SER A 89 -3.563 -23.752 -0.720 1.00 0.00 C ATOM 1365 O SER A 89 -3.536 -24.060 -1.910 1.00 0.00 O ATOM 1366 CB SER A 89 -2.984 -21.557 0.352 1.00 0.00 C ATOM 1367 OG SER A 89 -2.066 -21.064 -0.620 1.00 0.00 O ATOM 0 H SER A 89 -4.963 -22.488 1.625 1.00 0.00 H new ATOM 0 HA SER A 89 -4.465 -21.850 -1.158 1.00 0.00 H new ATOM 0 HB2 SER A 89 -3.420 -20.719 0.896 1.00 0.00 H new ATOM 0 HB3 SER A 89 -2.448 -22.166 1.080 1.00 0.00 H new ATOM 0 HG SER A 89 -1.370 -20.538 -0.175 1.00 0.00 H new ATOM 1373 N GLY A 90 -3.149 -24.533 0.267 1.00 0.00 N ATOM 1374 CA GLY A 90 -2.615 -25.858 0.000 1.00 0.00 C ATOM 1375 C GLY A 90 -2.305 -26.597 1.303 1.00 0.00 C ATOM 1376 O GLY A 90 -1.147 -26.897 1.590 1.00 0.00 O ATOM 0 H GLY A 90 -3.173 -24.274 1.253 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -3.333 -26.432 -0.586 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -1.708 -25.775 -0.599 1.00 0.00 H new TER 1380 GLY A 90