USER MOD reduce.3.24.130724 H: found=0, std=0, add=1164, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1155 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: B 32 LYS NZ :NH3+ -145:sc= -0.468 (180deg=0) USER MOD Set 1.2: C 50 HIS : no HD1:sc= -4.28! C(o=-4.7!,f=-7.7!) USER MOD Set 2.1: C 12 CYS SG : rot 159:sc= -5.85! USER MOD Set 2.2: C 15 CYS SG : rot 99:sc= -0.124 USER MOD Set 2.3: C 26 CYS SG : rot 166:sc= 0.914 USER MOD Set 2.4: C 29 CYS SG : rot -54:sc= 1.58 USER MOD Set 3.1: B 12 CYS SG : rot 158:sc= -5.97! USER MOD Set 3.2: B 15 CYS SG : rot 100:sc= -1.21 USER MOD Set 3.3: B 26 CYS SG : rot 163:sc= 0.365 USER MOD Set 3.4: B 29 CYS SG : rot -51:sc= 1.91 USER MOD Set 4.1: A 50 HIS : no HD1:sc= -3.84 K(o=-4.1,f=-7.7!) USER MOD Set 4.2: C 32 LYS NZ :NH3+ -144:sc= -0.263 (180deg=0) USER MOD Set 5.1: A 32 LYS NZ :NH3+ -142:sc= -0.523 (180deg=0) USER MOD Set 5.2: B 50 HIS : no HD1:sc= -4.2 K(o=-4.7,f=-7.1!) USER MOD Set 6.1: A 12 CYS SG : rot 159:sc= -5.8! USER MOD Set 6.2: A 15 CYS SG : rot 101:sc= 0.0844 USER MOD Set 6.3: A 26 CYS SG : rot 168:sc= 0.723 USER MOD Set 6.4: A 29 CYS SG : rot -52:sc= 2.09 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0197 USER MOD Single : A 14 LYS NZ :NH3+ 149:sc= -1.14 (180deg=-2.9!) USER MOD Single : A 24 THR OG1 : rot 60:sc= -2.99! USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 175:sc= -0.543 USER MOD Single : A 39 GLN : amide:sc= -2.36! C(o=-2.4!,f=-6!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot -166:sc= 1.21 USER MOD Single : A 48 GLN : amide:sc= -1.17 K(o=-1.2,f=-5.4!) USER MOD Single : A 49 LYS NZ :NH3+ -164:sc= 1.73 (180deg=1.5) USER MOD Single : A 52 ASN : amide:sc= -2.13! C(o=-2.1!,f=-2.9!) USER MOD Single : A 53 LYS NZ :NH3+ -170:sc= 1.15 (180deg=1.03) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.0137 USER MOD Single : B 14 LYS NZ :NH3+ 142:sc= -0.942 (180deg=-2.7!) USER MOD Single : B 24 THR OG1 : rot 180:sc= -2.69! USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 37 THR OG1 : rot 170:sc= -0.627 USER MOD Single : B 39 GLN : amide:sc= -2.22! C(o=-2.2!,f=-5.1!) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot -173:sc= 1.11 USER MOD Single : B 48 GLN : amide:sc= -1.22 K(o=-1.2,f=-5.6!) USER MOD Single : B 49 LYS NZ :NH3+ -176:sc= 1.61 (180deg=1.45) USER MOD Single : B 52 ASN : amide:sc= -2.23! C(o=-2.2!,f=-2.9!) USER MOD Single : B 53 LYS NZ :NH3+ 175:sc= 1.17 (180deg=1.06) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0.0221 USER MOD Single : C 14 LYS NZ :NH3+ 148:sc= -0.994 (180deg=-2.67!) USER MOD Single : C 24 THR OG1 : rot 180:sc= -2.85! USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 37 THR OG1 : rot 174:sc= -0.511 USER MOD Single : C 39 GLN : amide:sc= -2.25 K(o=-2.2,f=-5!) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 42 THR OG1 : rot -175:sc= 1.09 USER MOD Single : C 48 GLN : amide:sc= -1.22 K(o=-1.2,f=-5.5!) USER MOD Single : C 49 LYS NZ :NH3+ -154:sc= 1.68 (180deg=1.48) USER MOD Single : C 52 ASN : amide:sc= -2.23! C(o=-2.2!,f=-2.9!) USER MOD Single : C 53 LYS NZ :NH3+ -156:sc= 1.13 (180deg=0.948) USER MOD ----------------------------------------------------------------- ATOM 21 N VAL A 2 -0.373 -9.305 13.641 1.00 0.00 N ATOM 22 CA VAL A 2 -1.185 -8.606 14.628 1.00 0.00 C ATOM 23 C VAL A 2 -2.255 -7.790 13.900 1.00 0.00 C ATOM 24 O VAL A 2 -2.968 -6.977 14.484 1.00 0.00 O ATOM 25 CB VAL A 2 -0.319 -7.698 15.539 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.187 -6.476 14.787 1.00 0.00 C ATOM 27 CG2 VAL A 2 -1.081 -7.292 16.794 1.00 0.00 C ATOM 0 HA VAL A 2 -1.663 -9.339 15.277 1.00 0.00 H new ATOM 0 HB VAL A 2 0.551 -8.278 15.848 1.00 0.00 H new ATOM 0 HG11 VAL A 2 0.790 -5.862 15.455 1.00 0.00 H new ATOM 0 HG12 VAL A 2 0.795 -6.796 13.940 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.661 -5.894 14.426 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.449 -6.656 17.414 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.981 -6.745 16.512 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.359 -8.184 17.355 1.00 0.00 H new ATOM 37 N ILE A 3 -2.354 -8.042 12.604 1.00 0.00 N ATOM 38 CA ILE A 3 -3.331 -7.382 11.760 1.00 0.00 C ATOM 39 C ILE A 3 -3.910 -8.377 10.763 1.00 0.00 C ATOM 40 O ILE A 3 -3.178 -9.154 10.150 1.00 0.00 O ATOM 41 CB ILE A 3 -2.718 -6.174 11.004 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.811 -5.386 10.277 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.646 -6.631 10.016 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.300 -4.151 9.568 1.00 0.00 C ATOM 0 H ILE A 3 -1.760 -8.709 12.111 1.00 0.00 H new ATOM 0 HA ILE A 3 -4.124 -7.002 12.405 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.246 -5.522 11.739 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.294 -6.038 9.549 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.574 -5.091 10.997 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.233 -5.764 9.500 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.850 -7.145 10.555 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.089 -7.310 9.287 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.130 -3.644 9.076 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.843 -3.478 10.293 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.558 -4.440 8.823 1.00 0.00 H new ATOM 56 N ALA A 4 -5.221 -8.375 10.623 1.00 0.00 N ATOM 57 CA ALA A 4 -5.874 -9.244 9.664 1.00 0.00 C ATOM 58 C ALA A 4 -6.716 -8.415 8.709 1.00 0.00 C ATOM 59 O ALA A 4 -7.224 -7.351 9.069 1.00 0.00 O ATOM 60 CB ALA A 4 -6.727 -10.281 10.376 1.00 0.00 C ATOM 0 H ALA A 4 -5.854 -7.782 11.160 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.113 -9.773 9.090 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.209 -10.924 9.639 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -6.096 -10.886 11.028 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.488 -9.778 10.972 1.00 0.00 H new ATOM 66 N THR A 5 -6.845 -8.914 7.487 1.00 0.00 N ATOM 67 CA THR A 5 -7.540 -8.212 6.420 1.00 0.00 C ATOM 68 C THR A 5 -9.008 -7.967 6.768 1.00 0.00 C ATOM 69 O THR A 5 -9.635 -7.062 6.233 1.00 0.00 O ATOM 70 CB THR A 5 -7.449 -9.022 5.114 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.129 -9.565 4.983 1.00 0.00 O ATOM 72 CG2 THR A 5 -7.761 -8.153 3.903 1.00 0.00 C ATOM 0 H THR A 5 -6.469 -9.820 7.208 1.00 0.00 H new ATOM 0 HA THR A 5 -7.057 -7.244 6.291 1.00 0.00 H new ATOM 0 HB THR A 5 -8.184 -9.826 5.157 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.069 -10.083 4.153 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.689 -8.753 2.996 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.771 -7.752 3.993 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.047 -7.331 3.852 1.00 0.00 H new ATOM 80 N ASP A 6 -9.527 -8.739 7.715 1.00 0.00 N ATOM 81 CA ASP A 6 -10.944 -8.687 8.056 1.00 0.00 C ATOM 82 C ASP A 6 -11.238 -7.536 9.012 1.00 0.00 C ATOM 83 O ASP A 6 -12.392 -7.299 9.369 1.00 0.00 O ATOM 84 CB ASP A 6 -11.394 -10.004 8.700 1.00 0.00 C ATOM 85 CG ASP A 6 -11.135 -11.215 7.827 1.00 0.00 C ATOM 86 OD1 ASP A 6 -11.980 -11.539 6.967 1.00 0.00 O ATOM 87 OD2 ASP A 6 -10.088 -11.867 8.012 1.00 0.00 O ATOM 0 H ASP A 6 -8.987 -9.410 8.262 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.497 -8.528 7.130 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.876 -10.132 9.650 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.459 -9.946 8.923 1.00 0.00 H new ATOM 92 N ASP A 7 -10.196 -6.826 9.435 1.00 0.00 N ATOM 93 CA ASP A 7 -10.373 -5.687 10.330 1.00 0.00 C ATOM 94 C ASP A 7 -10.255 -4.370 9.571 1.00 0.00 C ATOM 95 O ASP A 7 -10.677 -3.319 10.060 1.00 0.00 O ATOM 96 CB ASP A 7 -9.321 -5.708 11.448 1.00 0.00 C ATOM 97 CG ASP A 7 -9.403 -6.937 12.330 1.00 0.00 C ATOM 98 OD1 ASP A 7 -10.209 -6.935 13.289 1.00 0.00 O ATOM 99 OD2 ASP A 7 -8.645 -7.900 12.091 1.00 0.00 O ATOM 0 H ASP A 7 -9.228 -7.017 9.175 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.371 -5.766 10.762 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.328 -5.655 11.003 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.441 -4.818 12.066 1.00 0.00 H new ATOM 104 N LEU A 8 -9.677 -4.423 8.378 1.00 0.00 N ATOM 105 CA LEU A 8 -9.527 -3.226 7.556 1.00 0.00 C ATOM 106 C LEU A 8 -10.381 -3.336 6.306 1.00 0.00 C ATOM 107 O LEU A 8 -10.598 -2.354 5.592 1.00 0.00 O ATOM 108 CB LEU A 8 -8.063 -2.982 7.185 1.00 0.00 C ATOM 109 CG LEU A 8 -7.190 -2.432 8.315 1.00 0.00 C ATOM 110 CD1 LEU A 8 -6.861 -3.510 9.335 1.00 0.00 C ATOM 111 CD2 LEU A 8 -5.919 -1.824 7.752 1.00 0.00 C ATOM 0 H LEU A 8 -9.306 -5.276 7.959 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.867 -2.372 8.142 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.631 -3.920 6.837 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.028 -2.285 6.348 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.754 -1.653 8.827 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.240 -3.087 10.124 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.784 -3.896 9.767 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.323 -4.322 8.846 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.308 -1.437 8.568 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.360 -2.587 7.210 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.175 -1.011 7.073 1.00 0.00 H new ATOM 123 N GLU A 9 -10.872 -4.538 6.071 1.00 0.00 N ATOM 124 CA GLU A 9 -11.802 -4.803 4.996 1.00 0.00 C ATOM 125 C GLU A 9 -12.920 -5.679 5.524 1.00 0.00 C ATOM 126 O GLU A 9 -12.684 -6.625 6.274 1.00 0.00 O ATOM 127 CB GLU A 9 -11.125 -5.471 3.791 1.00 0.00 C ATOM 128 CG GLU A 9 -10.161 -4.562 3.045 1.00 0.00 C ATOM 129 CD GLU A 9 -9.786 -5.099 1.677 1.00 0.00 C ATOM 130 OE1 GLU A 9 -9.128 -6.157 1.604 1.00 0.00 O ATOM 131 OE2 GLU A 9 -10.144 -4.454 0.667 1.00 0.00 O ATOM 0 H GLU A 9 -10.634 -5.361 6.625 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.199 -3.851 4.644 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.585 -6.354 4.133 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -11.894 -5.815 3.099 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -10.612 -3.576 2.932 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.257 -4.433 3.640 1.00 0.00 H new ATOM 138 N VAL A 10 -14.129 -5.346 5.147 1.00 0.00 N ATOM 139 CA VAL A 10 -15.301 -6.049 5.613 1.00 0.00 C ATOM 140 C VAL A 10 -16.174 -6.379 4.416 1.00 0.00 C ATOM 141 O VAL A 10 -16.195 -5.637 3.435 1.00 0.00 O ATOM 142 CB VAL A 10 -16.084 -5.204 6.650 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.552 -3.884 6.053 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.260 -5.984 7.216 1.00 0.00 C ATOM 0 H VAL A 10 -14.330 -4.578 4.507 1.00 0.00 H new ATOM 0 HA VAL A 10 -14.998 -6.969 6.113 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.400 -4.977 7.468 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -17.097 -3.317 6.807 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.688 -3.309 5.720 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -17.206 -4.080 5.203 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -17.791 -5.367 7.941 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -17.938 -6.258 6.407 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -16.896 -6.887 7.706 1.00 0.00 H new ATOM 154 N ALA A 11 -16.870 -7.497 4.478 1.00 0.00 N ATOM 155 CA ALA A 11 -17.690 -7.936 3.368 1.00 0.00 C ATOM 156 C ALA A 11 -18.827 -6.953 3.109 1.00 0.00 C ATOM 157 O ALA A 11 -19.496 -6.496 4.038 1.00 0.00 O ATOM 158 CB ALA A 11 -18.219 -9.329 3.667 1.00 0.00 C ATOM 0 H ALA A 11 -16.884 -8.118 5.287 1.00 0.00 H new ATOM 0 HA ALA A 11 -17.087 -7.972 2.461 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.838 -9.669 2.837 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -17.383 -10.015 3.801 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.816 -9.303 4.578 1.00 0.00 H new ATOM 164 N CYS A 12 -19.016 -6.623 1.832 1.00 0.00 N ATOM 165 CA CYS A 12 -19.916 -5.566 1.383 1.00 0.00 C ATOM 166 C CYS A 12 -21.388 -5.923 1.641 1.00 0.00 C ATOM 167 O CYS A 12 -21.694 -7.086 1.866 1.00 0.00 O ATOM 168 CB CYS A 12 -19.655 -5.419 -0.124 1.00 0.00 C ATOM 169 SG CYS A 12 -20.312 -3.947 -0.936 1.00 0.00 S ATOM 0 H CYS A 12 -18.536 -7.095 1.065 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.732 -4.639 1.927 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -18.577 -5.440 -0.284 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -20.068 -6.294 -0.625 1.00 0.00 H new ATOM 0 HG CYS A 12 -19.668 -3.740 -2.046 1.00 0.00 H new ATOM 174 N PRO A 13 -22.312 -4.932 1.625 1.00 0.00 N ATOM 175 CA PRO A 13 -23.755 -5.158 1.785 1.00 0.00 C ATOM 176 C PRO A 13 -24.277 -6.463 1.164 1.00 0.00 C ATOM 177 O PRO A 13 -25.063 -7.176 1.788 1.00 0.00 O ATOM 178 CB PRO A 13 -24.342 -3.957 1.054 1.00 0.00 C ATOM 179 CG PRO A 13 -23.390 -2.844 1.338 1.00 0.00 C ATOM 180 CD PRO A 13 -22.026 -3.484 1.510 1.00 0.00 C ATOM 0 HA PRO A 13 -24.027 -5.256 2.836 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.424 -4.145 -0.016 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.344 -3.724 1.415 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.381 -2.122 0.521 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.682 -2.303 2.238 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.378 -3.273 0.659 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.519 -3.107 2.398 1.00 0.00 H new ATOM 188 N LYS A 14 -23.819 -6.797 -0.047 1.00 0.00 N ATOM 189 CA LYS A 14 -24.428 -7.918 -0.764 1.00 0.00 C ATOM 190 C LYS A 14 -23.588 -8.502 -1.903 1.00 0.00 C ATOM 191 O LYS A 14 -24.027 -9.451 -2.545 1.00 0.00 O ATOM 192 CB LYS A 14 -25.796 -7.517 -1.314 1.00 0.00 C ATOM 193 CG LYS A 14 -25.754 -6.349 -2.289 1.00 0.00 C ATOM 194 CD LYS A 14 -27.093 -6.148 -3.000 1.00 0.00 C ATOM 195 CE LYS A 14 -27.277 -7.112 -4.170 1.00 0.00 C ATOM 196 NZ LYS A 14 -27.603 -8.499 -3.740 1.00 0.00 N ATOM 0 H LYS A 14 -23.057 -6.326 -0.536 1.00 0.00 H new ATOM 0 HA LYS A 14 -24.513 -8.706 -0.016 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.242 -8.377 -1.813 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -26.449 -7.258 -0.481 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.488 -5.438 -1.752 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -24.973 -6.522 -3.029 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -27.905 -6.286 -2.287 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -27.159 -5.122 -3.363 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.073 -6.742 -4.816 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -26.365 -7.128 -4.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -28.203 -8.953 -4.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -26.724 -9.043 -3.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -28.110 -8.471 -2.833 1.00 0.00 H new ATOM 210 N CYS A 15 -22.422 -7.949 -2.225 1.00 0.00 N ATOM 211 CA CYS A 15 -21.623 -8.576 -3.287 1.00 0.00 C ATOM 212 C CYS A 15 -20.250 -9.053 -2.829 1.00 0.00 C ATOM 213 O CYS A 15 -19.270 -8.924 -3.570 1.00 0.00 O ATOM 214 CB CYS A 15 -21.414 -7.573 -4.416 1.00 0.00 C ATOM 215 SG CYS A 15 -20.798 -5.971 -3.842 1.00 0.00 S ATOM 0 H CYS A 15 -22.021 -7.115 -1.797 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.185 -9.453 -3.608 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -20.710 -7.989 -5.137 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.358 -7.425 -4.941 1.00 0.00 H new ATOM 0 HG CYS A 15 -19.518 -5.896 -4.057 1.00 0.00 H new ATOM 220 N GLU A 16 -20.190 -9.689 -1.685 1.00 0.00 N ATOM 221 CA GLU A 16 -18.929 -10.109 -1.108 1.00 0.00 C ATOM 222 C GLU A 16 -18.540 -11.493 -1.586 1.00 0.00 C ATOM 223 O GLU A 16 -17.729 -12.167 -0.957 1.00 0.00 O ATOM 224 CB GLU A 16 -19.061 -10.154 0.416 1.00 0.00 C ATOM 225 CG GLU A 16 -20.339 -9.534 0.966 1.00 0.00 C ATOM 226 CD GLU A 16 -21.534 -10.464 0.857 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.218 -10.431 -0.184 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.783 -11.243 1.798 1.00 0.00 O ATOM 0 H GLU A 16 -21.008 -9.931 -1.126 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.165 -9.396 -1.416 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.010 -11.193 0.740 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.206 -9.640 0.856 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.187 -9.265 2.011 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.552 -8.611 0.427 1.00 0.00 H new ATOM 235 N ARG A 17 -19.111 -11.914 -2.705 1.00 0.00 N ATOM 236 CA ARG A 17 -18.923 -13.262 -3.200 1.00 0.00 C ATOM 237 C ARG A 17 -19.021 -13.214 -4.729 1.00 0.00 C ATOM 238 O ARG A 17 -18.663 -14.162 -5.423 1.00 0.00 O ATOM 239 CB ARG A 17 -19.944 -14.264 -2.622 1.00 0.00 C ATOM 240 CG ARG A 17 -21.058 -13.651 -1.783 1.00 0.00 C ATOM 241 CD ARG A 17 -22.120 -12.981 -2.635 1.00 0.00 C ATOM 242 NE ARG A 17 -23.122 -12.309 -1.812 1.00 0.00 N ATOM 243 CZ ARG A 17 -24.437 -12.438 -1.970 1.00 0.00 C ATOM 244 NH1 ARG A 17 -24.928 -13.207 -2.931 1.00 0.00 N ATOM 245 NH2 ARG A 17 -25.263 -11.791 -1.163 1.00 0.00 N ATOM 0 H ARG A 17 -19.713 -11.333 -3.289 1.00 0.00 H new ATOM 0 HA ARG A 17 -17.945 -13.620 -2.879 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.395 -14.814 -3.448 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -19.409 -14.990 -2.010 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.521 -14.428 -1.174 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -20.632 -12.920 -1.096 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -21.650 -12.257 -3.301 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -22.606 -13.726 -3.265 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.791 -11.699 -1.065 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -24.296 -13.706 -3.557 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -25.937 -13.300 -3.044 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -24.891 -11.196 -0.423 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -26.272 -11.888 -1.281 1.00 0.00 H new ATOM 259 N ALA A 18 -19.524 -12.076 -5.243 1.00 0.00 N ATOM 260 CA ALA A 18 -19.904 -11.977 -6.653 1.00 0.00 C ATOM 261 C ALA A 18 -18.956 -11.109 -7.477 1.00 0.00 C ATOM 262 O ALA A 18 -18.453 -11.546 -8.509 1.00 0.00 O ATOM 263 CB ALA A 18 -21.328 -11.450 -6.782 1.00 0.00 C ATOM 0 H ALA A 18 -19.673 -11.223 -4.704 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.840 -12.987 -7.057 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.597 -11.382 -7.836 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -22.014 -12.129 -6.276 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.393 -10.462 -6.326 1.00 0.00 H new ATOM 269 N GLY A 19 -18.703 -9.886 -7.023 1.00 0.00 N ATOM 270 CA GLY A 19 -17.917 -8.960 -7.821 1.00 0.00 C ATOM 271 C GLY A 19 -18.784 -7.966 -8.577 1.00 0.00 C ATOM 272 O GLY A 19 -18.311 -7.265 -9.465 1.00 0.00 O ATOM 0 H GLY A 19 -19.024 -9.521 -6.126 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.230 -8.418 -7.172 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.309 -9.521 -8.531 1.00 0.00 H new ATOM 276 N GLU A 20 -20.050 -7.908 -8.207 1.00 0.00 N ATOM 277 CA GLU A 20 -21.015 -7.007 -8.834 1.00 0.00 C ATOM 278 C GLU A 20 -22.252 -6.893 -7.978 1.00 0.00 C ATOM 279 O GLU A 20 -22.431 -7.642 -7.023 1.00 0.00 O ATOM 280 CB GLU A 20 -21.456 -7.519 -10.209 1.00 0.00 C ATOM 281 CG GLU A 20 -21.721 -9.017 -10.216 1.00 0.00 C ATOM 282 CD GLU A 20 -22.306 -9.520 -11.514 1.00 0.00 C ATOM 283 OE1 GLU A 20 -23.542 -9.471 -11.670 1.00 0.00 O ATOM 284 OE2 GLU A 20 -21.534 -9.993 -12.371 1.00 0.00 O ATOM 0 H GLU A 20 -20.444 -8.483 -7.463 1.00 0.00 H new ATOM 0 HA GLU A 20 -20.521 -6.041 -8.943 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -22.359 -6.992 -10.517 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -20.685 -7.286 -10.944 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -20.787 -9.544 -10.019 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -22.402 -9.261 -9.401 1.00 0.00 H new ATOM 291 N ILE A 21 -23.110 -5.982 -8.362 1.00 0.00 N ATOM 292 CA ILE A 21 -24.430 -5.868 -7.790 1.00 0.00 C ATOM 293 C ILE A 21 -25.372 -5.554 -8.924 1.00 0.00 C ATOM 294 O ILE A 21 -25.154 -4.594 -9.655 1.00 0.00 O ATOM 295 CB ILE A 21 -24.549 -4.780 -6.692 1.00 0.00 C ATOM 296 CG1 ILE A 21 -23.739 -5.174 -5.452 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.012 -4.565 -6.321 1.00 0.00 C ATOM 298 CD1 ILE A 21 -23.856 -4.192 -4.300 1.00 0.00 C ATOM 0 H ILE A 21 -22.911 -5.292 -9.087 1.00 0.00 H new ATOM 0 HA ILE A 21 -24.671 -6.807 -7.292 1.00 0.00 H new ATOM 0 HB ILE A 21 -24.145 -3.847 -7.085 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -24.068 -6.156 -5.113 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -22.689 -5.268 -5.731 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.083 -3.799 -5.549 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -26.568 -4.245 -7.202 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -26.433 -5.498 -5.946 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.254 -4.542 -3.461 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -23.499 -3.213 -4.619 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -24.899 -4.115 -3.992 1.00 0.00 H new ATOM 310 N GLU A 22 -26.396 -6.374 -9.078 1.00 0.00 N ATOM 311 CA GLU A 22 -27.336 -6.215 -10.178 1.00 0.00 C ATOM 312 C GLU A 22 -26.611 -6.166 -11.523 1.00 0.00 C ATOM 313 O GLU A 22 -26.899 -5.318 -12.368 1.00 0.00 O ATOM 314 CB GLU A 22 -28.107 -4.925 -9.967 1.00 0.00 C ATOM 315 CG GLU A 22 -29.416 -4.843 -10.745 1.00 0.00 C ATOM 316 CD GLU A 22 -30.254 -3.658 -10.325 1.00 0.00 C ATOM 317 OE1 GLU A 22 -29.906 -2.517 -10.688 1.00 0.00 O ATOM 318 OE2 GLU A 22 -31.265 -3.864 -9.623 1.00 0.00 O ATOM 0 H GLU A 22 -26.600 -7.157 -8.457 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.013 -7.069 -10.194 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -28.322 -4.813 -8.904 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -27.474 -4.086 -10.254 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -29.200 -4.774 -11.811 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -29.985 -5.760 -10.594 1.00 0.00 H new ATOM 325 N GLY A 23 -25.640 -7.044 -11.709 1.00 0.00 N ATOM 326 CA GLY A 23 -24.918 -7.085 -12.962 1.00 0.00 C ATOM 327 C GLY A 23 -24.086 -5.846 -13.214 1.00 0.00 C ATOM 328 O GLY A 23 -23.508 -5.697 -14.291 1.00 0.00 O ATOM 0 H GLY A 23 -25.339 -7.729 -11.016 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -24.267 -7.959 -12.970 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -25.629 -7.209 -13.779 1.00 0.00 H new ATOM 332 N THR A 24 -24.013 -4.946 -12.240 1.00 0.00 N ATOM 333 CA THR A 24 -23.287 -3.699 -12.439 1.00 0.00 C ATOM 334 C THR A 24 -22.212 -3.500 -11.354 1.00 0.00 C ATOM 335 O THR A 24 -22.272 -4.133 -10.296 1.00 0.00 O ATOM 336 CB THR A 24 -24.297 -2.536 -12.442 1.00 0.00 C ATOM 337 OG1 THR A 24 -23.844 -1.455 -13.268 1.00 0.00 O ATOM 338 CG2 THR A 24 -24.564 -2.011 -11.037 1.00 0.00 C ATOM 0 H THR A 24 -24.440 -5.053 -11.320 1.00 0.00 H new ATOM 0 HA THR A 24 -22.767 -3.731 -13.396 1.00 0.00 H new ATOM 0 HB THR A 24 -25.226 -2.937 -12.848 1.00 0.00 H new ATOM 0 HG1 THR A 24 -23.729 -1.772 -14.188 1.00 0.00 H new ATOM 0 HG21 THR A 24 -25.281 -1.192 -11.085 1.00 0.00 H new ATOM 0 HG22 THR A 24 -24.969 -2.813 -10.420 1.00 0.00 H new ATOM 0 HG23 THR A 24 -23.632 -1.652 -10.600 1.00 0.00 H new ATOM 346 N PRO A 25 -21.193 -2.648 -11.621 1.00 0.00 N ATOM 347 CA PRO A 25 -20.151 -2.313 -10.641 1.00 0.00 C ATOM 348 C PRO A 25 -20.736 -1.747 -9.352 1.00 0.00 C ATOM 349 O PRO A 25 -21.609 -0.879 -9.368 1.00 0.00 O ATOM 350 CB PRO A 25 -19.289 -1.260 -11.354 1.00 0.00 C ATOM 351 CG PRO A 25 -20.139 -0.767 -12.473 1.00 0.00 C ATOM 352 CD PRO A 25 -20.964 -1.949 -12.895 1.00 0.00 C ATOM 0 HA PRO A 25 -19.586 -3.194 -10.337 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -19.015 -0.450 -10.678 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -18.360 -1.694 -11.724 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -20.772 0.060 -12.151 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -19.529 -0.399 -13.298 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -21.899 -1.644 -13.365 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -20.436 -2.577 -13.613 1.00 0.00 H new ATOM 360 N CYS A 26 -20.239 -2.251 -8.237 1.00 0.00 N ATOM 361 CA CYS A 26 -20.790 -1.934 -6.929 1.00 0.00 C ATOM 362 C CYS A 26 -20.224 -0.635 -6.346 1.00 0.00 C ATOM 363 O CYS A 26 -19.009 -0.443 -6.319 1.00 0.00 O ATOM 364 CB CYS A 26 -20.518 -3.103 -5.991 1.00 0.00 C ATOM 365 SG CYS A 26 -20.817 -2.762 -4.222 1.00 0.00 S ATOM 0 H CYS A 26 -19.444 -2.890 -8.211 1.00 0.00 H new ATOM 0 HA CYS A 26 -21.862 -1.775 -7.041 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.142 -3.944 -6.293 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -19.481 -3.414 -6.115 1.00 0.00 H new ATOM 0 HG CYS A 26 -20.812 -3.880 -3.558 1.00 0.00 H new ATOM 370 N PRO A 27 -21.129 0.225 -5.819 1.00 0.00 N ATOM 371 CA PRO A 27 -20.842 1.563 -5.269 1.00 0.00 C ATOM 372 C PRO A 27 -19.442 1.768 -4.682 1.00 0.00 C ATOM 373 O PRO A 27 -18.700 2.645 -5.114 1.00 0.00 O ATOM 374 CB PRO A 27 -21.872 1.652 -4.146 1.00 0.00 C ATOM 375 CG PRO A 27 -23.062 0.885 -4.625 1.00 0.00 C ATOM 376 CD PRO A 27 -22.580 -0.041 -5.732 1.00 0.00 C ATOM 0 HA PRO A 27 -20.889 2.317 -6.055 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.480 1.229 -3.221 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.134 2.689 -3.936 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.505 0.313 -3.810 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -23.832 1.561 -4.996 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -22.780 -1.086 -5.493 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.081 0.172 -6.676 1.00 0.00 H new ATOM 384 N ALA A 28 -19.090 0.947 -3.703 1.00 0.00 N ATOM 385 CA ALA A 28 -17.916 1.219 -2.879 1.00 0.00 C ATOM 386 C ALA A 28 -16.810 0.185 -3.065 1.00 0.00 C ATOM 387 O ALA A 28 -15.689 0.387 -2.611 1.00 0.00 O ATOM 388 CB ALA A 28 -18.318 1.298 -1.413 1.00 0.00 C ATOM 0 H ALA A 28 -19.594 0.094 -3.459 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.511 2.177 -3.205 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.437 1.501 -0.805 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -19.045 2.099 -1.278 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.761 0.351 -1.106 1.00 0.00 H new ATOM 394 N CYS A 29 -17.113 -0.931 -3.713 1.00 0.00 N ATOM 395 CA CYS A 29 -16.101 -1.979 -3.850 1.00 0.00 C ATOM 396 C CYS A 29 -15.900 -2.429 -5.291 1.00 0.00 C ATOM 397 O CYS A 29 -15.055 -3.283 -5.540 1.00 0.00 O ATOM 398 CB CYS A 29 -16.478 -3.192 -2.990 1.00 0.00 C ATOM 399 SG CYS A 29 -17.917 -4.124 -3.602 1.00 0.00 S ATOM 0 H CYS A 29 -18.017 -1.135 -4.140 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.160 -1.547 -3.509 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -15.621 -3.864 -2.934 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.684 -2.853 -1.975 1.00 0.00 H new ATOM 0 HG CYS A 29 -18.912 -3.310 -3.793 1.00 0.00 H new ATOM 404 N SER A 30 -16.666 -1.861 -6.225 1.00 0.00 N ATOM 405 CA SER A 30 -16.564 -2.198 -7.654 1.00 0.00 C ATOM 406 C SER A 30 -16.950 -3.660 -7.943 1.00 0.00 C ATOM 407 O SER A 30 -17.988 -3.924 -8.548 1.00 0.00 O ATOM 408 CB SER A 30 -15.148 -1.902 -8.176 1.00 0.00 C ATOM 409 OG SER A 30 -15.013 -2.252 -9.543 1.00 0.00 O ATOM 0 H SER A 30 -17.373 -1.156 -6.017 1.00 0.00 H new ATOM 0 HA SER A 30 -17.280 -1.569 -8.183 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.926 -0.843 -8.047 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.418 -2.455 -7.584 1.00 0.00 H new ATOM 0 HG SER A 30 -14.103 -2.050 -9.844 1.00 0.00 H new ATOM 415 N GLY A 31 -16.164 -4.592 -7.419 1.00 0.00 N ATOM 416 CA GLY A 31 -16.250 -5.978 -7.809 1.00 0.00 C ATOM 417 C GLY A 31 -15.187 -6.812 -7.122 1.00 0.00 C ATOM 418 O GLY A 31 -14.732 -7.820 -7.656 1.00 0.00 O ATOM 0 H GLY A 31 -15.453 -4.400 -6.713 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -17.237 -6.367 -7.560 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -16.138 -6.061 -8.890 1.00 0.00 H new ATOM 422 N LYS A 32 -14.804 -6.394 -5.917 1.00 0.00 N ATOM 423 CA LYS A 32 -13.741 -7.049 -5.161 1.00 0.00 C ATOM 424 C LYS A 32 -14.348 -7.953 -4.097 1.00 0.00 C ATOM 425 O LYS A 32 -13.749 -8.941 -3.684 1.00 0.00 O ATOM 426 CB LYS A 32 -12.856 -5.986 -4.519 1.00 0.00 C ATOM 427 CG LYS A 32 -12.332 -5.006 -5.547 1.00 0.00 C ATOM 428 CD LYS A 32 -11.396 -3.970 -4.957 1.00 0.00 C ATOM 429 CE LYS A 32 -12.109 -2.998 -4.034 1.00 0.00 C ATOM 430 NZ LYS A 32 -11.267 -1.805 -3.775 1.00 0.00 N ATOM 0 H LYS A 32 -15.221 -5.595 -5.440 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.135 -7.661 -5.829 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.424 -5.449 -3.759 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.019 -6.466 -4.012 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.809 -5.555 -6.330 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -13.174 -4.500 -6.020 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.603 -4.475 -4.405 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.919 -3.415 -5.765 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.054 -2.691 -4.481 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -12.347 -3.492 -3.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.381 -1.508 -2.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.270 -2.039 -3.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.560 -1.030 -4.404 1.00 0.00 H new ATOM 444 N GLY A 33 -15.543 -7.587 -3.644 1.00 0.00 N ATOM 445 CA GLY A 33 -16.258 -8.379 -2.681 1.00 0.00 C ATOM 446 C GLY A 33 -16.343 -7.681 -1.344 1.00 0.00 C ATOM 447 O GLY A 33 -17.399 -7.662 -0.714 1.00 0.00 O ATOM 0 H GLY A 33 -16.029 -6.740 -3.938 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -17.263 -8.583 -3.051 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.761 -9.342 -2.559 1.00 0.00 H new ATOM 451 N VAL A 34 -15.264 -7.030 -0.943 1.00 0.00 N ATOM 452 CA VAL A 34 -15.218 -6.395 0.366 1.00 0.00 C ATOM 453 C VAL A 34 -15.087 -4.884 0.248 1.00 0.00 C ATOM 454 O VAL A 34 -14.791 -4.357 -0.828 1.00 0.00 O ATOM 455 CB VAL A 34 -14.043 -6.938 1.208 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.244 -8.413 1.531 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.721 -6.727 0.485 1.00 0.00 C ATOM 0 H VAL A 34 -14.415 -6.927 -1.498 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.158 -6.632 0.864 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.015 -6.383 2.146 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.404 -8.773 2.125 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.168 -8.539 2.096 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.304 -8.983 0.604 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -11.906 -7.117 1.095 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.741 -7.251 -0.471 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.567 -5.662 0.311 1.00 0.00 H new ATOM 467 N ILE A 35 -15.341 -4.202 1.352 1.00 0.00 N ATOM 468 CA ILE A 35 -15.176 -2.762 1.440 1.00 0.00 C ATOM 469 C ILE A 35 -14.293 -2.423 2.634 1.00 0.00 C ATOM 470 O ILE A 35 -14.149 -3.224 3.551 1.00 0.00 O ATOM 471 CB ILE A 35 -16.530 -2.027 1.585 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.348 -2.626 2.735 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.312 -2.078 0.281 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.658 -1.913 2.994 1.00 0.00 C ATOM 0 H ILE A 35 -15.669 -4.634 2.216 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.712 -2.428 0.512 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.329 -0.981 1.818 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.553 -3.673 2.514 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.748 -2.604 3.645 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.261 -1.555 0.405 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.734 -1.598 -0.509 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.503 -3.117 0.011 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.178 -2.396 3.822 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.461 -0.871 3.247 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.280 -1.958 2.100 1.00 0.00 H new ATOM 486 N LEU A 36 -13.709 -1.238 2.618 1.00 0.00 N ATOM 487 CA LEU A 36 -12.743 -0.854 3.641 1.00 0.00 C ATOM 488 C LEU A 36 -13.401 -0.224 4.861 1.00 0.00 C ATOM 489 O LEU A 36 -14.560 0.195 4.827 1.00 0.00 O ATOM 490 CB LEU A 36 -11.716 0.128 3.069 1.00 0.00 C ATOM 491 CG LEU A 36 -10.892 -0.394 1.893 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.631 -0.208 0.576 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.548 0.298 1.853 1.00 0.00 C ATOM 0 H LEU A 36 -13.884 -0.524 1.911 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.251 -1.773 3.959 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.239 1.030 2.752 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.034 0.419 3.867 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.734 -1.463 2.035 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.019 -0.589 -0.242 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.574 -0.753 0.608 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.830 0.852 0.417 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -8.968 -0.081 1.011 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.695 1.372 1.738 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.010 0.103 2.781 1.00 0.00 H new ATOM 505 N THR A 37 -12.622 -0.149 5.930 1.00 0.00 N ATOM 506 CA THR A 37 -13.021 0.535 7.146 1.00 0.00 C ATOM 507 C THR A 37 -12.269 1.854 7.213 1.00 0.00 C ATOM 508 O THR A 37 -11.414 2.096 6.371 1.00 0.00 O ATOM 509 CB THR A 37 -12.679 -0.305 8.398 1.00 0.00 C ATOM 510 OG1 THR A 37 -11.265 -0.552 8.458 1.00 0.00 O ATOM 511 CG2 THR A 37 -13.413 -1.637 8.384 1.00 0.00 C ATOM 0 H THR A 37 -11.691 -0.564 5.976 1.00 0.00 H new ATOM 0 HA THR A 37 -14.099 0.695 7.129 1.00 0.00 H new ATOM 0 HB THR A 37 -12.995 0.263 9.273 1.00 0.00 H new ATOM 0 HG1 THR A 37 -11.049 -1.014 9.295 1.00 0.00 H new ATOM 0 HG21 THR A 37 -13.152 -2.205 9.277 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.488 -1.460 8.368 1.00 0.00 H new ATOM 0 HG23 THR A 37 -13.125 -2.202 7.497 1.00 0.00 H new ATOM 519 N ALA A 38 -12.569 2.705 8.183 1.00 0.00 N ATOM 520 CA ALA A 38 -11.881 3.989 8.297 1.00 0.00 C ATOM 521 C ALA A 38 -10.368 3.794 8.377 1.00 0.00 C ATOM 522 O ALA A 38 -9.609 4.483 7.698 1.00 0.00 O ATOM 523 CB ALA A 38 -12.395 4.760 9.499 1.00 0.00 C ATOM 0 H ALA A 38 -13.277 2.535 8.898 1.00 0.00 H new ATOM 0 HA ALA A 38 -12.093 4.572 7.401 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.873 5.714 9.570 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.464 4.939 9.386 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -12.218 4.181 10.405 1.00 0.00 H new ATOM 529 N GLN A 39 -9.949 2.851 9.212 1.00 0.00 N ATOM 530 CA GLN A 39 -8.551 2.429 9.286 1.00 0.00 C ATOM 531 C GLN A 39 -8.007 2.110 7.887 1.00 0.00 C ATOM 532 O GLN A 39 -6.981 2.645 7.465 1.00 0.00 O ATOM 533 CB GLN A 39 -8.466 1.185 10.179 1.00 0.00 C ATOM 534 CG GLN A 39 -7.055 0.751 10.542 1.00 0.00 C ATOM 535 CD GLN A 39 -6.355 1.732 11.457 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.996 2.470 12.211 1.00 0.00 O ATOM 537 NE2 GLN A 39 -5.034 1.725 11.423 1.00 0.00 N ATOM 0 H GLN A 39 -10.566 2.357 9.857 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.948 3.235 9.705 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -9.019 1.378 11.098 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.966 0.358 9.674 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -7.093 -0.225 11.025 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -6.471 0.632 9.630 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.544 1.099 10.784 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.505 2.346 12.035 1.00 0.00 H new ATOM 546 N GLY A 40 -8.718 1.234 7.183 1.00 0.00 N ATOM 547 CA GLY A 40 -8.344 0.858 5.834 1.00 0.00 C ATOM 548 C GLY A 40 -8.420 2.012 4.847 1.00 0.00 C ATOM 549 O GLY A 40 -7.660 2.055 3.885 1.00 0.00 O ATOM 0 H GLY A 40 -9.559 0.773 7.531 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.328 0.462 5.843 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.997 0.054 5.494 1.00 0.00 H new ATOM 553 N TYR A 41 -9.327 2.951 5.085 1.00 0.00 N ATOM 554 CA TYR A 41 -9.495 4.095 4.197 1.00 0.00 C ATOM 555 C TYR A 41 -8.318 5.055 4.292 1.00 0.00 C ATOM 556 O TYR A 41 -7.942 5.677 3.297 1.00 0.00 O ATOM 557 CB TYR A 41 -10.794 4.837 4.532 1.00 0.00 C ATOM 558 CG TYR A 41 -11.988 4.442 3.689 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.815 3.390 4.058 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.299 5.141 2.527 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.913 3.042 3.296 1.00 0.00 C ATOM 562 CE2 TYR A 41 -13.394 4.797 1.759 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.198 3.747 2.147 1.00 0.00 C ATOM 564 OH TYR A 41 -15.294 3.404 1.390 1.00 0.00 O ATOM 0 H TYR A 41 -9.958 2.943 5.886 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.542 3.716 3.176 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -11.035 4.663 5.581 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.624 5.908 4.417 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -12.596 2.834 4.957 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -11.674 5.966 2.220 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -14.545 2.221 3.599 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -13.619 5.348 0.858 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.355 3.999 0.614 1.00 0.00 H new ATOM 574 N THR A 42 -7.717 5.155 5.466 1.00 0.00 N ATOM 575 CA THR A 42 -6.500 5.938 5.614 1.00 0.00 C ATOM 576 C THR A 42 -5.341 5.246 4.895 1.00 0.00 C ATOM 577 O THR A 42 -4.445 5.893 4.347 1.00 0.00 O ATOM 578 CB THR A 42 -6.132 6.126 7.096 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.229 6.710 7.807 1.00 0.00 O ATOM 580 CG2 THR A 42 -4.902 7.011 7.239 1.00 0.00 C ATOM 0 H THR A 42 -8.047 4.709 6.322 1.00 0.00 H new ATOM 0 HA THR A 42 -6.681 6.918 5.172 1.00 0.00 H new ATOM 0 HB THR A 42 -5.909 5.146 7.517 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.919 7.035 8.678 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.660 7.130 8.295 1.00 0.00 H new ATOM 0 HG22 THR A 42 -4.060 6.549 6.724 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.104 7.988 6.801 1.00 0.00 H new ATOM 588 N LEU A 43 -5.404 3.923 4.848 1.00 0.00 N ATOM 589 CA LEU A 43 -4.344 3.132 4.247 1.00 0.00 C ATOM 590 C LEU A 43 -4.576 2.976 2.747 1.00 0.00 C ATOM 591 O LEU A 43 -3.663 2.596 2.022 1.00 0.00 O ATOM 592 CB LEU A 43 -4.238 1.747 4.920 1.00 0.00 C ATOM 593 CG LEU A 43 -3.109 1.576 5.964 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.132 2.700 6.988 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.250 0.235 6.667 1.00 0.00 C ATOM 0 H LEU A 43 -6.180 3.376 5.220 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.402 3.659 4.401 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.189 1.529 5.406 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.099 0.998 4.141 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.155 1.613 5.439 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.327 2.553 7.708 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -2.996 3.656 6.482 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.090 2.698 7.509 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.451 0.123 7.400 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.215 0.188 7.172 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.185 -0.569 5.934 1.00 0.00 H new ATOM 607 N LEU A 44 -5.778 3.297 2.259 1.00 0.00 N ATOM 608 CA LEU A 44 -6.042 3.187 0.830 1.00 0.00 C ATOM 609 C LEU A 44 -5.583 4.451 0.116 1.00 0.00 C ATOM 610 O LEU A 44 -4.936 4.378 -0.918 1.00 0.00 O ATOM 611 CB LEU A 44 -7.531 2.864 0.531 1.00 0.00 C ATOM 612 CG LEU A 44 -8.513 4.044 0.366 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.394 4.679 -1.015 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.946 3.582 0.567 1.00 0.00 C ATOM 0 H LEU A 44 -6.563 3.627 2.820 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.467 2.345 0.445 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.566 2.271 -0.383 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.903 2.231 1.337 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.253 4.784 1.123 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.099 5.506 -1.097 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.380 5.051 -1.158 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.618 3.934 -1.779 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.622 4.429 0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.188 2.817 -0.170 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.058 3.169 1.569 1.00 0.00 H new ATOM 626 N ASP A 45 -5.872 5.613 0.695 1.00 0.00 N ATOM 627 CA ASP A 45 -5.533 6.882 0.056 1.00 0.00 C ATOM 628 C ASP A 45 -4.031 7.096 0.074 1.00 0.00 C ATOM 629 O ASP A 45 -3.474 7.794 -0.773 1.00 0.00 O ATOM 630 CB ASP A 45 -6.237 8.040 0.764 1.00 0.00 C ATOM 631 CG ASP A 45 -5.895 9.389 0.160 1.00 0.00 C ATOM 632 OD1 ASP A 45 -6.359 9.667 -0.963 1.00 0.00 O ATOM 633 OD2 ASP A 45 -5.174 10.178 0.812 1.00 0.00 O ATOM 0 H ASP A 45 -6.337 5.703 1.599 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.871 6.848 -0.980 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.315 7.888 0.717 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.961 8.038 1.818 1.00 0.00 H new ATOM 638 N PHE A 46 -3.377 6.437 1.010 1.00 0.00 N ATOM 639 CA PHE A 46 -1.932 6.468 1.098 1.00 0.00 C ATOM 640 C PHE A 46 -1.320 5.622 0.001 1.00 0.00 C ATOM 641 O PHE A 46 -0.369 6.035 -0.659 1.00 0.00 O ATOM 642 CB PHE A 46 -1.530 5.893 2.455 1.00 0.00 C ATOM 643 CG PHE A 46 -0.075 6.002 2.794 1.00 0.00 C ATOM 644 CD1 PHE A 46 0.411 7.116 3.457 1.00 0.00 C ATOM 645 CD2 PHE A 46 0.804 4.981 2.469 1.00 0.00 C ATOM 646 CE1 PHE A 46 1.747 7.209 3.790 1.00 0.00 C ATOM 647 CE2 PHE A 46 2.140 5.070 2.796 1.00 0.00 C ATOM 648 CZ PHE A 46 2.612 6.186 3.457 1.00 0.00 C ATOM 0 H PHE A 46 -3.829 5.869 1.726 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.578 7.493 0.987 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.105 6.400 3.230 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.814 4.841 2.483 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -0.262 7.920 3.716 1.00 0.00 H new ATOM 0 HD2 PHE A 46 0.438 4.105 1.954 1.00 0.00 H new ATOM 0 HE1 PHE A 46 2.115 8.081 4.310 1.00 0.00 H new ATOM 0 HE2 PHE A 46 2.816 4.269 2.536 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.658 6.259 3.714 1.00 0.00 H new ATOM 658 N ILE A 47 -1.884 4.457 -0.226 1.00 0.00 N ATOM 659 CA ILE A 47 -1.317 3.565 -1.208 1.00 0.00 C ATOM 660 C ILE A 47 -1.712 3.986 -2.622 1.00 0.00 C ATOM 661 O ILE A 47 -0.972 3.765 -3.578 1.00 0.00 O ATOM 662 CB ILE A 47 -1.706 2.101 -0.934 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.227 1.930 -0.987 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.166 1.685 0.425 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.708 0.541 -0.620 1.00 0.00 C ATOM 0 H ILE A 47 -2.719 4.111 0.247 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.232 3.634 -1.127 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.271 1.462 -1.703 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.686 2.652 -0.312 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.574 2.169 -1.992 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.439 0.649 0.623 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.080 1.781 0.430 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.591 2.326 1.197 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.796 0.504 -0.682 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.280 -0.186 -1.310 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.395 0.304 0.397 1.00 0.00 H new ATOM 677 N GLN A 48 -2.865 4.627 -2.737 1.00 0.00 N ATOM 678 CA GLN A 48 -3.255 5.295 -3.961 1.00 0.00 C ATOM 679 C GLN A 48 -2.180 6.296 -4.364 1.00 0.00 C ATOM 680 O GLN A 48 -1.558 6.165 -5.398 1.00 0.00 O ATOM 681 CB GLN A 48 -4.596 6.008 -3.748 1.00 0.00 C ATOM 682 CG GLN A 48 -5.776 5.056 -3.597 1.00 0.00 C ATOM 683 CD GLN A 48 -6.120 4.316 -4.879 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.280 4.136 -5.756 1.00 0.00 O ATOM 685 NE2 GLN A 48 -7.357 3.854 -4.978 1.00 0.00 N ATOM 0 H GLN A 48 -3.551 4.697 -1.986 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.367 4.562 -4.760 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.528 6.633 -2.858 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.782 6.673 -4.591 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.550 4.330 -2.816 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.648 5.619 -3.266 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.027 4.024 -4.228 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.640 3.328 -5.805 1.00 0.00 H new ATOM 694 N LYS A 49 -1.871 7.189 -3.448 1.00 0.00 N ATOM 695 CA LYS A 49 -1.100 8.401 -3.727 1.00 0.00 C ATOM 696 C LYS A 49 0.405 8.131 -3.877 1.00 0.00 C ATOM 697 O LYS A 49 1.172 9.038 -4.198 1.00 0.00 O ATOM 698 CB LYS A 49 -1.355 9.346 -2.557 1.00 0.00 C ATOM 699 CG LYS A 49 -1.115 10.821 -2.828 1.00 0.00 C ATOM 700 CD LYS A 49 -1.329 11.639 -1.560 1.00 0.00 C ATOM 701 CE LYS A 49 -2.720 11.417 -0.971 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.816 11.882 0.437 1.00 0.00 N ATOM 0 H LYS A 49 -2.149 7.100 -2.471 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.416 8.827 -4.679 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.388 9.220 -2.232 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.720 9.042 -1.725 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -0.100 10.969 -3.196 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.791 11.168 -3.610 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.574 11.369 -0.821 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.193 12.697 -1.783 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.457 11.944 -1.577 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.968 10.357 -1.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.666 11.477 0.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.973 11.575 0.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.877 12.920 0.456 1.00 0.00 H new ATOM 716 N HIS A 50 0.859 6.904 -3.621 1.00 0.00 N ATOM 717 CA HIS A 50 2.260 6.606 -3.936 1.00 0.00 C ATOM 718 C HIS A 50 2.428 5.532 -5.013 1.00 0.00 C ATOM 719 O HIS A 50 3.553 5.218 -5.391 1.00 0.00 O ATOM 720 CB HIS A 50 3.003 6.186 -2.664 1.00 0.00 C ATOM 721 CG HIS A 50 2.764 7.116 -1.516 1.00 0.00 C ATOM 722 ND1 HIS A 50 2.211 6.708 -0.329 1.00 0.00 N ATOM 723 CD2 HIS A 50 2.946 8.451 -1.401 1.00 0.00 C ATOM 724 CE1 HIS A 50 2.054 7.749 0.461 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.490 8.822 -0.163 1.00 0.00 N ATOM 0 H HIS A 50 0.317 6.139 -3.220 1.00 0.00 H new ATOM 0 HA HIS A 50 2.688 7.523 -4.341 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.690 5.181 -2.382 1.00 0.00 H new ATOM 0 HB3 HIS A 50 4.072 6.141 -2.872 1.00 0.00 H new ATOM 0 HD2 HIS A 50 3.372 9.105 -2.148 1.00 0.00 H new ATOM 0 HE1 HIS A 50 1.636 7.726 1.457 1.00 0.00 H new ATOM 0 HE2 HIS A 50 2.489 9.771 0.212 1.00 0.00 H new ATOM 734 N LEU A 51 1.332 4.975 -5.512 1.00 0.00 N ATOM 735 CA LEU A 51 1.415 4.042 -6.643 1.00 0.00 C ATOM 736 C LEU A 51 0.651 4.586 -7.840 1.00 0.00 C ATOM 737 O LEU A 51 1.159 4.642 -8.961 1.00 0.00 O ATOM 738 CB LEU A 51 0.832 2.660 -6.303 1.00 0.00 C ATOM 739 CG LEU A 51 1.655 1.765 -5.360 1.00 0.00 C ATOM 740 CD1 LEU A 51 3.077 1.584 -5.867 1.00 0.00 C ATOM 741 CD2 LEU A 51 1.659 2.318 -3.952 1.00 0.00 C ATOM 0 H LEU A 51 0.388 5.145 -5.164 1.00 0.00 H new ATOM 0 HA LEU A 51 2.475 3.935 -6.874 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.151 2.808 -5.856 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.680 2.118 -7.236 1.00 0.00 H new ATOM 0 HG LEU A 51 1.178 0.785 -5.342 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.631 0.947 -5.178 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.055 1.119 -6.853 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.566 2.556 -5.935 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.248 1.666 -3.307 1.00 0.00 H new ATOM 0 HD22 LEU A 51 2.096 3.317 -3.955 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.636 2.370 -3.579 1.00 0.00 H new ATOM 753 N ASN A 52 -0.572 4.994 -7.577 1.00 0.00 N ATOM 754 CA ASN A 52 -1.536 5.301 -8.616 1.00 0.00 C ATOM 755 C ASN A 52 -1.891 6.785 -8.663 1.00 0.00 C ATOM 756 O ASN A 52 -2.206 7.316 -9.728 1.00 0.00 O ATOM 757 CB ASN A 52 -2.792 4.462 -8.381 1.00 0.00 C ATOM 758 CG ASN A 52 -2.883 3.285 -9.341 1.00 0.00 C ATOM 759 OD1 ASN A 52 -3.403 2.225 -8.997 1.00 0.00 O ATOM 760 ND2 ASN A 52 -2.397 3.468 -10.563 1.00 0.00 N ATOM 0 H ASN A 52 -0.929 5.123 -6.630 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.089 5.058 -9.580 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.794 4.093 -7.355 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.674 5.092 -8.495 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -2.449 2.716 -11.250 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -1.972 4.361 -10.815 1.00 0.00 H new ATOM 767 N LYS A 53 -1.839 7.445 -7.523 1.00 0.00 N ATOM 768 CA LYS A 53 -2.169 8.854 -7.432 1.00 0.00 C ATOM 769 C LYS A 53 -0.918 9.679 -7.156 1.00 0.00 C ATOM 770 O LYS A 53 -0.884 10.381 -6.126 1.00 0.00 O ATOM 771 CB LYS A 53 -3.191 9.072 -6.314 1.00 0.00 C ATOM 772 CG LYS A 53 -4.629 9.148 -6.790 1.00 0.00 C ATOM 773 CD LYS A 53 -5.481 9.948 -5.817 1.00 0.00 C ATOM 774 CE LYS A 53 -5.553 9.302 -4.444 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.351 10.130 -3.501 1.00 0.00 N ATOM 776 OXT LYS A 53 0.034 9.596 -7.958 1.00 0.00 O ATOM 0 H LYS A 53 -1.568 7.021 -6.636 1.00 0.00 H new ATOM 0 HA LYS A 53 -2.595 9.176 -8.382 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.102 8.260 -5.592 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.945 9.994 -5.788 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -4.666 9.610 -7.777 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -5.036 8.142 -6.894 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -5.071 10.954 -5.721 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -6.488 10.051 -6.220 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -5.999 8.311 -4.529 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -4.546 9.166 -4.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -6.244 9.757 -2.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -6.014 11.113 -3.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -7.354 10.099 -3.775 1.00 0.00 H new ATOM 811 N VAL B 2 8.150 4.096 13.701 1.00 0.00 N ATOM 812 CA VAL B 2 7.967 3.022 14.668 1.00 0.00 C ATOM 813 C VAL B 2 7.809 1.698 13.918 1.00 0.00 C ATOM 814 O VAL B 2 7.491 0.657 14.488 1.00 0.00 O ATOM 815 CB VAL B 2 6.744 3.287 15.584 1.00 0.00 C ATOM 816 CG1 VAL B 2 5.435 3.117 14.829 1.00 0.00 C ATOM 817 CG2 VAL B 2 6.783 2.396 16.818 1.00 0.00 C ATOM 0 HA VAL B 2 8.844 2.973 15.313 1.00 0.00 H new ATOM 0 HB VAL B 2 6.800 4.324 15.915 1.00 0.00 H new ATOM 0 HG11 VAL B 2 4.599 3.310 15.502 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.401 3.820 13.997 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.365 2.099 14.447 1.00 0.00 H new ATOM 0 HG21 VAL B 2 5.914 2.602 17.443 1.00 0.00 H new ATOM 0 HG22 VAL B 2 6.770 1.350 16.512 1.00 0.00 H new ATOM 0 HG23 VAL B 2 7.693 2.597 17.383 1.00 0.00 H new ATOM 827 N ILE B 3 8.059 1.765 12.619 1.00 0.00 N ATOM 828 CA ILE B 3 7.986 0.600 11.756 1.00 0.00 C ATOM 829 C ILE B 3 9.141 0.614 10.762 1.00 0.00 C ATOM 830 O ILE B 3 9.456 1.651 10.175 1.00 0.00 O ATOM 831 CB ILE B 3 6.637 0.529 10.996 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.508 -0.803 10.252 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.497 1.698 10.024 1.00 0.00 C ATOM 834 CD1 ILE B 3 5.185 -0.976 9.540 1.00 0.00 C ATOM 0 H ILE B 3 8.317 2.626 12.137 1.00 0.00 H new ATOM 0 HA ILE B 3 8.058 -0.284 12.389 1.00 0.00 H new ATOM 0 HB ILE B 3 5.833 0.597 11.728 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.315 -0.882 9.524 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.638 -1.620 10.962 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.542 1.626 9.503 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.539 2.637 10.576 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.310 1.667 9.298 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.167 -1.942 9.036 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.373 -0.930 10.265 1.00 0.00 H new ATOM 0 HD13 ILE B 3 5.061 -0.181 8.805 1.00 0.00 H new ATOM 846 N ALA B 4 9.793 -0.522 10.595 1.00 0.00 N ATOM 847 CA ALA B 4 10.874 -0.636 9.634 1.00 0.00 C ATOM 848 C ALA B 4 10.588 -1.768 8.660 1.00 0.00 C ATOM 849 O ALA B 4 9.943 -2.760 9.006 1.00 0.00 O ATOM 850 CB ALA B 4 12.198 -0.859 10.347 1.00 0.00 C ATOM 0 H ALA B 4 9.593 -1.378 11.112 1.00 0.00 H new ATOM 0 HA ALA B 4 10.945 0.295 9.072 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.998 -0.942 9.611 1.00 0.00 H new ATOM 0 HB2 ALA B 4 12.401 -0.018 11.010 1.00 0.00 H new ATOM 0 HB3 ALA B 4 12.146 -1.777 10.932 1.00 0.00 H new ATOM 856 N THR B 5 11.077 -1.600 7.435 1.00 0.00 N ATOM 857 CA THR B 5 10.819 -2.536 6.350 1.00 0.00 C ATOM 858 C THR B 5 11.343 -3.931 6.677 1.00 0.00 C ATOM 859 O THR B 5 10.878 -4.922 6.124 1.00 0.00 O ATOM 860 CB THR B 5 11.482 -2.041 5.050 1.00 0.00 C ATOM 861 OG1 THR B 5 11.325 -0.620 4.938 1.00 0.00 O ATOM 862 CG2 THR B 5 10.866 -2.715 3.831 1.00 0.00 C ATOM 0 H THR B 5 11.664 -0.810 7.168 1.00 0.00 H new ATOM 0 HA THR B 5 9.738 -2.592 6.218 1.00 0.00 H new ATOM 0 HB THR B 5 12.541 -2.296 5.089 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.749 -0.308 4.111 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.352 -2.347 2.927 1.00 0.00 H new ATOM 0 HG22 THR B 5 11.003 -3.794 3.904 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.801 -2.487 3.788 1.00 0.00 H new ATOM 870 N ASP B 6 12.272 -4.006 7.620 1.00 0.00 N ATOM 871 CA ASP B 6 12.947 -5.257 7.935 1.00 0.00 C ATOM 872 C ASP B 6 12.114 -6.116 8.879 1.00 0.00 C ATOM 873 O ASP B 6 12.507 -7.234 9.217 1.00 0.00 O ATOM 874 CB ASP B 6 14.312 -4.982 8.570 1.00 0.00 C ATOM 875 CG ASP B 6 15.242 -4.207 7.657 1.00 0.00 C ATOM 876 OD1 ASP B 6 15.935 -4.836 6.829 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.296 -2.963 7.774 1.00 0.00 O ATOM 0 H ASP B 6 12.576 -3.211 8.182 1.00 0.00 H new ATOM 0 HA ASP B 6 13.082 -5.800 7.000 1.00 0.00 H new ATOM 0 HB2 ASP B 6 14.171 -4.423 9.495 1.00 0.00 H new ATOM 0 HB3 ASP B 6 14.780 -5.929 8.838 1.00 0.00 H new ATOM 882 N ASP B 7 10.972 -5.595 9.316 1.00 0.00 N ATOM 883 CA ASP B 7 10.085 -6.353 10.193 1.00 0.00 C ATOM 884 C ASP B 7 8.883 -6.889 9.427 1.00 0.00 C ATOM 885 O ASP B 7 8.182 -7.788 9.899 1.00 0.00 O ATOM 886 CB ASP B 7 9.585 -5.471 11.342 1.00 0.00 C ATOM 887 CG ASP B 7 10.702 -4.878 12.172 1.00 0.00 C ATOM 888 OD1 ASP B 7 11.274 -5.598 13.014 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.993 -3.677 12.007 1.00 0.00 O ATOM 0 H ASP B 7 10.641 -4.660 9.080 1.00 0.00 H new ATOM 0 HA ASP B 7 10.657 -7.190 10.592 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.978 -4.663 10.933 1.00 0.00 H new ATOM 0 HB3 ASP B 7 8.936 -6.062 11.988 1.00 0.00 H new ATOM 894 N LEU B 8 8.636 -6.333 8.248 1.00 0.00 N ATOM 895 CA LEU B 8 7.527 -6.789 7.416 1.00 0.00 C ATOM 896 C LEU B 8 8.052 -7.450 6.155 1.00 0.00 C ATOM 897 O LEU B 8 7.315 -8.124 5.432 1.00 0.00 O ATOM 898 CB LEU B 8 6.582 -5.638 7.066 1.00 0.00 C ATOM 899 CG LEU B 8 5.665 -5.180 8.204 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.429 -4.368 9.236 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.496 -4.381 7.654 1.00 0.00 C ATOM 0 H LEU B 8 9.183 -5.571 7.847 1.00 0.00 H new ATOM 0 HA LEU B 8 6.958 -7.523 7.987 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.178 -4.787 6.736 1.00 0.00 H new ATOM 0 HB3 LEU B 8 5.963 -5.941 6.221 1.00 0.00 H new ATOM 0 HG LEU B 8 5.277 -6.069 8.701 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.750 -4.058 10.030 1.00 0.00 H new ATOM 0 HD12 LEU B 8 7.228 -4.977 9.659 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.858 -3.486 8.760 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.854 -4.063 8.476 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.871 -3.504 7.126 1.00 0.00 H new ATOM 0 HD23 LEU B 8 3.923 -5.002 6.965 1.00 0.00 H new ATOM 913 N GLU B 9 9.339 -7.263 5.922 1.00 0.00 N ATOM 914 CA GLU B 9 10.036 -7.915 4.835 1.00 0.00 C ATOM 915 C GLU B 9 11.359 -8.446 5.352 1.00 0.00 C ATOM 916 O GLU B 9 12.062 -7.778 6.110 1.00 0.00 O ATOM 917 CB GLU B 9 10.262 -6.977 3.641 1.00 0.00 C ATOM 918 CG GLU B 9 8.982 -6.593 2.914 1.00 0.00 C ATOM 919 CD GLU B 9 9.241 -5.990 1.546 1.00 0.00 C ATOM 920 OE1 GLU B 9 9.825 -4.890 1.471 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.844 -6.616 0.536 1.00 0.00 O ATOM 0 H GLU B 9 9.930 -6.652 6.486 1.00 0.00 H new ATOM 0 HA GLU B 9 9.416 -8.735 4.472 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.757 -6.071 3.991 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.940 -7.458 2.936 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.353 -7.477 2.803 1.00 0.00 H new ATOM 0 HG3 GLU B 9 8.425 -5.879 3.521 1.00 0.00 H new ATOM 928 N VAL B 10 11.678 -9.654 4.955 1.00 0.00 N ATOM 929 CA VAL B 10 12.878 -10.321 5.406 1.00 0.00 C ATOM 930 C VAL B 10 13.604 -10.875 4.191 1.00 0.00 C ATOM 931 O VAL B 10 12.971 -11.247 3.203 1.00 0.00 O ATOM 932 CB VAL B 10 12.544 -11.453 6.412 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.635 -12.498 5.784 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.809 -12.102 6.953 1.00 0.00 C ATOM 0 H VAL B 10 11.113 -10.204 4.309 1.00 0.00 H new ATOM 0 HA VAL B 10 13.518 -9.609 5.927 1.00 0.00 H new ATOM 0 HB VAL B 10 12.012 -10.999 7.248 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.419 -13.278 6.514 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.703 -12.028 5.469 1.00 0.00 H new ATOM 0 HG13 VAL B 10 12.130 -12.938 4.918 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.541 -12.891 7.655 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.380 -12.528 6.129 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.413 -11.352 7.463 1.00 0.00 H new ATOM 944 N ALA B 11 14.923 -10.903 4.244 1.00 0.00 N ATOM 945 CA ALA B 11 15.712 -11.357 3.115 1.00 0.00 C ATOM 946 C ALA B 11 15.450 -12.831 2.826 1.00 0.00 C ATOM 947 O ALA B 11 15.438 -13.665 3.733 1.00 0.00 O ATOM 948 CB ALA B 11 17.182 -11.101 3.415 1.00 0.00 C ATOM 0 H ALA B 11 15.470 -10.617 5.056 1.00 0.00 H new ATOM 0 HA ALA B 11 15.427 -10.804 2.220 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.789 -11.437 2.574 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.341 -10.034 3.573 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.471 -11.648 4.313 1.00 0.00 H new ATOM 954 N CYS B 12 15.232 -13.137 1.546 1.00 0.00 N ATOM 955 CA CYS B 12 14.787 -14.446 1.090 1.00 0.00 C ATOM 956 C CYS B 12 15.838 -15.539 1.349 1.00 0.00 C ATOM 957 O CYS B 12 16.991 -15.220 1.612 1.00 0.00 O ATOM 958 CB CYS B 12 14.539 -14.301 -0.419 1.00 0.00 C ATOM 959 SG CYS B 12 13.531 -15.574 -1.207 1.00 0.00 S ATOM 0 H CYS B 12 15.363 -12.468 0.788 1.00 0.00 H new ATOM 0 HA CYS B 12 13.892 -14.752 1.632 1.00 0.00 H new ATOM 0 HB2 CYS B 12 14.064 -13.336 -0.593 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.506 -14.275 -0.921 1.00 0.00 H new ATOM 0 HG CYS B 12 13.028 -15.108 -2.312 1.00 0.00 H new ATOM 964 N PRO B 13 15.452 -16.840 1.303 1.00 0.00 N ATOM 965 CA PRO B 13 16.383 -17.967 1.438 1.00 0.00 C ATOM 966 C PRO B 13 17.760 -17.746 0.804 1.00 0.00 C ATOM 967 O PRO B 13 18.785 -18.067 1.414 1.00 0.00 O ATOM 968 CB PRO B 13 15.646 -19.078 0.699 1.00 0.00 C ATOM 969 CG PRO B 13 14.206 -18.831 0.992 1.00 0.00 C ATOM 970 CD PRO B 13 14.061 -17.332 1.170 1.00 0.00 C ATOM 0 HA PRO B 13 16.614 -18.161 2.485 1.00 0.00 H new ATOM 0 HB2 PRO B 13 15.845 -19.042 -0.372 1.00 0.00 H new ATOM 0 HB3 PRO B 13 15.959 -20.062 1.048 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.576 -19.189 0.178 1.00 0.00 H new ATOM 0 HG3 PRO B 13 13.895 -19.362 1.892 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.559 -16.877 0.316 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.469 -17.092 2.053 1.00 0.00 H new ATOM 978 N LYS B 14 17.801 -17.176 -0.404 1.00 0.00 N ATOM 979 CA LYS B 14 19.071 -17.116 -1.123 1.00 0.00 C ATOM 980 C LYS B 14 19.140 -16.072 -2.241 1.00 0.00 C ATOM 981 O LYS B 14 20.181 -15.953 -2.887 1.00 0.00 O ATOM 982 CB LYS B 14 19.424 -18.489 -1.713 1.00 0.00 C ATOM 983 CG LYS B 14 18.383 -19.054 -2.672 1.00 0.00 C ATOM 984 CD LYS B 14 18.895 -20.301 -3.403 1.00 0.00 C ATOM 985 CE LYS B 14 19.786 -19.954 -4.592 1.00 0.00 C ATOM 986 NZ LYS B 14 21.160 -19.555 -4.194 1.00 0.00 N ATOM 0 H LYS B 14 17.002 -16.765 -0.887 1.00 0.00 H new ATOM 0 HA LYS B 14 19.793 -16.808 -0.367 1.00 0.00 H new ATOM 0 HB2 LYS B 14 20.377 -18.411 -2.237 1.00 0.00 H new ATOM 0 HB3 LYS B 14 19.567 -19.195 -0.895 1.00 0.00 H new ATOM 0 HG2 LYS B 14 17.478 -19.304 -2.119 1.00 0.00 H new ATOM 0 HG3 LYS B 14 18.110 -18.292 -3.402 1.00 0.00 H new ATOM 0 HD2 LYS B 14 19.453 -20.925 -2.704 1.00 0.00 H new ATOM 0 HD3 LYS B 14 18.046 -20.890 -3.749 1.00 0.00 H new ATOM 0 HE2 LYS B 14 19.843 -20.814 -5.259 1.00 0.00 H new ATOM 0 HE3 LYS B 14 19.328 -19.142 -5.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 21.844 -19.935 -4.879 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 21.229 -18.517 -4.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 21.371 -19.933 -3.248 1.00 0.00 H new ATOM 1000 N CYS B 15 18.060 -15.351 -2.552 1.00 0.00 N ATOM 1001 CA CYS B 15 18.192 -14.338 -3.606 1.00 0.00 C ATOM 1002 C CYS B 15 17.921 -12.916 -3.125 1.00 0.00 C ATOM 1003 O CYS B 15 17.316 -12.119 -3.843 1.00 0.00 O ATOM 1004 CB CYS B 15 17.208 -14.643 -4.740 1.00 0.00 C ATOM 1005 SG CYS B 15 15.512 -14.935 -4.166 1.00 0.00 S ATOM 0 H CYS B 15 17.139 -15.437 -2.122 1.00 0.00 H new ATOM 0 HA CYS B 15 19.228 -14.387 -3.940 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.207 -13.810 -5.443 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.555 -15.521 -5.285 1.00 0.00 H new ATOM 0 HG CYS B 15 14.806 -13.856 -4.332 1.00 0.00 H new ATOM 1010 N GLU B 16 18.453 -12.560 -1.976 1.00 0.00 N ATOM 1011 CA GLU B 16 18.185 -11.263 -1.375 1.00 0.00 C ATOM 1012 C GLU B 16 19.175 -10.224 -1.837 1.00 0.00 C ATOM 1013 O GLU B 16 19.336 -9.186 -1.196 1.00 0.00 O ATOM 1014 CB GLU B 16 18.297 -11.368 0.149 1.00 0.00 C ATOM 1015 CG GLU B 16 18.375 -12.785 0.676 1.00 0.00 C ATOM 1016 CD GLU B 16 19.777 -13.354 0.578 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.099 -13.955 -0.465 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.561 -13.184 1.528 1.00 0.00 O ATOM 0 H GLU B 16 19.080 -13.153 -1.432 1.00 0.00 H new ATOM 0 HA GLU B 16 17.181 -10.965 -1.677 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.184 -10.824 0.474 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.436 -10.873 0.599 1.00 0.00 H new ATOM 0 HG2 GLU B 16 18.049 -12.803 1.716 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.687 -13.418 0.115 1.00 0.00 H new ATOM 1025 N ARG B 17 19.827 -10.491 -2.956 1.00 0.00 N ATOM 1026 CA ARG B 17 20.887 -9.630 -3.436 1.00 0.00 C ATOM 1027 C ARG B 17 20.885 -9.695 -4.964 1.00 0.00 C ATOM 1028 O ARG B 17 21.520 -8.884 -5.646 1.00 0.00 O ATOM 1029 CB ARG B 17 22.279 -10.008 -2.886 1.00 0.00 C ATOM 1030 CG ARG B 17 22.339 -11.286 -2.060 1.00 0.00 C ATOM 1031 CD ARG B 17 22.283 -12.531 -2.928 1.00 0.00 C ATOM 1032 NE ARG B 17 22.202 -13.742 -2.121 1.00 0.00 N ATOM 1033 CZ ARG B 17 22.961 -14.821 -2.294 1.00 0.00 C ATOM 1034 NH1 ARG B 17 23.880 -14.861 -3.254 1.00 0.00 N ATOM 1035 NH2 ARG B 17 22.792 -15.867 -1.500 1.00 0.00 N ATOM 0 H ARG B 17 19.638 -11.300 -3.548 1.00 0.00 H new ATOM 0 HA ARG B 17 20.694 -8.618 -3.079 1.00 0.00 H new ATOM 0 HB2 ARG B 17 22.966 -10.108 -3.726 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.643 -9.184 -2.273 1.00 0.00 H new ATOM 0 HG2 ARG B 17 23.257 -11.295 -1.473 1.00 0.00 H new ATOM 0 HG3 ARG B 17 21.509 -11.300 -1.353 1.00 0.00 H new ATOM 0 HD2 ARG B 17 21.419 -12.475 -3.590 1.00 0.00 H new ATOM 0 HD3 ARG B 17 23.168 -12.574 -3.562 1.00 0.00 H new ATOM 0 HE ARG B 17 21.513 -13.764 -1.369 1.00 0.00 H new ATOM 0 HH11 ARG B 17 24.010 -14.058 -3.869 1.00 0.00 H new ATOM 0 HH12 ARG B 17 24.455 -15.695 -3.375 1.00 0.00 H new ATOM 0 HH21 ARG B 17 22.086 -15.840 -0.765 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.368 -16.699 -1.624 1.00 0.00 H new ATOM 1049 N ALA B 18 20.150 -10.685 -5.496 1.00 0.00 N ATOM 1050 CA ALA B 18 20.258 -11.034 -6.906 1.00 0.00 C ATOM 1051 C ALA B 18 19.035 -10.636 -7.728 1.00 0.00 C ATOM 1052 O ALA B 18 19.165 -9.965 -8.752 1.00 0.00 O ATOM 1053 CB ALA B 18 20.515 -12.525 -7.055 1.00 0.00 C ATOM 0 H ALA B 18 19.483 -11.249 -4.969 1.00 0.00 H new ATOM 0 HA ALA B 18 21.098 -10.463 -7.300 1.00 0.00 H new ATOM 0 HB1 ALA B 18 20.594 -12.777 -8.113 1.00 0.00 H new ATOM 0 HB2 ALA B 18 21.444 -12.786 -6.549 1.00 0.00 H new ATOM 0 HB3 ALA B 18 19.691 -13.083 -6.610 1.00 0.00 H new ATOM 1059 N GLY B 19 17.852 -11.043 -7.284 1.00 0.00 N ATOM 1060 CA GLY B 19 16.660 -10.826 -8.083 1.00 0.00 C ATOM 1061 C GLY B 19 16.254 -12.066 -8.864 1.00 0.00 C ATOM 1062 O GLY B 19 15.415 -12.001 -9.756 1.00 0.00 O ATOM 0 H GLY B 19 17.697 -11.515 -6.393 1.00 0.00 H new ATOM 0 HA2 GLY B 19 15.839 -10.525 -7.432 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.835 -10.004 -8.777 1.00 0.00 H new ATOM 1066 N GLU B 20 16.853 -13.190 -8.514 1.00 0.00 N ATOM 1067 CA GLU B 20 16.568 -14.471 -9.157 1.00 0.00 C ATOM 1068 C GLU B 20 17.118 -15.605 -8.330 1.00 0.00 C ATOM 1069 O GLU B 20 17.866 -15.395 -7.378 1.00 0.00 O ATOM 1070 CB GLU B 20 17.209 -14.576 -10.546 1.00 0.00 C ATOM 1071 CG GLU B 20 18.611 -13.989 -10.593 1.00 0.00 C ATOM 1072 CD GLU B 20 19.310 -14.216 -11.912 1.00 0.00 C ATOM 1073 OE1 GLU B 20 19.171 -13.368 -12.815 1.00 0.00 O ATOM 1074 OE2 GLU B 20 20.020 -15.236 -12.045 1.00 0.00 O ATOM 0 H GLU B 20 17.553 -13.246 -7.775 1.00 0.00 H new ATOM 0 HA GLU B 20 15.484 -14.533 -9.249 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.248 -15.623 -10.845 1.00 0.00 H new ATOM 0 HB3 GLU B 20 16.580 -14.061 -11.272 1.00 0.00 H new ATOM 0 HG2 GLU B 20 18.556 -12.918 -10.399 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.208 -14.427 -9.793 1.00 0.00 H new ATOM 1081 N ILE B 21 16.767 -16.800 -8.736 1.00 0.00 N ATOM 1082 CA ILE B 21 17.333 -18.007 -8.190 1.00 0.00 C ATOM 1083 C ILE B 21 17.517 -18.966 -9.331 1.00 0.00 C ATOM 1084 O ILE B 21 16.572 -19.237 -10.063 1.00 0.00 O ATOM 1085 CB ILE B 21 16.466 -18.652 -7.083 1.00 0.00 C ATOM 1086 CG1 ILE B 21 16.457 -17.745 -5.853 1.00 0.00 C ATOM 1087 CG2 ILE B 21 17.001 -20.036 -6.732 1.00 0.00 C ATOM 1088 CD1 ILE B 21 15.708 -18.291 -4.662 1.00 0.00 C ATOM 0 H ILE B 21 16.071 -16.963 -9.464 1.00 0.00 H new ATOM 0 HA ILE B 21 18.279 -17.759 -7.708 1.00 0.00 H new ATOM 0 HB ILE B 21 15.444 -18.768 -7.444 1.00 0.00 H new ATOM 0 HG12 ILE B 21 17.488 -17.550 -5.557 1.00 0.00 H new ATOM 0 HG13 ILE B 21 16.018 -16.786 -6.130 1.00 0.00 H new ATOM 0 HG21 ILE B 21 16.382 -20.478 -5.952 1.00 0.00 H new ATOM 0 HG22 ILE B 21 16.977 -20.671 -7.618 1.00 0.00 H new ATOM 0 HG23 ILE B 21 18.027 -19.950 -6.375 1.00 0.00 H new ATOM 0 HD11 ILE B 21 15.759 -17.576 -3.841 1.00 0.00 H new ATOM 0 HD12 ILE B 21 14.666 -18.458 -4.933 1.00 0.00 H new ATOM 0 HD13 ILE B 21 16.158 -19.234 -4.350 1.00 0.00 H new ATOM 1100 N GLU B 22 18.730 -19.454 -9.492 1.00 0.00 N ATOM 1101 CA GLU B 22 19.054 -20.326 -10.609 1.00 0.00 C ATOM 1102 C GLU B 22 18.655 -19.685 -11.938 1.00 0.00 C ATOM 1103 O GLU B 22 18.065 -20.334 -12.799 1.00 0.00 O ATOM 1104 CB GLU B 22 18.305 -21.635 -10.424 1.00 0.00 C ATOM 1105 CG GLU B 22 18.883 -22.807 -11.212 1.00 0.00 C ATOM 1106 CD GLU B 22 18.211 -24.114 -10.863 1.00 0.00 C ATOM 1107 OE1 GLU B 22 17.056 -24.328 -11.285 1.00 0.00 O ATOM 1108 OE2 GLU B 22 18.832 -24.939 -10.162 1.00 0.00 O ATOM 0 H GLU B 22 19.511 -19.263 -8.864 1.00 0.00 H new ATOM 0 HA GLU B 22 20.130 -20.500 -10.632 1.00 0.00 H new ATOM 0 HB2 GLU B 22 18.302 -21.891 -9.365 1.00 0.00 H new ATOM 0 HB3 GLU B 22 17.266 -21.490 -10.720 1.00 0.00 H new ATOM 0 HG2 GLU B 22 18.771 -22.616 -12.279 1.00 0.00 H new ATOM 0 HG3 GLU B 22 19.952 -22.885 -11.013 1.00 0.00 H new ATOM 1115 N GLY B 23 18.935 -18.401 -12.091 1.00 0.00 N ATOM 1116 CA GLY B 23 18.598 -17.722 -13.324 1.00 0.00 C ATOM 1117 C GLY B 23 17.106 -17.625 -13.574 1.00 0.00 C ATOM 1118 O GLY B 23 16.684 -17.192 -14.648 1.00 0.00 O ATOM 0 H GLY B 23 19.388 -17.818 -11.387 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.021 -16.718 -13.303 1.00 0.00 H new ATOM 0 HA3 GLY B 23 19.064 -18.247 -14.158 1.00 0.00 H new ATOM 1122 N THR B 24 16.296 -18.023 -12.602 1.00 0.00 N ATOM 1123 CA THR B 24 14.851 -18.042 -12.803 1.00 0.00 C ATOM 1124 C THR B 24 14.132 -17.230 -11.715 1.00 0.00 C ATOM 1125 O THR B 24 14.698 -16.986 -10.645 1.00 0.00 O ATOM 1126 CB THR B 24 14.365 -19.510 -12.817 1.00 0.00 C ATOM 1127 OG1 THR B 24 13.174 -19.653 -13.604 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.091 -20.034 -11.416 1.00 0.00 C ATOM 0 H THR B 24 16.606 -18.332 -11.681 1.00 0.00 H new ATOM 0 HA THR B 24 14.613 -17.576 -13.759 1.00 0.00 H new ATOM 0 HB THR B 24 15.171 -20.095 -13.259 1.00 0.00 H new ATOM 0 HG1 THR B 24 12.889 -20.590 -13.598 1.00 0.00 H new ATOM 0 HG21 THR B 24 13.752 -21.068 -11.474 1.00 0.00 H new ATOM 0 HG22 THR B 24 15.005 -19.984 -10.824 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.320 -19.425 -10.944 1.00 0.00 H new ATOM 1136 N PRO B 25 12.890 -16.765 -11.986 1.00 0.00 N ATOM 1137 CA PRO B 25 12.074 -16.058 -10.992 1.00 0.00 C ATOM 1138 C PRO B 25 11.887 -16.885 -9.722 1.00 0.00 C ATOM 1139 O PRO B 25 11.606 -18.083 -9.771 1.00 0.00 O ATOM 1140 CB PRO B 25 10.728 -15.836 -11.699 1.00 0.00 C ATOM 1141 CG PRO B 25 10.738 -16.787 -12.846 1.00 0.00 C ATOM 1142 CD PRO B 25 12.176 -16.885 -13.268 1.00 0.00 C ATOM 0 HA PRO B 25 12.542 -15.128 -10.669 1.00 0.00 H new ATOM 0 HB2 PRO B 25 9.892 -16.034 -11.028 1.00 0.00 H new ATOM 0 HB3 PRO B 25 10.626 -14.806 -12.040 1.00 0.00 H new ATOM 0 HG2 PRO B 25 10.347 -17.761 -12.552 1.00 0.00 H new ATOM 0 HG3 PRO B 25 10.112 -16.425 -13.662 1.00 0.00 H new ATOM 0 HD2 PRO B 25 12.390 -17.831 -13.765 1.00 0.00 H new ATOM 0 HD3 PRO B 25 12.451 -16.091 -13.962 1.00 0.00 H new ATOM 1150 N CYS B 26 12.052 -16.226 -8.587 1.00 0.00 N ATOM 1151 CA CYS B 26 12.068 -16.898 -7.299 1.00 0.00 C ATOM 1152 C CYS B 26 10.672 -17.076 -6.700 1.00 0.00 C ATOM 1153 O CYS B 26 9.903 -16.122 -6.633 1.00 0.00 O ATOM 1154 CB CYS B 26 12.942 -16.106 -6.344 1.00 0.00 C ATOM 1155 SG CYS B 26 12.800 -16.602 -4.594 1.00 0.00 S ATOM 0 H CYS B 26 12.178 -15.215 -8.533 1.00 0.00 H new ATOM 0 HA CYS B 26 12.469 -17.899 -7.454 1.00 0.00 H new ATOM 0 HB2 CYS B 26 13.982 -16.209 -6.654 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.687 -15.050 -6.430 1.00 0.00 H new ATOM 0 HG CYS B 26 13.820 -16.145 -3.929 1.00 0.00 H new ATOM 1160 N PRO B 27 10.393 -18.302 -6.194 1.00 0.00 N ATOM 1161 CA PRO B 27 9.099 -18.739 -5.645 1.00 0.00 C ATOM 1162 C PRO B 27 8.205 -17.642 -5.055 1.00 0.00 C ATOM 1163 O PRO B 27 7.085 -17.431 -5.514 1.00 0.00 O ATOM 1164 CB PRO B 27 9.548 -19.674 -4.528 1.00 0.00 C ATOM 1165 CG PRO B 27 10.818 -20.303 -5.010 1.00 0.00 C ATOM 1166 CD PRO B 27 11.356 -19.421 -6.125 1.00 0.00 C ATOM 0 HA PRO B 27 8.475 -19.161 -6.432 1.00 0.00 H new ATOM 0 HB2 PRO B 27 9.711 -19.125 -3.600 1.00 0.00 H new ATOM 0 HB3 PRO B 27 8.790 -20.430 -4.322 1.00 0.00 H new ATOM 0 HG2 PRO B 27 11.541 -20.382 -4.198 1.00 0.00 H new ATOM 0 HG3 PRO B 27 10.634 -21.314 -5.373 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.363 -19.068 -5.903 1.00 0.00 H new ATOM 0 HD3 PRO B 27 11.409 -19.961 -7.070 1.00 0.00 H new ATOM 1174 N ALA B 28 8.721 -16.938 -4.053 1.00 0.00 N ATOM 1175 CA ALA B 28 7.882 -16.076 -3.221 1.00 0.00 C ATOM 1176 C ALA B 28 8.215 -14.597 -3.380 1.00 0.00 C ATOM 1177 O ALA B 28 7.466 -13.735 -2.932 1.00 0.00 O ATOM 1178 CB ALA B 28 8.010 -16.480 -1.762 1.00 0.00 C ATOM 0 H ALA B 28 9.708 -16.945 -3.797 1.00 0.00 H new ATOM 0 HA ALA B 28 6.854 -16.211 -3.558 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.382 -15.833 -1.149 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.691 -17.515 -1.642 1.00 0.00 H new ATOM 0 HB3 ALA B 28 9.049 -16.382 -1.447 1.00 0.00 H new ATOM 1184 N CYS B 29 9.340 -14.293 -4.006 1.00 0.00 N ATOM 1185 CA CYS B 29 9.750 -12.890 -4.110 1.00 0.00 C ATOM 1186 C CYS B 29 10.041 -12.459 -5.538 1.00 0.00 C ATOM 1187 O CYS B 29 10.370 -11.298 -5.753 1.00 0.00 O ATOM 1188 CB CYS B 29 10.994 -12.629 -3.250 1.00 0.00 C ATOM 1189 SG CYS B 29 12.504 -13.431 -3.872 1.00 0.00 S ATOM 0 H CYS B 29 9.971 -14.968 -4.438 1.00 0.00 H new ATOM 0 HA CYS B 29 8.906 -12.301 -3.750 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.164 -11.554 -3.191 1.00 0.00 H new ATOM 0 HB3 CYS B 29 10.801 -12.977 -2.235 1.00 0.00 H new ATOM 0 HG CYS B 29 12.267 -14.690 -4.095 1.00 0.00 H new ATOM 1194 N SER B 30 9.932 -13.384 -6.491 1.00 0.00 N ATOM 1195 CA SER B 30 10.150 -13.091 -7.914 1.00 0.00 C ATOM 1196 C SER B 30 11.599 -12.673 -8.213 1.00 0.00 C ATOM 1197 O SER B 30 12.346 -13.418 -8.845 1.00 0.00 O ATOM 1198 CB SER B 30 9.168 -12.007 -8.396 1.00 0.00 C ATOM 1199 OG SER B 30 9.336 -11.727 -9.774 1.00 0.00 O ATOM 0 H SER B 30 9.691 -14.357 -6.303 1.00 0.00 H new ATOM 0 HA SER B 30 9.964 -14.014 -8.463 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.145 -12.335 -8.213 1.00 0.00 H new ATOM 0 HB3 SER B 30 9.319 -11.095 -7.818 1.00 0.00 H new ATOM 0 HG SER B 30 8.697 -11.037 -10.048 1.00 0.00 H new ATOM 1205 N GLY B 31 12.009 -11.533 -7.671 1.00 0.00 N ATOM 1206 CA GLY B 31 13.243 -10.897 -8.056 1.00 0.00 C ATOM 1207 C GLY B 31 13.397 -9.556 -7.369 1.00 0.00 C ATOM 1208 O GLY B 31 13.923 -8.605 -7.942 1.00 0.00 O ATOM 0 H GLY B 31 11.488 -11.030 -6.952 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.084 -11.541 -7.799 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.265 -10.761 -9.137 1.00 0.00 H new ATOM 1212 N LYS B 32 12.918 -9.486 -6.131 1.00 0.00 N ATOM 1213 CA LYS B 32 12.953 -8.258 -5.346 1.00 0.00 C ATOM 1214 C LYS B 32 14.037 -8.351 -4.284 1.00 0.00 C ATOM 1215 O LYS B 32 14.608 -7.351 -3.865 1.00 0.00 O ATOM 1216 CB LYS B 32 11.590 -8.041 -4.701 1.00 0.00 C ATOM 1217 CG LYS B 32 10.483 -8.058 -5.731 1.00 0.00 C ATOM 1218 CD LYS B 32 9.119 -7.779 -5.137 1.00 0.00 C ATOM 1219 CE LYS B 32 8.650 -8.890 -4.215 1.00 0.00 C ATOM 1220 NZ LYS B 32 7.203 -8.757 -3.935 1.00 0.00 N ATOM 0 H LYS B 32 12.496 -10.277 -5.645 1.00 0.00 H new ATOM 0 HA LYS B 32 13.182 -7.412 -5.994 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.410 -8.818 -3.958 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.583 -7.087 -4.173 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.698 -7.315 -6.499 1.00 0.00 H new ATOM 0 HG3 LYS B 32 10.467 -9.030 -6.223 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.152 -6.841 -4.583 1.00 0.00 H new ATOM 0 HD3 LYS B 32 8.395 -7.649 -5.942 1.00 0.00 H new ATOM 0 HE2 LYS B 32 8.850 -9.859 -4.673 1.00 0.00 H new ATOM 0 HE3 LYS B 32 9.211 -8.857 -3.281 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 7.009 -9.059 -2.959 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 6.916 -7.764 -4.054 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 6.665 -9.354 -4.595 1.00 0.00 H new ATOM 1234 N GLY B 33 14.299 -9.577 -3.844 1.00 0.00 N ATOM 1235 CA GLY B 33 15.343 -9.826 -2.889 1.00 0.00 C ATOM 1236 C GLY B 33 14.784 -10.272 -1.561 1.00 0.00 C ATOM 1237 O GLY B 33 15.290 -11.214 -0.954 1.00 0.00 O ATOM 0 H GLY B 33 13.793 -10.410 -4.143 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.017 -10.590 -3.276 1.00 0.00 H new ATOM 0 HA3 GLY B 33 15.934 -8.921 -2.750 1.00 0.00 H new ATOM 1241 N VAL B 34 13.687 -9.664 -1.146 1.00 0.00 N ATOM 1242 CA VAL B 34 13.118 -9.959 0.158 1.00 0.00 C ATOM 1243 C VAL B 34 11.748 -10.607 0.028 1.00 0.00 C ATOM 1244 O VAL B 34 11.141 -10.596 -1.046 1.00 0.00 O ATOM 1245 CB VAL B 34 12.996 -8.682 1.018 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.371 -8.118 1.350 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.152 -7.636 0.307 1.00 0.00 C ATOM 0 H VAL B 34 13.175 -8.968 -1.688 1.00 0.00 H new ATOM 0 HA VAL B 34 13.797 -10.656 0.650 1.00 0.00 H new ATOM 0 HB VAL B 34 12.502 -8.950 1.952 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.259 -7.219 1.956 1.00 0.00 H new ATOM 0 HG12 VAL B 34 14.945 -8.861 1.905 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.895 -7.870 0.427 1.00 0.00 H new ATOM 0 HG21 VAL B 34 12.078 -6.744 0.929 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.618 -7.378 -0.644 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.154 -8.036 0.125 1.00 0.00 H new ATOM 1257 N ILE B 35 11.289 -11.193 1.121 1.00 0.00 N ATOM 1258 CA ILE B 35 9.961 -11.772 1.197 1.00 0.00 C ATOM 1259 C ILE B 35 9.226 -11.199 2.402 1.00 0.00 C ATOM 1260 O ILE B 35 9.849 -10.686 3.325 1.00 0.00 O ATOM 1261 CB ILE B 35 10.002 -13.314 1.313 1.00 0.00 C ATOM 1262 CG1 ILE B 35 10.938 -13.744 2.448 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.427 -13.942 -0.005 1.00 0.00 C ATOM 1264 CD1 ILE B 35 10.980 -15.241 2.672 1.00 0.00 C ATOM 0 H ILE B 35 11.829 -11.280 1.982 1.00 0.00 H new ATOM 0 HA ILE B 35 9.440 -11.520 0.273 1.00 0.00 H new ATOM 0 HB ILE B 35 8.998 -13.667 1.547 1.00 0.00 H new ATOM 0 HG12 ILE B 35 11.946 -13.390 2.229 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.623 -13.257 3.371 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.449 -15.027 0.099 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.717 -13.667 -0.785 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.420 -13.583 -0.275 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.663 -15.467 3.490 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.982 -15.599 2.923 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.325 -15.735 1.764 1.00 0.00 H new ATOM 1276 N LEU B 36 7.910 -11.291 2.387 1.00 0.00 N ATOM 1277 CA LEU B 36 7.096 -10.667 3.421 1.00 0.00 C ATOM 1278 C LEU B 36 6.893 -11.572 4.626 1.00 0.00 C ATOM 1279 O LEU B 36 7.141 -12.777 4.575 1.00 0.00 O ATOM 1280 CB LEU B 36 5.723 -10.275 2.864 1.00 0.00 C ATOM 1281 CG LEU B 36 5.747 -9.281 1.705 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.952 -9.992 0.375 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.469 -8.474 1.689 1.00 0.00 C ATOM 0 H LEU B 36 7.379 -11.790 1.673 1.00 0.00 H new ATOM 0 HA LEU B 36 7.640 -9.780 3.746 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.212 -11.179 2.534 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.129 -9.850 3.673 1.00 0.00 H new ATOM 0 HG LEU B 36 6.589 -8.604 1.850 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.965 -9.259 -0.431 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.900 -10.529 0.392 1.00 0.00 H new ATOM 0 HD13 LEU B 36 5.138 -10.698 0.211 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.495 -7.768 0.859 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.617 -9.144 1.569 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.372 -7.928 2.627 1.00 0.00 H new ATOM 1295 N THR B 37 6.427 -10.962 5.705 1.00 0.00 N ATOM 1296 CA THR B 37 6.036 -11.677 6.906 1.00 0.00 C ATOM 1297 C THR B 37 4.516 -11.698 6.972 1.00 0.00 C ATOM 1298 O THR B 37 3.877 -11.065 6.144 1.00 0.00 O ATOM 1299 CB THR B 37 6.586 -10.984 8.172 1.00 0.00 C ATOM 1300 OG1 THR B 37 6.088 -9.638 8.253 1.00 0.00 O ATOM 1301 CG2 THR B 37 8.106 -10.951 8.165 1.00 0.00 C ATOM 0 H THR B 37 6.309 -9.951 5.770 1.00 0.00 H new ATOM 0 HA THR B 37 6.443 -12.687 6.867 1.00 0.00 H new ATOM 0 HB THR B 37 6.251 -11.557 9.036 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.307 -9.261 9.131 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.463 -10.457 9.069 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.492 -11.970 8.131 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.454 -10.402 7.290 1.00 0.00 H new ATOM 1309 N ALA B 38 3.935 -12.408 7.929 1.00 0.00 N ATOM 1310 CA ALA B 38 2.477 -12.465 8.046 1.00 0.00 C ATOM 1311 C ALA B 38 1.884 -11.062 8.152 1.00 0.00 C ATOM 1312 O ALA B 38 0.905 -10.740 7.480 1.00 0.00 O ATOM 1313 CB ALA B 38 2.074 -13.318 9.237 1.00 0.00 C ATOM 0 H ALA B 38 4.441 -12.949 8.631 1.00 0.00 H new ATOM 0 HA ALA B 38 2.077 -12.928 7.144 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.987 -13.350 9.310 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.459 -14.329 9.107 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.486 -12.887 10.149 1.00 0.00 H new ATOM 1319 N GLN B 39 2.489 -10.240 9.003 1.00 0.00 N ATOM 1320 CA GLN B 39 2.154 -8.821 9.106 1.00 0.00 C ATOM 1321 C GLN B 39 2.157 -8.160 7.720 1.00 0.00 C ATOM 1322 O GLN B 39 1.182 -7.523 7.315 1.00 0.00 O ATOM 1323 CB GLN B 39 3.188 -8.146 10.015 1.00 0.00 C ATOM 1324 CG GLN B 39 2.855 -6.722 10.428 1.00 0.00 C ATOM 1325 CD GLN B 39 1.626 -6.637 11.309 1.00 0.00 C ATOM 1326 OE1 GLN B 39 1.265 -7.596 11.994 1.00 0.00 O ATOM 1327 NE2 GLN B 39 0.999 -5.473 11.329 1.00 0.00 N ATOM 0 H GLN B 39 3.226 -10.537 9.642 1.00 0.00 H new ATOM 0 HA GLN B 39 1.154 -8.710 9.526 1.00 0.00 H new ATOM 0 HB2 GLN B 39 3.306 -8.750 10.915 1.00 0.00 H new ATOM 0 HB3 GLN B 39 4.151 -8.143 9.504 1.00 0.00 H new ATOM 0 HG2 GLN B 39 3.706 -6.294 10.958 1.00 0.00 H new ATOM 0 HG3 GLN B 39 2.698 -6.117 9.535 1.00 0.00 H new ATOM 0 HE21 GLN B 39 1.331 -4.705 10.746 1.00 0.00 H new ATOM 0 HE22 GLN B 39 0.183 -5.343 11.927 1.00 0.00 H new ATOM 1336 N GLY B 40 3.268 -8.328 7.008 1.00 0.00 N ATOM 1337 CA GLY B 40 3.402 -7.792 5.668 1.00 0.00 C ATOM 1338 C GLY B 40 2.442 -8.421 4.671 1.00 0.00 C ATOM 1339 O GLY B 40 2.022 -7.771 3.718 1.00 0.00 O ATOM 0 H GLY B 40 4.088 -8.834 7.343 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.232 -6.716 5.696 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.425 -7.945 5.323 1.00 0.00 H new ATOM 1343 N TYR B 41 2.086 -9.680 4.890 1.00 0.00 N ATOM 1344 CA TYR B 41 1.182 -10.386 3.990 1.00 0.00 C ATOM 1345 C TYR B 41 -0.239 -9.852 4.093 1.00 0.00 C ATOM 1346 O TYR B 41 -0.962 -9.812 3.093 1.00 0.00 O ATOM 1347 CB TYR B 41 1.198 -11.886 4.298 1.00 0.00 C ATOM 1348 CG TYR B 41 2.134 -12.701 3.432 1.00 0.00 C ATOM 1349 CD1 TYR B 41 3.457 -12.910 3.795 1.00 0.00 C ATOM 1350 CD2 TYR B 41 1.682 -13.280 2.254 1.00 0.00 C ATOM 1351 CE1 TYR B 41 4.303 -13.670 3.009 1.00 0.00 C ATOM 1352 CE2 TYR B 41 2.521 -14.037 1.461 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.829 -14.230 1.843 1.00 0.00 C ATOM 1354 OH TYR B 41 4.666 -14.995 1.060 1.00 0.00 O ATOM 0 H TYR B 41 2.409 -10.234 5.683 1.00 0.00 H new ATOM 0 HA TYR B 41 1.531 -10.220 2.971 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.478 -12.025 5.342 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.187 -12.277 4.184 1.00 0.00 H new ATOM 0 HD1 TYR B 41 3.832 -12.471 4.708 1.00 0.00 H new ATOM 0 HD2 TYR B 41 0.655 -13.136 1.952 1.00 0.00 H new ATOM 0 HE1 TYR B 41 5.330 -13.824 3.307 1.00 0.00 H new ATOM 0 HE2 TYR B 41 2.153 -14.476 0.545 1.00 0.00 H new ATOM 0 HH TYR B 41 4.176 -15.316 0.274 1.00 0.00 H new ATOM 1364 N THR B 42 -0.629 -9.409 5.278 1.00 0.00 N ATOM 1365 CA THR B 42 -1.916 -8.753 5.444 1.00 0.00 C ATOM 1366 C THR B 42 -1.903 -7.391 4.750 1.00 0.00 C ATOM 1367 O THR B 42 -2.914 -6.935 4.208 1.00 0.00 O ATOM 1368 CB THR B 42 -2.254 -8.553 6.933 1.00 0.00 C ATOM 1369 OG1 THR B 42 -2.191 -9.803 7.627 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.637 -7.945 7.098 1.00 0.00 C ATOM 0 H THR B 42 -0.078 -9.491 6.132 1.00 0.00 H new ATOM 0 HA THR B 42 -2.675 -9.394 4.995 1.00 0.00 H new ATOM 0 HB THR B 42 -1.520 -7.868 7.357 1.00 0.00 H new ATOM 0 HG1 THR B 42 -2.520 -9.686 8.543 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.853 -7.814 8.158 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.671 -6.977 6.598 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.381 -8.608 6.656 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.731 -6.776 4.717 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.583 -5.449 4.141 1.00 0.00 C ATOM 1380 C LEU B 43 -0.334 -5.545 2.639 1.00 0.00 C ATOM 1381 O LEU B 43 -0.460 -4.551 1.932 1.00 0.00 O ATOM 1382 CB LEU B 43 0.562 -4.673 4.827 1.00 0.00 C ATOM 1383 CG LEU B 43 0.144 -3.631 5.891 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.820 -4.233 6.901 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.375 -3.097 6.606 1.00 0.00 C ATOM 0 H LEU B 43 0.133 -7.176 5.083 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.511 -4.902 4.308 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.229 -5.394 5.299 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.139 -4.162 4.056 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.364 -2.812 5.382 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -1.096 -3.477 7.636 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.715 -4.582 6.386 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.341 -5.072 7.406 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.072 -2.364 7.354 1.00 0.00 H new ATOM 0 HD22 LEU B 43 1.897 -3.919 7.095 1.00 0.00 H new ATOM 0 HD23 LEU B 43 2.039 -2.624 5.883 1.00 0.00 H new ATOM 1397 N LEU B 44 -0.013 -6.737 2.129 1.00 0.00 N ATOM 1398 CA LEU B 44 0.210 -6.884 0.697 1.00 0.00 C ATOM 1399 C LEU B 44 -1.117 -7.109 -0.018 1.00 0.00 C ATOM 1400 O LEU B 44 -1.382 -6.489 -1.036 1.00 0.00 O ATOM 1401 CB LEU B 44 1.239 -8.001 0.373 1.00 0.00 C ATOM 1402 CG LEU B 44 0.716 -9.441 0.181 1.00 0.00 C ATOM 1403 CD1 LEU B 44 0.102 -9.630 -1.203 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.839 -10.448 0.356 1.00 0.00 C ATOM 0 H LEU B 44 0.095 -7.592 2.674 1.00 0.00 H new ATOM 0 HA LEU B 44 0.647 -5.956 0.327 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.766 -7.714 -0.537 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.975 -8.019 1.176 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.051 -9.606 0.938 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.256 -10.654 -1.305 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.732 -8.940 -1.328 1.00 0.00 H new ATOM 0 HD13 LEU B 44 0.855 -9.431 -1.965 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.449 -11.456 0.217 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.618 -10.255 -0.381 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.257 -10.356 1.358 1.00 0.00 H new ATOM 1416 N ASP B 45 -1.976 -7.955 0.544 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.244 -8.288 -0.103 1.00 0.00 C ATOM 1418 C ASP B 45 -4.185 -7.100 -0.059 1.00 0.00 C ATOM 1419 O ASP B 45 -5.071 -6.955 -0.900 1.00 0.00 O ATOM 1420 CB ASP B 45 -3.892 -9.496 0.576 1.00 0.00 C ATOM 1421 CG ASP B 45 -5.216 -9.886 -0.060 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -5.198 -10.351 -1.218 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.271 -9.753 0.599 1.00 0.00 O ATOM 0 H ASP B 45 -1.820 -8.420 1.439 1.00 0.00 H new ATOM 0 HA ASP B 45 -3.043 -8.540 -1.144 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -3.208 -10.343 0.530 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -4.052 -9.272 1.631 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.943 -6.221 0.893 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.694 -4.989 1.005 1.00 0.00 C ATOM 1430 C PHE B 46 -4.271 -4.015 -0.075 1.00 0.00 C ATOM 1431 O PHE B 46 -5.107 -3.391 -0.726 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.392 -4.380 2.375 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.210 -3.179 2.743 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.414 -3.326 3.412 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -4.764 -1.902 2.443 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.158 -2.223 3.773 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -5.506 -0.796 2.797 1.00 0.00 C ATOM 1438 CZ PHE B 46 -6.702 -0.955 3.465 1.00 0.00 C ATOM 0 H PHE B 46 -3.224 -6.340 1.607 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.759 -5.192 0.892 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -4.542 -5.147 3.135 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.338 -4.103 2.406 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -6.774 -4.315 3.653 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -3.825 -1.772 1.926 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.095 -2.349 4.295 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -5.151 0.194 2.552 1.00 0.00 H new ATOM 0 HZ PHE B 46 -7.282 -0.089 3.747 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.978 -3.910 -0.300 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.493 -2.954 -1.265 1.00 0.00 C ATOM 1450 C ILE B 47 -2.655 -3.487 -2.689 1.00 0.00 C ATOM 1451 O ILE B 47 -2.833 -2.721 -3.632 1.00 0.00 O ATOM 1452 CB ILE B 47 -1.031 -2.556 -0.984 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.116 -3.780 -1.060 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.946 -1.906 0.388 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.324 -3.501 -0.687 1.00 0.00 C ATOM 0 H ILE B 47 -2.258 -4.464 0.164 1.00 0.00 H new ATOM 0 HA ILE B 47 -3.099 -2.053 -1.169 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.699 -1.845 -1.740 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.507 -4.554 -0.400 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.146 -4.180 -2.073 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.086 -1.622 0.593 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.578 -1.018 0.410 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.286 -2.611 1.146 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.905 -4.420 -0.767 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.736 -2.751 -1.362 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.369 -3.131 0.337 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.627 -4.804 -2.825 1.00 0.00 N ATOM 1468 CA GLN B 48 -3.008 -5.457 -4.059 1.00 0.00 C ATOM 1469 C GLN B 48 -4.415 -5.023 -4.451 1.00 0.00 C ATOM 1470 O GLN B 48 -4.613 -4.396 -5.471 1.00 0.00 O ATOM 1471 CB GLN B 48 -2.950 -6.979 -3.877 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.536 -7.522 -3.735 1.00 0.00 C ATOM 1473 CD GLN B 48 -0.718 -7.424 -5.011 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -0.976 -6.584 -5.870 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.297 -8.264 -5.127 1.00 0.00 N ATOM 0 H GLN B 48 -2.340 -5.444 -2.084 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.317 -5.172 -4.852 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.526 -7.253 -2.993 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.430 -7.457 -4.731 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -1.024 -6.977 -2.942 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.586 -8.565 -3.424 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.480 -8.948 -4.392 1.00 0.00 H new ATOM 0 HE22 GLN B 48 0.897 -8.228 -5.951 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.341 -5.227 -3.539 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.778 -5.167 -3.817 1.00 0.00 C ATOM 1486 C LYS B 49 -7.309 -3.731 -3.929 1.00 0.00 C ATOM 1487 O LYS B 49 -8.484 -3.524 -4.223 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.465 -5.896 -2.668 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.872 -6.395 -2.948 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.479 -7.009 -1.693 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.591 -8.108 -1.115 1.00 0.00 C ATOM 1492 NZ LYS B 49 -8.977 -8.461 0.276 1.00 0.00 N ATOM 0 H LYS B 49 -5.124 -5.443 -2.566 1.00 0.00 H new ATOM 0 HA LYS B 49 -6.983 -5.629 -4.783 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.848 -6.748 -2.383 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -7.502 -5.227 -1.808 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.495 -5.570 -3.294 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -8.849 -7.135 -3.748 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.630 -6.232 -0.944 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -10.461 -7.420 -1.928 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -8.655 -8.995 -1.745 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -7.552 -7.780 -1.131 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -8.308 -9.161 0.655 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -8.957 -7.607 0.869 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -9.937 -8.862 0.279 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.480 -2.724 -3.661 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.935 -1.361 -3.949 1.00 0.00 C ATOM 1508 C HIS B 50 -6.099 -0.655 -5.019 1.00 0.00 C ATOM 1509 O HIS B 50 -6.409 0.475 -5.389 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.936 -0.532 -2.659 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.611 -1.230 -1.518 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -6.982 -1.493 -0.328 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -8.845 -1.775 -1.413 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -7.793 -2.175 0.453 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -8.930 -2.362 -0.178 1.00 0.00 N ATOM 0 H HIS B 50 -5.543 -2.811 -3.268 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.946 -1.446 -4.349 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.908 -0.302 -2.380 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.437 0.418 -2.844 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -9.620 -1.752 -2.164 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -7.562 -2.523 1.449 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -9.740 -2.861 0.190 1.00 0.00 H new ATOM 1524 N LEU B 51 -5.062 -1.308 -5.527 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.303 -0.752 -6.652 1.00 0.00 C ATOM 1526 C LEU B 51 -4.396 -1.671 -7.861 1.00 0.00 C ATOM 1527 O LEU B 51 -4.741 -1.255 -8.966 1.00 0.00 O ATOM 1528 CB LEU B 51 -2.815 -0.564 -6.313 1.00 0.00 C ATOM 1529 CG LEU B 51 -2.453 0.582 -5.352 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -3.010 1.911 -5.840 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -2.933 0.288 -3.948 1.00 0.00 C ATOM 0 H LEU B 51 -4.727 -2.210 -5.188 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.743 0.221 -6.870 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.446 -1.495 -5.883 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.273 -0.407 -7.246 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.366 0.660 -5.332 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.737 2.700 -5.139 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.597 2.140 -6.822 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.096 1.847 -5.909 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.663 1.115 -3.291 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -4.016 0.166 -3.952 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -2.466 -0.629 -3.588 1.00 0.00 H new ATOM 1543 N ASN B 52 -4.102 -2.932 -7.621 1.00 0.00 N ATOM 1544 CA ASN B 52 -3.885 -3.902 -8.677 1.00 0.00 C ATOM 1545 C ASN B 52 -4.984 -4.961 -8.732 1.00 0.00 C ATOM 1546 O ASN B 52 -5.264 -5.518 -9.793 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.524 -4.561 -8.455 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.462 -4.016 -9.395 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -0.287 -3.924 -9.042 1.00 0.00 O ATOM 1550 ND2 ASN B 52 -1.861 -3.670 -10.612 1.00 0.00 N ATOM 0 H ASN B 52 -4.006 -3.317 -6.681 1.00 0.00 H new ATOM 0 HA ASN B 52 -3.909 -3.381 -9.634 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -2.210 -4.403 -7.423 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.616 -5.638 -8.598 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -1.185 -3.315 -11.288 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -2.843 -3.759 -10.871 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.593 -5.243 -7.601 1.00 0.00 N ATOM 1558 CA LYS B 53 -6.649 -6.229 -7.521 1.00 0.00 C ATOM 1559 C LYS B 53 -7.987 -5.563 -7.226 1.00 0.00 C ATOM 1560 O LYS B 53 -8.640 -5.954 -6.238 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.315 -7.244 -6.431 1.00 0.00 C ATOM 1562 CG LYS B 53 -5.627 -8.492 -6.941 1.00 0.00 C ATOM 1563 CD LYS B 53 -5.890 -9.668 -6.021 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.289 -9.475 -4.642 1.00 0.00 C ATOM 1565 NZ LYS B 53 -5.631 -10.614 -3.751 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.364 -4.635 -7.969 1.00 0.00 O ATOM 0 H LYS B 53 -5.371 -4.796 -6.712 1.00 0.00 H new ATOM 0 HA LYS B 53 -6.728 -6.740 -8.481 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -5.676 -6.767 -5.688 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.235 -7.531 -5.922 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -5.982 -8.724 -7.945 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -4.554 -8.316 -7.016 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -6.966 -9.818 -5.927 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -5.480 -10.573 -6.468 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -4.206 -9.383 -4.722 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.656 -8.545 -4.208 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -5.140 -10.502 -2.841 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -6.658 -10.633 -3.590 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -5.334 -11.505 -4.197 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.629 4.892 13.784 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.603 5.249 14.754 1.00 0.00 C ATOM 1603 C VAL C 2 -5.365 5.749 14.006 1.00 0.00 C ATOM 1604 O VAL C 2 -4.288 5.943 14.573 1.00 0.00 O ATOM 1605 CB VAL C 2 -6.245 4.048 15.662 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -5.459 2.996 14.898 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -5.486 4.500 16.903 1.00 0.00 C ATOM 0 HA VAL C 2 -6.985 6.039 15.400 1.00 0.00 H new ATOM 0 HB VAL C 2 -7.180 3.594 15.990 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -5.222 2.165 15.562 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -6.055 2.633 14.061 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.535 3.434 14.522 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -5.249 3.633 17.520 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -4.563 4.996 16.604 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -6.103 5.194 17.474 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.552 5.960 12.713 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.505 6.473 11.851 1.00 0.00 C ATOM 1619 C ILE C 3 -5.095 7.470 10.863 1.00 0.00 C ATOM 1620 O ILE C 3 -6.152 7.225 10.280 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.779 5.338 11.082 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.567 5.894 10.328 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.731 4.633 10.119 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.765 4.837 9.602 1.00 0.00 C ATOM 0 H ILE C 3 -6.434 5.780 12.234 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.768 6.968 12.483 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.431 4.604 11.809 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.908 6.637 9.607 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.916 6.410 11.034 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.197 3.842 9.593 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.560 4.200 10.679 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -5.117 5.353 9.397 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -0.923 5.305 9.092 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.393 4.106 10.320 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.400 4.337 8.871 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.441 8.603 10.703 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.887 9.599 9.749 1.00 0.00 C ATOM 1638 C ALA C 4 -3.761 9.939 8.786 1.00 0.00 C ATOM 1639 O ALA C 4 -2.580 9.854 9.132 1.00 0.00 O ATOM 1640 CB ALA C 4 -5.371 10.844 10.473 1.00 0.00 C ATOM 0 H ALA C 4 -3.600 8.857 11.221 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.721 9.192 9.177 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.703 11.583 9.744 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -6.201 10.584 11.129 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.556 11.260 11.066 1.00 0.00 H new ATOM 1646 N THR C 5 -4.146 10.324 7.575 1.00 0.00 N ATOM 1647 CA THR C 5 -3.207 10.575 6.490 1.00 0.00 C ATOM 1648 C THR C 5 -2.247 11.716 6.831 1.00 0.00 C ATOM 1649 O THR C 5 -1.158 11.804 6.274 1.00 0.00 O ATOM 1650 CB THR C 5 -3.967 10.922 5.193 1.00 0.00 C ATOM 1651 OG1 THR C 5 -5.111 10.064 5.057 1.00 0.00 O ATOM 1652 CG2 THR C 5 -3.071 10.760 3.973 1.00 0.00 C ATOM 0 H THR C 5 -5.122 10.471 7.318 1.00 0.00 H new ATOM 0 HA THR C 5 -2.626 9.664 6.345 1.00 0.00 H new ATOM 0 HB THR C 5 -4.286 11.962 5.255 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.592 10.288 4.233 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.633 11.011 3.073 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.212 11.425 4.062 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.726 9.728 3.909 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.633 12.549 7.789 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.864 13.741 8.126 1.00 0.00 C ATOM 1662 C ASP C 6 -0.707 13.409 9.057 1.00 0.00 C ATOM 1663 O ASP C 6 0.096 14.281 9.399 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.758 14.793 8.788 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.813 15.348 7.856 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.921 14.777 7.800 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -3.544 16.372 7.191 1.00 0.00 O ATOM 0 H ASP C 6 -3.476 12.421 8.348 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.462 14.140 7.195 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -3.246 14.352 9.657 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -2.137 15.611 9.152 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.620 12.154 9.481 1.00 0.00 N ATOM 1673 CA ASP C 7 0.465 11.735 10.359 1.00 0.00 C ATOM 1674 C ASP C 7 1.522 10.955 9.586 1.00 0.00 C ATOM 1675 O ASP C 7 2.640 10.760 10.064 1.00 0.00 O ATOM 1676 CB ASP C 7 -0.080 10.864 11.500 1.00 0.00 C ATOM 1677 CG ASP C 7 -1.149 11.559 12.323 1.00 0.00 C ATOM 1678 OD1 ASP C 7 -0.799 12.305 13.261 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -2.348 11.349 12.052 1.00 0.00 O ATOM 0 H ASP C 7 -1.280 11.416 9.235 1.00 0.00 H new ATOM 0 HA ASP C 7 0.925 12.632 10.774 1.00 0.00 H new ATOM 0 HB2 ASP C 7 -0.492 9.945 11.082 1.00 0.00 H new ATOM 0 HB3 ASP C 7 0.743 10.576 12.154 1.00 0.00 H new ATOM 1684 N LEU C 8 1.174 10.511 8.385 1.00 0.00 N ATOM 1685 CA LEU C 8 2.121 9.786 7.544 1.00 0.00 C ATOM 1686 C LEU C 8 2.439 10.586 6.293 1.00 0.00 C ATOM 1687 O LEU C 8 3.383 10.281 5.561 1.00 0.00 O ATOM 1688 CB LEU C 8 1.591 8.400 7.173 1.00 0.00 C ATOM 1689 CG LEU C 8 1.645 7.363 8.298 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.556 7.611 9.330 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.533 5.960 7.730 1.00 0.00 C ATOM 0 H LEU C 8 0.250 10.638 7.972 1.00 0.00 H new ATOM 0 HA LEU C 8 3.039 9.649 8.116 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.558 8.500 6.841 1.00 0.00 H new ATOM 0 HB3 LEU C 8 2.163 8.024 6.325 1.00 0.00 H new ATOM 0 HG LEU C 8 2.608 7.461 8.800 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.621 6.858 10.116 1.00 0.00 H new ATOM 0 HD12 LEU C 8 0.686 8.602 9.765 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.421 7.551 8.850 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.573 5.234 8.542 1.00 0.00 H new ATOM 0 HD22 LEU C 8 0.587 5.857 7.198 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.358 5.779 7.041 1.00 0.00 H new ATOM 1703 N GLU C 9 1.648 11.621 6.078 1.00 0.00 N ATOM 1704 CA GLU C 9 1.874 12.563 5.003 1.00 0.00 C ATOM 1705 C GLU C 9 1.683 13.970 5.538 1.00 0.00 C ATOM 1706 O GLU C 9 0.760 14.237 6.306 1.00 0.00 O ATOM 1707 CB GLU C 9 0.947 12.314 3.807 1.00 0.00 C ATOM 1708 CG GLU C 9 1.242 11.020 3.063 1.00 0.00 C ATOM 1709 CD GLU C 9 0.580 10.959 1.701 1.00 0.00 C ATOM 1710 OE1 GLU C 9 -0.664 10.918 1.637 1.00 0.00 O ATOM 1711 OE2 GLU C 9 1.313 10.936 0.685 1.00 0.00 O ATOM 0 H GLU C 9 0.828 11.831 6.648 1.00 0.00 H new ATOM 0 HA GLU C 9 2.893 12.432 4.640 1.00 0.00 H new ATOM 0 HB2 GLU C 9 -0.085 12.294 4.157 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.032 13.150 3.112 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.320 10.914 2.942 1.00 0.00 H new ATOM 0 HG3 GLU C 9 0.904 10.176 3.664 1.00 0.00 H new ATOM 1718 N VAL C 10 2.568 14.853 5.146 1.00 0.00 N ATOM 1719 CA VAL C 10 2.551 16.220 5.612 1.00 0.00 C ATOM 1720 C VAL C 10 2.675 17.144 4.412 1.00 0.00 C ATOM 1721 O VAL C 10 3.322 16.799 3.424 1.00 0.00 O ATOM 1722 CB VAL C 10 3.697 16.480 6.626 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.058 16.212 6.002 1.00 0.00 C ATOM 1724 CG2 VAL C 10 3.627 17.895 7.181 1.00 0.00 C ATOM 0 H VAL C 10 3.323 14.645 4.493 1.00 0.00 H new ATOM 0 HA VAL C 10 1.612 16.413 6.130 1.00 0.00 H new ATOM 0 HB VAL C 10 3.566 15.785 7.455 1.00 0.00 H new ATOM 0 HG11 VAL C 10 5.839 16.403 6.737 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.111 15.173 5.678 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.200 16.868 5.143 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.442 18.049 7.889 1.00 0.00 H new ATOM 0 HG22 VAL C 10 3.716 18.611 6.364 1.00 0.00 H new ATOM 0 HG23 VAL C 10 2.673 18.040 7.689 1.00 0.00 H new ATOM 1734 N ALA C 11 2.038 18.298 4.480 1.00 0.00 N ATOM 1735 CA ALA C 11 2.041 19.226 3.367 1.00 0.00 C ATOM 1736 C ALA C 11 3.450 19.738 3.094 1.00 0.00 C ATOM 1737 O ALA C 11 4.176 20.121 4.012 1.00 0.00 O ATOM 1738 CB ALA C 11 1.087 20.370 3.677 1.00 0.00 C ATOM 0 H ALA C 11 1.512 18.614 5.295 1.00 0.00 H new ATOM 0 HA ALA C 11 1.704 18.716 2.464 1.00 0.00 H new ATOM 0 HB1 ALA C 11 1.082 21.075 2.845 1.00 0.00 H new ATOM 0 HB2 ALA C 11 0.082 19.975 3.825 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.413 20.881 4.583 1.00 0.00 H new ATOM 1744 N CYS C 12 3.822 19.727 1.813 1.00 0.00 N ATOM 1745 CA CYS C 12 5.182 19.982 1.351 1.00 0.00 C ATOM 1746 C CYS C 12 5.615 21.431 1.623 1.00 0.00 C ATOM 1747 O CYS C 12 4.766 22.276 1.880 1.00 0.00 O ATOM 1748 CB CYS C 12 5.165 19.704 -0.161 1.00 0.00 C ATOM 1749 SG CYS C 12 6.760 19.471 -0.964 1.00 0.00 S ATOM 0 H CYS C 12 3.169 19.536 1.053 1.00 0.00 H new ATOM 0 HA CYS C 12 5.895 19.349 1.879 1.00 0.00 H new ATOM 0 HB2 CYS C 12 4.564 18.812 -0.335 1.00 0.00 H new ATOM 0 HB3 CYS C 12 4.655 20.533 -0.653 1.00 0.00 H new ATOM 0 HG CYS C 12 6.594 18.820 -2.077 1.00 0.00 H new ATOM 1754 N PRO C 13 6.933 21.733 1.585 1.00 0.00 N ATOM 1755 CA PRO C 13 7.466 23.094 1.746 1.00 0.00 C ATOM 1756 C PRO C 13 6.592 24.203 1.149 1.00 0.00 C ATOM 1757 O PRO C 13 6.372 25.238 1.784 1.00 0.00 O ATOM 1758 CB PRO C 13 8.779 23.004 0.980 1.00 0.00 C ATOM 1759 CG PRO C 13 9.272 21.621 1.237 1.00 0.00 C ATOM 1760 CD PRO C 13 8.040 20.762 1.438 1.00 0.00 C ATOM 0 HA PRO C 13 7.540 23.368 2.798 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.629 23.180 -0.085 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.493 23.750 1.329 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.867 21.258 0.399 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.913 21.594 2.118 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.876 20.098 0.589 1.00 0.00 H new ATOM 0 HD3 PRO C 13 8.135 20.132 2.322 1.00 0.00 H new ATOM 1768 N LYS C 14 6.067 23.979 -0.060 1.00 0.00 N ATOM 1769 CA LYS C 14 5.392 25.062 -0.770 1.00 0.00 C ATOM 1770 C LYS C 14 4.454 24.621 -1.898 1.00 0.00 C ATOM 1771 O LYS C 14 3.827 25.473 -2.516 1.00 0.00 O ATOM 1772 CB LYS C 14 6.413 26.054 -1.335 1.00 0.00 C ATOM 1773 CG LYS C 14 7.394 25.431 -2.314 1.00 0.00 C ATOM 1774 CD LYS C 14 8.232 26.484 -3.038 1.00 0.00 C ATOM 1775 CE LYS C 14 7.486 27.096 -4.221 1.00 0.00 C ATOM 1776 NZ LYS C 14 6.444 28.074 -3.814 1.00 0.00 N ATOM 0 H LYS C 14 6.095 23.086 -0.552 1.00 0.00 H new ATOM 0 HA LYS C 14 4.761 25.528 -0.014 1.00 0.00 H new ATOM 0 HB2 LYS C 14 5.881 26.864 -1.834 1.00 0.00 H new ATOM 0 HB3 LYS C 14 6.970 26.498 -0.510 1.00 0.00 H new ATOM 0 HG2 LYS C 14 8.054 24.748 -1.780 1.00 0.00 H new ATOM 0 HG3 LYS C 14 6.847 24.838 -3.046 1.00 0.00 H new ATOM 0 HD2 LYS C 14 8.508 27.272 -2.337 1.00 0.00 H new ATOM 0 HD3 LYS C 14 9.159 26.031 -3.389 1.00 0.00 H new ATOM 0 HE2 LYS C 14 8.202 27.590 -4.877 1.00 0.00 H new ATOM 0 HE3 LYS C 14 7.020 26.299 -4.800 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 6.359 28.813 -4.541 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 5.532 27.586 -3.709 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 6.711 28.509 -2.908 1.00 0.00 H new ATOM 1790 N CYS C 15 4.360 23.334 -2.228 1.00 0.00 N ATOM 1791 CA CYS C 15 3.414 22.966 -3.282 1.00 0.00 C ATOM 1792 C CYS C 15 2.305 22.028 -2.825 1.00 0.00 C ATOM 1793 O CYS C 15 1.919 21.122 -3.569 1.00 0.00 O ATOM 1794 CB CYS C 15 4.163 22.273 -4.405 1.00 0.00 C ATOM 1795 SG CYS C 15 5.173 20.872 -3.859 1.00 0.00 S ATOM 0 H CYS C 15 4.891 22.569 -1.811 1.00 0.00 H new ATOM 0 HA CYS C 15 2.947 23.898 -3.600 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.444 21.923 -5.146 1.00 0.00 H new ATOM 0 HB3 CYS C 15 4.806 22.999 -4.902 1.00 0.00 H new ATOM 0 HG CYS C 15 4.529 19.763 -4.072 1.00 0.00 H new ATOM 1800 N GLU C 16 1.736 22.289 -1.670 1.00 0.00 N ATOM 1801 CA GLU C 16 0.748 21.398 -1.085 1.00 0.00 C ATOM 1802 C GLU C 16 -0.649 21.748 -1.553 1.00 0.00 C ATOM 1803 O GLU C 16 -1.635 21.363 -0.928 1.00 0.00 O ATOM 1804 CB GLU C 16 0.785 21.528 0.442 1.00 0.00 C ATOM 1805 CG GLU C 16 1.955 22.337 0.982 1.00 0.00 C ATOM 1806 CD GLU C 16 1.717 23.835 0.892 1.00 0.00 C ATOM 1807 OE1 GLU C 16 2.069 24.432 -0.143 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.158 24.413 1.847 1.00 0.00 O ATOM 0 H GLU C 16 1.940 23.117 -1.110 1.00 0.00 H new ATOM 0 HA GLU C 16 0.987 20.381 -1.396 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.144 21.990 0.777 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.819 20.529 0.878 1.00 0.00 H new ATOM 0 HG2 GLU C 16 2.133 22.062 2.022 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.857 22.082 0.426 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.742 22.460 -2.664 1.00 0.00 N ATOM 1816 CA ARG C 17 -2.014 22.957 -3.141 1.00 0.00 C ATOM 1817 C ARG C 17 -1.949 23.000 -4.670 1.00 0.00 C ATOM 1818 O ARG C 17 -2.967 23.110 -5.349 1.00 0.00 O ATOM 1819 CB ARG C 17 -2.370 24.343 -2.568 1.00 0.00 C ATOM 1820 CG ARG C 17 -1.274 25.009 -1.746 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.190 25.625 -2.615 1.00 0.00 C ATOM 1822 NE ARG C 17 0.905 26.157 -1.806 1.00 0.00 N ATOM 1823 CZ ARG C 17 1.437 27.371 -1.954 1.00 0.00 C ATOM 1824 NH1 ARG C 17 1.011 28.183 -2.915 1.00 0.00 N ATOM 1825 NH2 ARG C 17 2.412 27.764 -1.141 1.00 0.00 N ATOM 0 H ARG C 17 0.054 22.706 -3.252 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.805 22.289 -2.801 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.633 25.003 -3.395 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -3.259 24.243 -1.945 1.00 0.00 H new ATOM 0 HG2 ARG C 17 -1.715 25.783 -1.117 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -0.826 24.273 -1.079 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.196 24.874 -3.304 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -0.618 26.424 -3.221 1.00 0.00 H new ATOM 0 HE ARG C 17 1.290 25.557 -1.076 1.00 0.00 H new ATOM 0 HH11 ARG C 17 0.271 27.880 -3.548 1.00 0.00 H new ATOM 0 HH12 ARG C 17 1.424 29.110 -3.020 1.00 0.00 H new ATOM 0 HH21 ARG C 17 2.749 27.138 -0.409 1.00 0.00 H new ATOM 0 HH22 ARG C 17 2.823 28.691 -1.249 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.717 22.892 -5.206 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.477 23.159 -6.624 1.00 0.00 C ATOM 1841 C ALA C 18 -0.221 21.897 -7.446 1.00 0.00 C ATOM 1842 O ALA C 18 -0.888 21.662 -8.454 1.00 0.00 O ATOM 1843 CB ALA C 18 0.688 24.126 -6.780 1.00 0.00 C ATOM 0 H ALA C 18 0.114 22.624 -4.679 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.392 23.603 -7.015 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.861 24.320 -7.839 1.00 0.00 H new ATOM 0 HB2 ALA C 18 0.454 25.062 -6.273 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.585 23.689 -6.340 1.00 0.00 H new ATOM 1849 N GLY C 19 0.727 21.075 -7.008 1.00 0.00 N ATOM 1850 CA GLY C 19 1.136 19.934 -7.811 1.00 0.00 C ATOM 1851 C GLY C 19 2.415 20.197 -8.588 1.00 0.00 C ATOM 1852 O GLY C 19 2.781 19.438 -9.476 1.00 0.00 O ATOM 0 H GLY C 19 1.217 21.176 -6.119 1.00 0.00 H new ATOM 0 HA2 GLY C 19 1.280 19.070 -7.162 1.00 0.00 H new ATOM 0 HA3 GLY C 19 0.337 19.679 -8.508 1.00 0.00 H new ATOM 1856 N GLU C 20 3.095 21.269 -8.230 1.00 0.00 N ATOM 1857 CA GLU C 20 4.345 21.664 -8.873 1.00 0.00 C ATOM 1858 C GLU C 20 5.063 22.679 -8.021 1.00 0.00 C ATOM 1859 O GLU C 20 4.517 23.183 -7.043 1.00 0.00 O ATOM 1860 CB GLU C 20 4.112 22.306 -10.246 1.00 0.00 C ATOM 1861 CG GLU C 20 2.905 23.230 -10.273 1.00 0.00 C ATOM 1862 CD GLU C 20 2.803 24.035 -11.547 1.00 0.00 C ATOM 1863 OE1 GLU C 20 2.414 23.467 -12.584 1.00 0.00 O ATOM 1864 OE2 GLU C 20 3.104 25.251 -11.506 1.00 0.00 O ATOM 0 H GLU C 20 2.799 21.897 -7.482 1.00 0.00 H new ATOM 0 HA GLU C 20 4.933 20.755 -8.995 1.00 0.00 H new ATOM 0 HB2 GLU C 20 5.000 22.869 -10.533 1.00 0.00 H new ATOM 0 HB3 GLU C 20 3.978 21.521 -10.990 1.00 0.00 H new ATOM 0 HG2 GLU C 20 1.998 22.637 -10.151 1.00 0.00 H new ATOM 0 HG3 GLU C 20 2.957 23.911 -9.423 1.00 0.00 H new ATOM 1871 N ILE C 21 6.268 22.991 -8.430 1.00 0.00 N ATOM 1872 CA ILE C 21 7.022 24.080 -7.866 1.00 0.00 C ATOM 1873 C ILE C 21 7.761 24.735 -9.001 1.00 0.00 C ATOM 1874 O ILE C 21 8.461 24.060 -9.748 1.00 0.00 O ATOM 1875 CB ILE C 21 8.015 23.642 -6.761 1.00 0.00 C ATOM 1876 CG1 ILE C 21 7.238 23.159 -5.532 1.00 0.00 C ATOM 1877 CG2 ILE C 21 8.941 24.796 -6.396 1.00 0.00 C ATOM 1878 CD1 ILE C 21 8.094 22.769 -4.346 1.00 0.00 C ATOM 0 H ILE C 21 6.757 22.490 -9.172 1.00 0.00 H new ATOM 0 HA ILE C 21 6.331 24.765 -7.375 1.00 0.00 H new ATOM 0 HB ILE C 21 8.628 22.821 -7.133 1.00 0.00 H new ATOM 0 HG12 ILE C 21 6.552 23.947 -5.222 1.00 0.00 H new ATOM 0 HG13 ILE C 21 6.630 22.301 -5.819 1.00 0.00 H new ATOM 0 HG21 ILE C 21 9.634 24.475 -5.618 1.00 0.00 H new ATOM 0 HG22 ILE C 21 9.503 25.104 -7.278 1.00 0.00 H new ATOM 0 HG23 ILE C 21 8.350 25.636 -6.031 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.454 22.441 -3.527 1.00 0.00 H new ATOM 0 HD12 ILE C 21 8.762 21.957 -4.631 1.00 0.00 H new ATOM 0 HD13 ILE C 21 8.683 23.628 -4.024 1.00 0.00 H new ATOM 1890 N GLU C 22 7.574 26.033 -9.147 1.00 0.00 N ATOM 1891 CA GLU C 22 8.168 26.761 -10.257 1.00 0.00 C ATOM 1892 C GLU C 22 7.812 26.110 -11.595 1.00 0.00 C ATOM 1893 O GLU C 22 8.671 25.929 -12.455 1.00 0.00 O ATOM 1894 CB GLU C 22 9.676 26.766 -10.073 1.00 0.00 C ATOM 1895 CG GLU C 22 10.400 27.848 -10.867 1.00 0.00 C ATOM 1896 CD GLU C 22 11.853 27.966 -10.473 1.00 0.00 C ATOM 1897 OE1 GLU C 22 12.628 27.025 -10.752 1.00 0.00 O ATOM 1898 OE2 GLU C 22 12.224 28.998 -9.877 1.00 0.00 O ATOM 0 H GLU C 22 7.017 26.606 -8.513 1.00 0.00 H new ATOM 0 HA GLU C 22 7.780 27.780 -10.268 1.00 0.00 H new ATOM 0 HB2 GLU C 22 9.901 26.896 -9.014 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.069 25.792 -10.365 1.00 0.00 H new ATOM 0 HG2 GLU C 22 10.331 27.624 -11.931 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.903 28.806 -10.710 1.00 0.00 H new ATOM 1905 N GLY C 23 6.557 25.716 -11.755 1.00 0.00 N ATOM 1906 CA GLY C 23 6.135 25.098 -12.996 1.00 0.00 C ATOM 1907 C GLY C 23 6.833 23.784 -13.282 1.00 0.00 C ATOM 1908 O GLY C 23 6.753 23.268 -14.399 1.00 0.00 O ATOM 0 H GLY C 23 5.825 25.812 -11.051 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.059 24.929 -12.961 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.323 25.787 -13.819 1.00 0.00 H new ATOM 1912 N THR C 24 7.543 23.243 -12.301 1.00 0.00 N ATOM 1913 CA THR C 24 8.266 21.997 -12.513 1.00 0.00 C ATOM 1914 C THR C 24 7.931 20.965 -11.422 1.00 0.00 C ATOM 1915 O THR C 24 7.457 21.333 -10.342 1.00 0.00 O ATOM 1916 CB THR C 24 9.781 22.297 -12.557 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.462 21.368 -13.412 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.411 22.254 -11.172 1.00 0.00 C ATOM 0 H THR C 24 7.633 23.639 -11.366 1.00 0.00 H new ATOM 0 HA THR C 24 7.960 21.561 -13.464 1.00 0.00 H new ATOM 0 HB THR C 24 9.888 23.306 -12.954 1.00 0.00 H new ATOM 0 HG1 THR C 24 11.419 21.578 -13.426 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.476 22.471 -11.250 1.00 0.00 H new ATOM 0 HG22 THR C 24 9.935 22.998 -10.533 1.00 0.00 H new ATOM 0 HG23 THR C 24 10.273 21.263 -10.740 1.00 0.00 H new ATOM 1926 N PRO C 25 8.133 19.657 -11.707 1.00 0.00 N ATOM 1927 CA PRO C 25 7.914 18.582 -10.732 1.00 0.00 C ATOM 1928 C PRO C 25 8.734 18.784 -9.463 1.00 0.00 C ATOM 1929 O PRO C 25 9.930 19.078 -9.510 1.00 0.00 O ATOM 1930 CB PRO C 25 8.360 17.310 -11.469 1.00 0.00 C ATOM 1931 CG PRO C 25 9.189 17.802 -12.601 1.00 0.00 C ATOM 1932 CD PRO C 25 8.581 19.117 -12.997 1.00 0.00 C ATOM 0 HA PRO C 25 6.876 18.543 -10.401 1.00 0.00 H new ATOM 0 HB2 PRO C 25 8.933 16.653 -10.814 1.00 0.00 H new ATOM 0 HB3 PRO C 25 7.504 16.737 -11.825 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.230 17.924 -12.302 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.177 17.097 -13.432 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.306 19.771 -13.481 1.00 0.00 H new ATOM 0 HD3 PRO C 25 7.753 18.988 -13.694 1.00 0.00 H new ATOM 1940 N CYS C 26 8.072 18.611 -8.334 1.00 0.00 N ATOM 1941 CA CYS C 26 8.649 18.927 -7.039 1.00 0.00 C ATOM 1942 C CYS C 26 9.496 17.783 -6.471 1.00 0.00 C ATOM 1943 O CYS C 26 9.059 16.633 -6.452 1.00 0.00 O ATOM 1944 CB CYS C 26 7.522 19.283 -6.077 1.00 0.00 C ATOM 1945 SG CYS C 26 8.017 19.370 -4.323 1.00 0.00 S ATOM 0 H CYS C 26 7.120 18.248 -8.288 1.00 0.00 H new ATOM 0 HA CYS C 26 9.325 19.772 -7.167 1.00 0.00 H new ATOM 0 HB2 CYS C 26 7.102 20.245 -6.370 1.00 0.00 H new ATOM 0 HB3 CYS C 26 6.727 18.544 -6.180 1.00 0.00 H new ATOM 0 HG CYS C 26 7.086 19.965 -3.638 1.00 0.00 H new ATOM 1950 N PRO C 27 10.696 18.133 -5.954 1.00 0.00 N ATOM 1951 CA PRO C 27 11.711 17.212 -5.415 1.00 0.00 C ATOM 1952 C PRO C 27 11.187 15.899 -4.824 1.00 0.00 C ATOM 1953 O PRO C 27 11.531 14.815 -5.287 1.00 0.00 O ATOM 1954 CB PRO C 27 12.322 18.059 -4.300 1.00 0.00 C ATOM 1955 CG PRO C 27 12.253 19.472 -4.780 1.00 0.00 C ATOM 1956 CD PRO C 27 11.192 19.521 -5.868 1.00 0.00 C ATOM 0 HA PRO C 27 12.378 16.871 -6.207 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.771 17.935 -3.368 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.352 17.762 -4.103 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.997 20.145 -3.962 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.219 19.795 -5.169 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.391 20.215 -5.612 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.611 19.854 -6.818 1.00 0.00 H new ATOM 1964 N ALA C 28 10.335 16.011 -3.813 1.00 0.00 N ATOM 1965 CA ALA C 28 9.992 14.858 -2.988 1.00 0.00 C ATOM 1966 C ALA C 28 8.541 14.419 -3.159 1.00 0.00 C ATOM 1967 O ALA C 28 8.158 13.340 -2.717 1.00 0.00 O ATOM 1968 CB ALA C 28 10.281 15.164 -1.525 1.00 0.00 C ATOM 0 H ALA C 28 9.872 16.880 -3.545 1.00 0.00 H new ATOM 0 HA ALA C 28 10.613 14.027 -3.323 1.00 0.00 H new ATOM 0 HB1 ALA C 28 10.023 14.299 -0.914 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.340 15.391 -1.403 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.687 16.022 -1.209 1.00 0.00 H new ATOM 1974 N CYS C 29 7.721 15.249 -3.789 1.00 0.00 N ATOM 1975 CA CYS C 29 6.308 14.906 -3.907 1.00 0.00 C ATOM 1976 C CYS C 29 5.800 14.958 -5.340 1.00 0.00 C ATOM 1977 O CYS C 29 4.639 14.642 -5.575 1.00 0.00 O ATOM 1978 CB CYS C 29 5.461 15.843 -3.042 1.00 0.00 C ATOM 1979 SG CYS C 29 5.394 17.559 -3.647 1.00 0.00 S ATOM 0 H CYS C 29 7.995 16.135 -4.213 1.00 0.00 H new ATOM 0 HA CYS C 29 6.213 13.877 -3.561 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.446 15.449 -2.986 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.860 15.842 -2.028 1.00 0.00 H new ATOM 0 HG CYS C 29 6.603 18.012 -3.801 1.00 0.00 H new ATOM 1984 N SER C 30 6.663 15.347 -6.282 1.00 0.00 N ATOM 1985 CA SER C 30 6.305 15.420 -7.706 1.00 0.00 C ATOM 1986 C SER C 30 5.215 16.470 -7.987 1.00 0.00 C ATOM 1987 O SER C 30 5.488 17.504 -8.591 1.00 0.00 O ATOM 1988 CB SER C 30 5.872 14.039 -8.221 1.00 0.00 C ATOM 1989 OG SER C 30 5.474 14.091 -9.579 1.00 0.00 O ATOM 0 H SER C 30 7.626 15.620 -6.083 1.00 0.00 H new ATOM 0 HA SER C 30 7.197 15.739 -8.245 1.00 0.00 H new ATOM 0 HB2 SER C 30 6.695 13.334 -8.109 1.00 0.00 H new ATOM 0 HB3 SER C 30 5.048 13.665 -7.614 1.00 0.00 H new ATOM 0 HG SER C 30 5.206 13.196 -9.876 1.00 0.00 H new ATOM 1995 N GLY C 31 4.020 16.239 -7.457 1.00 0.00 N ATOM 1996 CA GLY C 31 2.854 16.998 -7.836 1.00 0.00 C ATOM 1997 C GLY C 31 1.611 16.487 -7.133 1.00 0.00 C ATOM 1998 O GLY C 31 0.506 16.565 -7.665 1.00 0.00 O ATOM 0 H GLY C 31 3.841 15.521 -6.755 1.00 0.00 H new ATOM 0 HA2 GLY C 31 3.006 18.049 -7.591 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.714 16.939 -8.915 1.00 0.00 H new ATOM 2002 N LYS C 32 1.798 15.975 -5.919 1.00 0.00 N ATOM 2003 CA LYS C 32 0.708 15.398 -5.137 1.00 0.00 C ATOM 2004 C LYS C 32 0.255 16.387 -4.071 1.00 0.00 C ATOM 2005 O LYS C 32 -0.897 16.389 -3.650 1.00 0.00 O ATOM 2006 CB LYS C 32 1.191 14.102 -4.496 1.00 0.00 C ATOM 2007 CG LYS C 32 1.750 13.149 -5.529 1.00 0.00 C ATOM 2008 CD LYS C 32 2.189 11.826 -4.940 1.00 0.00 C ATOM 2009 CE LYS C 32 3.429 11.957 -4.071 1.00 0.00 C ATOM 2010 NZ LYS C 32 4.044 10.629 -3.829 1.00 0.00 N ATOM 0 H LYS C 32 2.704 15.948 -5.452 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.141 15.183 -5.786 1.00 0.00 H new ATOM 0 HB2 LYS C 32 1.957 14.325 -3.753 1.00 0.00 H new ATOM 0 HB3 LYS C 32 0.365 13.625 -3.969 1.00 0.00 H new ATOM 0 HG2 LYS C 32 0.994 12.967 -6.293 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.599 13.618 -6.026 1.00 0.00 H new ATOM 0 HD2 LYS C 32 1.376 11.409 -4.346 1.00 0.00 H new ATOM 0 HD3 LYS C 32 2.388 11.121 -5.747 1.00 0.00 H new ATOM 0 HE2 LYS C 32 4.151 12.614 -4.556 1.00 0.00 H new ATOM 0 HE3 LYS C 32 3.165 12.420 -3.120 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 4.431 10.596 -2.864 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 3.323 9.887 -3.938 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 4.810 10.471 -4.515 1.00 0.00 H new ATOM 2024 N GLY C 33 1.190 17.223 -3.629 1.00 0.00 N ATOM 2025 CA GLY C 33 0.885 18.239 -2.659 1.00 0.00 C ATOM 2026 C GLY C 33 1.548 17.953 -1.332 1.00 0.00 C ATOM 2027 O GLY C 33 2.110 18.850 -0.707 1.00 0.00 O ATOM 0 H GLY C 33 2.163 17.207 -3.935 1.00 0.00 H new ATOM 0 HA2 GLY C 33 1.215 19.209 -3.030 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.195 18.301 -2.522 1.00 0.00 H new ATOM 2031 N VAL C 34 1.563 16.693 -0.936 1.00 0.00 N ATOM 2032 CA VAL C 34 2.106 16.323 0.363 1.00 0.00 C ATOM 2033 C VAL C 34 3.347 15.454 0.224 1.00 0.00 C ATOM 2034 O VAL C 34 3.636 14.929 -0.856 1.00 0.00 O ATOM 2035 CB VAL C 34 1.059 15.575 1.217 1.00 0.00 C ATOM 2036 CG1 VAL C 34 -0.109 16.487 1.562 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.567 14.329 0.496 1.00 0.00 C ATOM 0 H VAL C 34 1.209 15.912 -1.489 1.00 0.00 H new ATOM 0 HA VAL C 34 2.379 17.253 0.863 1.00 0.00 H new ATOM 0 HB VAL C 34 1.539 15.268 2.146 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.834 15.938 2.164 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.254 17.346 2.126 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.586 16.831 0.644 1.00 0.00 H new ATOM 0 HG21 VAL C 34 -0.170 13.817 1.115 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.110 14.614 -0.452 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.408 13.662 0.307 1.00 0.00 H new ATOM 2047 N ILE C 35 4.082 15.332 1.318 1.00 0.00 N ATOM 2048 CA ILE C 35 5.249 14.470 1.386 1.00 0.00 C ATOM 2049 C ILE C 35 5.122 13.535 2.583 1.00 0.00 C ATOM 2050 O ILE C 35 4.375 13.813 3.514 1.00 0.00 O ATOM 2051 CB ILE C 35 6.566 15.273 1.509 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.479 16.281 2.660 1.00 0.00 C ATOM 2053 CG2 ILE C 35 6.891 15.974 0.201 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.758 17.059 2.890 1.00 0.00 C ATOM 0 H ILE C 35 3.884 15.830 2.186 1.00 0.00 H new ATOM 0 HA ILE C 35 5.290 13.903 0.456 1.00 0.00 H new ATOM 0 HB ILE C 35 7.373 14.575 1.729 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.670 16.982 2.456 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.218 15.751 3.576 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.821 16.533 0.309 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.003 15.233 -0.591 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.083 16.660 -0.055 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.618 17.752 3.720 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.567 16.368 3.127 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.011 17.618 1.989 1.00 0.00 H new ATOM 2066 N LEU C 36 5.854 12.437 2.555 1.00 0.00 N ATOM 2067 CA LEU C 36 5.715 11.408 3.578 1.00 0.00 C ATOM 2068 C LEU C 36 6.603 11.665 4.787 1.00 0.00 C ATOM 2069 O LEU C 36 7.531 12.478 4.745 1.00 0.00 O ATOM 2070 CB LEU C 36 6.048 10.027 3.002 1.00 0.00 C ATOM 2071 CG LEU C 36 5.170 9.573 1.837 1.00 0.00 C ATOM 2072 CD1 LEU C 36 5.684 10.123 0.514 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.100 8.063 1.796 1.00 0.00 C ATOM 0 H LEU C 36 6.550 12.232 1.838 1.00 0.00 H new ATOM 0 HA LEU C 36 4.676 11.438 3.906 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.087 10.031 2.672 1.00 0.00 H new ATOM 0 HB3 LEU C 36 5.970 9.290 3.802 1.00 0.00 H new ATOM 0 HG LEU C 36 4.166 9.967 1.992 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.039 9.783 -0.296 1.00 0.00 H new ATOM 0 HD12 LEU C 36 5.681 11.212 0.547 1.00 0.00 H new ATOM 0 HD13 LEU C 36 6.700 9.768 0.342 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.472 7.750 0.962 1.00 0.00 H new ATOM 0 HD22 LEU C 36 6.103 7.656 1.668 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.675 7.693 2.729 1.00 0.00 H new ATOM 2085 N THR C 37 6.302 10.946 5.859 1.00 0.00 N ATOM 2086 CA THR C 37 7.115 10.945 7.061 1.00 0.00 C ATOM 2087 C THR C 37 7.885 9.635 7.111 1.00 0.00 C ATOM 2088 O THR C 37 7.660 8.781 6.264 1.00 0.00 O ATOM 2089 CB THR C 37 6.241 11.063 8.329 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.327 9.957 8.404 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.448 12.360 8.331 1.00 0.00 C ATOM 0 H THR C 37 5.481 10.344 5.917 1.00 0.00 H new ATOM 0 HA THR C 37 7.790 11.800 7.033 1.00 0.00 H new ATOM 0 HB THR C 37 6.907 11.055 9.192 1.00 0.00 H new ATOM 0 HG1 THR C 37 4.846 9.988 9.257 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.842 12.415 9.236 1.00 0.00 H new ATOM 0 HG22 THR C 37 6.134 13.206 8.302 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.798 12.390 7.457 1.00 0.00 H new ATOM 2099 N ALA C 38 8.781 9.461 8.073 1.00 0.00 N ATOM 2100 CA ALA C 38 9.552 8.221 8.164 1.00 0.00 C ATOM 2101 C ALA C 38 8.627 7.010 8.256 1.00 0.00 C ATOM 2102 O ALA C 38 8.836 6.005 7.575 1.00 0.00 O ATOM 2103 CB ALA C 38 10.500 8.270 9.346 1.00 0.00 C ATOM 0 H ALA C 38 8.993 10.150 8.794 1.00 0.00 H new ATOM 0 HA ALA C 38 10.145 8.120 7.255 1.00 0.00 H new ATOM 0 HB1 ALA C 38 11.065 7.339 9.398 1.00 0.00 H new ATOM 0 HB2 ALA C 38 11.189 9.106 9.226 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.929 8.399 10.265 1.00 0.00 H new ATOM 2109 N GLN C 39 7.608 7.118 9.104 1.00 0.00 N ATOM 2110 CA GLN C 39 6.542 6.121 9.188 1.00 0.00 C ATOM 2111 C GLN C 39 5.972 5.814 7.796 1.00 0.00 C ATOM 2112 O GLN C 39 5.906 4.657 7.374 1.00 0.00 O ATOM 2113 CB GLN C 39 5.437 6.666 10.102 1.00 0.00 C ATOM 2114 CG GLN C 39 4.369 5.659 10.495 1.00 0.00 C ATOM 2115 CD GLN C 39 4.903 4.546 11.373 1.00 0.00 C ATOM 2116 OE1 GLN C 39 5.898 4.715 12.081 1.00 0.00 O ATOM 2117 NE2 GLN C 39 4.226 3.408 11.361 1.00 0.00 N ATOM 0 H GLN C 39 7.497 7.898 9.752 1.00 0.00 H new ATOM 0 HA GLN C 39 6.944 5.193 9.596 1.00 0.00 H new ATOM 0 HB2 GLN C 39 5.898 7.056 11.010 1.00 0.00 H new ATOM 0 HB3 GLN C 39 4.955 7.506 9.602 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.565 6.175 11.020 1.00 0.00 H new ATOM 0 HG3 GLN C 39 3.935 5.227 9.593 1.00 0.00 H new ATOM 0 HE21 GLN C 39 3.407 3.308 10.761 1.00 0.00 H new ATOM 0 HE22 GLN C 39 4.523 2.632 11.952 1.00 0.00 H new ATOM 2126 N GLY C 40 5.566 6.871 7.101 1.00 0.00 N ATOM 2127 CA GLY C 40 5.034 6.743 5.758 1.00 0.00 C ATOM 2128 C GLY C 40 6.056 6.234 4.754 1.00 0.00 C ATOM 2129 O GLY C 40 5.698 5.558 3.793 1.00 0.00 O ATOM 0 H GLY C 40 5.597 7.828 7.452 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.182 6.064 5.775 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.662 7.713 5.428 1.00 0.00 H new ATOM 2133 N TYR C 41 7.325 6.545 4.976 1.00 0.00 N ATOM 2134 CA TYR C 41 8.386 6.119 4.071 1.00 0.00 C ATOM 2135 C TYR C 41 8.626 4.619 4.156 1.00 0.00 C ATOM 2136 O TYR C 41 8.954 3.984 3.151 1.00 0.00 O ATOM 2137 CB TYR C 41 9.685 6.867 4.390 1.00 0.00 C ATOM 2138 CG TYR C 41 9.932 8.099 3.544 1.00 0.00 C ATOM 2139 CD1 TYR C 41 9.449 9.343 3.922 1.00 0.00 C ATOM 2140 CD2 TYR C 41 10.671 8.013 2.369 1.00 0.00 C ATOM 2141 CE1 TYR C 41 9.692 10.467 3.155 1.00 0.00 C ATOM 2142 CE2 TYR C 41 10.914 9.132 1.597 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.424 10.356 1.993 1.00 0.00 C ATOM 2144 OH TYR C 41 10.672 11.475 1.231 1.00 0.00 O ATOM 0 H TYR C 41 7.646 7.091 5.775 1.00 0.00 H new ATOM 0 HA TYR C 41 8.067 6.355 3.056 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.670 7.161 5.440 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.523 6.182 4.263 1.00 0.00 H new ATOM 0 HD1 TYR C 41 8.873 9.435 4.831 1.00 0.00 H new ATOM 0 HD2 TYR C 41 11.061 7.056 2.055 1.00 0.00 H new ATOM 0 HE1 TYR C 41 9.310 11.428 3.465 1.00 0.00 H new ATOM 0 HE2 TYR C 41 11.487 9.047 0.685 1.00 0.00 H new ATOM 0 HH TYR C 41 11.202 11.225 0.446 1.00 0.00 H new ATOM 2154 N THR C 42 8.433 4.044 5.332 1.00 0.00 N ATOM 2155 CA THR C 42 8.506 2.598 5.476 1.00 0.00 C ATOM 2156 C THR C 42 7.318 1.942 4.771 1.00 0.00 C ATOM 2157 O THR C 42 7.423 0.843 4.217 1.00 0.00 O ATOM 2158 CB THR C 42 8.503 2.184 6.958 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.567 2.839 7.657 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.651 0.677 7.101 1.00 0.00 C ATOM 0 H THR C 42 8.227 4.550 6.193 1.00 0.00 H new ATOM 0 HA THR C 42 9.439 2.265 5.022 1.00 0.00 H new ATOM 0 HB THR C 42 7.548 2.484 7.390 1.00 0.00 H new ATOM 0 HG1 THR C 42 9.609 2.504 8.577 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.646 0.410 8.158 1.00 0.00 H new ATOM 0 HG22 THR C 42 7.822 0.181 6.597 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.591 0.359 6.651 1.00 0.00 H new ATOM 2168 N LEU C 43 6.201 2.654 4.747 1.00 0.00 N ATOM 2169 CA LEU C 43 4.978 2.132 4.163 1.00 0.00 C ATOM 2170 C LEU C 43 4.936 2.419 2.665 1.00 0.00 C ATOM 2171 O LEU C 43 4.135 1.828 1.950 1.00 0.00 O ATOM 2172 CB LEU C 43 3.735 2.729 4.858 1.00 0.00 C ATOM 2173 CG LEU C 43 3.036 1.832 5.906 1.00 0.00 C ATOM 2174 CD1 LEU C 43 4.037 1.277 6.907 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.964 2.624 6.634 1.00 0.00 C ATOM 0 H LEU C 43 6.118 3.597 5.127 1.00 0.00 H new ATOM 0 HA LEU C 43 4.967 1.052 4.313 1.00 0.00 H new ATOM 0 HB2 LEU C 43 4.030 3.658 5.346 1.00 0.00 H new ATOM 0 HB3 LEU C 43 3.006 2.989 4.090 1.00 0.00 H new ATOM 0 HG LEU C 43 2.576 0.994 5.383 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.517 0.650 7.632 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.784 0.682 6.382 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.528 2.101 7.426 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.476 1.985 7.370 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.420 3.476 7.138 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.225 2.980 5.917 1.00 0.00 H new ATOM 2187 N LEU C 44 5.812 3.298 2.168 1.00 0.00 N ATOM 2188 CA LEU C 44 5.825 3.589 0.740 1.00 0.00 C ATOM 2189 C LEU C 44 6.677 2.562 0.007 1.00 0.00 C ATOM 2190 O LEU C 44 6.272 2.047 -1.026 1.00 0.00 O ATOM 2191 CB LEU C 44 6.286 5.041 0.439 1.00 0.00 C ATOM 2192 CG LEU C 44 7.797 5.302 0.249 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.265 4.883 -1.141 1.00 0.00 C ATOM 2194 CD2 LEU C 44 8.116 6.773 0.449 1.00 0.00 C ATOM 0 H LEU C 44 6.503 3.806 2.720 1.00 0.00 H new ATOM 0 HA LEU C 44 4.802 3.516 0.372 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.775 5.372 -0.465 1.00 0.00 H new ATOM 0 HB3 LEU C 44 5.938 5.677 1.253 1.00 0.00 H new ATOM 0 HG LEU C 44 8.321 4.705 0.995 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.332 5.080 -1.240 1.00 0.00 H new ATOM 0 HD12 LEU C 44 8.078 3.818 -1.282 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.719 5.450 -1.895 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.185 6.936 0.311 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.562 7.368 -0.277 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.831 7.073 1.457 1.00 0.00 H new ATOM 2206 N ASP C 45 7.838 2.227 0.561 1.00 0.00 N ATOM 2207 CA ASP C 45 8.755 1.303 -0.102 1.00 0.00 C ATOM 2208 C ASP C 45 8.189 -0.104 -0.077 1.00 0.00 C ATOM 2209 O ASP C 45 8.496 -0.931 -0.936 1.00 0.00 O ATOM 2210 CB ASP C 45 10.126 1.332 0.574 1.00 0.00 C ATOM 2211 CG ASP C 45 11.111 0.374 -0.068 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.574 0.666 -1.188 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.436 -0.666 0.547 1.00 0.00 O ATOM 0 H ASP C 45 8.166 2.578 1.461 1.00 0.00 H new ATOM 0 HA ASP C 45 8.873 1.617 -1.139 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.528 2.344 0.530 1.00 0.00 H new ATOM 0 HB3 ASP C 45 10.013 1.079 1.628 1.00 0.00 H new ATOM 2218 N PHE C 46 7.312 -0.347 0.878 1.00 0.00 N ATOM 2219 CA PHE C 46 6.619 -1.616 0.975 1.00 0.00 C ATOM 2220 C PHE C 46 5.559 -1.720 -0.102 1.00 0.00 C ATOM 2221 O PHE C 46 5.429 -2.749 -0.761 1.00 0.00 O ATOM 2222 CB PHE C 46 5.946 -1.680 2.346 1.00 0.00 C ATOM 2223 CG PHE C 46 5.312 -2.994 2.691 1.00 0.00 C ATOM 2224 CD1 PHE C 46 6.039 -3.977 3.340 1.00 0.00 C ATOM 2225 CD2 PHE C 46 3.982 -3.237 2.389 1.00 0.00 C ATOM 2226 CE1 PHE C 46 5.453 -5.179 3.680 1.00 0.00 C ATOM 2227 CE2 PHE C 46 3.391 -4.437 2.722 1.00 0.00 C ATOM 2228 CZ PHE C 46 4.128 -5.408 3.369 1.00 0.00 C ATOM 0 H PHE C 46 7.061 0.325 1.603 1.00 0.00 H new ATOM 0 HA PHE C 46 7.327 -2.435 0.848 1.00 0.00 H new ATOM 0 HB2 PHE C 46 6.689 -1.443 3.108 1.00 0.00 H new ATOM 0 HB3 PHE C 46 5.182 -0.904 2.393 1.00 0.00 H new ATOM 0 HD1 PHE C 46 7.077 -3.801 3.583 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.401 -2.477 1.887 1.00 0.00 H new ATOM 0 HE1 PHE C 46 6.029 -5.938 4.188 1.00 0.00 H new ATOM 0 HE2 PHE C 46 2.355 -4.617 2.477 1.00 0.00 H new ATOM 0 HZ PHE C 46 3.667 -6.349 3.632 1.00 0.00 H new ATOM 2238 N ILE C 47 4.827 -0.649 -0.312 1.00 0.00 N ATOM 2239 CA ILE C 47 3.755 -0.691 -1.277 1.00 0.00 C ATOM 2240 C ILE C 47 4.295 -0.551 -2.701 1.00 0.00 C ATOM 2241 O ILE C 47 3.717 -1.071 -3.650 1.00 0.00 O ATOM 2242 CB ILE C 47 2.685 0.374 -0.982 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.291 1.778 -1.040 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.077 0.107 0.387 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.335 2.884 -0.651 1.00 0.00 C ATOM 0 H ILE C 47 4.951 0.245 0.163 1.00 0.00 H new ATOM 0 HA ILE C 47 3.275 -1.666 -1.192 1.00 0.00 H new ATOM 0 HB ILE C 47 1.903 0.318 -1.739 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.158 1.814 -0.381 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.652 1.964 -2.052 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.318 0.859 0.601 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.620 -0.882 0.395 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.857 0.153 1.147 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.844 3.846 -0.719 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.478 2.878 -1.325 1.00 0.00 H new ATOM 0 HD13 ILE C 47 1.993 2.726 0.372 1.00 0.00 H new ATOM 2257 N GLN C 48 5.427 0.124 -2.828 1.00 0.00 N ATOM 2258 CA GLN C 48 6.180 0.135 -4.064 1.00 0.00 C ATOM 2259 C GLN C 48 6.504 -1.295 -4.480 1.00 0.00 C ATOM 2260 O GLN C 48 6.064 -1.761 -5.510 1.00 0.00 O ATOM 2261 CB GLN C 48 7.471 0.940 -3.873 1.00 0.00 C ATOM 2262 CG GLN C 48 7.235 2.436 -3.724 1.00 0.00 C ATOM 2263 CD GLN C 48 6.747 3.097 -5.002 1.00 0.00 C ATOM 2264 OE1 GLN C 48 6.168 2.449 -5.872 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.948 4.400 -5.108 1.00 0.00 N ATOM 0 H GLN C 48 5.845 0.676 -2.079 1.00 0.00 H new ATOM 0 HA GLN C 48 5.586 0.603 -4.849 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.992 0.572 -2.989 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.128 0.767 -4.725 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.504 2.605 -2.934 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.162 2.913 -3.407 1.00 0.00 H new ATOM 0 HE21 GLN C 48 7.433 4.903 -4.365 1.00 0.00 H new ATOM 0 HE22 GLN C 48 6.618 4.901 -5.933 1.00 0.00 H new ATOM 2274 N LYS C 49 7.136 -2.011 -3.577 1.00 0.00 N ATOM 2275 CA LYS C 49 7.799 -3.282 -3.872 1.00 0.00 C ATOM 2276 C LYS C 49 6.814 -4.454 -4.003 1.00 0.00 C ATOM 2277 O LYS C 49 7.219 -5.573 -4.306 1.00 0.00 O ATOM 2278 CB LYS C 49 8.772 -3.533 -2.724 1.00 0.00 C ATOM 2279 CG LYS C 49 9.911 -4.494 -3.020 1.00 0.00 C ATOM 2280 CD LYS C 49 10.753 -4.726 -1.771 1.00 0.00 C ATOM 2281 CE LYS C 49 11.276 -3.415 -1.189 1.00 0.00 C ATOM 2282 NZ LYS C 49 11.774 -3.579 0.202 1.00 0.00 N ATOM 0 H LYS C 49 7.211 -1.731 -2.599 1.00 0.00 H new ATOM 0 HA LYS C 49 8.305 -3.217 -4.835 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.198 -2.577 -2.419 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.209 -3.917 -1.873 1.00 0.00 H new ATOM 0 HG2 LYS C 49 9.510 -5.443 -3.377 1.00 0.00 H new ATOM 0 HG3 LYS C 49 10.536 -4.092 -3.817 1.00 0.00 H new ATOM 0 HD2 LYS C 49 10.156 -5.244 -1.021 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.593 -5.377 -2.014 1.00 0.00 H new ATOM 0 HE2 LYS C 49 12.080 -3.035 -1.819 1.00 0.00 H new ATOM 0 HE3 LYS C 49 10.481 -2.670 -1.203 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 11.704 -2.672 0.705 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 11.200 -4.293 0.694 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 12.767 -3.887 0.181 1.00 0.00 H new ATOM 2296 N HIS C 50 5.526 -4.234 -3.737 1.00 0.00 N ATOM 2297 CA HIS C 50 4.564 -5.298 -4.046 1.00 0.00 C ATOM 2298 C HIS C 50 3.535 -4.905 -5.109 1.00 0.00 C ATOM 2299 O HIS C 50 2.698 -5.724 -5.481 1.00 0.00 O ATOM 2300 CB HIS C 50 3.847 -5.730 -2.763 1.00 0.00 C ATOM 2301 CG HIS C 50 4.788 -5.993 -1.628 1.00 0.00 C ATOM 2302 ND1 HIS C 50 4.724 -5.319 -0.435 1.00 0.00 N ATOM 2303 CD2 HIS C 50 5.861 -6.813 -1.534 1.00 0.00 C ATOM 2304 CE1 HIS C 50 5.717 -5.704 0.337 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.426 -6.608 -0.302 1.00 0.00 N ATOM 0 H HIS C 50 5.138 -3.382 -3.332 1.00 0.00 H new ATOM 0 HA HIS C 50 5.137 -6.126 -4.464 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.140 -4.954 -2.469 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.267 -6.631 -2.963 1.00 0.00 H new ATOM 0 HD2 HIS C 50 6.208 -7.502 -2.290 1.00 0.00 H new ATOM 0 HE1 HIS C 50 5.917 -5.337 1.333 1.00 0.00 H new ATOM 0 HE2 HIS C 50 7.257 -7.078 0.058 1.00 0.00 H new ATOM 2314 N LEU C 51 3.587 -3.674 -5.599 1.00 0.00 N ATOM 2315 CA LEU C 51 2.720 -3.275 -6.714 1.00 0.00 C ATOM 2316 C LEU C 51 3.549 -2.879 -7.925 1.00 0.00 C ATOM 2317 O LEU C 51 3.299 -3.310 -9.051 1.00 0.00 O ATOM 2318 CB LEU C 51 1.821 -2.081 -6.352 1.00 0.00 C ATOM 2319 CG LEU C 51 0.651 -2.350 -5.388 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.226 -3.488 -5.887 1.00 0.00 C ATOM 2321 CD2 LEU C 51 1.152 -2.638 -3.991 1.00 0.00 C ATOM 0 H LEU C 51 4.207 -2.941 -5.254 1.00 0.00 H new ATOM 0 HA LEU C 51 2.096 -4.140 -6.938 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.449 -1.306 -5.913 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.411 -1.674 -7.276 1.00 0.00 H new ATOM 0 HG LEU C 51 0.042 -1.446 -5.352 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -1.043 -3.653 -5.184 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.635 -3.231 -6.864 1.00 0.00 H new ATOM 0 HD13 LEU C 51 0.370 -4.397 -5.971 1.00 0.00 H new ATOM 0 HD21 LEU C 51 0.304 -2.824 -3.332 1.00 0.00 H new ATOM 0 HD22 LEU C 51 1.797 -3.516 -4.010 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.716 -1.781 -3.623 1.00 0.00 H new ATOM 2333 N ASN C 52 4.547 -2.059 -7.668 1.00 0.00 N ATOM 2334 CA ASN C 52 5.282 -1.369 -8.712 1.00 0.00 C ATOM 2335 C ASN C 52 6.746 -1.797 -8.773 1.00 0.00 C ATOM 2336 O ASN C 52 7.362 -1.771 -9.839 1.00 0.00 O ATOM 2337 CB ASN C 52 5.178 0.136 -8.463 1.00 0.00 C ATOM 2338 CG ASN C 52 4.180 0.811 -9.391 1.00 0.00 C ATOM 2339 OD1 ASN C 52 3.533 1.787 -9.021 1.00 0.00 O ATOM 2340 ND2 ASN C 52 4.063 0.311 -10.616 1.00 0.00 N ATOM 0 H ASN C 52 4.874 -1.850 -6.725 1.00 0.00 H new ATOM 0 HA ASN C 52 4.842 -1.630 -9.675 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.883 0.311 -7.428 1.00 0.00 H new ATOM 0 HB3 ASN C 52 6.159 0.592 -8.596 1.00 0.00 H new ATOM 0 HD21 ASN C 52 3.420 0.739 -11.282 1.00 0.00 H new ATOM 0 HD22 ASN C 52 4.616 -0.501 -10.890 1.00 0.00 H new ATOM 2347 N LYS C 53 7.301 -2.178 -7.640 1.00 0.00 N ATOM 2348 CA LYS C 53 8.688 -2.583 -7.566 1.00 0.00 C ATOM 2349 C LYS C 53 8.803 -4.079 -7.295 1.00 0.00 C ATOM 2350 O LYS C 53 9.475 -4.455 -6.315 1.00 0.00 O ATOM 2351 CB LYS C 53 9.391 -1.796 -6.462 1.00 0.00 C ATOM 2352 CG LYS C 53 10.138 -0.574 -6.953 1.00 0.00 C ATOM 2353 CD LYS C 53 11.283 -0.231 -6.017 1.00 0.00 C ATOM 2354 CE LYS C 53 10.802 0.131 -4.625 1.00 0.00 C ATOM 2355 NZ LYS C 53 11.949 0.335 -3.702 1.00 0.00 N ATOM 2356 OXT LYS C 53 8.203 -4.864 -8.057 1.00 0.00 O ATOM 0 H LYS C 53 6.805 -2.215 -6.749 1.00 0.00 H new ATOM 0 HA LYS C 53 9.165 -2.373 -8.524 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.651 -1.484 -5.725 1.00 0.00 H new ATOM 0 HB3 LYS C 53 10.092 -2.456 -5.950 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.524 -0.757 -7.956 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.454 0.272 -7.024 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.964 -1.080 -5.954 1.00 0.00 H new ATOM 0 HD3 LYS C 53 11.850 0.603 -6.431 1.00 0.00 H new ATOM 0 HE2 LYS C 53 10.200 1.039 -4.669 1.00 0.00 H new ATOM 0 HE3 LYS C 53 10.158 -0.660 -4.241 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 11.638 0.178 -2.722 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 12.707 -0.337 -3.937 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 12.305 1.307 -3.800 1.00 0.00 H new