USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 933 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: C 13 ASN : amide:sc= -0.148 K(o=-0.15,f=0.54) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0.237 USER MOD Set 2.2: C 21 THR OG1 : rot -75:sc= 0.234 USER MOD Set 3.1: A 13 ASN : amide:sc= 1.01 K(o=1,f=-0.84) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0.492 USER MOD Set 4.2: A 21 THR OG1 : rot -71:sc= 0.534 USER MOD Single : A 1 MET CE :methyl 175:sc= -0.167 (180deg=-0.271) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 29 GLN : amide:sc= -0.118 X(o=-0.12,f=0) USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= -1.02 K(o=-1,f=-1.6) USER MOD Single : A 48 TYR OH : rot 180:sc= -0.0324 USER MOD Single : A 49 GLN : amide:sc= 1.05 K(o=1.1,f=-1.5e-05) USER MOD Single : A 52 GLN : amide:sc= -4.06! K(o=-4.1!,f=-1.5) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 177:sc= -0.113 (180deg=-0.133) USER MOD Single : C 1 MET N :NH3+ 129:sc= 0.0116 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 35 ASN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HD1:sc= -0.689 X(o=-0.69,f=-0.27) USER MOD Single : C 48 TYR OH : rot 36:sc= 0.595 USER MOD Single : C 49 GLN : amide:sc= 0.655 K(o=0.65,f=0) USER MOD Single : C 52 GLN : amide:sc= -2.85! K(o=-2.8!,f=-1.2) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.526 -7.528 -10.432 1.00 0.00 N ATOM 2 CA MET A 1 3.855 -6.595 -9.507 1.00 0.00 C ATOM 3 C MET A 1 2.576 -7.226 -8.971 1.00 0.00 C ATOM 4 O MET A 1 1.736 -7.657 -9.754 1.00 0.00 O ATOM 5 CB MET A 1 3.546 -5.275 -10.211 1.00 0.00 C ATOM 6 CG MET A 1 3.347 -4.157 -9.190 1.00 0.00 C ATOM 7 SD MET A 1 3.035 -2.528 -9.915 1.00 0.00 S ATOM 8 CE MET A 1 1.385 -2.823 -10.592 1.00 0.00 C ATOM 0 H1 MET A 1 5.398 -7.091 -10.794 1.00 0.00 H new ATOM 0 H2 MET A 1 4.762 -8.407 -9.928 1.00 0.00 H new ATOM 0 H3 MET A 1 3.892 -7.745 -11.227 1.00 0.00 H new ATOM 0 HA MET A 1 4.522 -6.388 -8.670 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.361 -5.017 -10.887 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.649 -5.383 -10.820 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.511 -4.419 -8.541 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.233 -4.096 -8.559 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.990 -1.895 -11.004 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.444 -3.574 -11.380 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.725 -3.179 -9.801 1.00 0.00 H new ATOM 20 N LEU A 2 2.429 -7.287 -7.645 1.00 0.00 N ATOM 21 CA LEU A 2 1.244 -7.854 -7.019 1.00 0.00 C ATOM 22 C LEU A 2 0.162 -6.772 -6.949 1.00 0.00 C ATOM 23 O LEU A 2 0.466 -5.623 -6.638 1.00 0.00 O ATOM 24 CB LEU A 2 1.644 -8.338 -5.614 1.00 0.00 C ATOM 25 CG LEU A 2 0.808 -9.485 -5.022 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.945 -9.464 -3.501 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.674 -9.439 -5.365 1.00 0.00 C ATOM 0 H LEU A 2 3.126 -6.946 -6.983 1.00 0.00 H new ATOM 0 HA LEU A 2 0.848 -8.695 -7.588 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.686 -8.656 -5.646 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.591 -7.489 -4.932 1.00 0.00 H new ATOM 0 HG LEU A 2 1.202 -10.398 -5.468 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.356 -10.274 -3.071 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.992 -9.593 -3.228 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.585 -8.510 -3.116 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.181 -10.287 -4.904 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.106 -8.511 -4.990 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.799 -9.486 -6.447 1.00 0.00 H new ATOM 39 N ILE A 3 -1.093 -7.126 -7.239 1.00 0.00 N ATOM 40 CA ILE A 3 -2.229 -6.225 -7.117 1.00 0.00 C ATOM 41 C ILE A 3 -3.249 -6.813 -6.158 1.00 0.00 C ATOM 42 O ILE A 3 -3.373 -8.028 -6.037 1.00 0.00 O ATOM 43 CB ILE A 3 -2.873 -5.956 -8.489 1.00 0.00 C ATOM 44 CG1 ILE A 3 -2.028 -4.977 -9.302 1.00 0.00 C ATOM 45 CG2 ILE A 3 -4.250 -5.310 -8.348 1.00 0.00 C ATOM 46 CD1 ILE A 3 -1.016 -5.666 -10.206 1.00 0.00 C ATOM 0 H ILE A 3 -1.346 -8.058 -7.568 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.875 -5.272 -6.723 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.949 -6.926 -8.981 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.686 -4.357 -9.911 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.501 -4.309 -8.621 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.673 -5.135 -9.337 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.907 -5.973 -7.784 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -4.154 -4.360 -7.822 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.448 -4.915 -10.756 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.335 -6.264 -9.600 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.539 -6.313 -10.910 1.00 0.00 H new ATOM 58 N LEU A 4 -3.983 -5.930 -5.481 1.00 0.00 N ATOM 59 CA LEU A 4 -5.072 -6.295 -4.596 1.00 0.00 C ATOM 60 C LEU A 4 -6.160 -5.236 -4.727 1.00 0.00 C ATOM 61 O LEU A 4 -5.921 -4.147 -5.254 1.00 0.00 O ATOM 62 CB LEU A 4 -4.559 -6.395 -3.153 1.00 0.00 C ATOM 63 CG LEU A 4 -3.566 -7.547 -2.957 1.00 0.00 C ATOM 64 CD1 LEU A 4 -2.962 -7.500 -1.555 1.00 0.00 C ATOM 65 CD2 LEU A 4 -4.267 -8.896 -3.105 1.00 0.00 C ATOM 0 H LEU A 4 -3.829 -4.923 -5.538 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.482 -7.268 -4.865 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.079 -5.456 -2.876 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.405 -6.531 -2.479 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.790 -7.437 -3.714 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.260 -8.325 -1.434 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.438 -6.554 -1.416 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.756 -7.588 -0.814 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.544 -9.699 -2.962 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.056 -8.980 -2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.702 -8.972 -4.101 1.00 0.00 H new ATOM 77 N THR A 5 -7.356 -5.558 -4.245 1.00 0.00 N ATOM 78 CA THR A 5 -8.508 -4.683 -4.344 1.00 0.00 C ATOM 79 C THR A 5 -9.106 -4.532 -2.959 1.00 0.00 C ATOM 80 O THR A 5 -9.240 -5.503 -2.219 1.00 0.00 O ATOM 81 CB THR A 5 -9.513 -5.266 -5.344 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.899 -5.377 -6.607 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.752 -4.391 -5.497 1.00 0.00 C ATOM 0 H THR A 5 -7.550 -6.441 -3.772 1.00 0.00 H new ATOM 0 HA THR A 5 -8.223 -3.697 -4.711 1.00 0.00 H new ATOM 0 HB THR A 5 -9.823 -6.238 -4.961 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.538 -5.751 -7.249 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.433 -4.847 -6.216 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.252 -4.296 -4.533 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.458 -3.403 -5.852 1.00 0.00 H new ATOM 91 N ARG A 6 -9.466 -3.296 -2.612 1.00 0.00 N ATOM 92 CA ARG A 6 -9.938 -2.940 -1.286 1.00 0.00 C ATOM 93 C ARG A 6 -11.041 -1.903 -1.418 1.00 0.00 C ATOM 94 O ARG A 6 -11.318 -1.419 -2.513 1.00 0.00 O ATOM 95 CB ARG A 6 -8.770 -2.336 -0.493 1.00 0.00 C ATOM 96 CG ARG A 6 -7.671 -3.347 -0.160 1.00 0.00 C ATOM 97 CD ARG A 6 -7.926 -4.077 1.160 1.00 0.00 C ATOM 98 NE ARG A 6 -9.241 -4.730 1.201 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.451 -6.047 1.244 1.00 0.00 C ATOM 100 NH1 ARG A 6 -8.441 -6.908 1.207 1.00 0.00 N ATOM 101 NH2 ARG A 6 -10.691 -6.514 1.329 1.00 0.00 N ATOM 0 H ARG A 6 -9.435 -2.507 -3.258 1.00 0.00 H new ATOM 0 HA ARG A 6 -10.320 -3.822 -0.772 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -8.337 -1.516 -1.067 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -9.153 -1.909 0.434 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.597 -4.077 -0.966 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -6.712 -2.832 -0.107 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -7.148 -4.825 1.313 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -7.852 -3.367 1.984 1.00 0.00 H new ATOM 0 HE ARG A 6 -10.063 -4.126 1.196 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -7.482 -6.567 1.145 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -8.624 -7.911 1.241 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.479 -5.867 1.361 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.856 -7.520 1.362 1.00 0.00 H new ATOM 115 N LYS A 7 -11.676 -1.565 -0.296 1.00 0.00 N ATOM 116 CA LYS A 7 -12.630 -0.476 -0.235 1.00 0.00 C ATOM 117 C LYS A 7 -12.183 0.465 0.867 1.00 0.00 C ATOM 118 O LYS A 7 -11.439 0.050 1.758 1.00 0.00 O ATOM 119 CB LYS A 7 -14.041 -1.008 0.023 1.00 0.00 C ATOM 120 CG LYS A 7 -14.384 -2.194 -0.877 1.00 0.00 C ATOM 121 CD LYS A 7 -15.901 -2.375 -0.893 1.00 0.00 C ATOM 122 CE LYS A 7 -16.290 -3.724 -1.497 1.00 0.00 C ATOM 123 NZ LYS A 7 -17.754 -3.909 -1.460 1.00 0.00 N ATOM 0 H LYS A 7 -11.538 -2.044 0.594 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.664 0.057 -1.185 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.129 -1.309 1.067 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.764 -0.209 -0.140 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.014 -2.021 -1.887 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.899 -3.099 -0.510 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -16.289 -2.303 0.123 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -16.360 -1.570 -1.468 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -15.937 -3.783 -2.527 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.803 -4.529 -0.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -17.998 -4.831 -1.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -18.083 -3.875 -0.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -18.213 -3.152 -2.005 1.00 0.00 H new ATOM 137 N VAL A 8 -12.615 1.726 0.824 1.00 0.00 N ATOM 138 CA VAL A 8 -12.121 2.687 1.802 1.00 0.00 C ATOM 139 C VAL A 8 -12.478 2.259 3.217 1.00 0.00 C ATOM 140 O VAL A 8 -13.652 2.169 3.577 1.00 0.00 O ATOM 141 CB VAL A 8 -12.554 4.118 1.473 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.023 4.477 0.082 1.00 0.00 C ATOM 143 CG2 VAL A 8 -14.054 4.394 1.472 1.00 0.00 C ATOM 0 H VAL A 8 -13.283 2.094 0.146 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.032 2.695 1.746 1.00 0.00 H new ATOM 0 HB VAL A 8 -12.142 4.723 2.281 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -12.322 5.494 -0.170 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -10.935 4.407 0.079 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.433 3.785 -0.654 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -14.231 5.441 1.225 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -14.540 3.759 0.731 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -14.464 4.179 2.459 1.00 0.00 H new ATOM 153 N GLY A 9 -11.442 1.990 4.019 1.00 0.00 N ATOM 154 CA GLY A 9 -11.594 1.519 5.387 1.00 0.00 C ATOM 155 C GLY A 9 -10.893 0.179 5.622 1.00 0.00 C ATOM 156 O GLY A 9 -10.966 -0.352 6.728 1.00 0.00 O ATOM 0 H GLY A 9 -10.470 2.096 3.728 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -11.189 2.263 6.072 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.654 1.417 5.618 1.00 0.00 H new ATOM 160 N GLU A 10 -10.215 -0.368 4.607 1.00 0.00 N ATOM 161 CA GLU A 10 -9.533 -1.655 4.712 1.00 0.00 C ATOM 162 C GLU A 10 -8.012 -1.489 4.617 1.00 0.00 C ATOM 163 O GLU A 10 -7.518 -0.372 4.464 1.00 0.00 O ATOM 164 CB GLU A 10 -10.060 -2.601 3.633 1.00 0.00 C ATOM 165 CG GLU A 10 -11.564 -2.823 3.788 1.00 0.00 C ATOM 166 CD GLU A 10 -12.085 -3.830 2.767 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.741 -3.673 1.573 1.00 0.00 O ATOM 168 OE2 GLU A 10 -12.822 -4.752 3.184 1.00 0.00 O ATOM 0 H GLU A 10 -10.126 0.072 3.691 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.743 -2.087 5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.849 -2.187 2.647 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.539 -3.556 3.696 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.779 -3.179 4.795 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.088 -1.875 3.667 1.00 0.00 H new ATOM 175 N SER A 11 -7.266 -2.598 4.708 1.00 0.00 N ATOM 176 CA SER A 11 -5.810 -2.555 4.811 1.00 0.00 C ATOM 177 C SER A 11 -5.118 -3.682 4.044 1.00 0.00 C ATOM 178 O SER A 11 -5.760 -4.589 3.514 1.00 0.00 O ATOM 179 CB SER A 11 -5.420 -2.625 6.286 1.00 0.00 C ATOM 180 OG SER A 11 -5.889 -1.485 6.975 1.00 0.00 O ATOM 0 H SER A 11 -7.655 -3.541 4.712 1.00 0.00 H new ATOM 0 HA SER A 11 -5.478 -1.621 4.358 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.836 -3.526 6.736 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.336 -2.693 6.379 1.00 0.00 H new ATOM 0 HG SER A 11 -5.633 -1.545 7.919 1.00 0.00 H new ATOM 186 N ILE A 12 -3.786 -3.602 3.997 1.00 0.00 N ATOM 187 CA ILE A 12 -2.877 -4.513 3.299 1.00 0.00 C ATOM 188 C ILE A 12 -1.647 -4.707 4.190 1.00 0.00 C ATOM 189 O ILE A 12 -1.439 -3.923 5.117 1.00 0.00 O ATOM 190 CB ILE A 12 -2.478 -3.894 1.947 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.690 -3.622 1.045 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.476 -4.781 1.191 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.399 -4.900 0.593 1.00 0.00 C ATOM 0 H ILE A 12 -3.283 -2.854 4.474 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.351 -5.476 3.105 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.006 -2.941 2.186 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.399 -2.990 1.580 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.364 -3.064 0.167 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.218 -4.311 0.242 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.575 -4.905 1.791 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.924 -5.757 1.003 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.247 -4.641 -0.041 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.703 -5.523 0.032 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.753 -5.448 1.466 1.00 0.00 H new ATOM 205 N ASN A 13 -0.825 -5.734 3.940 1.00 0.00 N ATOM 206 CA ASN A 13 0.306 -6.035 4.810 1.00 0.00 C ATOM 207 C ASN A 13 1.553 -6.413 4.003 1.00 0.00 C ATOM 208 O ASN A 13 1.450 -6.979 2.914 1.00 0.00 O ATOM 209 CB ASN A 13 -0.117 -7.175 5.736 1.00 0.00 C ATOM 210 CG ASN A 13 0.717 -7.212 7.008 1.00 0.00 C ATOM 211 OD1 ASN A 13 1.908 -7.516 6.977 1.00 0.00 O ATOM 212 ND2 ASN A 13 0.092 -6.902 8.137 1.00 0.00 N ATOM 0 H ASN A 13 -0.926 -6.365 3.145 1.00 0.00 H new ATOM 0 HA ASN A 13 0.574 -5.152 5.391 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.170 -7.061 5.995 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.020 -8.125 5.210 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.601 -6.911 9.021 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.898 -6.655 8.121 1.00 0.00 H new ATOM 219 N ILE A 14 2.732 -6.095 4.550 1.00 0.00 N ATOM 220 CA ILE A 14 4.020 -6.368 3.919 1.00 0.00 C ATOM 221 C ILE A 14 5.052 -6.756 4.985 1.00 0.00 C ATOM 222 O ILE A 14 5.001 -6.286 6.120 1.00 0.00 O ATOM 223 CB ILE A 14 4.499 -5.127 3.146 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.489 -4.754 2.050 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.886 -5.382 2.538 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.920 -3.519 1.258 1.00 0.00 C ATOM 0 H ILE A 14 2.815 -5.634 5.456 1.00 0.00 H new ATOM 0 HA ILE A 14 3.906 -7.197 3.220 1.00 0.00 H new ATOM 0 HB ILE A 14 4.574 -4.291 3.841 1.00 0.00 H new ATOM 0 HG12 ILE A 14 3.369 -5.596 1.368 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.515 -4.570 2.504 1.00 0.00 H new ATOM 0 HG21 ILE A 14 6.213 -4.496 1.994 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.597 -5.602 3.334 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.833 -6.229 1.854 1.00 0.00 H new ATOM 0 HD11 ILE A 14 3.173 -3.297 0.496 1.00 0.00 H new ATOM 0 HD12 ILE A 14 4.014 -2.668 1.933 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.881 -3.710 0.780 1.00 0.00 H new ATOM 238 N GLY A 15 5.996 -7.625 4.605 1.00 0.00 N ATOM 239 CA GLY A 15 7.073 -8.046 5.483 1.00 0.00 C ATOM 240 C GLY A 15 6.536 -8.651 6.776 1.00 0.00 C ATOM 241 O GLY A 15 5.597 -9.450 6.752 1.00 0.00 O ATOM 0 H GLY A 15 6.027 -8.051 3.679 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.697 -8.777 4.970 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.709 -7.192 5.716 1.00 0.00 H new ATOM 245 N ASP A 16 7.140 -8.256 7.899 1.00 0.00 N ATOM 246 CA ASP A 16 6.754 -8.710 9.226 1.00 0.00 C ATOM 247 C ASP A 16 6.583 -7.515 10.168 1.00 0.00 C ATOM 248 O ASP A 16 6.359 -7.688 11.364 1.00 0.00 O ATOM 249 CB ASP A 16 7.809 -9.702 9.730 1.00 0.00 C ATOM 250 CG ASP A 16 7.428 -10.333 11.066 1.00 0.00 C ATOM 251 OD1 ASP A 16 6.322 -10.915 11.135 1.00 0.00 O ATOM 252 OD2 ASP A 16 8.246 -10.231 12.008 1.00 0.00 O ATOM 0 H ASP A 16 7.922 -7.602 7.906 1.00 0.00 H new ATOM 0 HA ASP A 16 5.791 -9.220 9.190 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.948 -10.488 8.987 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.765 -9.189 9.834 1.00 0.00 H new ATOM 257 N ASP A 17 6.695 -6.297 9.628 1.00 0.00 N ATOM 258 CA ASP A 17 6.645 -5.074 10.419 1.00 0.00 C ATOM 259 C ASP A 17 5.968 -3.917 9.669 1.00 0.00 C ATOM 260 O ASP A 17 6.045 -2.777 10.122 1.00 0.00 O ATOM 261 CB ASP A 17 8.068 -4.661 10.805 1.00 0.00 C ATOM 262 CG ASP A 17 8.765 -5.706 11.679 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.502 -5.706 12.904 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.555 -6.493 11.114 1.00 0.00 O ATOM 0 H ASP A 17 6.823 -6.137 8.629 1.00 0.00 H new ATOM 0 HA ASP A 17 6.049 -5.284 11.307 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.654 -4.500 9.900 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.035 -3.710 11.337 1.00 0.00 H new ATOM 269 N ILE A 18 5.305 -4.182 8.537 1.00 0.00 N ATOM 270 CA ILE A 18 4.706 -3.115 7.741 1.00 0.00 C ATOM 271 C ILE A 18 3.242 -3.426 7.430 1.00 0.00 C ATOM 272 O ILE A 18 2.887 -4.559 7.113 1.00 0.00 O ATOM 273 CB ILE A 18 5.508 -2.942 6.442 1.00 0.00 C ATOM 274 CG1 ILE A 18 6.973 -2.615 6.753 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.881 -1.847 5.574 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.819 -2.580 5.481 1.00 0.00 C ATOM 0 H ILE A 18 5.173 -5.120 8.158 1.00 0.00 H new ATOM 0 HA ILE A 18 4.735 -2.186 8.310 1.00 0.00 H new ATOM 0 HB ILE A 18 5.480 -3.880 5.888 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.033 -1.651 7.258 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.376 -3.360 7.439 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.459 -1.734 4.657 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.856 -2.122 5.326 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.881 -0.904 6.121 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.852 -2.345 5.737 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.779 -3.553 4.990 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.430 -1.817 4.806 1.00 0.00 H new ATOM 288 N THR A 19 2.395 -2.396 7.529 1.00 0.00 N ATOM 289 CA THR A 19 0.978 -2.497 7.206 1.00 0.00 C ATOM 290 C THR A 19 0.556 -1.199 6.532 1.00 0.00 C ATOM 291 O THR A 19 1.106 -0.143 6.846 1.00 0.00 O ATOM 292 CB THR A 19 0.170 -2.735 8.491 1.00 0.00 C ATOM 293 OG1 THR A 19 0.714 -3.807 9.226 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.288 -3.078 8.186 1.00 0.00 C ATOM 0 H THR A 19 2.680 -1.466 7.838 1.00 0.00 H new ATOM 0 HA THR A 19 0.793 -3.335 6.534 1.00 0.00 H new ATOM 0 HB THR A 19 0.217 -1.809 9.064 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.189 -3.944 10.042 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.827 -3.239 9.120 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.748 -2.255 7.639 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.330 -3.984 7.582 1.00 0.00 H new ATOM 302 N ILE A 20 -0.407 -1.273 5.612 1.00 0.00 N ATOM 303 CA ILE A 20 -0.839 -0.136 4.809 1.00 0.00 C ATOM 304 C ILE A 20 -2.363 -0.051 4.850 1.00 0.00 C ATOM 305 O ILE A 20 -3.032 -1.071 5.005 1.00 0.00 O ATOM 306 CB ILE A 20 -0.347 -0.303 3.361 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.132 -0.698 3.268 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.574 0.991 2.573 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.088 0.379 3.774 1.00 0.00 C ATOM 0 H ILE A 20 -0.912 -2.134 5.404 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.417 0.785 5.211 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.929 -1.119 2.932 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.292 -1.611 3.841 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.373 -0.927 2.230 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.222 0.860 1.550 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.638 1.229 2.563 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -0.024 1.805 3.045 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.115 0.028 3.677 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.957 1.287 3.185 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.875 0.592 4.822 1.00 0.00 H new ATOM 321 N THR A 21 -2.921 1.155 4.710 1.00 0.00 N ATOM 322 CA THR A 21 -4.358 1.361 4.830 1.00 0.00 C ATOM 323 C THR A 21 -4.847 2.375 3.800 1.00 0.00 C ATOM 324 O THR A 21 -4.102 3.267 3.394 1.00 0.00 O ATOM 325 CB THR A 21 -4.663 1.843 6.254 1.00 0.00 C ATOM 326 OG1 THR A 21 -4.154 0.923 7.192 1.00 0.00 O ATOM 327 CG2 THR A 21 -6.163 1.995 6.499 1.00 0.00 C ATOM 0 H THR A 21 -2.392 2.004 4.512 1.00 0.00 H new ATOM 0 HA THR A 21 -4.881 0.424 4.639 1.00 0.00 H new ATOM 0 HB THR A 21 -4.189 2.818 6.369 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.689 0.102 7.169 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.332 2.338 7.520 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.574 2.722 5.799 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.655 1.033 6.353 1.00 0.00 H new ATOM 335 N ILE A 22 -6.108 2.234 3.384 1.00 0.00 N ATOM 336 CA ILE A 22 -6.758 3.139 2.445 1.00 0.00 C ATOM 337 C ILE A 22 -7.799 3.946 3.213 1.00 0.00 C ATOM 338 O ILE A 22 -8.934 3.515 3.406 1.00 0.00 O ATOM 339 CB ILE A 22 -7.324 2.349 1.246 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.209 3.210 0.338 1.00 0.00 C ATOM 341 CG2 ILE A 22 -8.126 1.118 1.674 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.431 4.372 -0.272 1.00 0.00 C ATOM 0 H ILE A 22 -6.712 1.474 3.698 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.051 3.846 2.010 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.444 2.026 0.690 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.623 2.592 -0.458 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.051 3.597 0.912 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.500 0.602 0.790 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.484 0.445 2.243 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.966 1.429 2.295 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.093 4.959 -0.909 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.039 5.005 0.524 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.605 3.984 -0.867 1.00 0.00 H new ATOM 354 N LEU A 23 -7.394 5.138 3.661 1.00 0.00 N ATOM 355 CA LEU A 23 -8.220 5.974 4.518 1.00 0.00 C ATOM 356 C LEU A 23 -9.447 6.485 3.771 1.00 0.00 C ATOM 357 O LEU A 23 -10.496 6.696 4.372 1.00 0.00 O ATOM 358 CB LEU A 23 -7.388 7.151 5.047 1.00 0.00 C ATOM 359 CG LEU A 23 -6.117 6.700 5.773 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.384 7.930 6.302 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.435 5.775 6.947 1.00 0.00 C ATOM 0 H LEU A 23 -6.486 5.544 3.437 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.568 5.372 5.357 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.115 7.800 4.215 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.998 7.745 5.727 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.499 6.151 5.063 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.477 7.618 6.821 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.120 8.582 5.470 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.031 8.469 6.994 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.508 5.477 7.437 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.070 6.299 7.661 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.954 4.889 6.582 1.00 0.00 H new ATOM 373 N GLY A 24 -9.319 6.679 2.455 1.00 0.00 N ATOM 374 CA GLY A 24 -10.453 6.998 1.603 1.00 0.00 C ATOM 375 C GLY A 24 -10.050 7.573 0.254 1.00 0.00 C ATOM 376 O GLY A 24 -8.882 7.528 -0.133 1.00 0.00 O ATOM 0 H GLY A 24 -8.430 6.618 1.959 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.044 6.096 1.444 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.095 7.713 2.117 1.00 0.00 H new ATOM 380 N VAL A 25 -11.040 8.114 -0.454 1.00 0.00 N ATOM 381 CA VAL A 25 -10.877 8.589 -1.818 1.00 0.00 C ATOM 382 C VAL A 25 -11.472 9.989 -1.962 1.00 0.00 C ATOM 383 O VAL A 25 -12.358 10.382 -1.203 1.00 0.00 O ATOM 384 CB VAL A 25 -11.523 7.570 -2.768 1.00 0.00 C ATOM 385 CG1 VAL A 25 -13.020 7.421 -2.496 1.00 0.00 C ATOM 386 CG2 VAL A 25 -11.322 7.953 -4.230 1.00 0.00 C ATOM 0 H VAL A 25 -11.985 8.234 -0.089 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.821 8.674 -2.076 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.026 6.618 -2.579 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.444 6.692 -3.186 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -13.172 7.081 -1.471 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.513 8.383 -2.636 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.794 7.207 -4.870 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.773 8.928 -4.416 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.256 7.998 -4.451 1.00 0.00 H new ATOM 396 N SER A 26 -10.974 10.736 -2.946 1.00 0.00 N ATOM 397 CA SER A 26 -11.341 12.123 -3.189 1.00 0.00 C ATOM 398 C SER A 26 -11.339 12.361 -4.692 1.00 0.00 C ATOM 399 O SER A 26 -10.599 13.200 -5.201 1.00 0.00 O ATOM 400 CB SER A 26 -10.346 13.049 -2.483 1.00 0.00 C ATOM 401 OG SER A 26 -10.477 12.914 -1.082 1.00 0.00 O ATOM 0 H SER A 26 -10.287 10.381 -3.611 1.00 0.00 H new ATOM 0 HA SER A 26 -12.334 12.334 -2.793 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.328 12.804 -2.788 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.527 14.083 -2.776 1.00 0.00 H new ATOM 0 HG SER A 26 -9.837 13.507 -0.635 1.00 0.00 H new ATOM 407 N GLY A 27 -12.179 11.613 -5.413 1.00 0.00 N ATOM 408 CA GLY A 27 -12.211 11.688 -6.864 1.00 0.00 C ATOM 409 C GLY A 27 -10.986 10.973 -7.420 1.00 0.00 C ATOM 410 O GLY A 27 -10.685 9.851 -7.021 1.00 0.00 O ATOM 0 H GLY A 27 -12.843 10.951 -5.010 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.122 11.228 -7.246 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.220 12.729 -7.188 1.00 0.00 H new ATOM 414 N GLN A 28 -10.277 11.622 -8.346 1.00 0.00 N ATOM 415 CA GLN A 28 -9.043 11.085 -8.896 1.00 0.00 C ATOM 416 C GLN A 28 -7.926 11.103 -7.848 1.00 0.00 C ATOM 417 O GLN A 28 -6.859 10.537 -8.080 1.00 0.00 O ATOM 418 CB GLN A 28 -8.668 11.892 -10.140 1.00 0.00 C ATOM 419 CG GLN A 28 -7.537 11.218 -10.929 1.00 0.00 C ATOM 420 CD GLN A 28 -7.237 11.942 -12.236 1.00 0.00 C ATOM 421 OE1 GLN A 28 -7.982 12.811 -12.680 1.00 0.00 O ATOM 422 NE2 GLN A 28 -6.125 11.579 -12.875 1.00 0.00 N ATOM 0 H GLN A 28 -10.545 12.528 -8.730 1.00 0.00 H new ATOM 0 HA GLN A 28 -9.187 10.043 -9.182 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.543 12.003 -10.780 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.359 12.895 -9.845 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.636 11.189 -10.316 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -7.811 10.185 -11.142 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.525 10.854 -12.482 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -5.874 12.026 -13.757 1.00 0.00 H new ATOM 431 N GLN A 29 -8.158 11.743 -6.693 1.00 0.00 N ATOM 432 CA GLN A 29 -7.177 11.765 -5.616 1.00 0.00 C ATOM 433 C GLN A 29 -7.506 10.678 -4.599 1.00 0.00 C ATOM 434 O GLN A 29 -8.627 10.172 -4.555 1.00 0.00 O ATOM 435 CB GLN A 29 -7.156 13.114 -4.898 1.00 0.00 C ATOM 436 CG GLN A 29 -6.945 14.300 -5.837 1.00 0.00 C ATOM 437 CD GLN A 29 -6.785 15.583 -5.040 1.00 0.00 C ATOM 438 OE1 GLN A 29 -7.715 16.373 -4.910 1.00 0.00 O ATOM 439 NE2 GLN A 29 -5.589 15.792 -4.500 1.00 0.00 N ATOM 0 H GLN A 29 -9.019 12.250 -6.488 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.197 11.592 -6.061 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -8.096 13.247 -4.363 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.363 13.107 -4.151 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.060 14.133 -6.451 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.793 14.390 -6.517 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.843 15.109 -4.633 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.417 16.635 -3.953 1.00 0.00 H new ATOM 448 N VAL A 30 -6.521 10.321 -3.773 1.00 0.00 N ATOM 449 CA VAL A 30 -6.629 9.231 -2.810 1.00 0.00 C ATOM 450 C VAL A 30 -5.858 9.565 -1.535 1.00 0.00 C ATOM 451 O VAL A 30 -4.829 10.239 -1.586 1.00 0.00 O ATOM 452 CB VAL A 30 -6.079 7.955 -3.465 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.973 6.822 -2.452 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.987 7.488 -4.600 1.00 0.00 C ATOM 0 H VAL A 30 -5.615 10.789 -3.756 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.672 9.080 -2.530 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.091 8.200 -3.854 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.581 5.931 -2.942 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.302 7.117 -1.645 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.960 6.606 -2.043 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.575 6.583 -5.047 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.982 7.278 -4.207 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.053 8.269 -5.358 1.00 0.00 H new ATOM 464 N ARG A 31 -6.363 9.090 -0.390 1.00 0.00 N ATOM 465 CA ARG A 31 -5.767 9.284 0.926 1.00 0.00 C ATOM 466 C ARG A 31 -5.423 7.919 1.498 1.00 0.00 C ATOM 467 O ARG A 31 -6.301 7.078 1.695 1.00 0.00 O ATOM 468 CB ARG A 31 -6.761 10.024 1.834 1.00 0.00 C ATOM 469 CG ARG A 31 -6.313 11.451 2.162 1.00 0.00 C ATOM 470 CD ARG A 31 -5.185 11.468 3.205 1.00 0.00 C ATOM 471 NE ARG A 31 -4.738 12.844 3.466 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.425 13.746 4.177 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.586 13.445 4.752 1.00 0.00 N ATOM 474 NH2 ARG A 31 -4.956 14.978 4.327 1.00 0.00 N ATOM 0 H ARG A 31 -7.224 8.544 -0.359 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.860 9.885 0.855 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.736 10.056 1.348 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.886 9.465 2.761 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.974 11.944 1.251 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -7.163 12.022 2.536 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -5.533 11.012 4.132 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.346 10.869 2.850 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.840 13.132 3.077 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.974 12.507 4.657 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -7.088 14.153 5.288 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.068 15.241 3.899 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.483 15.662 4.870 1.00 0.00 H new ATOM 488 N ILE A 32 -4.136 7.699 1.765 1.00 0.00 N ATOM 489 CA ILE A 32 -3.638 6.414 2.237 1.00 0.00 C ATOM 490 C ILE A 32 -2.673 6.625 3.396 1.00 0.00 C ATOM 491 O ILE A 32 -2.079 7.690 3.538 1.00 0.00 O ATOM 492 CB ILE A 32 -2.932 5.657 1.103 1.00 0.00 C ATOM 493 CG1 ILE A 32 -2.002 6.589 0.318 1.00 0.00 C ATOM 494 CG2 ILE A 32 -3.976 5.016 0.190 1.00 0.00 C ATOM 495 CD1 ILE A 32 -1.243 5.843 -0.775 1.00 0.00 C ATOM 0 H ILE A 32 -3.411 8.409 1.659 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.486 5.819 2.577 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.312 4.870 1.532 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.586 7.393 -0.129 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.291 7.054 1.002 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.475 4.479 -0.615 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.585 4.320 0.767 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.614 5.792 -0.234 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.595 6.539 -1.308 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.638 5.056 -0.325 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.953 5.401 -1.474 1.00 0.00 H new ATOM 507 N GLY A 33 -2.529 5.590 4.226 1.00 0.00 N ATOM 508 CA GLY A 33 -1.669 5.644 5.394 1.00 0.00 C ATOM 509 C GLY A 33 -0.734 4.448 5.420 1.00 0.00 C ATOM 510 O GLY A 33 -0.943 3.460 4.715 1.00 0.00 O ATOM 0 H GLY A 33 -3.006 4.697 4.102 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -1.089 6.567 5.384 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.276 5.659 6.299 1.00 0.00 H new ATOM 514 N ILE A 34 0.308 4.547 6.247 1.00 0.00 N ATOM 515 CA ILE A 34 1.376 3.566 6.324 1.00 0.00 C ATOM 516 C ILE A 34 1.706 3.352 7.795 1.00 0.00 C ATOM 517 O ILE A 34 1.757 4.309 8.570 1.00 0.00 O ATOM 518 CB ILE A 34 2.608 4.106 5.590 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.262 4.389 4.126 1.00 0.00 C ATOM 520 CG2 ILE A 34 3.765 3.106 5.681 1.00 0.00 C ATOM 521 CD1 ILE A 34 3.400 5.111 3.407 1.00 0.00 C ATOM 0 H ILE A 34 0.430 5.328 6.891 1.00 0.00 H new ATOM 0 HA ILE A 34 1.074 2.625 5.864 1.00 0.00 H new ATOM 0 HB ILE A 34 2.920 5.037 6.064 1.00 0.00 H new ATOM 0 HG12 ILE A 34 2.046 3.451 3.615 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.357 4.995 4.076 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.632 3.504 5.155 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.020 2.939 6.727 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.466 2.162 5.226 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.117 5.294 2.370 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.599 6.061 3.903 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.298 4.493 3.434 1.00 0.00 H new ATOM 533 N ASN A 35 1.931 2.096 8.167 1.00 0.00 N ATOM 534 CA ASN A 35 2.180 1.713 9.539 1.00 0.00 C ATOM 535 C ASN A 35 3.400 0.801 9.585 1.00 0.00 C ATOM 536 O ASN A 35 3.318 -0.403 9.824 1.00 0.00 O ATOM 537 CB ASN A 35 0.929 1.073 10.120 1.00 0.00 C ATOM 538 CG ASN A 35 0.899 1.144 11.642 1.00 0.00 C ATOM 539 OD1 ASN A 35 1.907 0.930 12.307 1.00 0.00 O ATOM 540 ND2 ASN A 35 -0.269 1.452 12.197 1.00 0.00 N ATOM 0 H ASN A 35 1.944 1.313 7.513 1.00 0.00 H new ATOM 0 HA ASN A 35 2.404 2.582 10.157 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.047 1.572 9.717 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.877 0.031 9.806 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -0.350 1.518 13.212 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.084 1.623 11.608 1.00 0.00 H new ATOM 547 N ALA A 36 4.547 1.434 9.342 1.00 0.00 N ATOM 548 CA ALA A 36 5.868 0.841 9.429 1.00 0.00 C ATOM 549 C ALA A 36 6.617 1.531 10.563 1.00 0.00 C ATOM 550 O ALA A 36 6.264 2.652 10.934 1.00 0.00 O ATOM 551 CB ALA A 36 6.589 1.066 8.101 1.00 0.00 C ATOM 0 H ALA A 36 4.575 2.416 9.068 1.00 0.00 H new ATOM 0 HA ALA A 36 5.812 -0.230 9.626 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.585 0.626 8.149 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.023 0.597 7.296 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.674 2.136 7.910 1.00 0.00 H new ATOM 557 N PRO A 37 7.645 0.888 11.124 1.00 0.00 N ATOM 558 CA PRO A 37 8.392 1.458 12.219 1.00 0.00 C ATOM 559 C PRO A 37 9.198 2.633 11.698 1.00 0.00 C ATOM 560 O PRO A 37 9.620 2.638 10.544 1.00 0.00 O ATOM 561 CB PRO A 37 9.286 0.324 12.729 1.00 0.00 C ATOM 562 CG PRO A 37 9.483 -0.555 11.494 1.00 0.00 C ATOM 563 CD PRO A 37 8.159 -0.411 10.754 1.00 0.00 C ATOM 0 HA PRO A 37 7.765 1.837 13.026 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.235 0.701 13.109 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.813 -0.226 13.542 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.323 -0.216 10.888 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.683 -1.592 11.765 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.303 -0.483 9.676 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.464 -1.202 11.036 1.00 0.00 H new ATOM 571 N LYS A 38 9.416 3.641 12.544 1.00 0.00 N ATOM 572 CA LYS A 38 10.179 4.816 12.153 1.00 0.00 C ATOM 573 C LYS A 38 11.652 4.449 11.956 1.00 0.00 C ATOM 574 O LYS A 38 12.465 5.304 11.612 1.00 0.00 O ATOM 575 CB LYS A 38 9.962 5.927 13.179 1.00 0.00 C ATOM 576 CG LYS A 38 8.451 6.152 13.310 1.00 0.00 C ATOM 577 CD LYS A 38 8.115 7.368 14.166 1.00 0.00 C ATOM 578 CE LYS A 38 6.596 7.450 14.331 1.00 0.00 C ATOM 579 NZ LYS A 38 6.202 8.620 15.138 1.00 0.00 N ATOM 0 H LYS A 38 9.072 3.662 13.504 1.00 0.00 H new ATOM 0 HA LYS A 38 9.829 5.195 11.193 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.392 5.648 14.141 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.459 6.844 12.861 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.018 6.279 12.318 1.00 0.00 H new ATOM 0 HG3 LYS A 38 7.991 5.266 13.747 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.597 7.288 15.141 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.493 8.276 13.697 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.125 7.508 13.350 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.231 6.539 14.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.166 8.645 15.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.632 8.551 16.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.529 9.490 14.671 1.00 0.00 H new ATOM 593 N ASP A 39 11.985 3.175 12.180 1.00 0.00 N ATOM 594 CA ASP A 39 13.306 2.624 11.933 1.00 0.00 C ATOM 595 C ASP A 39 13.506 2.288 10.452 1.00 0.00 C ATOM 596 O ASP A 39 14.635 2.025 10.042 1.00 0.00 O ATOM 597 CB ASP A 39 13.483 1.362 12.784 1.00 0.00 C ATOM 598 CG ASP A 39 13.406 1.687 14.271 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.428 2.166 14.812 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.327 1.455 14.857 1.00 0.00 O ATOM 0 H ASP A 39 11.325 2.489 12.546 1.00 0.00 H new ATOM 0 HA ASP A 39 14.052 3.371 12.205 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.712 0.635 12.527 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.444 0.900 12.559 1.00 0.00 H new ATOM 605 N VAL A 40 12.440 2.291 9.639 1.00 0.00 N ATOM 606 CA VAL A 40 12.570 2.111 8.198 1.00 0.00 C ATOM 607 C VAL A 40 12.033 3.338 7.464 1.00 0.00 C ATOM 608 O VAL A 40 11.068 3.968 7.895 1.00 0.00 O ATOM 609 CB VAL A 40 11.878 0.832 7.711 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.441 -0.388 8.437 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.363 0.883 7.894 1.00 0.00 C ATOM 0 H VAL A 40 11.480 2.417 9.961 1.00 0.00 H new ATOM 0 HA VAL A 40 13.631 2.001 7.972 1.00 0.00 H new ATOM 0 HB VAL A 40 12.080 0.752 6.643 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.939 -1.287 8.080 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.510 -0.467 8.241 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.276 -0.282 9.509 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.922 -0.046 7.534 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.128 1.010 8.951 1.00 0.00 H new ATOM 0 HG23 VAL A 40 9.956 1.721 7.328 1.00 0.00 H new ATOM 621 N ALA A 41 12.679 3.667 6.344 1.00 0.00 N ATOM 622 CA ALA A 41 12.353 4.841 5.555 1.00 0.00 C ATOM 623 C ALA A 41 11.006 4.682 4.854 1.00 0.00 C ATOM 624 O ALA A 41 10.651 3.590 4.410 1.00 0.00 O ATOM 625 CB ALA A 41 13.458 5.045 4.522 1.00 0.00 C ATOM 0 H ALA A 41 13.448 3.117 5.962 1.00 0.00 H new ATOM 0 HA ALA A 41 12.279 5.707 6.213 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.233 5.923 3.917 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.410 5.190 5.032 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.521 4.168 3.878 1.00 0.00 H new ATOM 631 N VAL A 42 10.263 5.786 4.765 1.00 0.00 N ATOM 632 CA VAL A 42 8.973 5.848 4.096 1.00 0.00 C ATOM 633 C VAL A 42 8.813 7.244 3.507 1.00 0.00 C ATOM 634 O VAL A 42 8.874 8.231 4.241 1.00 0.00 O ATOM 635 CB VAL A 42 7.850 5.578 5.101 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.502 5.638 4.397 1.00 0.00 C ATOM 637 CG2 VAL A 42 7.967 4.199 5.754 1.00 0.00 C ATOM 0 H VAL A 42 10.552 6.678 5.166 1.00 0.00 H new ATOM 0 HA VAL A 42 8.921 5.096 3.309 1.00 0.00 H new ATOM 0 HB VAL A 42 7.935 6.343 5.873 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.707 5.445 5.117 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.364 6.627 3.960 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.469 4.885 3.609 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.146 4.059 6.458 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.922 3.427 4.985 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.916 4.127 6.285 1.00 0.00 H new ATOM 647 N HIS A 43 8.613 7.318 2.185 1.00 0.00 N ATOM 648 CA HIS A 43 8.572 8.568 1.431 1.00 0.00 C ATOM 649 C HIS A 43 7.631 8.445 0.236 1.00 0.00 C ATOM 650 O HIS A 43 7.039 7.387 0.030 1.00 0.00 O ATOM 651 CB HIS A 43 9.981 8.899 0.920 1.00 0.00 C ATOM 652 CG HIS A 43 11.036 9.001 1.990 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.413 10.170 2.647 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.778 7.960 2.474 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.371 9.808 3.514 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.614 8.488 3.429 1.00 0.00 N ATOM 0 H HIS A 43 8.473 6.492 1.603 1.00 0.00 H new ATOM 0 HA HIS A 43 8.211 9.359 2.089 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.282 8.133 0.205 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.942 9.843 0.377 1.00 0.00 H new ATOM 0 HD1 HIS A 43 11.038 11.107 2.500 1.00 0.00 H new ATOM 0 HD2 HIS A 43 11.719 6.926 2.167 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.877 10.484 4.187 1.00 0.00 H new ATOM 664 N ARG A 44 7.485 9.512 -0.564 1.00 0.00 N ATOM 665 CA ARG A 44 6.687 9.445 -1.784 1.00 0.00 C ATOM 666 C ARG A 44 7.595 9.459 -3.013 1.00 0.00 C ATOM 667 O ARG A 44 8.727 9.935 -2.936 1.00 0.00 O ATOM 668 CB ARG A 44 5.561 10.495 -1.789 1.00 0.00 C ATOM 669 CG ARG A 44 5.824 11.861 -2.434 1.00 0.00 C ATOM 670 CD ARG A 44 6.516 12.887 -1.534 1.00 0.00 C ATOM 671 NE ARG A 44 6.419 14.223 -2.132 1.00 0.00 N ATOM 672 CZ ARG A 44 6.574 15.377 -1.476 1.00 0.00 C ATOM 673 NH1 ARG A 44 6.815 15.405 -0.168 1.00 0.00 N ATOM 674 NH2 ARG A 44 6.484 16.522 -2.145 1.00 0.00 N ATOM 0 H ARG A 44 7.908 10.423 -0.385 1.00 0.00 H new ATOM 0 HA ARG A 44 6.158 8.493 -1.821 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.701 10.053 -2.292 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.269 10.670 -0.753 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.435 11.712 -3.324 1.00 0.00 H new ATOM 0 HG3 ARG A 44 4.873 12.277 -2.766 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.055 12.887 -0.546 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.563 12.616 -1.397 1.00 0.00 H new ATOM 0 HE ARG A 44 6.217 14.276 -3.130 1.00 0.00 H new ATOM 0 HH11 ARG A 44 6.885 14.533 0.356 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.930 16.299 0.310 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.298 16.513 -3.148 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.600 17.409 -1.655 1.00 0.00 H new ATOM 688 N GLU A 45 7.116 8.941 -4.149 1.00 0.00 N ATOM 689 CA GLU A 45 7.965 8.743 -5.322 1.00 0.00 C ATOM 690 C GLU A 45 8.536 10.049 -5.870 1.00 0.00 C ATOM 691 O GLU A 45 9.567 10.037 -6.536 1.00 0.00 O ATOM 692 CB GLU A 45 7.205 7.968 -6.401 1.00 0.00 C ATOM 693 CG GLU A 45 6.179 8.826 -7.154 1.00 0.00 C ATOM 694 CD GLU A 45 6.797 9.630 -8.298 1.00 0.00 C ATOM 695 OE1 GLU A 45 7.535 9.026 -9.108 1.00 0.00 O ATOM 696 OE2 GLU A 45 6.522 10.849 -8.354 1.00 0.00 O ATOM 0 H GLU A 45 6.146 8.653 -4.278 1.00 0.00 H new ATOM 0 HA GLU A 45 8.824 8.152 -5.003 1.00 0.00 H new ATOM 0 HB2 GLU A 45 7.919 7.557 -7.115 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.694 7.123 -5.940 1.00 0.00 H new ATOM 0 HG2 GLU A 45 5.396 8.180 -7.552 1.00 0.00 H new ATOM 0 HG3 GLU A 45 5.701 9.510 -6.453 1.00 0.00 H new ATOM 703 N GLU A 46 7.871 11.174 -5.597 1.00 0.00 N ATOM 704 CA GLU A 46 8.320 12.493 -6.015 1.00 0.00 C ATOM 705 C GLU A 46 9.567 12.906 -5.229 1.00 0.00 C ATOM 706 O GLU A 46 10.196 13.917 -5.539 1.00 0.00 O ATOM 707 CB GLU A 46 7.167 13.475 -5.771 1.00 0.00 C ATOM 708 CG GLU A 46 7.443 14.881 -6.303 1.00 0.00 C ATOM 709 CD GLU A 46 6.241 15.785 -6.043 1.00 0.00 C ATOM 710 OE1 GLU A 46 5.944 16.018 -4.848 1.00 0.00 O ATOM 711 OE2 GLU A 46 5.632 16.238 -7.033 1.00 0.00 O ATOM 0 H GLU A 46 6.996 11.189 -5.073 1.00 0.00 H new ATOM 0 HA GLU A 46 8.590 12.489 -7.071 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.264 13.087 -6.242 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.969 13.532 -4.701 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.329 15.293 -5.821 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.652 14.839 -7.372 1.00 0.00 H new ATOM 718 N ILE A 47 9.926 12.124 -4.209 1.00 0.00 N ATOM 719 CA ILE A 47 10.977 12.481 -3.271 1.00 0.00 C ATOM 720 C ILE A 47 11.989 11.363 -3.051 1.00 0.00 C ATOM 721 O ILE A 47 13.101 11.617 -2.594 1.00 0.00 O ATOM 722 CB ILE A 47 10.301 12.932 -1.973 1.00 0.00 C ATOM 723 CG1 ILE A 47 9.848 14.383 -2.186 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.179 12.758 -0.732 1.00 0.00 C ATOM 725 CD1 ILE A 47 9.931 15.219 -0.914 1.00 0.00 C ATOM 0 H ILE A 47 9.490 11.222 -4.015 1.00 0.00 H new ATOM 0 HA ILE A 47 11.572 13.296 -3.683 1.00 0.00 H new ATOM 0 HB ILE A 47 9.443 12.292 -1.764 1.00 0.00 H new ATOM 0 HG12 ILE A 47 10.465 14.842 -2.958 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.822 14.389 -2.553 1.00 0.00 H new ATOM 0 HG21 ILE A 47 10.635 13.098 0.149 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.439 11.706 -0.615 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.090 13.346 -0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.599 16.236 -1.124 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.292 14.780 -0.148 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.961 15.240 -0.559 1.00 0.00 H new ATOM 737 N TYR A 48 11.635 10.118 -3.367 1.00 0.00 N ATOM 738 CA TYR A 48 12.573 9.019 -3.192 1.00 0.00 C ATOM 739 C TYR A 48 13.734 9.178 -4.169 1.00 0.00 C ATOM 740 O TYR A 48 14.861 8.775 -3.879 1.00 0.00 O ATOM 741 CB TYR A 48 11.865 7.692 -3.424 1.00 0.00 C ATOM 742 CG TYR A 48 12.834 6.537 -3.451 1.00 0.00 C ATOM 743 CD1 TYR A 48 13.312 5.994 -2.249 1.00 0.00 C ATOM 744 CD2 TYR A 48 13.265 6.019 -4.677 1.00 0.00 C ATOM 745 CE1 TYR A 48 14.221 4.931 -2.272 1.00 0.00 C ATOM 746 CE2 TYR A 48 14.174 4.951 -4.715 1.00 0.00 C ATOM 747 CZ TYR A 48 14.650 4.396 -3.508 1.00 0.00 C ATOM 748 OH TYR A 48 15.520 3.345 -3.534 1.00 0.00 O ATOM 0 H TYR A 48 10.723 9.852 -3.738 1.00 0.00 H new ATOM 0 HA TYR A 48 12.962 9.033 -2.174 1.00 0.00 H new ATOM 0 HB2 TYR A 48 11.129 7.530 -2.637 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.320 7.731 -4.367 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.978 6.397 -1.305 1.00 0.00 H new ATOM 0 HD2 TYR A 48 12.896 6.443 -5.599 1.00 0.00 H new ATOM 0 HE1 TYR A 48 14.595 4.519 -1.346 1.00 0.00 H new ATOM 0 HE2 TYR A 48 14.508 4.556 -5.663 1.00 0.00 H new ATOM 0 HH TYR A 48 15.710 3.101 -4.464 1.00 0.00 H new ATOM 758 N GLN A 49 13.446 9.771 -5.329 1.00 0.00 N ATOM 759 CA GLN A 49 14.434 10.000 -6.369 1.00 0.00 C ATOM 760 C GLN A 49 15.457 11.043 -5.915 1.00 0.00 C ATOM 761 O GLN A 49 16.527 11.159 -6.505 1.00 0.00 O ATOM 762 CB GLN A 49 13.712 10.481 -7.630 1.00 0.00 C ATOM 763 CG GLN A 49 12.655 9.453 -8.045 1.00 0.00 C ATOM 764 CD GLN A 49 11.877 9.898 -9.275 1.00 0.00 C ATOM 765 OE1 GLN A 49 12.453 10.168 -10.328 1.00 0.00 O ATOM 766 NE2 GLN A 49 10.555 9.976 -9.148 1.00 0.00 N ATOM 0 H GLN A 49 12.513 10.106 -5.569 1.00 0.00 H new ATOM 0 HA GLN A 49 14.968 9.073 -6.578 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.241 11.446 -7.445 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.429 10.626 -8.438 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.139 8.498 -8.248 1.00 0.00 H new ATOM 0 HG3 GLN A 49 11.964 9.290 -7.218 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.114 9.744 -8.258 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.983 10.268 -9.940 1.00 0.00 H new ATOM 775 N ARG A 50 15.123 11.802 -4.863 1.00 0.00 N ATOM 776 CA ARG A 50 16.026 12.781 -4.276 1.00 0.00 C ATOM 777 C ARG A 50 16.987 12.078 -3.328 1.00 0.00 C ATOM 778 O ARG A 50 18.198 12.275 -3.373 1.00 0.00 O ATOM 779 CB ARG A 50 15.242 13.788 -3.423 1.00 0.00 C ATOM 780 CG ARG A 50 13.972 14.306 -4.083 1.00 0.00 C ATOM 781 CD ARG A 50 13.259 15.295 -3.161 1.00 0.00 C ATOM 782 NE ARG A 50 12.317 16.124 -3.918 1.00 0.00 N ATOM 783 CZ ARG A 50 11.726 17.233 -3.457 1.00 0.00 C ATOM 784 NH1 ARG A 50 11.950 17.662 -2.218 1.00 0.00 N ATOM 785 NH2 ARG A 50 10.902 17.921 -4.241 1.00 0.00 N ATOM 0 H ARG A 50 14.216 11.749 -4.400 1.00 0.00 H new ATOM 0 HA ARG A 50 16.550 13.283 -5.089 1.00 0.00 H new ATOM 0 HB2 ARG A 50 14.980 13.318 -2.475 1.00 0.00 H new ATOM 0 HB3 ARG A 50 15.889 14.634 -3.192 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.217 14.791 -5.028 1.00 0.00 H new ATOM 0 HG3 ARG A 50 13.309 13.473 -4.315 1.00 0.00 H new ATOM 0 HD2 ARG A 50 12.727 14.752 -2.380 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.992 15.930 -2.665 1.00 0.00 H new ATOM 0 HE ARG A 50 12.094 15.833 -4.870 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.580 17.144 -1.605 1.00 0.00 H new ATOM 0 HH12 ARG A 50 11.492 18.509 -1.881 1.00 0.00 H new ATOM 0 HH21 ARG A 50 10.720 17.604 -5.193 1.00 0.00 H new ATOM 0 HH22 ARG A 50 10.451 18.766 -3.890 1.00 0.00 H new ATOM 799 N ILE A 51 16.395 11.249 -2.470 1.00 0.00 N ATOM 800 CA ILE A 51 17.039 10.626 -1.331 1.00 0.00 C ATOM 801 C ILE A 51 18.084 9.605 -1.756 1.00 0.00 C ATOM 802 O ILE A 51 19.240 9.687 -1.345 1.00 0.00 O ATOM 803 CB ILE A 51 15.930 9.983 -0.499 1.00 0.00 C ATOM 804 CG1 ILE A 51 15.024 11.094 0.037 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.487 9.174 0.668 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.689 10.515 0.468 1.00 0.00 C ATOM 0 H ILE A 51 15.413 10.987 -2.559 1.00 0.00 H new ATOM 0 HA ILE A 51 17.581 11.369 -0.746 1.00 0.00 H new ATOM 0 HB ILE A 51 15.373 9.295 -1.136 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.504 11.590 0.881 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.870 11.851 -0.732 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.664 8.735 1.232 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.130 8.380 0.287 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.066 9.828 1.320 1.00 0.00 H new ATOM 0 HD11 ILE A 51 13.052 11.314 0.848 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.206 10.040 -0.386 1.00 0.00 H new ATOM 0 HD13 ILE A 51 13.849 9.775 1.252 1.00 0.00 H new ATOM 818 N GLN A 52 17.693 8.637 -2.585 1.00 0.00 N ATOM 819 CA GLN A 52 18.590 7.542 -2.932 1.00 0.00 C ATOM 820 C GLN A 52 19.540 7.918 -4.064 1.00 0.00 C ATOM 821 O GLN A 52 20.217 7.057 -4.623 1.00 0.00 O ATOM 822 CB GLN A 52 17.782 6.265 -3.170 1.00 0.00 C ATOM 823 CG GLN A 52 17.240 5.791 -1.816 1.00 0.00 C ATOM 824 CD GLN A 52 18.351 5.698 -0.777 1.00 0.00 C ATOM 825 OE1 GLN A 52 19.373 5.047 -0.995 1.00 0.00 O ATOM 826 NE2 GLN A 52 18.158 6.356 0.361 1.00 0.00 N ATOM 0 H GLN A 52 16.773 8.591 -3.022 1.00 0.00 H new ATOM 0 HA GLN A 52 19.253 7.334 -2.092 1.00 0.00 H new ATOM 0 HB2 GLN A 52 16.963 6.456 -3.863 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.409 5.495 -3.621 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.471 6.480 -1.468 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.766 4.817 -1.933 1.00 0.00 H new ATOM 0 HE21 GLN A 52 17.298 6.885 0.505 1.00 0.00 H new ATOM 0 HE22 GLN A 52 18.870 6.332 1.091 1.00 0.00 H new ATOM 835 N ALA A 53 19.597 9.211 -4.402 1.00 0.00 N ATOM 836 CA ALA A 53 20.576 9.716 -5.345 1.00 0.00 C ATOM 837 C ALA A 53 21.973 9.752 -4.716 1.00 0.00 C ATOM 838 O ALA A 53 22.964 9.809 -5.444 1.00 0.00 O ATOM 839 CB ALA A 53 20.161 11.115 -5.798 1.00 0.00 C ATOM 0 H ALA A 53 18.969 9.923 -4.029 1.00 0.00 H new ATOM 0 HA ALA A 53 20.616 9.050 -6.207 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.894 11.500 -6.507 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.183 11.067 -6.277 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.110 11.777 -4.934 1.00 0.00 H new ATOM 845 N GLY A 54 22.062 9.718 -3.379 1.00 0.00 N ATOM 846 CA GLY A 54 23.353 9.701 -2.697 1.00 0.00 C ATOM 847 C GLY A 54 23.365 10.551 -1.428 1.00 0.00 C ATOM 848 O GLY A 54 24.440 10.821 -0.890 1.00 0.00 O ATOM 0 H GLY A 54 21.255 9.702 -2.755 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.610 8.673 -2.442 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.123 10.063 -3.378 1.00 0.00 H new ATOM 852 N LEU A 55 22.195 10.975 -0.942 1.00 0.00 N ATOM 853 CA LEU A 55 22.067 11.876 0.197 1.00 0.00 C ATOM 854 C LEU A 55 20.937 11.430 1.126 1.00 0.00 C ATOM 855 O LEU A 55 20.426 10.319 1.002 1.00 0.00 O ATOM 856 CB LEU A 55 21.856 13.294 -0.346 1.00 0.00 C ATOM 857 CG LEU A 55 20.671 13.403 -1.315 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.326 13.290 -0.602 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.735 14.752 -2.019 1.00 0.00 C ATOM 0 H LEU A 55 21.298 10.695 -1.338 1.00 0.00 H new ATOM 0 HA LEU A 55 22.973 11.858 0.803 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.697 13.976 0.490 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.763 13.620 -0.855 1.00 0.00 H new ATOM 0 HG LEU A 55 20.746 12.578 -2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.520 13.373 -1.331 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.261 12.326 -0.098 1.00 0.00 H new ATOM 0 HD13 LEU A 55 19.235 14.090 0.133 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.897 14.841 -2.711 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.682 15.551 -1.280 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.672 14.830 -2.571 1.00 0.00 H new ATOM 871 N THR A 56 20.542 12.300 2.063 1.00 0.00 N ATOM 872 CA THR A 56 19.436 12.025 2.974 1.00 0.00 C ATOM 873 C THR A 56 18.604 13.293 3.192 1.00 0.00 C ATOM 874 O THR A 56 18.966 14.366 2.707 1.00 0.00 O ATOM 875 CB THR A 56 19.962 11.465 4.299 1.00 0.00 C ATOM 876 OG1 THR A 56 20.869 12.367 4.891 1.00 0.00 O ATOM 877 CG2 THR A 56 20.659 10.125 4.081 1.00 0.00 C ATOM 0 H THR A 56 20.981 13.209 2.207 1.00 0.00 H new ATOM 0 HA THR A 56 18.788 11.270 2.529 1.00 0.00 H new ATOM 0 HB THR A 56 19.109 11.321 4.962 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.195 11.995 5.737 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.025 9.746 5.035 1.00 0.00 H new ATOM 0 HG22 THR A 56 19.953 9.413 3.654 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.498 10.258 3.398 1.00 0.00 H new ATOM 885 N ALA A 57 17.487 13.169 3.918 1.00 0.00 N ATOM 886 CA ALA A 57 16.562 14.271 4.167 1.00 0.00 C ATOM 887 C ALA A 57 17.275 15.515 4.703 1.00 0.00 C ATOM 888 O ALA A 57 18.293 15.406 5.392 1.00 0.00 O ATOM 889 CB ALA A 57 15.505 13.807 5.165 1.00 0.00 C ATOM 0 H ALA A 57 17.201 12.291 4.351 1.00 0.00 H new ATOM 0 HA ALA A 57 16.100 14.551 3.220 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.807 14.621 5.360 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.964 12.956 4.752 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.988 13.512 6.096 1.00 0.00 H new ATOM 895 N PRO A 58 16.740 16.704 4.391 1.00 0.00 N ATOM 896 CA PRO A 58 17.273 17.980 4.836 1.00 0.00 C ATOM 897 C PRO A 58 16.880 18.255 6.281 1.00 0.00 C ATOM 898 O PRO A 58 16.025 17.583 6.855 1.00 0.00 O ATOM 899 CB PRO A 58 16.630 19.011 3.911 1.00 0.00 C ATOM 900 CG PRO A 58 15.265 18.392 3.614 1.00 0.00 C ATOM 901 CD PRO A 58 15.563 16.893 3.567 1.00 0.00 C ATOM 0 HA PRO A 58 18.362 18.004 4.797 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.537 19.984 4.392 1.00 0.00 H new ATOM 0 HB3 PRO A 58 17.214 19.159 3.002 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.537 18.633 4.388 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.857 18.751 2.669 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.721 16.314 3.947 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.743 16.561 2.545 1.00 0.00 H new ATOM 909 N ASP A 59 17.526 19.263 6.866 1.00 0.00 N ATOM 910 CA ASP A 59 17.209 19.762 8.189 1.00 0.00 C ATOM 911 C ASP A 59 15.789 20.337 8.202 1.00 0.00 C ATOM 912 O ASP A 59 15.190 20.548 7.146 1.00 0.00 O ATOM 913 CB ASP A 59 18.261 20.814 8.534 1.00 0.00 C ATOM 914 CG ASP A 59 17.989 21.496 9.869 1.00 0.00 C ATOM 915 OD1 ASP A 59 18.213 20.837 10.908 1.00 0.00 O ATOM 916 OD2 ASP A 59 17.555 22.670 9.845 1.00 0.00 O ATOM 0 H ASP A 59 18.297 19.760 6.420 1.00 0.00 H new ATOM 0 HA ASP A 59 17.230 18.969 8.937 1.00 0.00 H new ATOM 0 HB2 ASP A 59 19.244 20.344 8.564 1.00 0.00 H new ATOM 0 HB3 ASP A 59 18.291 21.566 7.745 1.00 0.00 H new ATOM 1635 N MET C 1 1.602 7.383 12.878 1.00 0.00 N ATOM 1636 CA MET C 1 1.288 6.775 11.569 1.00 0.00 C ATOM 1637 C MET C 1 1.490 7.805 10.463 1.00 0.00 C ATOM 1638 O MET C 1 1.089 8.955 10.624 1.00 0.00 O ATOM 1639 CB MET C 1 -0.151 6.247 11.567 1.00 0.00 C ATOM 1640 CG MET C 1 -0.341 5.223 10.450 1.00 0.00 C ATOM 1641 SD MET C 1 -1.961 4.410 10.438 1.00 0.00 S ATOM 1642 CE MET C 1 -2.998 5.810 9.949 1.00 0.00 C ATOM 0 H1 MET C 1 0.816 7.212 13.538 1.00 0.00 H new ATOM 0 H2 MET C 1 2.472 6.958 13.258 1.00 0.00 H new ATOM 0 H3 MET C 1 1.739 8.407 12.761 1.00 0.00 H new ATOM 0 HA MET C 1 1.959 5.935 11.389 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.379 5.790 12.530 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.848 7.074 11.433 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.191 5.719 9.491 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.433 4.460 10.539 1.00 0.00 H new ATOM 0 HE1 MET C 1 -4.030 5.477 9.839 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.946 6.586 10.713 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.643 6.212 9.000 1.00 0.00 H new ATOM 1654 N LEU C 2 2.107 7.412 9.343 1.00 0.00 N ATOM 1655 CA LEU C 2 2.431 8.343 8.270 1.00 0.00 C ATOM 1656 C LEU C 2 1.337 8.269 7.199 1.00 0.00 C ATOM 1657 O LEU C 2 0.964 7.176 6.775 1.00 0.00 O ATOM 1658 CB LEU C 2 3.813 7.949 7.716 1.00 0.00 C ATOM 1659 CG LEU C 2 4.598 9.049 6.979 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.602 8.389 6.035 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.736 10.005 6.170 1.00 0.00 C ATOM 0 H LEU C 2 2.391 6.449 9.161 1.00 0.00 H new ATOM 0 HA LEU C 2 2.473 9.374 8.622 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.424 7.592 8.545 1.00 0.00 H new ATOM 0 HB3 LEU C 2 3.680 7.110 7.034 1.00 0.00 H new ATOM 0 HG LEU C 2 5.082 9.646 7.752 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.165 9.159 5.507 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.289 7.768 6.610 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.070 7.769 5.314 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.371 10.746 5.685 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.186 9.447 5.412 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.031 10.509 6.832 1.00 0.00 H new ATOM 1673 N ILE C 3 0.820 9.419 6.760 1.00 0.00 N ATOM 1674 CA ILE C 3 -0.220 9.502 5.741 1.00 0.00 C ATOM 1675 C ILE C 3 0.323 10.305 4.569 1.00 0.00 C ATOM 1676 O ILE C 3 1.144 11.204 4.751 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.496 10.165 6.300 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.279 9.221 7.212 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.460 10.568 5.180 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.654 9.107 8.599 1.00 0.00 C ATOM 0 H ILE C 3 1.119 10.329 7.110 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.491 8.497 5.417 1.00 0.00 H new ATOM 0 HB ILE C 3 -1.146 11.037 6.852 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.305 9.578 7.306 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -2.326 8.233 6.754 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.347 11.031 5.612 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.968 11.277 4.514 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.752 9.683 4.615 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.246 8.426 9.210 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.637 8.724 8.510 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -1.631 10.090 9.070 1.00 0.00 H new ATOM 1692 N LEU C 4 -0.136 9.977 3.360 1.00 0.00 N ATOM 1693 CA LEU C 4 0.267 10.648 2.141 1.00 0.00 C ATOM 1694 C LEU C 4 -0.936 10.724 1.204 1.00 0.00 C ATOM 1695 O LEU C 4 -1.940 10.041 1.410 1.00 0.00 O ATOM 1696 CB LEU C 4 1.425 9.879 1.487 1.00 0.00 C ATOM 1697 CG LEU C 4 2.705 9.916 2.333 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.764 8.992 1.741 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.293 11.325 2.367 1.00 0.00 C ATOM 0 H LEU C 4 -0.808 9.225 3.207 1.00 0.00 H new ATOM 0 HA LEU C 4 0.612 11.658 2.360 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.126 8.842 1.330 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.630 10.304 0.504 1.00 0.00 H new ATOM 0 HG LEU C 4 2.436 9.595 3.339 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.665 9.031 2.354 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.384 7.971 1.719 1.00 0.00 H new ATOM 0 HD13 LEU C 4 4.001 9.313 0.727 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.199 11.326 2.972 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.534 11.643 1.353 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.566 12.012 2.800 1.00 0.00 H new ATOM 1711 N THR C 5 -0.830 11.560 0.170 1.00 0.00 N ATOM 1712 CA THR C 5 -1.902 11.752 -0.791 1.00 0.00 C ATOM 1713 C THR C 5 -1.342 11.558 -2.194 1.00 0.00 C ATOM 1714 O THR C 5 -0.240 12.012 -2.507 1.00 0.00 O ATOM 1715 CB THR C 5 -2.515 13.140 -0.603 1.00 0.00 C ATOM 1716 OG1 THR C 5 -3.100 13.215 0.678 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.595 13.460 -1.636 1.00 0.00 C ATOM 0 H THR C 5 0.002 12.119 -0.019 1.00 0.00 H new ATOM 0 HA THR C 5 -2.696 11.022 -0.637 1.00 0.00 H new ATOM 0 HB THR C 5 -1.708 13.863 -0.726 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.494 14.103 0.806 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.992 14.458 -1.450 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.164 13.421 -2.637 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.400 12.729 -1.559 1.00 0.00 H new ATOM 1725 N ARG C 6 -2.119 10.876 -3.032 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.718 10.476 -4.370 1.00 0.00 C ATOM 1727 C ARG C 6 -2.915 10.571 -5.302 1.00 0.00 C ATOM 1728 O ARG C 6 -4.033 10.826 -4.863 1.00 0.00 O ATOM 1729 CB ARG C 6 -1.222 9.023 -4.343 1.00 0.00 C ATOM 1730 CG ARG C 6 0.049 8.793 -3.514 1.00 0.00 C ATOM 1731 CD ARG C 6 1.325 9.184 -4.260 1.00 0.00 C ATOM 1732 NE ARG C 6 1.447 10.631 -4.443 1.00 0.00 N ATOM 1733 CZ ARG C 6 2.486 11.224 -5.032 1.00 0.00 C ATOM 1734 NH1 ARG C 6 3.541 10.513 -5.429 1.00 0.00 N ATOM 1735 NH2 ARG C 6 2.478 12.541 -5.225 1.00 0.00 N ATOM 0 H ARG C 6 -3.065 10.582 -2.790 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.921 11.131 -4.720 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -2.016 8.390 -3.948 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -1.035 8.698 -5.367 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -0.017 9.368 -2.591 1.00 0.00 H new ATOM 0 HG3 ARG C 6 0.107 7.742 -3.231 1.00 0.00 H new ATOM 0 HD2 ARG C 6 2.191 8.817 -3.709 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.336 8.696 -5.234 1.00 0.00 H new ATOM 0 HE ARG C 6 0.691 11.222 -4.099 1.00 0.00 H new ATOM 0 HH11 ARG C 6 3.560 9.504 -5.283 1.00 0.00 H new ATOM 0 HH12 ARG C 6 4.330 10.978 -5.878 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.677 13.096 -4.922 1.00 0.00 H new ATOM 0 HH22 ARG C 6 3.272 12.995 -5.675 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.670 10.359 -6.594 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.725 10.280 -7.590 1.00 0.00 C ATOM 1751 C LYS C 7 -3.482 9.058 -8.453 1.00 0.00 C ATOM 1752 O LYS C 7 -2.380 8.512 -8.457 1.00 0.00 O ATOM 1753 CB LYS C 7 -3.761 11.553 -8.437 1.00 0.00 C ATOM 1754 CG LYS C 7 -3.733 12.825 -7.591 1.00 0.00 C ATOM 1755 CD LYS C 7 -4.123 14.005 -8.478 1.00 0.00 C ATOM 1756 CE LYS C 7 -3.935 15.337 -7.754 1.00 0.00 C ATOM 1757 NZ LYS C 7 -4.336 16.463 -8.619 1.00 0.00 N ATOM 0 H LYS C 7 -1.732 10.238 -6.975 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.694 10.190 -7.099 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.910 11.556 -9.118 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -4.661 11.550 -9.052 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -4.423 12.737 -6.752 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -2.739 12.979 -7.171 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -3.519 13.995 -9.385 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -5.163 13.901 -8.787 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -4.528 15.346 -6.839 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -2.892 15.452 -7.459 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -4.200 17.359 -8.108 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -3.753 16.464 -9.480 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -5.338 16.361 -8.879 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.508 8.624 -9.185 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.414 7.440 -10.030 1.00 0.00 C ATOM 1773 C VAL C 8 -3.179 7.519 -10.928 1.00 0.00 C ATOM 1774 O VAL C 8 -3.094 8.390 -11.797 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.690 7.320 -10.868 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.568 6.134 -11.820 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.897 7.118 -9.951 1.00 0.00 C ATOM 0 H VAL C 8 -5.420 9.081 -9.207 1.00 0.00 H new ATOM 0 HA VAL C 8 -4.312 6.554 -9.404 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.827 8.235 -11.444 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.477 6.050 -12.415 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.714 6.284 -12.481 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.425 5.219 -11.245 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.801 7.033 -10.553 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.763 6.207 -9.368 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.988 7.970 -9.277 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.225 6.606 -10.713 1.00 0.00 N ATOM 1788 CA GLY C 9 -1.014 6.517 -11.523 1.00 0.00 C ATOM 1789 C GLY C 9 0.244 6.894 -10.744 1.00 0.00 C ATOM 1790 O GLY C 9 1.348 6.642 -11.222 1.00 0.00 O ATOM 0 H GLY C 9 -2.275 5.909 -9.970 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -0.910 5.501 -11.904 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -1.111 7.173 -12.388 1.00 0.00 H new ATOM 1794 N GLU C 10 0.098 7.493 -9.558 1.00 0.00 N ATOM 1795 CA GLU C 10 1.233 7.905 -8.741 1.00 0.00 C ATOM 1796 C GLU C 10 1.669 6.783 -7.798 1.00 0.00 C ATOM 1797 O GLU C 10 1.026 5.733 -7.731 1.00 0.00 O ATOM 1798 CB GLU C 10 0.874 9.172 -7.959 1.00 0.00 C ATOM 1799 CG GLU C 10 0.568 10.323 -8.917 1.00 0.00 C ATOM 1800 CD GLU C 10 0.381 11.642 -8.171 1.00 0.00 C ATOM 1801 OE1 GLU C 10 -0.149 11.594 -7.039 1.00 0.00 O ATOM 1802 OE2 GLU C 10 0.771 12.688 -8.739 1.00 0.00 O ATOM 0 H GLU C 10 -0.809 7.703 -9.142 1.00 0.00 H new ATOM 0 HA GLU C 10 2.075 8.124 -9.397 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.010 8.981 -7.323 1.00 0.00 H new ATOM 0 HB3 GLU C 10 1.699 9.447 -7.302 1.00 0.00 H new ATOM 0 HG2 GLU C 10 1.380 10.424 -9.637 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -0.334 10.094 -9.485 1.00 0.00 H new ATOM 1809 N SER C 11 2.766 7.003 -7.064 1.00 0.00 N ATOM 1810 CA SER C 11 3.408 5.950 -6.280 1.00 0.00 C ATOM 1811 C SER C 11 3.982 6.461 -4.960 1.00 0.00 C ATOM 1812 O SER C 11 4.072 7.667 -4.722 1.00 0.00 O ATOM 1813 CB SER C 11 4.523 5.301 -7.105 1.00 0.00 C ATOM 1814 OG SER C 11 4.014 4.716 -8.285 1.00 0.00 O ATOM 0 H SER C 11 3.228 7.910 -6.999 1.00 0.00 H new ATOM 0 HA SER C 11 2.638 5.218 -6.035 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.272 6.050 -7.362 1.00 0.00 H new ATOM 0 HB3 SER C 11 5.025 4.541 -6.507 1.00 0.00 H new ATOM 0 HG SER C 11 4.748 4.311 -8.792 1.00 0.00 H new ATOM 1820 N ILE C 12 4.366 5.503 -4.113 1.00 0.00 N ATOM 1821 CA ILE C 12 4.889 5.689 -2.769 1.00 0.00 C ATOM 1822 C ILE C 12 6.071 4.731 -2.615 1.00 0.00 C ATOM 1823 O ILE C 12 6.183 3.772 -3.378 1.00 0.00 O ATOM 1824 CB ILE C 12 3.778 5.351 -1.759 1.00 0.00 C ATOM 1825 CG1 ILE C 12 2.553 6.262 -1.904 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.280 5.411 -0.313 1.00 0.00 C ATOM 1827 CD1 ILE C 12 2.853 7.707 -1.512 1.00 0.00 C ATOM 0 H ILE C 12 4.314 4.517 -4.369 1.00 0.00 H new ATOM 0 HA ILE C 12 5.214 6.714 -2.593 1.00 0.00 H new ATOM 0 HB ILE C 12 3.478 4.329 -1.990 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.202 6.234 -2.936 1.00 0.00 H new ATOM 0 HG13 ILE C 12 1.744 5.880 -1.282 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.463 5.166 0.366 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.091 4.695 -0.179 1.00 0.00 H new ATOM 0 HG23 ILE C 12 4.644 6.415 -0.095 1.00 0.00 H new ATOM 0 HD11 ILE C 12 1.954 8.311 -1.632 1.00 0.00 H new ATOM 0 HD12 ILE C 12 3.177 7.742 -0.472 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.643 8.101 -2.152 1.00 0.00 H new ATOM 1839 N ASN C 13 6.956 4.969 -1.647 1.00 0.00 N ATOM 1840 CA ASN C 13 8.149 4.154 -1.500 1.00 0.00 C ATOM 1841 C ASN C 13 8.440 3.839 -0.038 1.00 0.00 C ATOM 1842 O ASN C 13 8.104 4.617 0.856 1.00 0.00 O ATOM 1843 CB ASN C 13 9.326 4.900 -2.124 1.00 0.00 C ATOM 1844 CG ASN C 13 9.243 4.917 -3.640 1.00 0.00 C ATOM 1845 OD1 ASN C 13 8.666 5.821 -4.231 1.00 0.00 O ATOM 1846 ND2 ASN C 13 9.824 3.905 -4.279 1.00 0.00 N ATOM 0 H ASN C 13 6.865 5.717 -0.959 1.00 0.00 H new ATOM 0 HA ASN C 13 7.991 3.202 -2.008 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.347 5.923 -1.750 1.00 0.00 H new ATOM 0 HB3 ASN C 13 10.259 4.429 -1.816 1.00 0.00 H new ATOM 0 HD21 ASN C 13 9.798 3.863 -5.298 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.295 3.171 -3.750 1.00 0.00 H new ATOM 1853 N ILE C 14 9.077 2.687 0.187 1.00 0.00 N ATOM 1854 CA ILE C 14 9.455 2.221 1.516 1.00 0.00 C ATOM 1855 C ILE C 14 10.815 1.519 1.429 1.00 0.00 C ATOM 1856 O ILE C 14 11.122 0.868 0.427 1.00 0.00 O ATOM 1857 CB ILE C 14 8.386 1.263 2.069 1.00 0.00 C ATOM 1858 CG1 ILE C 14 7.026 1.973 2.151 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.813 0.759 3.453 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.927 1.074 2.722 1.00 0.00 C ATOM 0 H ILE C 14 9.346 2.047 -0.560 1.00 0.00 H new ATOM 0 HA ILE C 14 9.530 3.070 2.195 1.00 0.00 H new ATOM 0 HB ILE C 14 8.287 0.411 1.397 1.00 0.00 H new ATOM 0 HG12 ILE C 14 7.122 2.863 2.773 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.735 2.309 1.156 1.00 0.00 H new ATOM 0 HG21 ILE C 14 8.054 0.080 3.843 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.764 0.232 3.371 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.925 1.606 4.130 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.988 1.626 2.758 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.808 0.196 2.087 1.00 0.00 H new ATOM 0 HD13 ILE C 14 6.201 0.759 3.729 1.00 0.00 H new ATOM 1872 N GLY C 15 11.623 1.659 2.487 1.00 0.00 N ATOM 1873 CA GLY C 15 12.933 1.039 2.536 1.00 0.00 C ATOM 1874 C GLY C 15 13.774 1.460 1.334 1.00 0.00 C ATOM 1875 O GLY C 15 13.768 2.624 0.943 1.00 0.00 O ATOM 0 H GLY C 15 11.383 2.200 3.318 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.440 1.322 3.458 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.827 -0.046 2.550 1.00 0.00 H new ATOM 1879 N ASP C 16 14.494 0.498 0.757 1.00 0.00 N ATOM 1880 CA ASP C 16 15.327 0.706 -0.416 1.00 0.00 C ATOM 1881 C ASP C 16 15.015 -0.361 -1.467 1.00 0.00 C ATOM 1882 O ASP C 16 15.732 -0.494 -2.459 1.00 0.00 O ATOM 1883 CB ASP C 16 16.802 0.672 -0.012 1.00 0.00 C ATOM 1884 CG ASP C 16 17.132 1.759 1.001 1.00 0.00 C ATOM 1885 OD1 ASP C 16 17.219 2.934 0.573 1.00 0.00 O ATOM 1886 OD2 ASP C 16 17.297 1.414 2.195 1.00 0.00 O ATOM 0 H ASP C 16 14.512 -0.462 1.101 1.00 0.00 H new ATOM 0 HA ASP C 16 15.115 1.683 -0.851 1.00 0.00 H new ATOM 0 HB2 ASP C 16 17.042 -0.304 0.410 1.00 0.00 H new ATOM 0 HB3 ASP C 16 17.425 0.798 -0.897 1.00 0.00 H new ATOM 1891 N ASP C 17 13.939 -1.124 -1.245 1.00 0.00 N ATOM 1892 CA ASP C 17 13.584 -2.264 -2.072 1.00 0.00 C ATOM 1893 C ASP C 17 12.074 -2.415 -2.257 1.00 0.00 C ATOM 1894 O ASP C 17 11.633 -3.428 -2.800 1.00 0.00 O ATOM 1895 CB ASP C 17 14.166 -3.530 -1.443 1.00 0.00 C ATOM 1896 CG ASP C 17 13.456 -3.918 -0.151 1.00 0.00 C ATOM 1897 OD1 ASP C 17 13.471 -3.095 0.793 1.00 0.00 O ATOM 1898 OD2 ASP C 17 12.902 -5.040 -0.114 1.00 0.00 O ATOM 0 H ASP C 17 13.289 -0.959 -0.477 1.00 0.00 H new ATOM 0 HA ASP C 17 14.003 -2.100 -3.065 1.00 0.00 H new ATOM 0 HB2 ASP C 17 14.093 -4.352 -2.155 1.00 0.00 H new ATOM 0 HB3 ASP C 17 15.226 -3.377 -1.240 1.00 0.00 H new ATOM 1903 N ILE C 18 11.270 -1.439 -1.816 1.00 0.00 N ATOM 1904 CA ILE C 18 9.819 -1.565 -1.894 1.00 0.00 C ATOM 1905 C ILE C 18 9.196 -0.295 -2.459 1.00 0.00 C ATOM 1906 O ILE C 18 9.612 0.816 -2.135 1.00 0.00 O ATOM 1907 CB ILE C 18 9.273 -1.864 -0.491 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.840 -3.198 0.009 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.741 -1.910 -0.507 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.623 -3.371 1.506 1.00 0.00 C ATOM 0 H ILE C 18 11.600 -0.565 -1.407 1.00 0.00 H new ATOM 0 HA ILE C 18 9.560 -2.383 -2.567 1.00 0.00 H new ATOM 0 HB ILE C 18 9.583 -1.067 0.185 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.364 -4.020 -0.526 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.906 -3.248 -0.213 1.00 0.00 H new ATOM 0 HG21 ILE C 18 7.373 -2.123 0.497 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.352 -0.948 -0.840 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.408 -2.692 -1.189 1.00 0.00 H new ATOM 0 HD11 ILE C 18 10.037 -4.327 1.826 1.00 0.00 H new ATOM 0 HD12 ILE C 18 10.121 -2.563 2.042 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.555 -3.347 1.724 1.00 0.00 H new ATOM 1922 N THR C 19 8.184 -0.479 -3.312 1.00 0.00 N ATOM 1923 CA THR C 19 7.439 0.617 -3.915 1.00 0.00 C ATOM 1924 C THR C 19 5.973 0.219 -4.002 1.00 0.00 C ATOM 1925 O THR C 19 5.668 -0.960 -4.175 1.00 0.00 O ATOM 1926 CB THR C 19 8.002 0.905 -5.313 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.389 1.155 -5.234 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.326 2.108 -5.966 1.00 0.00 C ATOM 0 H THR C 19 7.861 -1.402 -3.602 1.00 0.00 H new ATOM 0 HA THR C 19 7.532 1.519 -3.310 1.00 0.00 H new ATOM 0 HB THR C 19 7.806 0.024 -5.924 1.00 0.00 H new ATOM 0 HG1 THR C 19 9.740 1.336 -6.131 1.00 0.00 H new ATOM 0 HG21 THR C 19 7.756 2.275 -6.954 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.257 1.917 -6.063 1.00 0.00 H new ATOM 0 HG23 THR C 19 7.482 2.992 -5.348 1.00 0.00 H new ATOM 1936 N ILE C 20 5.072 1.194 -3.880 1.00 0.00 N ATOM 1937 CA ILE C 20 3.629 0.963 -3.863 1.00 0.00 C ATOM 1938 C ILE C 20 2.979 1.927 -4.851 1.00 0.00 C ATOM 1939 O ILE C 20 3.505 3.016 -5.076 1.00 0.00 O ATOM 1940 CB ILE C 20 3.083 1.188 -2.443 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.921 0.499 -1.356 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.632 0.709 -2.355 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.901 -1.024 -1.455 1.00 0.00 C ATOM 0 H ILE C 20 5.327 2.177 -3.789 1.00 0.00 H new ATOM 0 HA ILE C 20 3.403 -0.063 -4.153 1.00 0.00 H new ATOM 0 HB ILE C 20 3.139 2.260 -2.256 1.00 0.00 H new ATOM 0 HG12 ILE C 20 4.951 0.847 -1.426 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.549 0.798 -0.376 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.255 0.873 -1.345 1.00 0.00 H new ATOM 0 HG22 ILE C 20 1.021 1.266 -3.065 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.585 -0.354 -2.592 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.512 -1.448 -0.659 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.876 -1.382 -1.356 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.300 -1.331 -2.422 1.00 0.00 H new ATOM 1955 N THR C 21 1.845 1.546 -5.441 1.00 0.00 N ATOM 1956 CA THR C 21 1.213 2.347 -6.482 1.00 0.00 C ATOM 1957 C THR C 21 -0.308 2.296 -6.362 1.00 0.00 C ATOM 1958 O THR C 21 -0.865 1.323 -5.859 1.00 0.00 O ATOM 1959 CB THR C 21 1.662 1.813 -7.849 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.072 1.779 -7.910 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.181 2.678 -9.010 1.00 0.00 C ATOM 0 H THR C 21 1.347 0.685 -5.213 1.00 0.00 H new ATOM 0 HA THR C 21 1.515 3.388 -6.372 1.00 0.00 H new ATOM 0 HB THR C 21 1.226 0.819 -7.946 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.416 2.689 -8.030 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.529 2.251 -9.951 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.092 2.715 -9.009 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.578 3.687 -8.901 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.974 3.357 -6.830 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.429 3.451 -6.863 1.00 0.00 C ATOM 1971 C ILE C 22 -2.850 3.333 -8.325 1.00 0.00 C ATOM 1972 O ILE C 22 -2.781 4.292 -9.094 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.896 4.751 -6.181 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -4.381 5.047 -6.436 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -2.083 5.969 -6.619 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -5.279 3.936 -5.893 1.00 0.00 C ATOM 0 H ILE C 22 -0.506 4.184 -7.201 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.907 2.649 -6.300 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.739 4.578 -5.116 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.649 5.994 -5.967 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.551 5.162 -7.507 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.454 6.857 -6.108 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -1.034 5.817 -6.365 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -2.180 6.103 -7.696 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.322 4.181 -6.092 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -5.028 2.994 -6.381 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -5.128 3.839 -4.818 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.289 2.135 -8.716 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.526 1.815 -10.116 1.00 0.00 C ATOM 1990 C LEU C 23 -4.839 2.409 -10.610 1.00 0.00 C ATOM 1991 O LEU C 23 -4.996 2.637 -11.808 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.543 0.292 -10.279 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.310 -0.357 -9.643 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.384 -1.862 -9.828 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -0.993 0.140 -10.237 1.00 0.00 C ATOM 0 H LEU C 23 -3.487 1.368 -8.073 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.725 2.249 -10.715 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.445 -0.113 -9.821 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.582 0.039 -11.339 1.00 0.00 H new ATOM 0 HG LEU C 23 -2.319 -0.081 -8.589 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.508 -2.328 -9.377 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.285 -2.244 -9.348 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.412 -2.097 -10.892 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.160 -0.359 -9.743 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -0.968 -0.083 -11.304 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -0.911 1.217 -10.089 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.782 2.659 -9.699 1.00 0.00 N ATOM 2008 CA GLY C 24 -7.034 3.300 -10.066 1.00 0.00 C ATOM 2009 C GLY C 24 -8.083 3.193 -8.969 1.00 0.00 C ATOM 2010 O GLY C 24 -7.813 2.709 -7.872 1.00 0.00 O ATOM 0 H GLY C 24 -5.698 2.427 -8.709 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.850 4.351 -10.288 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.419 2.845 -10.979 1.00 0.00 H new ATOM 2014 N VAL C 25 -9.296 3.659 -9.280 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.410 3.674 -8.346 1.00 0.00 C ATOM 2016 C VAL C 25 -11.650 3.089 -9.011 1.00 0.00 C ATOM 2017 O VAL C 25 -11.731 3.005 -10.237 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.682 5.102 -7.848 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -9.466 5.675 -7.114 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -11.032 6.040 -9.003 1.00 0.00 C ATOM 0 H VAL C 25 -9.528 4.039 -10.198 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.153 3.061 -7.482 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.528 5.035 -7.164 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -9.690 6.686 -6.774 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -9.230 5.047 -6.255 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -8.611 5.700 -7.790 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -11.218 7.041 -8.615 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -10.202 6.073 -9.709 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.925 5.675 -9.510 1.00 0.00 H new ATOM 2030 N SER C 26 -12.621 2.676 -8.196 1.00 0.00 N ATOM 2031 CA SER C 26 -13.852 2.048 -8.654 1.00 0.00 C ATOM 2032 C SER C 26 -14.975 2.407 -7.681 1.00 0.00 C ATOM 2033 O SER C 26 -15.648 1.528 -7.143 1.00 0.00 O ATOM 2034 CB SER C 26 -13.660 0.529 -8.734 1.00 0.00 C ATOM 2035 OG SER C 26 -12.799 0.202 -9.804 1.00 0.00 O ATOM 0 H SER C 26 -12.569 2.772 -7.182 1.00 0.00 H new ATOM 0 HA SER C 26 -14.113 2.407 -9.649 1.00 0.00 H new ATOM 0 HB2 SER C 26 -13.245 0.158 -7.797 1.00 0.00 H new ATOM 0 HB3 SER C 26 -14.624 0.040 -8.871 1.00 0.00 H new ATOM 0 HG SER C 26 -12.682 -0.770 -9.845 1.00 0.00 H new ATOM 2041 N GLY C 27 -15.168 3.708 -7.450 1.00 0.00 N ATOM 2042 CA GLY C 27 -16.168 4.187 -6.510 1.00 0.00 C ATOM 2043 C GLY C 27 -15.686 3.946 -5.086 1.00 0.00 C ATOM 2044 O GLY C 27 -14.583 4.356 -4.726 1.00 0.00 O ATOM 0 H GLY C 27 -14.637 4.449 -7.908 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.351 5.250 -6.668 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -17.114 3.673 -6.676 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.509 3.277 -4.275 1.00 0.00 N ATOM 2049 CA GLN C 28 -16.141 2.910 -2.918 1.00 0.00 C ATOM 2050 C GLN C 28 -15.008 1.873 -2.920 1.00 0.00 C ATOM 2051 O GLN C 28 -14.389 1.635 -1.883 1.00 0.00 O ATOM 2052 CB GLN C 28 -17.395 2.390 -2.205 1.00 0.00 C ATOM 2053 CG GLN C 28 -17.133 2.063 -0.735 1.00 0.00 C ATOM 2054 CD GLN C 28 -18.437 1.809 0.009 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -18.785 2.542 0.930 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -19.171 0.767 -0.376 1.00 0.00 N ATOM 0 H GLN C 28 -17.446 2.978 -4.546 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.761 3.779 -2.381 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -18.185 3.138 -2.273 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.756 1.497 -2.715 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -16.492 1.184 -0.663 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.597 2.888 -0.265 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -18.854 0.177 -1.145 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -20.050 0.559 0.098 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.730 1.258 -4.078 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.641 0.298 -4.208 1.00 0.00 C ATOM 2067 C GLN C 29 -12.412 0.976 -4.806 1.00 0.00 C ATOM 2068 O GLN C 29 -12.502 2.053 -5.392 1.00 0.00 O ATOM 2069 CB GLN C 29 -14.044 -0.861 -5.127 1.00 0.00 C ATOM 2070 CG GLN C 29 -15.327 -1.577 -4.708 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.579 -2.752 -5.640 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -16.221 -2.607 -6.676 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -15.075 -3.925 -5.273 1.00 0.00 N ATOM 0 H GLN C 29 -15.252 1.414 -4.940 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.415 -0.085 -3.213 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -14.169 -0.480 -6.140 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -13.230 -1.586 -5.157 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -15.242 -1.927 -3.679 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -16.169 -0.886 -4.741 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -14.547 -4.004 -4.404 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -15.216 -4.747 -5.860 1.00 0.00 H new ATOM 2082 N VAL C 30 -11.253 0.329 -4.650 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.970 0.840 -5.119 1.00 0.00 C ATOM 2084 C VAL C 30 -9.065 -0.320 -5.532 1.00 0.00 C ATOM 2085 O VAL C 30 -9.143 -1.401 -4.948 1.00 0.00 O ATOM 2086 CB VAL C 30 -9.300 1.634 -3.986 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.910 2.102 -4.406 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -10.122 2.864 -3.596 1.00 0.00 C ATOM 0 H VAL C 30 -11.183 -0.577 -4.187 1.00 0.00 H new ATOM 0 HA VAL C 30 -10.132 1.488 -5.980 1.00 0.00 H new ATOM 0 HB VAL C 30 -9.230 0.963 -3.130 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -7.453 2.662 -3.590 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.291 1.237 -4.644 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.992 2.742 -5.284 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.617 3.400 -2.792 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -10.227 3.520 -4.460 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -11.109 2.549 -3.257 1.00 0.00 H new ATOM 2098 N ARG C 31 -8.204 -0.098 -6.534 1.00 0.00 N ATOM 2099 CA ARG C 31 -7.193 -1.069 -6.921 1.00 0.00 C ATOM 2100 C ARG C 31 -5.815 -0.447 -6.727 1.00 0.00 C ATOM 2101 O ARG C 31 -5.520 0.637 -7.224 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.390 -1.568 -8.360 1.00 0.00 C ATOM 2103 CG ARG C 31 -6.204 -2.480 -8.715 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.318 -3.165 -10.076 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.282 -4.268 -10.040 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.813 -4.844 -11.125 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.435 -4.490 -12.349 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.737 -5.789 -10.987 1.00 0.00 N ATOM 0 H ARG C 31 -8.195 0.756 -7.091 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.287 -1.949 -6.284 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.330 -2.113 -8.449 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -7.443 -0.727 -9.051 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -5.288 -1.889 -8.695 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -6.106 -3.245 -7.944 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -6.624 -2.437 -10.827 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -5.341 -3.543 -10.378 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.568 -4.621 -9.126 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.727 -3.766 -12.475 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.853 -4.942 -13.162 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -9.040 -6.074 -10.056 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -9.143 -6.229 -11.812 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.983 -1.171 -5.985 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.641 -0.768 -5.604 1.00 0.00 C ATOM 2124 C ILE C 32 -2.698 -1.943 -5.816 1.00 0.00 C ATOM 2125 O ILE C 32 -3.136 -3.091 -5.864 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.628 -0.323 -4.135 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.472 -1.280 -3.278 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -4.159 1.110 -4.027 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -4.401 -0.912 -1.796 1.00 0.00 C ATOM 0 H ILE C 32 -5.238 -2.089 -5.621 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.314 0.072 -6.217 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.604 -0.349 -3.762 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.509 -1.251 -3.612 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.120 -2.302 -3.418 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -4.149 1.424 -2.983 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.527 1.777 -4.613 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -5.179 1.150 -4.408 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -5.009 -1.609 -1.219 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.366 -0.966 -1.457 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.777 0.101 -1.654 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.403 -1.662 -5.940 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.423 -2.704 -6.188 1.00 0.00 C ATOM 2143 C GLY C 33 0.848 -2.477 -5.385 1.00 0.00 C ATOM 2144 O GLY C 33 1.046 -1.414 -4.799 1.00 0.00 O ATOM 0 H GLY C 33 -1.013 -0.722 -5.872 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.849 -3.674 -5.931 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.183 -2.733 -7.251 1.00 0.00 H new ATOM 2148 N ILE C 34 1.703 -3.496 -5.370 1.00 0.00 N ATOM 2149 CA ILE C 34 2.931 -3.500 -4.599 1.00 0.00 C ATOM 2150 C ILE C 34 4.051 -3.971 -5.509 1.00 0.00 C ATOM 2151 O ILE C 34 3.856 -4.861 -6.337 1.00 0.00 O ATOM 2152 CB ILE C 34 2.802 -4.445 -3.387 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.727 -3.993 -2.392 1.00 0.00 C ATOM 2154 CG2 ILE C 34 4.140 -4.516 -2.645 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.349 -4.571 -2.732 1.00 0.00 C ATOM 0 H ILE C 34 1.555 -4.353 -5.903 1.00 0.00 H new ATOM 0 HA ILE C 34 3.141 -2.499 -4.223 1.00 0.00 H new ATOM 0 HB ILE C 34 2.512 -5.419 -3.780 1.00 0.00 H new ATOM 0 HG12 ILE C 34 2.011 -4.302 -1.386 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.672 -2.904 -2.387 1.00 0.00 H new ATOM 0 HG21 ILE C 34 4.046 -5.184 -1.789 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.910 -4.894 -3.318 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.418 -3.520 -2.299 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.381 -4.224 -2.001 1.00 0.00 H new ATOM 0 HD12 ILE C 34 0.051 -4.240 -3.727 1.00 0.00 H new ATOM 0 HD13 ILE C 34 0.396 -5.660 -2.710 1.00 0.00 H new ATOM 2167 N ASN C 35 5.227 -3.370 -5.352 1.00 0.00 N ATOM 2168 CA ASN C 35 6.381 -3.649 -6.179 1.00 0.00 C ATOM 2169 C ASN C 35 7.573 -3.931 -5.276 1.00 0.00 C ATOM 2170 O ASN C 35 8.475 -3.113 -5.099 1.00 0.00 O ATOM 2171 CB ASN C 35 6.602 -2.487 -7.142 1.00 0.00 C ATOM 2172 CG ASN C 35 7.355 -2.922 -8.391 1.00 0.00 C ATOM 2173 OD1 ASN C 35 8.306 -3.695 -8.324 1.00 0.00 O ATOM 2174 ND2 ASN C 35 6.928 -2.423 -9.549 1.00 0.00 N ATOM 0 H ASN C 35 5.400 -2.666 -4.634 1.00 0.00 H new ATOM 0 HA ASN C 35 6.230 -4.536 -6.794 1.00 0.00 H new ATOM 0 HB2 ASN C 35 5.639 -2.064 -7.427 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.160 -1.698 -6.638 1.00 0.00 H new ATOM 0 HD21 ASN C 35 7.395 -2.681 -10.419 1.00 0.00 H new ATOM 0 HD22 ASN C 35 6.134 -1.783 -9.567 1.00 0.00 H new ATOM 2181 N ALA C 36 7.534 -5.137 -4.711 1.00 0.00 N ATOM 2182 CA ALA C 36 8.549 -5.688 -3.833 1.00 0.00 C ATOM 2183 C ALA C 36 8.918 -7.079 -4.343 1.00 0.00 C ATOM 2184 O ALA C 36 8.144 -7.685 -5.087 1.00 0.00 O ATOM 2185 CB ALA C 36 7.971 -5.760 -2.417 1.00 0.00 C ATOM 0 H ALA C 36 6.757 -5.780 -4.864 1.00 0.00 H new ATOM 0 HA ALA C 36 9.445 -5.068 -3.818 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.719 -6.172 -1.739 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.694 -4.759 -2.086 1.00 0.00 H new ATOM 0 HB3 ALA C 36 7.089 -6.400 -2.416 1.00 0.00 H new ATOM 2191 N PRO C 37 10.086 -7.596 -3.957 1.00 0.00 N ATOM 2192 CA PRO C 37 10.516 -8.922 -4.352 1.00 0.00 C ATOM 2193 C PRO C 37 9.761 -9.954 -3.524 1.00 0.00 C ATOM 2194 O PRO C 37 9.303 -9.655 -2.420 1.00 0.00 O ATOM 2195 CB PRO C 37 12.013 -8.948 -4.034 1.00 0.00 C ATOM 2196 CG PRO C 37 12.123 -8.020 -2.825 1.00 0.00 C ATOM 2197 CD PRO C 37 11.075 -6.951 -3.113 1.00 0.00 C ATOM 0 HA PRO C 37 10.326 -9.148 -5.401 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.359 -9.955 -3.803 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.610 -8.591 -4.873 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.917 -8.546 -1.893 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.121 -7.592 -2.735 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.625 -6.584 -2.191 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.519 -6.091 -3.615 1.00 0.00 H new ATOM 2205 N LYS C 38 9.628 -11.177 -4.039 1.00 0.00 N ATOM 2206 CA LYS C 38 9.017 -12.256 -3.280 1.00 0.00 C ATOM 2207 C LYS C 38 9.930 -12.692 -2.137 1.00 0.00 C ATOM 2208 O LYS C 38 9.607 -13.617 -1.394 1.00 0.00 O ATOM 2209 CB LYS C 38 8.611 -13.394 -4.215 1.00 0.00 C ATOM 2210 CG LYS C 38 7.423 -12.872 -5.020 1.00 0.00 C ATOM 2211 CD LYS C 38 6.731 -13.953 -5.842 1.00 0.00 C ATOM 2212 CE LYS C 38 7.630 -14.421 -6.983 1.00 0.00 C ATOM 2213 NZ LYS C 38 6.917 -15.366 -7.863 1.00 0.00 N ATOM 0 H LYS C 38 9.936 -11.439 -4.975 1.00 0.00 H new ATOM 0 HA LYS C 38 8.099 -11.904 -2.810 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.435 -13.673 -4.872 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.338 -14.285 -3.650 1.00 0.00 H new ATOM 0 HG2 LYS C 38 6.700 -12.424 -4.339 1.00 0.00 H new ATOM 0 HG3 LYS C 38 7.764 -12.081 -5.687 1.00 0.00 H new ATOM 0 HD2 LYS C 38 6.478 -14.798 -5.202 1.00 0.00 H new ATOM 0 HD3 LYS C 38 5.795 -13.567 -6.245 1.00 0.00 H new ATOM 0 HE2 LYS C 38 7.966 -13.561 -7.563 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.521 -14.899 -6.576 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 7.549 -15.670 -8.631 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 6.618 -16.196 -7.312 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 6.080 -14.900 -8.268 1.00 0.00 H new ATOM 2227 N ASP C 39 11.079 -12.019 -2.003 1.00 0.00 N ATOM 2228 CA ASP C 39 11.962 -12.174 -0.857 1.00 0.00 C ATOM 2229 C ASP C 39 11.262 -11.675 0.401 1.00 0.00 C ATOM 2230 O ASP C 39 11.653 -12.043 1.508 1.00 0.00 O ATOM 2231 CB ASP C 39 13.226 -11.338 -1.081 1.00 0.00 C ATOM 2232 CG ASP C 39 14.299 -11.650 -0.037 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.746 -12.816 0.003 1.00 0.00 O ATOM 2234 OD2 ASP C 39 14.664 -10.715 0.709 1.00 0.00 O ATOM 0 H ASP C 39 11.418 -11.350 -2.694 1.00 0.00 H new ATOM 0 HA ASP C 39 12.221 -13.226 -0.741 1.00 0.00 H new ATOM 0 HB2 ASP C 39 13.620 -11.533 -2.078 1.00 0.00 H new ATOM 0 HB3 ASP C 39 12.974 -10.278 -1.040 1.00 0.00 H new ATOM 2239 N VAL C 40 10.232 -10.840 0.233 1.00 0.00 N ATOM 2240 CA VAL C 40 9.442 -10.334 1.342 1.00 0.00 C ATOM 2241 C VAL C 40 7.963 -10.605 1.095 1.00 0.00 C ATOM 2242 O VAL C 40 7.477 -10.552 -0.037 1.00 0.00 O ATOM 2243 CB VAL C 40 9.731 -8.845 1.561 1.00 0.00 C ATOM 2244 CG1 VAL C 40 11.239 -8.623 1.707 1.00 0.00 C ATOM 2245 CG2 VAL C 40 9.220 -7.984 0.409 1.00 0.00 C ATOM 0 H VAL C 40 9.928 -10.500 -0.679 1.00 0.00 H new ATOM 0 HA VAL C 40 9.721 -10.855 2.258 1.00 0.00 H new ATOM 0 HB VAL C 40 9.208 -8.548 2.470 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.437 -7.563 1.862 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.609 -9.190 2.561 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.745 -8.958 0.802 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.447 -6.937 0.609 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.706 -8.291 -0.518 1.00 0.00 H new ATOM 0 HG23 VAL C 40 8.142 -8.109 0.312 1.00 0.00 H new ATOM 2255 N ALA C 41 7.248 -10.897 2.180 1.00 0.00 N ATOM 2256 CA ALA C 41 5.842 -11.263 2.126 1.00 0.00 C ATOM 2257 C ALA C 41 4.985 -10.049 1.783 1.00 0.00 C ATOM 2258 O ALA C 41 5.271 -8.936 2.220 1.00 0.00 O ATOM 2259 CB ALA C 41 5.430 -11.842 3.475 1.00 0.00 C ATOM 0 H ALA C 41 7.634 -10.885 3.124 1.00 0.00 H new ATOM 0 HA ALA C 41 5.691 -12.010 1.347 1.00 0.00 H new ATOM 0 HB1 ALA C 41 4.376 -12.120 3.445 1.00 0.00 H new ATOM 0 HB2 ALA C 41 6.032 -12.724 3.691 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.587 -11.096 4.254 1.00 0.00 H new ATOM 2265 N VAL C 42 3.931 -10.275 0.999 1.00 0.00 N ATOM 2266 CA VAL C 42 2.968 -9.245 0.636 1.00 0.00 C ATOM 2267 C VAL C 42 1.611 -9.915 0.465 1.00 0.00 C ATOM 2268 O VAL C 42 1.448 -10.739 -0.434 1.00 0.00 O ATOM 2269 CB VAL C 42 3.383 -8.567 -0.676 1.00 0.00 C ATOM 2270 CG1 VAL C 42 2.367 -7.495 -1.058 1.00 0.00 C ATOM 2271 CG2 VAL C 42 4.748 -7.893 -0.571 1.00 0.00 C ATOM 0 H VAL C 42 3.723 -11.189 0.596 1.00 0.00 H new ATOM 0 HA VAL C 42 2.924 -8.482 1.413 1.00 0.00 H new ATOM 0 HB VAL C 42 3.430 -9.353 -1.430 1.00 0.00 H new ATOM 0 HG11 VAL C 42 2.672 -7.021 -1.991 1.00 0.00 H new ATOM 0 HG12 VAL C 42 1.386 -7.953 -1.187 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.316 -6.745 -0.269 1.00 0.00 H new ATOM 0 HG21 VAL C 42 4.998 -7.427 -1.524 1.00 0.00 H new ATOM 0 HG22 VAL C 42 4.719 -7.132 0.208 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.504 -8.638 -0.322 1.00 0.00 H new ATOM 2281 N HIS C 43 0.646 -9.561 1.322 1.00 0.00 N ATOM 2282 CA HIS C 43 -0.695 -10.131 1.302 1.00 0.00 C ATOM 2283 C HIS C 43 -1.718 -9.102 1.770 1.00 0.00 C ATOM 2284 O HIS C 43 -1.360 -8.058 2.311 1.00 0.00 O ATOM 2285 CB HIS C 43 -0.787 -11.341 2.243 1.00 0.00 C ATOM 2286 CG HIS C 43 0.256 -12.408 2.042 1.00 0.00 C ATOM 2287 ND1 HIS C 43 0.056 -13.599 1.345 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.537 -12.372 2.514 1.00 0.00 C ATOM 2289 CE1 HIS C 43 1.225 -14.257 1.414 1.00 0.00 C ATOM 2290 NE2 HIS C 43 2.131 -13.543 2.105 1.00 0.00 N ATOM 0 H HIS C 43 0.781 -8.863 2.054 1.00 0.00 H new ATOM 0 HA HIS C 43 -0.903 -10.437 0.277 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -0.721 -10.984 3.271 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -1.771 -11.795 2.126 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.992 -11.582 3.093 1.00 0.00 H new ATOM 0 HE1 HIS C 43 1.412 -15.226 0.975 1.00 0.00 H new ATOM 0 HE2 HIS C 43 3.094 -13.822 2.294 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.001 -9.403 1.562 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.104 -8.604 2.085 1.00 0.00 C ATOM 2300 C ARG C 44 -4.149 -8.735 3.605 1.00 0.00 C ATOM 2301 O ARG C 44 -3.806 -9.780 4.151 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.402 -9.091 1.435 1.00 0.00 C ATOM 2303 CG ARG C 44 -5.652 -10.556 1.801 1.00 0.00 C ATOM 2304 CD ARG C 44 -6.404 -11.299 0.701 1.00 0.00 C ATOM 2305 NE ARG C 44 -7.825 -10.962 0.688 1.00 0.00 N ATOM 2306 CZ ARG C 44 -8.633 -11.217 -0.344 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -8.175 -11.837 -1.427 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -9.910 -10.853 -0.292 1.00 0.00 N ATOM 0 H ARG C 44 -3.303 -10.214 1.022 1.00 0.00 H new ATOM 0 HA ARG C 44 -3.970 -7.548 1.849 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.238 -8.476 1.768 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.339 -8.984 0.352 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -4.699 -11.051 1.987 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.223 -10.606 2.728 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -5.965 -11.056 -0.267 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -6.287 -12.373 0.844 1.00 0.00 H new ATOM 0 HE ARG C 44 -8.221 -10.508 1.511 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -7.197 -12.123 -1.476 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -8.801 -12.027 -2.209 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -10.272 -10.379 0.536 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -10.528 -11.047 -1.080 1.00 0.00 H new ATOM 2322 N GLU C 45 -4.574 -7.676 4.300 1.00 0.00 N ATOM 2323 CA GLU C 45 -4.575 -7.658 5.759 1.00 0.00 C ATOM 2324 C GLU C 45 -5.572 -8.663 6.342 1.00 0.00 C ATOM 2325 O GLU C 45 -5.338 -9.214 7.415 1.00 0.00 O ATOM 2326 CB GLU C 45 -4.911 -6.237 6.208 1.00 0.00 C ATOM 2327 CG GLU C 45 -5.063 -6.092 7.723 1.00 0.00 C ATOM 2328 CD GLU C 45 -3.769 -6.358 8.502 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -2.720 -6.552 7.856 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -3.848 -6.365 9.750 1.00 0.00 O ATOM 0 H GLU C 45 -4.922 -6.819 3.871 1.00 0.00 H new ATOM 0 HA GLU C 45 -3.592 -7.953 6.126 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -4.128 -5.562 5.864 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -5.837 -5.923 5.727 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -5.412 -5.084 7.949 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -5.833 -6.781 8.069 1.00 0.00 H new ATOM 2337 N GLU C 46 -6.681 -8.904 5.641 1.00 0.00 N ATOM 2338 CA GLU C 46 -7.713 -9.837 6.081 1.00 0.00 C ATOM 2339 C GLU C 46 -7.288 -11.307 5.977 1.00 0.00 C ATOM 2340 O GLU C 46 -8.064 -12.192 6.326 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.004 -9.585 5.295 1.00 0.00 C ATOM 2342 CG GLU C 46 -8.823 -9.914 3.811 1.00 0.00 C ATOM 2343 CD GLU C 46 -10.098 -9.650 3.013 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -11.196 -9.900 3.557 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -9.959 -9.198 1.857 1.00 0.00 O ATOM 0 H GLU C 46 -6.887 -8.454 4.749 1.00 0.00 H new ATOM 0 HA GLU C 46 -7.883 -9.651 7.141 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.809 -10.192 5.709 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -9.302 -8.542 5.405 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -8.008 -9.316 3.403 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -8.536 -10.960 3.703 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.067 -11.575 5.497 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.531 -12.931 5.408 1.00 0.00 C ATOM 2354 C ILE C 47 -4.137 -12.996 6.018 1.00 0.00 C ATOM 2355 O ILE C 47 -3.700 -14.068 6.426 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.528 -13.397 3.940 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.923 -13.901 3.552 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.478 -14.475 3.650 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.899 -14.756 2.283 1.00 0.00 C ATOM 0 H ILE C 47 -5.427 -10.856 5.161 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.169 -13.607 5.978 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.259 -12.532 3.334 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.337 -14.485 4.374 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.586 -13.049 3.401 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.529 -14.759 2.599 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.485 -14.085 3.873 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.672 -15.349 4.272 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.910 -15.089 2.049 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.511 -14.165 1.453 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.259 -15.624 2.441 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.413 -11.875 6.102 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.065 -11.928 6.635 1.00 0.00 C ATOM 2373 C TYR C 48 -2.094 -12.386 8.090 1.00 0.00 C ATOM 2374 O TYR C 48 -1.179 -13.059 8.556 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.410 -10.557 6.522 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.019 -10.581 7.098 1.00 0.00 C ATOM 2377 CD1 TYR C 48 1.069 -10.914 6.276 1.00 0.00 C ATOM 2378 CD2 TYR C 48 0.177 -10.281 8.454 1.00 0.00 C ATOM 2379 CE1 TYR C 48 2.362 -10.961 6.817 1.00 0.00 C ATOM 2380 CE2 TYR C 48 1.466 -10.322 8.997 1.00 0.00 C ATOM 2381 CZ TYR C 48 2.565 -10.650 8.178 1.00 0.00 C ATOM 2382 OH TYR C 48 3.819 -10.674 8.705 1.00 0.00 O ATOM 0 H TYR C 48 -3.733 -10.950 5.815 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.481 -12.645 6.058 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.370 -10.253 5.476 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.013 -9.816 7.047 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.911 -11.133 5.230 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.665 -10.019 9.078 1.00 0.00 H new ATOM 0 HE1 TYR C 48 3.200 -11.235 6.193 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.619 -10.102 10.043 1.00 0.00 H new ATOM 0 HH TYR C 48 4.461 -10.355 8.037 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.156 -12.017 8.805 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.319 -12.360 10.208 1.00 0.00 C ATOM 2394 C GLN C 49 -3.638 -13.843 10.374 1.00 0.00 C ATOM 2395 O GLN C 49 -3.525 -14.376 11.476 1.00 0.00 O ATOM 2396 CB GLN C 49 -4.442 -11.500 10.782 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.131 -10.024 10.543 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.239 -9.139 11.093 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.332 -8.924 12.299 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -6.092 -8.622 10.213 1.00 0.00 N ATOM 0 H GLN C 49 -3.927 -11.470 8.422 1.00 0.00 H new ATOM 0 HA GLN C 49 -2.390 -12.168 10.744 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -5.390 -11.763 10.313 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -4.550 -11.691 11.850 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.185 -9.766 11.018 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.011 -9.842 9.475 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -5.983 -8.823 9.219 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -6.855 -8.025 10.532 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.031 -14.512 9.283 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.311 -15.944 9.306 1.00 0.00 C ATOM 2411 C ARG C 50 -3.064 -16.732 8.907 1.00 0.00 C ATOM 2412 O ARG C 50 -2.903 -17.877 9.319 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.525 -16.244 8.413 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.165 -16.859 7.058 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.403 -16.918 6.164 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.418 -17.831 6.706 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.573 -18.110 6.096 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.874 -17.562 4.920 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.437 -18.945 6.667 1.00 0.00 N ATOM 0 H ARG C 50 -4.161 -14.077 8.370 1.00 0.00 H new ATOM 0 HA ARG C 50 -4.568 -16.262 10.316 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.193 -16.923 8.942 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.077 -15.319 8.245 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.387 -16.267 6.576 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.761 -17.861 7.200 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.828 -15.919 6.063 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -6.116 -17.244 5.165 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.229 -18.279 7.603 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.219 -16.920 4.474 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.760 -17.784 4.466 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -9.216 -19.370 7.568 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -10.320 -19.160 6.204 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.182 -16.124 8.107 1.00 0.00 N ATOM 2434 CA ILE C 51 -0.899 -16.714 7.738 1.00 0.00 C ATOM 2435 C ILE C 51 0.004 -16.730 8.960 1.00 0.00 C ATOM 2436 O ILE C 51 0.589 -17.753 9.303 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.264 -15.878 6.622 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.120 -15.960 5.356 1.00 0.00 C ATOM 2439 CG2 ILE C 51 1.152 -16.363 6.294 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.638 -14.955 4.320 1.00 0.00 C ATOM 0 H ILE C 51 -2.343 -15.204 7.697 1.00 0.00 H new ATOM 0 HA ILE C 51 -1.040 -17.734 7.381 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.208 -14.848 6.974 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -1.073 -16.968 4.943 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.164 -15.765 5.602 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.572 -15.748 5.498 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.778 -16.285 7.183 1.00 0.00 H new ATOM 0 HG23 ILE C 51 1.114 -17.402 5.967 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.258 -15.028 3.427 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -0.709 -13.948 4.730 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.399 -15.169 4.060 1.00 0.00 H new ATOM 2452 N GLN C 52 0.115 -15.581 9.625 1.00 0.00 N ATOM 2453 CA GLN C 52 0.979 -15.426 10.784 1.00 0.00 C ATOM 2454 C GLN C 52 0.386 -16.094 12.024 1.00 0.00 C ATOM 2455 O GLN C 52 0.940 -15.970 13.115 1.00 0.00 O ATOM 2456 CB GLN C 52 1.268 -13.935 11.003 1.00 0.00 C ATOM 2457 CG GLN C 52 2.009 -13.379 9.791 1.00 0.00 C ATOM 2458 CD GLN C 52 3.208 -14.237 9.407 1.00 0.00 C ATOM 2459 OE1 GLN C 52 4.165 -14.367 10.167 1.00 0.00 O ATOM 2460 NE2 GLN C 52 3.159 -14.832 8.218 1.00 0.00 N ATOM 0 H GLN C 52 -0.394 -14.734 9.372 1.00 0.00 H new ATOM 0 HA GLN C 52 1.924 -15.936 10.597 1.00 0.00 H new ATOM 0 HB2 GLN C 52 0.336 -13.391 11.154 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.867 -13.798 11.903 1.00 0.00 H new ATOM 0 HG2 GLN C 52 1.324 -13.316 8.946 1.00 0.00 H new ATOM 0 HG3 GLN C 52 2.344 -12.364 10.006 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.347 -14.700 7.615 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.933 -15.420 7.910 1.00 0.00 H new ATOM 2469 N ALA C 53 -0.739 -16.800 11.861 1.00 0.00 N ATOM 2470 CA ALA C 53 -1.366 -17.503 12.960 1.00 0.00 C ATOM 2471 C ALA C 53 -0.561 -18.743 13.358 1.00 0.00 C ATOM 2472 O ALA C 53 -0.746 -19.264 14.456 1.00 0.00 O ATOM 2473 CB ALA C 53 -2.788 -17.906 12.561 1.00 0.00 C ATOM 0 H ALA C 53 -1.227 -16.893 10.970 1.00 0.00 H new ATOM 0 HA ALA C 53 -1.400 -16.837 13.822 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.262 -18.436 13.388 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -3.366 -17.013 12.323 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -2.750 -18.557 11.687 1.00 0.00 H new ATOM 2479 N GLY C 54 0.331 -19.216 12.478 1.00 0.00 N ATOM 2480 CA GLY C 54 1.166 -20.379 12.753 1.00 0.00 C ATOM 2481 C GLY C 54 1.212 -21.347 11.570 1.00 0.00 C ATOM 2482 O GLY C 54 1.604 -22.499 11.739 1.00 0.00 O ATOM 0 H GLY C 54 0.489 -18.801 11.560 1.00 0.00 H new ATOM 0 HA2 GLY C 54 2.178 -20.050 12.991 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.784 -20.899 13.632 1.00 0.00 H new ATOM 2486 N LEU C 55 0.813 -20.882 10.384 1.00 0.00 N ATOM 2487 CA LEU C 55 0.691 -21.711 9.195 1.00 0.00 C ATOM 2488 C LEU C 55 1.220 -20.972 7.966 1.00 0.00 C ATOM 2489 O LEU C 55 1.799 -19.894 8.087 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.777 -22.128 9.045 1.00 0.00 C ATOM 2491 CG LEU C 55 -1.755 -20.945 8.985 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -1.772 -20.289 7.605 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.156 -21.459 9.291 1.00 0.00 C ATOM 0 H LEU C 55 0.564 -19.906 10.226 1.00 0.00 H new ATOM 0 HA LEU C 55 1.298 -22.611 9.292 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.885 -22.723 8.138 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -1.050 -22.771 9.882 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.432 -20.201 9.713 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.477 -19.457 7.606 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -0.775 -19.920 7.365 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.077 -21.022 6.858 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -3.864 -20.631 9.253 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.437 -22.211 8.554 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -3.171 -21.903 10.286 1.00 0.00 H new ATOM 2505 N THR C 56 1.028 -21.549 6.777 1.00 0.00 N ATOM 2506 CA THR C 56 1.461 -20.939 5.527 1.00 0.00 C ATOM 2507 C THR C 56 0.396 -21.134 4.451 1.00 0.00 C ATOM 2508 O THR C 56 -0.589 -21.842 4.667 1.00 0.00 O ATOM 2509 CB THR C 56 2.805 -21.536 5.091 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.704 -22.939 4.972 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.892 -21.211 6.116 1.00 0.00 C ATOM 0 H THR C 56 0.568 -22.452 6.659 1.00 0.00 H new ATOM 0 HA THR C 56 1.597 -19.868 5.677 1.00 0.00 H new ATOM 0 HB THR C 56 3.067 -21.101 4.126 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.568 -23.307 4.692 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.839 -21.642 5.791 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.997 -20.130 6.205 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.616 -21.629 7.084 1.00 0.00 H new ATOM 2519 N ALA C 57 0.589 -20.504 3.289 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.361 -20.560 2.186 1.00 0.00 C ATOM 2521 C ALA C 57 -0.681 -22.005 1.786 1.00 0.00 C ATOM 2522 O ALA C 57 0.156 -22.897 1.937 1.00 0.00 O ATOM 2523 CB ALA C 57 0.234 -19.815 0.992 1.00 0.00 C ATOM 0 H ALA C 57 1.415 -19.939 3.091 1.00 0.00 H new ATOM 0 HA ALA C 57 -1.293 -20.094 2.505 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -0.466 -19.848 0.157 1.00 0.00 H new ATOM 0 HB2 ALA C 57 0.422 -18.777 1.267 1.00 0.00 H new ATOM 0 HB3 ALA C 57 1.171 -20.288 0.699 1.00 0.00 H new