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= -0.248 K(o=-0.25,f=-1.1) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= -0.0064 USER MOD Set 2.1: A 13 ASN : amide:sc= -0.0405 K(o=-0.043,f=0.69) USER MOD Set 2.2: A 19 THR OG1 : rot 180:sc=-0.00251 USER MOD Set 3.1: A 11 SER OG : rot 180:sc= 0.244 USER MOD Set 3.2: A 21 THR OG1 : rot -75:sc= 0.254 USER MOD Single : A 1 MET CE :methyl -179:sc= -0.943 (180deg=-0.964) 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 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -0.58 K(o=-0.58,f=-5.5!) USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= -0.655 X(o=-0.66,f=-1.1) USER MOD Single : A 48 TYR OH : rot 180:sc= -0.001 USER MOD Single : A 49 GLN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : A 52 GLN : amide:sc= -2.42! K(o=-2.4!,f=-1.3) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 176:sc= -0.451 (180deg=-0.484) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (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 11 SER OG : rot 180:sc= 0 USER MOD Single : C 21 THR OG1 : rot 180:sc= 0 USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= -0.364 K(o=-0.36,f=-2.4!) USER MOD Single : C 29 GLN : amide:sc= -1.52! C(o=-1.5!,f=-3.2!) USER MOD Single : C 35 ASN : amide:sc= 0.263 K(o=0.26,f=-0.5) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HE2:sc= -1.36 X(o=-1.4,f=-1.4) USER MOD Single : C 48 TYR OH : rot 25:sc= 0.768 USER MOD Single : C 49 GLN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : C 52 GLN : amide:sc= -3.87! K(o=-3.9!,f=-1.4) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.726 -7.580 -10.327 1.00 0.00 N ATOM 2 CA MET A 1 3.981 -6.664 -9.442 1.00 0.00 C ATOM 3 C MET A 1 2.692 -7.330 -8.970 1.00 0.00 C ATOM 4 O MET A 1 1.893 -7.764 -9.795 1.00 0.00 O ATOM 5 CB MET A 1 3.671 -5.357 -10.176 1.00 0.00 C ATOM 6 CG MET A 1 3.295 -4.266 -9.175 1.00 0.00 C ATOM 7 SD MET A 1 3.012 -2.624 -9.895 1.00 0.00 S ATOM 8 CE MET A 1 1.421 -2.931 -10.688 1.00 0.00 C ATOM 0 H1 MET A 1 5.603 -7.119 -10.644 1.00 0.00 H new ATOM 0 H2 MET A 1 4.960 -8.450 -9.808 1.00 0.00 H new ATOM 0 H3 MET A 1 4.141 -7.817 -11.153 1.00 0.00 H new ATOM 0 HA MET A 1 4.595 -6.434 -8.571 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.538 -5.044 -10.758 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.854 -5.512 -10.880 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.393 -4.574 -8.647 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.088 -4.188 -8.432 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.091 -2.029 -11.203 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.524 -3.743 -11.408 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.685 -3.207 -9.933 1.00 0.00 H new ATOM 20 N LEU A 2 2.478 -7.412 -7.654 1.00 0.00 N ATOM 21 CA LEU A 2 1.240 -7.959 -7.115 1.00 0.00 C ATOM 22 C LEU A 2 0.188 -6.853 -7.148 1.00 0.00 C ATOM 23 O LEU A 2 0.509 -5.708 -6.841 1.00 0.00 O ATOM 24 CB LEU A 2 1.479 -8.426 -5.669 1.00 0.00 C ATOM 25 CG LEU A 2 0.564 -9.562 -5.168 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.383 -9.441 -3.663 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.824 -9.600 -5.790 1.00 0.00 C ATOM 0 H LEU A 2 3.147 -7.106 -6.947 1.00 0.00 H new ATOM 0 HA LEU A 2 0.901 -8.812 -7.703 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.515 -8.754 -5.580 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.358 -7.569 -5.006 1.00 0.00 H new ATOM 0 HG LEU A 2 1.072 -10.480 -5.465 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -0.264 -10.244 -3.309 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.354 -9.514 -3.173 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -0.071 -8.479 -3.427 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.388 -10.434 -5.371 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.344 -8.666 -5.576 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.736 -9.727 -6.869 1.00 0.00 H new ATOM 39 N ILE A 3 -1.052 -7.173 -7.518 1.00 0.00 N ATOM 40 CA ILE A 3 -2.161 -6.229 -7.481 1.00 0.00 C ATOM 41 C ILE A 3 -3.227 -6.789 -6.552 1.00 0.00 C ATOM 42 O ILE A 3 -3.511 -7.985 -6.577 1.00 0.00 O ATOM 43 CB ILE A 3 -2.749 -5.989 -8.884 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.859 -5.084 -9.741 1.00 0.00 C ATOM 45 CG2 ILE A 3 -4.098 -5.275 -8.787 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.655 -5.809 -10.323 1.00 0.00 C ATOM 0 H ILE A 3 -1.313 -8.100 -7.853 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.801 -5.267 -7.117 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.837 -6.976 -9.338 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.452 -4.666 -10.554 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.513 -4.246 -9.136 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.497 -5.114 -9.788 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.793 -5.887 -8.213 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.966 -4.314 -8.290 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.065 -5.113 -10.920 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -0.041 -6.204 -9.513 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.995 -6.630 -10.954 1.00 0.00 H new ATOM 58 N LEU A 4 -3.816 -5.918 -5.735 1.00 0.00 N ATOM 59 CA LEU A 4 -4.853 -6.284 -4.791 1.00 0.00 C ATOM 60 C LEU A 4 -5.941 -5.209 -4.850 1.00 0.00 C ATOM 61 O LEU A 4 -5.714 -4.111 -5.361 1.00 0.00 O ATOM 62 CB LEU A 4 -4.255 -6.421 -3.384 1.00 0.00 C ATOM 63 CG LEU A 4 -3.238 -7.569 -3.223 1.00 0.00 C ATOM 64 CD1 LEU A 4 -2.751 -7.630 -1.779 1.00 0.00 C ATOM 65 CD2 LEU A 4 -3.880 -8.924 -3.515 1.00 0.00 C ATOM 0 H LEU A 4 -3.578 -4.926 -5.715 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.293 -7.249 -5.044 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.768 -5.483 -3.119 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.067 -6.571 -2.672 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.424 -7.373 -3.921 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.033 -8.443 -1.671 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.273 -6.686 -1.516 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.599 -7.805 -1.116 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.137 -9.712 -3.393 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.705 -9.092 -2.823 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.256 -8.935 -4.538 1.00 0.00 H new ATOM 77 N THR A 5 -7.126 -5.526 -4.321 1.00 0.00 N ATOM 78 CA THR A 5 -8.280 -4.644 -4.399 1.00 0.00 C ATOM 79 C THR A 5 -8.856 -4.449 -3.006 1.00 0.00 C ATOM 80 O THR A 5 -8.984 -5.401 -2.238 1.00 0.00 O ATOM 81 CB THR A 5 -9.317 -5.244 -5.359 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.748 -5.348 -6.645 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.581 -4.392 -5.458 1.00 0.00 C ATOM 0 H THR A 5 -7.306 -6.401 -3.829 1.00 0.00 H new ATOM 0 HA THR A 5 -7.987 -3.668 -4.786 1.00 0.00 H new ATOM 0 HB THR A 5 -9.598 -6.221 -4.966 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.404 -5.732 -7.263 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.282 -4.860 -6.149 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.042 -4.310 -4.474 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.322 -3.398 -5.822 1.00 0.00 H new ATOM 91 N ARG A 6 -9.203 -3.197 -2.693 1.00 0.00 N ATOM 92 CA ARG A 6 -9.652 -2.778 -1.372 1.00 0.00 C ATOM 93 C ARG A 6 -10.688 -1.674 -1.517 1.00 0.00 C ATOM 94 O ARG A 6 -10.968 -1.218 -2.627 1.00 0.00 O ATOM 95 CB ARG A 6 -8.452 -2.242 -0.581 1.00 0.00 C ATOM 96 CG ARG A 6 -7.434 -3.323 -0.199 1.00 0.00 C ATOM 97 CD ARG A 6 -7.801 -4.034 1.102 1.00 0.00 C ATOM 98 NE ARG A 6 -9.155 -4.596 1.078 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.456 -5.880 0.868 1.00 0.00 C ATOM 100 NH1 ARG A 6 -8.509 -6.780 0.624 1.00 0.00 N ATOM 101 NH2 ARG A 6 -10.726 -6.259 0.902 1.00 0.00 N ATOM 0 H ARG A 6 -9.177 -2.434 -3.369 1.00 0.00 H new ATOM 0 HA ARG A 6 -10.093 -3.626 -0.848 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -7.951 -1.476 -1.173 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -8.813 -1.758 0.327 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.366 -4.055 -1.004 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -6.448 -2.870 -0.097 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -7.084 -4.833 1.289 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -7.719 -3.331 1.931 1.00 0.00 H new ATOM 0 HE ARG A 6 -9.931 -3.953 1.235 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -7.530 -6.495 0.594 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -8.761 -7.756 0.466 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.458 -5.573 1.087 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.971 -7.236 0.743 1.00 0.00 H new ATOM 115 N LYS A 7 -11.254 -1.245 -0.391 1.00 0.00 N ATOM 116 CA LYS A 7 -12.182 -0.126 -0.353 1.00 0.00 C ATOM 117 C LYS A 7 -11.754 0.849 0.733 1.00 0.00 C ATOM 118 O LYS A 7 -10.968 0.496 1.612 1.00 0.00 O ATOM 119 CB LYS A 7 -13.607 -0.616 -0.086 1.00 0.00 C ATOM 120 CG LYS A 7 -13.969 -1.899 -0.839 1.00 0.00 C ATOM 121 CD LYS A 7 -15.492 -2.062 -0.812 1.00 0.00 C ATOM 122 CE LYS A 7 -15.891 -3.506 -1.110 1.00 0.00 C ATOM 123 NZ LYS A 7 -17.358 -3.651 -1.114 1.00 0.00 N ATOM 0 H LYS A 7 -11.079 -1.667 0.521 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.169 0.377 -1.320 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.728 -0.787 0.984 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.310 0.169 -0.365 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.611 -1.849 -1.867 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.487 -2.760 -0.375 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.876 -1.769 0.165 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -15.946 -1.396 -1.546 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -15.488 -3.808 -2.077 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.457 -4.170 -0.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -17.609 -4.639 -1.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -17.736 -3.383 -0.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -17.766 -3.032 -1.844 1.00 0.00 H new ATOM 137 N VAL A 8 -12.274 2.075 0.674 1.00 0.00 N ATOM 138 CA VAL A 8 -11.998 3.093 1.673 1.00 0.00 C ATOM 139 C VAL A 8 -12.256 2.521 3.063 1.00 0.00 C ATOM 140 O VAL A 8 -13.396 2.194 3.397 1.00 0.00 O ATOM 141 CB VAL A 8 -12.890 4.305 1.408 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.769 5.310 2.550 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.491 4.978 0.092 1.00 0.00 C ATOM 0 H VAL A 8 -12.898 2.385 -0.071 1.00 0.00 H new ATOM 0 HA VAL A 8 -10.955 3.406 1.617 1.00 0.00 H new ATOM 0 HB VAL A 8 -13.923 3.964 1.338 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.410 6.169 2.348 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.077 4.839 3.483 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.734 5.641 2.635 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.134 5.840 -0.085 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.453 5.305 0.151 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.602 4.268 -0.728 1.00 0.00 H new ATOM 153 N GLY A 9 -11.199 2.399 3.874 1.00 0.00 N ATOM 154 CA GLY A 9 -11.325 1.909 5.239 1.00 0.00 C ATOM 155 C GLY A 9 -10.726 0.517 5.425 1.00 0.00 C ATOM 156 O GLY A 9 -10.958 -0.112 6.455 1.00 0.00 O ATOM 0 H GLY A 9 -10.245 2.636 3.601 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.832 2.605 5.917 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.379 1.886 5.516 1.00 0.00 H new ATOM 160 N GLU A 10 -9.961 0.027 4.444 1.00 0.00 N ATOM 161 CA GLU A 10 -9.359 -1.299 4.506 1.00 0.00 C ATOM 162 C GLU A 10 -7.843 -1.206 4.358 1.00 0.00 C ATOM 163 O GLU A 10 -7.302 -0.123 4.129 1.00 0.00 O ATOM 164 CB GLU A 10 -9.972 -2.199 3.431 1.00 0.00 C ATOM 165 CG GLU A 10 -11.484 -2.344 3.624 1.00 0.00 C ATOM 166 CD GLU A 10 -12.082 -3.333 2.627 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.568 -3.387 1.488 1.00 0.00 O ATOM 168 OE2 GLU A 10 -13.050 -4.028 3.009 1.00 0.00 O ATOM 0 H GLU A 10 -9.745 0.540 3.589 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.567 -1.742 5.480 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.767 -1.783 2.445 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.503 -3.182 3.466 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.692 -2.679 4.640 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.962 -1.372 3.505 1.00 0.00 H new ATOM 175 N SER A 11 -7.149 -2.342 4.488 1.00 0.00 N ATOM 176 CA SER A 11 -5.696 -2.365 4.584 1.00 0.00 C ATOM 177 C SER A 11 -5.065 -3.512 3.801 1.00 0.00 C ATOM 178 O SER A 11 -5.751 -4.401 3.300 1.00 0.00 O ATOM 179 CB SER A 11 -5.292 -2.483 6.057 1.00 0.00 C ATOM 180 OG SER A 11 -5.809 -1.402 6.805 1.00 0.00 O ATOM 0 H SER A 11 -7.582 -3.265 4.529 1.00 0.00 H new ATOM 0 HA SER A 11 -5.330 -1.436 4.147 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.660 -3.424 6.466 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.205 -2.503 6.141 1.00 0.00 H new ATOM 0 HG SER A 11 -5.542 -1.496 7.743 1.00 0.00 H new ATOM 186 N ILE A 12 -3.733 -3.471 3.710 1.00 0.00 N ATOM 187 CA ILE A 12 -2.881 -4.442 3.040 1.00 0.00 C ATOM 188 C ILE A 12 -1.658 -4.611 3.940 1.00 0.00 C ATOM 189 O ILE A 12 -1.398 -3.762 4.789 1.00 0.00 O ATOM 190 CB ILE A 12 -2.483 -3.919 1.650 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.700 -3.739 0.732 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.475 -4.839 0.955 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.393 -5.061 0.404 1.00 0.00 C ATOM 0 H ILE A 12 -3.194 -2.712 4.128 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.385 -5.396 2.885 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.019 -2.948 1.824 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.414 -3.068 1.210 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.383 -3.260 -0.194 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.223 -4.430 -0.023 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.572 -4.913 1.561 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.912 -5.830 0.832 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.246 -4.873 -0.248 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.691 -5.725 -0.100 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.737 -5.530 1.326 1.00 0.00 H new ATOM 205 N ASN A 13 -0.901 -5.696 3.771 1.00 0.00 N ATOM 206 CA ASN A 13 0.222 -5.988 4.650 1.00 0.00 C ATOM 207 C ASN A 13 1.442 -6.409 3.843 1.00 0.00 C ATOM 208 O ASN A 13 1.308 -6.982 2.760 1.00 0.00 O ATOM 209 CB ASN A 13 -0.190 -7.100 5.613 1.00 0.00 C ATOM 210 CG ASN A 13 -1.169 -6.596 6.659 1.00 0.00 C ATOM 211 OD1 ASN A 13 -2.381 -6.717 6.506 1.00 0.00 O ATOM 212 ND2 ASN A 13 -0.649 -6.022 7.739 1.00 0.00 N ATOM 0 H ASN A 13 -1.048 -6.384 3.033 1.00 0.00 H new ATOM 0 HA ASN A 13 0.489 -5.092 5.211 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.643 -7.918 5.053 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.695 -7.503 6.106 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -1.262 -5.666 8.472 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.363 -5.938 7.834 1.00 0.00 H new ATOM 219 N ILE A 14 2.630 -6.118 4.383 1.00 0.00 N ATOM 220 CA ILE A 14 3.899 -6.416 3.729 1.00 0.00 C ATOM 221 C ILE A 14 4.936 -6.811 4.785 1.00 0.00 C ATOM 222 O ILE A 14 4.890 -6.335 5.921 1.00 0.00 O ATOM 223 CB ILE A 14 4.380 -5.194 2.928 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.297 -4.719 1.948 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.664 -5.540 2.164 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.741 -3.505 1.127 1.00 0.00 C ATOM 0 H ILE A 14 2.734 -5.666 5.292 1.00 0.00 H new ATOM 0 HA ILE A 14 3.765 -7.247 3.037 1.00 0.00 H new ATOM 0 HB ILE A 14 4.586 -4.385 3.629 1.00 0.00 H new ATOM 0 HG12 ILE A 14 3.039 -5.535 1.273 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.394 -4.467 2.504 1.00 0.00 H new ATOM 0 HG21 ILE A 14 5.997 -4.669 1.600 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.440 -5.833 2.871 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.468 -6.364 1.478 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.939 -3.210 0.451 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.973 -2.677 1.797 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.628 -3.762 0.548 1.00 0.00 H new ATOM 238 N GLY A 15 5.875 -7.682 4.406 1.00 0.00 N ATOM 239 CA GLY A 15 6.934 -8.120 5.299 1.00 0.00 C ATOM 240 C GLY A 15 6.358 -8.704 6.582 1.00 0.00 C ATOM 241 O GLY A 15 5.388 -9.458 6.551 1.00 0.00 O ATOM 0 H GLY A 15 5.917 -8.097 3.475 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.550 -8.868 4.799 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.585 -7.279 5.538 1.00 0.00 H new ATOM 245 N ASP A 16 6.962 -8.347 7.717 1.00 0.00 N ATOM 246 CA ASP A 16 6.519 -8.769 9.038 1.00 0.00 C ATOM 247 C ASP A 16 6.399 -7.574 9.989 1.00 0.00 C ATOM 248 O ASP A 16 6.152 -7.761 11.178 1.00 0.00 O ATOM 249 CB ASP A 16 7.441 -9.869 9.574 1.00 0.00 C ATOM 250 CG ASP A 16 8.858 -9.371 9.857 1.00 0.00 C ATOM 251 OD1 ASP A 16 9.466 -8.764 8.946 1.00 0.00 O ATOM 252 OD2 ASP A 16 9.326 -9.606 10.993 1.00 0.00 O ATOM 0 H ASP A 16 7.786 -7.746 7.739 1.00 0.00 H new ATOM 0 HA ASP A 16 5.518 -9.194 8.962 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.015 -10.279 10.490 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.485 -10.684 8.851 1.00 0.00 H new ATOM 257 N ASP A 17 6.578 -6.355 9.472 1.00 0.00 N ATOM 258 CA ASP A 17 6.507 -5.132 10.260 1.00 0.00 C ATOM 259 C ASP A 17 5.889 -3.971 9.469 1.00 0.00 C ATOM 260 O ASP A 17 5.985 -2.827 9.908 1.00 0.00 O ATOM 261 CB ASP A 17 7.906 -4.733 10.735 1.00 0.00 C ATOM 262 CG ASP A 17 8.461 -5.683 11.795 1.00 0.00 C ATOM 263 OD1 ASP A 17 7.855 -5.744 12.889 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.487 -6.339 11.506 1.00 0.00 O ATOM 0 H ASP A 17 6.778 -6.193 8.485 1.00 0.00 H new ATOM 0 HA ASP A 17 5.864 -5.336 11.116 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.583 -4.712 9.881 1.00 0.00 H new ATOM 0 HB3 ASP A 17 7.873 -3.722 11.140 1.00 0.00 H new ATOM 269 N ILE A 18 5.258 -4.232 8.315 1.00 0.00 N ATOM 270 CA ILE A 18 4.702 -3.161 7.497 1.00 0.00 C ATOM 271 C ILE A 18 3.227 -3.422 7.191 1.00 0.00 C ATOM 272 O ILE A 18 2.826 -4.555 6.925 1.00 0.00 O ATOM 273 CB ILE A 18 5.517 -3.028 6.204 1.00 0.00 C ATOM 274 CG1 ILE A 18 6.987 -2.741 6.537 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.932 -1.916 5.324 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.867 -2.748 5.286 1.00 0.00 C ATOM 0 H ILE A 18 5.124 -5.169 7.935 1.00 0.00 H new ATOM 0 HA ILE A 18 4.762 -2.223 8.049 1.00 0.00 H new ATOM 0 HB ILE A 18 5.465 -3.966 5.651 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.065 -1.772 7.030 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.352 -3.488 7.242 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.518 -1.830 4.409 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.899 -2.157 5.072 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.963 -0.970 5.865 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.900 -2.541 5.566 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.810 -3.725 4.807 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.519 -1.983 4.592 1.00 0.00 H new ATOM 288 N THR A 19 2.427 -2.352 7.228 1.00 0.00 N ATOM 289 CA THR A 19 1.004 -2.390 6.921 1.00 0.00 C ATOM 290 C THR A 19 0.640 -1.101 6.199 1.00 0.00 C ATOM 291 O THR A 19 1.236 -0.058 6.463 1.00 0.00 O ATOM 292 CB THR A 19 0.203 -2.525 8.222 1.00 0.00 C ATOM 293 OG1 THR A 19 0.625 -3.667 8.937 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.293 -2.648 7.948 1.00 0.00 C ATOM 0 H THR A 19 2.761 -1.421 7.477 1.00 0.00 H new ATOM 0 HA THR A 19 0.769 -3.244 6.285 1.00 0.00 H new ATOM 0 HB THR A 19 0.382 -1.624 8.808 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.108 -3.743 9.766 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.829 -2.742 8.892 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.640 -1.760 7.420 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.479 -3.530 7.336 1.00 0.00 H new ATOM 302 N ILE A 20 -0.336 -1.165 5.293 1.00 0.00 N ATOM 303 CA ILE A 20 -0.728 -0.043 4.451 1.00 0.00 C ATOM 304 C ILE A 20 -2.249 0.077 4.484 1.00 0.00 C ATOM 305 O ILE A 20 -2.939 -0.926 4.654 1.00 0.00 O ATOM 306 CB ILE A 20 -0.238 -0.280 3.012 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.225 -0.746 2.944 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.410 0.999 2.192 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.229 0.306 3.411 1.00 0.00 C ATOM 0 H ILE A 20 -0.881 -2.010 5.124 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.281 0.881 4.818 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.847 -1.083 2.597 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.340 -1.641 3.555 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.459 -1.028 1.918 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.062 0.828 1.173 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.463 1.280 2.173 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.172 1.802 2.644 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.239 -0.096 3.334 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.143 1.194 2.785 1.00 0.00 H new ATOM 0 HD13 ILE A 20 2.022 0.571 4.448 1.00 0.00 H new ATOM 321 N THR A 21 -2.784 1.290 4.322 1.00 0.00 N ATOM 322 CA THR A 21 -4.220 1.521 4.434 1.00 0.00 C ATOM 323 C THR A 21 -4.688 2.557 3.413 1.00 0.00 C ATOM 324 O THR A 21 -3.925 3.431 3.004 1.00 0.00 O ATOM 325 CB THR A 21 -4.531 1.999 5.857 1.00 0.00 C ATOM 326 OG1 THR A 21 -3.983 1.105 6.799 1.00 0.00 O ATOM 327 CG2 THR A 21 -6.030 2.085 6.130 1.00 0.00 C ATOM 0 H THR A 21 -2.240 2.127 4.112 1.00 0.00 H new ATOM 0 HA THR A 21 -4.751 0.592 4.229 1.00 0.00 H new ATOM 0 HB THR A 21 -4.094 2.994 5.948 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.531 0.293 6.837 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.195 2.428 7.151 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.487 2.787 5.433 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.480 1.101 6.001 1.00 0.00 H new ATOM 335 N ILE A 22 -5.960 2.458 3.009 1.00 0.00 N ATOM 336 CA ILE A 22 -6.604 3.399 2.104 1.00 0.00 C ATOM 337 C ILE A 22 -7.601 4.209 2.930 1.00 0.00 C ATOM 338 O ILE A 22 -8.725 3.779 3.189 1.00 0.00 O ATOM 339 CB ILE A 22 -7.230 2.654 0.912 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.138 3.562 0.074 1.00 0.00 C ATOM 341 CG2 ILE A 22 -8.037 1.429 1.347 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.372 4.748 -0.505 1.00 0.00 C ATOM 0 H ILE A 22 -6.577 1.704 3.312 1.00 0.00 H new ATOM 0 HA ILE A 22 -5.891 4.092 1.656 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.386 2.327 0.305 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.581 2.984 -0.737 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.959 3.926 0.692 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.457 0.939 0.468 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.385 0.732 1.874 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.844 1.742 2.009 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.050 5.367 -1.092 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.951 5.340 0.307 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.567 4.384 -1.144 1.00 0.00 H new ATOM 354 N LEU A 23 -7.173 5.403 3.352 1.00 0.00 N ATOM 355 CA LEU A 23 -7.928 6.213 4.296 1.00 0.00 C ATOM 356 C LEU A 23 -9.117 6.881 3.616 1.00 0.00 C ATOM 357 O LEU A 23 -10.097 7.214 4.280 1.00 0.00 O ATOM 358 CB LEU A 23 -6.997 7.269 4.897 1.00 0.00 C ATOM 359 CG LEU A 23 -5.701 6.649 5.431 1.00 0.00 C ATOM 360 CD1 LEU A 23 -4.813 7.745 5.994 1.00 0.00 C ATOM 361 CD2 LEU A 23 -5.950 5.601 6.510 1.00 0.00 C ATOM 0 H LEU A 23 -6.297 5.828 3.047 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.318 5.571 5.086 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.757 8.015 4.140 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.511 7.789 5.705 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.215 6.146 4.595 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.891 7.306 6.374 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.577 8.462 5.208 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.334 8.255 6.805 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.997 5.196 6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.470 6.060 7.350 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.561 4.796 6.101 1.00 0.00 H new ATOM 373 N GLY A 24 -9.040 7.078 2.300 1.00 0.00 N ATOM 374 CA GLY A 24 -10.140 7.625 1.526 1.00 0.00 C ATOM 375 C GLY A 24 -9.704 8.051 0.131 1.00 0.00 C ATOM 376 O GLY A 24 -8.552 7.865 -0.251 1.00 0.00 O ATOM 0 H GLY A 24 -8.211 6.861 1.746 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -10.932 6.880 1.446 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.561 8.482 2.051 1.00 0.00 H new ATOM 380 N VAL A 25 -10.635 8.627 -0.628 1.00 0.00 N ATOM 381 CA VAL A 25 -10.405 9.000 -2.017 1.00 0.00 C ATOM 382 C VAL A 25 -11.102 10.316 -2.349 1.00 0.00 C ATOM 383 O VAL A 25 -12.046 10.720 -1.673 1.00 0.00 O ATOM 384 CB VAL A 25 -10.869 7.848 -2.920 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.374 7.598 -2.799 1.00 0.00 C ATOM 386 CG2 VAL A 25 -10.538 8.124 -4.384 1.00 0.00 C ATOM 0 H VAL A 25 -11.573 8.848 -0.293 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.342 9.167 -2.189 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.333 6.961 -2.583 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.660 6.775 -3.454 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.619 7.343 -1.768 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.917 8.498 -3.089 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.879 7.290 -4.998 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.038 9.038 -4.704 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.460 8.241 -4.498 1.00 0.00 H new ATOM 396 N SER A 26 -10.617 10.982 -3.401 1.00 0.00 N ATOM 397 CA SER A 26 -11.105 12.278 -3.852 1.00 0.00 C ATOM 398 C SER A 26 -10.997 12.344 -5.373 1.00 0.00 C ATOM 399 O SER A 26 -10.301 13.200 -5.916 1.00 0.00 O ATOM 400 CB SER A 26 -10.292 13.403 -3.208 1.00 0.00 C ATOM 401 OG SER A 26 -10.469 13.401 -1.807 1.00 0.00 O ATOM 0 H SER A 26 -9.854 10.621 -3.974 1.00 0.00 H new ATOM 0 HA SER A 26 -12.147 12.402 -3.556 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.236 13.279 -3.447 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.601 14.364 -3.618 1.00 0.00 H new ATOM 0 HG SER A 26 -9.942 14.125 -1.410 1.00 0.00 H new ATOM 407 N GLY A 27 -11.694 11.433 -6.059 1.00 0.00 N ATOM 408 CA GLY A 27 -11.699 11.390 -7.513 1.00 0.00 C ATOM 409 C GLY A 27 -10.330 10.983 -8.047 1.00 0.00 C ATOM 410 O GLY A 27 -9.849 9.888 -7.760 1.00 0.00 O ATOM 0 H GLY A 27 -12.265 10.711 -5.619 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.454 10.683 -7.858 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.973 12.368 -7.909 1.00 0.00 H new ATOM 414 N GLN A 28 -9.710 11.872 -8.824 1.00 0.00 N ATOM 415 CA GLN A 28 -8.412 11.624 -9.431 1.00 0.00 C ATOM 416 C GLN A 28 -7.294 11.615 -8.382 1.00 0.00 C ATOM 417 O GLN A 28 -6.146 11.319 -8.712 1.00 0.00 O ATOM 418 CB GLN A 28 -8.184 12.680 -10.517 1.00 0.00 C ATOM 419 CG GLN A 28 -6.891 12.439 -11.296 1.00 0.00 C ATOM 420 CD GLN A 28 -6.876 13.212 -12.611 1.00 0.00 C ATOM 421 OE1 GLN A 28 -6.700 12.622 -13.676 1.00 0.00 O ATOM 422 NE2 GLN A 28 -7.059 14.527 -12.565 1.00 0.00 N ATOM 0 H GLN A 28 -10.100 12.787 -9.048 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.395 10.634 -9.886 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.028 12.677 -11.207 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.151 13.668 -10.059 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.038 12.738 -10.687 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -6.780 11.374 -11.498 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -7.203 14.991 -11.668 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -7.056 15.073 -13.427 1.00 0.00 H new ATOM 431 N GLN A 29 -7.603 11.932 -7.118 1.00 0.00 N ATOM 432 CA GLN A 29 -6.615 11.934 -6.045 1.00 0.00 C ATOM 433 C GLN A 29 -7.051 11.004 -4.920 1.00 0.00 C ATOM 434 O GLN A 29 -8.212 10.603 -4.849 1.00 0.00 O ATOM 435 CB GLN A 29 -6.385 13.354 -5.524 1.00 0.00 C ATOM 436 CG GLN A 29 -6.080 14.323 -6.666 1.00 0.00 C ATOM 437 CD GLN A 29 -5.642 15.682 -6.137 1.00 0.00 C ATOM 438 OE1 GLN A 29 -4.589 16.195 -6.498 1.00 0.00 O ATOM 439 NE2 GLN A 29 -6.453 16.278 -5.269 1.00 0.00 N ATOM 0 H GLN A 29 -8.542 12.192 -6.817 1.00 0.00 H new ATOM 0 HA GLN A 29 -5.670 11.566 -6.444 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.269 13.693 -4.983 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.558 13.354 -4.814 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.296 13.907 -7.299 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.965 14.442 -7.291 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -7.322 15.824 -4.989 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.206 17.189 -4.883 1.00 0.00 H new ATOM 448 N VAL A 30 -6.111 10.662 -4.035 1.00 0.00 N ATOM 449 CA VAL A 30 -6.324 9.661 -2.993 1.00 0.00 C ATOM 450 C VAL A 30 -5.526 9.999 -1.737 1.00 0.00 C ATOM 451 O VAL A 30 -4.478 10.637 -1.834 1.00 0.00 O ATOM 452 CB VAL A 30 -5.832 8.305 -3.522 1.00 0.00 C ATOM 453 CG1 VAL A 30 -6.210 7.182 -2.563 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.408 7.953 -4.893 1.00 0.00 C ATOM 0 H VAL A 30 -5.178 11.075 -4.023 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.384 9.635 -2.741 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.750 8.402 -3.609 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.852 6.231 -2.957 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.755 7.366 -1.590 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -7.294 7.145 -2.455 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.023 6.984 -5.212 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.495 7.908 -4.830 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.117 8.715 -5.616 1.00 0.00 H new ATOM 464 N ARG A 31 -6.012 9.580 -0.561 1.00 0.00 N ATOM 465 CA ARG A 31 -5.233 9.642 0.672 1.00 0.00 C ATOM 466 C ARG A 31 -5.039 8.224 1.192 1.00 0.00 C ATOM 467 O ARG A 31 -5.995 7.489 1.439 1.00 0.00 O ATOM 468 CB ARG A 31 -5.871 10.548 1.734 1.00 0.00 C ATOM 469 CG ARG A 31 -5.046 10.413 3.024 1.00 0.00 C ATOM 470 CD ARG A 31 -5.415 11.393 4.145 1.00 0.00 C ATOM 471 NE ARG A 31 -4.963 12.749 3.835 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.351 13.847 4.488 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.155 13.783 5.547 1.00 0.00 N ATOM 474 NH2 ARG A 31 -4.927 15.038 4.080 1.00 0.00 N ATOM 0 H ARG A 31 -6.948 9.193 -0.443 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.266 10.093 0.450 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -5.883 11.584 1.395 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.907 10.258 1.911 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.157 9.397 3.402 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.993 10.548 2.778 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -6.495 11.392 4.291 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.966 11.063 5.082 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.304 12.864 3.065 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.491 12.879 5.879 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.435 14.638 6.027 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.309 15.110 3.272 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.220 15.881 4.575 1.00 0.00 H new ATOM 488 N ILE A 32 -3.772 7.864 1.357 1.00 0.00 N ATOM 489 CA ILE A 32 -3.341 6.554 1.814 1.00 0.00 C ATOM 490 C ILE A 32 -2.329 6.724 2.940 1.00 0.00 C ATOM 491 O ILE A 32 -1.680 7.764 3.049 1.00 0.00 O ATOM 492 CB ILE A 32 -2.715 5.768 0.650 1.00 0.00 C ATOM 493 CG1 ILE A 32 -1.731 6.650 -0.130 1.00 0.00 C ATOM 494 CG2 ILE A 32 -3.819 5.249 -0.269 1.00 0.00 C ATOM 495 CD1 ILE A 32 -1.057 5.875 -1.261 1.00 0.00 C ATOM 0 H ILE A 32 -2.994 8.497 1.170 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.202 5.996 2.183 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.160 4.920 1.051 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.260 7.510 -0.542 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -0.972 7.038 0.549 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.374 4.692 -1.094 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.484 4.594 0.294 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.388 6.090 -0.665 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.367 6.532 -1.791 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.507 5.030 -0.846 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.815 5.510 -1.954 1.00 0.00 H new ATOM 507 N GLY A 33 -2.196 5.700 3.783 1.00 0.00 N ATOM 508 CA GLY A 33 -1.305 5.758 4.922 1.00 0.00 C ATOM 509 C GLY A 33 -0.396 4.540 4.960 1.00 0.00 C ATOM 510 O GLY A 33 -0.653 3.539 4.292 1.00 0.00 O ATOM 0 H GLY A 33 -2.701 4.819 3.690 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.703 6.665 4.872 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.887 5.812 5.842 1.00 0.00 H new ATOM 514 N ILE A 34 0.670 4.639 5.750 1.00 0.00 N ATOM 515 CA ILE A 34 1.679 3.605 5.865 1.00 0.00 C ATOM 516 C ILE A 34 1.960 3.410 7.348 1.00 0.00 C ATOM 517 O ILE A 34 2.014 4.377 8.109 1.00 0.00 O ATOM 518 CB ILE A 34 2.970 4.021 5.138 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.768 4.196 3.627 1.00 0.00 C ATOM 520 CG2 ILE A 34 4.045 2.951 5.350 1.00 0.00 C ATOM 521 CD1 ILE A 34 2.331 5.614 3.256 1.00 0.00 C ATOM 0 H ILE A 34 0.854 5.454 6.334 1.00 0.00 H new ATOM 0 HA ILE A 34 1.325 2.681 5.408 1.00 0.00 H new ATOM 0 HB ILE A 34 3.272 4.981 5.558 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.697 3.958 3.109 1.00 0.00 H new ATOM 0 HG13 ILE A 34 2.018 3.485 3.279 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.959 3.246 4.835 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.247 2.845 6.416 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.695 1.999 4.951 1.00 0.00 H new ATOM 0 HD11 ILE A 34 2.202 5.684 2.176 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.387 5.845 3.750 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.092 6.325 3.578 1.00 0.00 H new ATOM 533 N ASN A 35 2.142 2.156 7.756 1.00 0.00 N ATOM 534 CA ASN A 35 2.353 1.803 9.143 1.00 0.00 C ATOM 535 C ASN A 35 3.535 0.847 9.233 1.00 0.00 C ATOM 536 O ASN A 35 3.394 -0.354 9.442 1.00 0.00 O ATOM 537 CB ASN A 35 1.062 1.229 9.717 1.00 0.00 C ATOM 538 CG ASN A 35 1.003 1.359 11.234 1.00 0.00 C ATOM 539 OD1 ASN A 35 1.992 1.146 11.928 1.00 0.00 O ATOM 540 ND2 ASN A 35 -0.164 1.718 11.752 1.00 0.00 N ATOM 0 H ASN A 35 2.146 1.356 7.123 1.00 0.00 H new ATOM 0 HA ASN A 35 2.602 2.677 9.745 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.209 1.744 9.276 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.978 0.178 9.440 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -0.262 1.826 12.761 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.963 1.886 11.141 1.00 0.00 H new ATOM 547 N ALA A 36 4.715 1.440 9.065 1.00 0.00 N ATOM 548 CA ALA A 36 6.014 0.790 9.144 1.00 0.00 C ATOM 549 C ALA A 36 6.786 1.447 10.282 1.00 0.00 C ATOM 550 O ALA A 36 6.455 2.563 10.687 1.00 0.00 O ATOM 551 CB ALA A 36 6.727 0.985 7.808 1.00 0.00 C ATOM 0 H ALA A 36 4.791 2.436 8.860 1.00 0.00 H new ATOM 0 HA ALA A 36 5.928 -0.279 9.338 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.705 0.505 7.844 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.133 0.539 7.010 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.853 2.050 7.615 1.00 0.00 H new ATOM 557 N PRO A 37 7.814 0.778 10.809 1.00 0.00 N ATOM 558 CA PRO A 37 8.586 1.318 11.906 1.00 0.00 C ATOM 559 C PRO A 37 9.363 2.525 11.403 1.00 0.00 C ATOM 560 O PRO A 37 9.764 2.576 10.240 1.00 0.00 O ATOM 561 CB PRO A 37 9.500 0.177 12.359 1.00 0.00 C ATOM 562 CG PRO A 37 9.658 -0.671 11.102 1.00 0.00 C ATOM 563 CD PRO A 37 8.311 -0.520 10.407 1.00 0.00 C ATOM 0 HA PRO A 37 7.980 1.662 12.744 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.460 0.549 12.716 1.00 0.00 H new ATOM 0 HB3 PRO A 37 9.056 -0.393 13.175 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.476 -0.314 10.476 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.872 -1.712 11.343 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.419 -0.581 9.324 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.625 -1.313 10.704 1.00 0.00 H new ATOM 571 N LYS A 38 9.581 3.503 12.279 1.00 0.00 N ATOM 572 CA LYS A 38 10.311 4.707 11.908 1.00 0.00 C ATOM 573 C LYS A 38 11.790 4.386 11.679 1.00 0.00 C ATOM 574 O LYS A 38 12.581 5.263 11.339 1.00 0.00 O ATOM 575 CB LYS A 38 10.070 5.786 12.961 1.00 0.00 C ATOM 576 CG LYS A 38 8.555 5.975 13.088 1.00 0.00 C ATOM 577 CD LYS A 38 8.189 7.138 14.004 1.00 0.00 C ATOM 578 CE LYS A 38 6.665 7.184 14.151 1.00 0.00 C ATOM 579 NZ LYS A 38 6.245 8.290 15.034 1.00 0.00 N ATOM 0 H LYS A 38 9.262 3.483 13.248 1.00 0.00 H new ATOM 0 HA LYS A 38 9.945 5.101 10.960 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.501 5.491 13.918 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.550 6.720 12.669 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.129 6.147 12.100 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.108 5.058 13.473 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.659 7.014 14.979 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.558 8.076 13.590 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.206 7.305 13.170 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.308 6.237 14.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.208 8.296 15.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.664 8.160 15.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.566 9.195 14.634 1.00 0.00 H new ATOM 593 N ASP A 39 12.148 3.111 11.871 1.00 0.00 N ATOM 594 CA ASP A 39 13.474 2.588 11.588 1.00 0.00 C ATOM 595 C ASP A 39 13.650 2.310 10.093 1.00 0.00 C ATOM 596 O ASP A 39 14.779 2.104 9.649 1.00 0.00 O ATOM 597 CB ASP A 39 13.685 1.298 12.383 1.00 0.00 C ATOM 598 CG ASP A 39 13.614 1.560 13.884 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.649 1.983 14.448 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.525 1.332 14.459 1.00 0.00 O ATOM 0 H ASP A 39 11.506 2.407 12.235 1.00 0.00 H new ATOM 0 HA ASP A 39 14.213 3.333 11.882 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.928 0.566 12.102 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.654 0.867 12.131 1.00 0.00 H new ATOM 605 N VAL A 40 12.565 2.304 9.306 1.00 0.00 N ATOM 606 CA VAL A 40 12.672 2.184 7.855 1.00 0.00 C ATOM 607 C VAL A 40 12.098 3.421 7.173 1.00 0.00 C ATOM 608 O VAL A 40 11.122 4.014 7.633 1.00 0.00 O ATOM 609 CB VAL A 40 12.009 0.905 7.332 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.621 -0.327 7.996 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.495 0.900 7.543 1.00 0.00 C ATOM 0 H VAL A 40 11.609 2.381 9.653 1.00 0.00 H new ATOM 0 HA VAL A 40 13.731 2.113 7.608 1.00 0.00 H new ATOM 0 HB VAL A 40 12.194 0.876 6.258 1.00 0.00 H new ATOM 0 HG11 VAL A 40 12.137 -1.225 7.612 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.688 -0.367 7.776 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.475 -0.269 9.075 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.077 -0.028 7.154 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.276 0.979 8.608 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.052 1.746 7.017 1.00 0.00 H new ATOM 621 N ALA A 41 12.723 3.802 6.057 1.00 0.00 N ATOM 622 CA ALA A 41 12.376 4.994 5.308 1.00 0.00 C ATOM 623 C ALA A 41 11.017 4.843 4.623 1.00 0.00 C ATOM 624 O ALA A 41 10.662 3.758 4.169 1.00 0.00 O ATOM 625 CB ALA A 41 13.463 5.251 4.268 1.00 0.00 C ATOM 0 H ALA A 41 13.496 3.277 5.648 1.00 0.00 H new ATOM 0 HA ALA A 41 12.305 5.837 5.995 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.215 6.145 3.696 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.420 5.394 4.770 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.531 4.397 3.594 1.00 0.00 H new ATOM 631 N VAL A 42 10.267 5.941 4.551 1.00 0.00 N ATOM 632 CA VAL A 42 8.978 6.001 3.876 1.00 0.00 C ATOM 633 C VAL A 42 8.807 7.405 3.305 1.00 0.00 C ATOM 634 O VAL A 42 8.782 8.370 4.069 1.00 0.00 O ATOM 635 CB VAL A 42 7.849 5.699 4.872 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.493 5.781 4.182 1.00 0.00 C ATOM 637 CG2 VAL A 42 7.964 4.303 5.479 1.00 0.00 C ATOM 0 H VAL A 42 10.546 6.829 4.969 1.00 0.00 H new ATOM 0 HA VAL A 42 8.937 5.261 3.076 1.00 0.00 H new ATOM 0 HB VAL A 42 7.938 6.444 5.662 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.704 5.564 4.903 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.350 6.783 3.778 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.453 5.054 3.371 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.142 4.140 6.176 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.920 3.557 4.686 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.912 4.214 6.009 1.00 0.00 H new ATOM 647 N HIS A 43 8.688 7.508 1.974 1.00 0.00 N ATOM 648 CA HIS A 43 8.552 8.780 1.270 1.00 0.00 C ATOM 649 C HIS A 43 7.676 8.597 0.028 1.00 0.00 C ATOM 650 O HIS A 43 7.143 7.512 -0.195 1.00 0.00 O ATOM 651 CB HIS A 43 9.924 9.312 0.825 1.00 0.00 C ATOM 652 CG HIS A 43 10.987 9.330 1.894 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.362 10.451 2.636 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.738 8.260 2.285 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.334 10.026 3.459 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.580 8.716 3.271 1.00 0.00 N ATOM 0 H HIS A 43 8.684 6.698 1.354 1.00 0.00 H new ATOM 0 HA HIS A 43 8.094 9.494 1.955 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.279 8.703 -0.007 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.796 10.326 0.446 1.00 0.00 H new ATOM 0 HD1 HIS A 43 10.979 11.394 2.568 1.00 0.00 H new ATOM 0 HD2 HIS A 43 11.682 7.254 1.897 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.849 10.650 4.175 1.00 0.00 H new ATOM 664 N ARG A 44 7.522 9.656 -0.780 1.00 0.00 N ATOM 665 CA ARG A 44 6.755 9.581 -2.018 1.00 0.00 C ATOM 666 C ARG A 44 7.652 9.763 -3.241 1.00 0.00 C ATOM 667 O ARG A 44 8.715 10.370 -3.147 1.00 0.00 O ATOM 668 CB ARG A 44 5.548 10.529 -1.982 1.00 0.00 C ATOM 669 CG ARG A 44 5.777 11.987 -1.574 1.00 0.00 C ATOM 670 CD ARG A 44 6.865 12.674 -2.385 1.00 0.00 C ATOM 671 NE ARG A 44 6.635 14.119 -2.492 1.00 0.00 N ATOM 672 CZ ARG A 44 6.854 15.034 -1.545 1.00 0.00 C ATOM 673 NH1 ARG A 44 7.281 14.700 -0.336 1.00 0.00 N ATOM 674 NH2 ARG A 44 6.647 16.316 -1.817 1.00 0.00 N ATOM 0 H ARG A 44 7.923 10.575 -0.592 1.00 0.00 H new ATOM 0 HA ARG A 44 6.339 8.578 -2.109 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.097 10.529 -2.974 1.00 0.00 H new ATOM 0 HB3 ARG A 44 4.813 10.105 -1.298 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.845 12.540 -1.688 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.043 12.024 -0.517 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.834 12.494 -1.919 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.905 12.237 -3.383 1.00 0.00 H new ATOM 0 HE ARG A 44 6.270 14.460 -3.382 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.452 13.721 -0.108 1.00 0.00 H new ATOM 0 HH12 ARG A 44 7.439 15.422 0.367 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.323 16.595 -2.743 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.812 17.023 -1.100 1.00 0.00 H new ATOM 688 N GLU A 45 7.221 9.230 -4.387 1.00 0.00 N ATOM 689 CA GLU A 45 8.047 9.137 -5.588 1.00 0.00 C ATOM 690 C GLU A 45 8.500 10.494 -6.126 1.00 0.00 C ATOM 691 O GLU A 45 9.513 10.564 -6.823 1.00 0.00 O ATOM 692 CB GLU A 45 7.316 8.317 -6.659 1.00 0.00 C ATOM 693 CG GLU A 45 6.089 9.028 -7.248 1.00 0.00 C ATOM 694 CD GLU A 45 6.455 10.052 -8.322 1.00 0.00 C ATOM 695 OE1 GLU A 45 7.251 9.697 -9.218 1.00 0.00 O ATOM 696 OE2 GLU A 45 5.932 11.185 -8.239 1.00 0.00 O ATOM 0 H GLU A 45 6.282 8.849 -4.506 1.00 0.00 H new ATOM 0 HA GLU A 45 8.966 8.623 -5.307 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.012 8.085 -7.465 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.002 7.367 -6.226 1.00 0.00 H new ATOM 0 HG2 GLU A 45 5.415 8.285 -7.675 1.00 0.00 H new ATOM 0 HG3 GLU A 45 5.545 9.528 -6.446 1.00 0.00 H new ATOM 703 N GLU A 46 7.771 11.566 -5.815 1.00 0.00 N ATOM 704 CA GLU A 46 8.119 12.909 -6.251 1.00 0.00 C ATOM 705 C GLU A 46 9.412 13.378 -5.572 1.00 0.00 C ATOM 706 O GLU A 46 10.003 14.372 -5.984 1.00 0.00 O ATOM 707 CB GLU A 46 6.933 13.826 -5.930 1.00 0.00 C ATOM 708 CG GLU A 46 7.174 15.296 -6.266 1.00 0.00 C ATOM 709 CD GLU A 46 5.988 16.141 -5.801 1.00 0.00 C ATOM 710 OE1 GLU A 46 5.795 16.229 -4.569 1.00 0.00 O ATOM 711 OE2 GLU A 46 5.285 16.685 -6.682 1.00 0.00 O ATOM 0 H GLU A 46 6.921 11.522 -5.252 1.00 0.00 H new ATOM 0 HA GLU A 46 8.311 12.931 -7.324 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.059 13.477 -6.479 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.698 13.740 -4.869 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.089 15.642 -5.784 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.315 15.413 -7.340 1.00 0.00 H new ATOM 718 N ILE A 47 9.859 12.662 -4.532 1.00 0.00 N ATOM 719 CA ILE A 47 11.035 13.047 -3.765 1.00 0.00 C ATOM 720 C ILE A 47 11.957 11.860 -3.509 1.00 0.00 C ATOM 721 O ILE A 47 13.149 12.062 -3.300 1.00 0.00 O ATOM 722 CB ILE A 47 10.562 13.697 -2.452 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.495 15.215 -2.641 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.427 13.307 -1.254 1.00 0.00 C ATOM 725 CD1 ILE A 47 10.358 15.933 -1.300 1.00 0.00 C ATOM 0 H ILE A 47 9.413 11.805 -4.205 1.00 0.00 H new ATOM 0 HA ILE A 47 11.625 13.764 -4.336 1.00 0.00 H new ATOM 0 HB ILE A 47 9.566 13.320 -2.221 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.394 15.561 -3.151 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.649 15.468 -3.280 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.047 13.795 -0.356 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.397 12.226 -1.120 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.456 13.622 -1.430 1.00 0.00 H new ATOM 0 HD11 ILE A 47 10.313 17.009 -1.466 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.445 15.604 -0.803 1.00 0.00 H new ATOM 0 HD13 ILE A 47 11.218 15.699 -0.672 1.00 0.00 H new ATOM 737 N TYR A 48 11.453 10.627 -3.515 1.00 0.00 N ATOM 738 CA TYR A 48 12.312 9.502 -3.193 1.00 0.00 C ATOM 739 C TYR A 48 13.449 9.390 -4.200 1.00 0.00 C ATOM 740 O TYR A 48 14.552 8.963 -3.862 1.00 0.00 O ATOM 741 CB TYR A 48 11.492 8.217 -3.171 1.00 0.00 C ATOM 742 CG TYR A 48 12.360 7.026 -2.851 1.00 0.00 C ATOM 743 CD1 TYR A 48 12.983 6.315 -3.888 1.00 0.00 C ATOM 744 CD2 TYR A 48 12.552 6.644 -1.515 1.00 0.00 C ATOM 745 CE1 TYR A 48 13.809 5.222 -3.589 1.00 0.00 C ATOM 746 CE2 TYR A 48 13.373 5.549 -1.210 1.00 0.00 C ATOM 747 CZ TYR A 48 13.992 4.824 -2.248 1.00 0.00 C ATOM 748 OH TYR A 48 14.771 3.744 -1.957 1.00 0.00 O ATOM 0 H TYR A 48 10.485 10.391 -3.733 1.00 0.00 H new ATOM 0 HA TYR A 48 12.747 9.663 -2.207 1.00 0.00 H new ATOM 0 HB2 TYR A 48 10.697 8.302 -2.430 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.012 8.072 -4.139 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.826 6.609 -4.915 1.00 0.00 H new ATOM 0 HD2 TYR A 48 12.067 7.193 -0.721 1.00 0.00 H new ATOM 0 HE1 TYR A 48 14.305 4.685 -4.385 1.00 0.00 H new ATOM 0 HE2 TYR A 48 13.531 5.262 -0.181 1.00 0.00 H new ATOM 0 HH TYR A 48 14.792 3.608 -0.987 1.00 0.00 H new ATOM 758 N GLN A 49 13.175 9.780 -5.446 1.00 0.00 N ATOM 759 CA GLN A 49 14.151 9.711 -6.520 1.00 0.00 C ATOM 760 C GLN A 49 15.212 10.802 -6.363 1.00 0.00 C ATOM 761 O GLN A 49 16.246 10.758 -7.027 1.00 0.00 O ATOM 762 CB GLN A 49 13.409 9.835 -7.853 1.00 0.00 C ATOM 763 CG GLN A 49 12.328 8.753 -7.919 1.00 0.00 C ATOM 764 CD GLN A 49 11.565 8.785 -9.237 1.00 0.00 C ATOM 765 OE1 GLN A 49 12.071 8.377 -10.280 1.00 0.00 O ATOM 766 NE2 GLN A 49 10.329 9.278 -9.202 1.00 0.00 N ATOM 0 H GLN A 49 12.269 10.151 -5.733 1.00 0.00 H new ATOM 0 HA GLN A 49 14.676 8.756 -6.487 1.00 0.00 H new ATOM 0 HB2 GLN A 49 12.959 10.824 -7.944 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.105 9.724 -8.684 1.00 0.00 H new ATOM 0 HG2 GLN A 49 12.788 7.773 -7.791 1.00 0.00 H new ATOM 0 HG3 GLN A 49 11.630 8.888 -7.093 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.937 9.609 -8.321 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.774 9.325 -10.057 1.00 0.00 H new ATOM 775 N ARG A 50 14.962 11.778 -5.482 1.00 0.00 N ATOM 776 CA ARG A 50 15.925 12.822 -5.162 1.00 0.00 C ATOM 777 C ARG A 50 16.738 12.424 -3.933 1.00 0.00 C ATOM 778 O ARG A 50 17.881 12.851 -3.790 1.00 0.00 O ATOM 779 CB ARG A 50 15.183 14.156 -4.960 1.00 0.00 C ATOM 780 CG ARG A 50 15.071 14.588 -3.497 1.00 0.00 C ATOM 781 CD ARG A 50 14.205 15.839 -3.400 1.00 0.00 C ATOM 782 NE ARG A 50 14.865 17.002 -4.002 1.00 0.00 N ATOM 783 CZ ARG A 50 14.347 18.232 -4.022 1.00 0.00 C ATOM 784 NH1 ARG A 50 13.159 18.483 -3.478 1.00 0.00 N ATOM 785 NH2 ARG A 50 15.020 19.226 -4.591 1.00 0.00 N ATOM 0 H ARG A 50 14.082 11.860 -4.973 1.00 0.00 H new ATOM 0 HA ARG A 50 16.627 12.950 -5.986 1.00 0.00 H new ATOM 0 HB2 ARG A 50 15.699 14.936 -5.520 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.181 14.071 -5.381 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.636 13.785 -2.902 1.00 0.00 H new ATOM 0 HG3 ARG A 50 16.062 14.786 -3.089 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.252 15.662 -3.899 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.983 16.048 -2.354 1.00 0.00 H new ATOM 0 HE ARG A 50 15.779 16.862 -4.433 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.630 17.730 -3.037 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.777 19.428 -3.501 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.932 19.049 -5.012 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.625 20.166 -4.607 1.00 0.00 H new ATOM 799 N ILE A 51 16.152 11.612 -3.045 1.00 0.00 N ATOM 800 CA ILE A 51 16.840 11.121 -1.857 1.00 0.00 C ATOM 801 C ILE A 51 17.913 10.122 -2.280 1.00 0.00 C ATOM 802 O ILE A 51 19.074 10.233 -1.888 1.00 0.00 O ATOM 803 CB ILE A 51 15.837 10.438 -0.922 1.00 0.00 C ATOM 804 CG1 ILE A 51 14.820 11.451 -0.401 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.550 9.803 0.274 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.687 10.755 0.345 1.00 0.00 C ATOM 0 H ILE A 51 15.191 11.281 -3.134 1.00 0.00 H new ATOM 0 HA ILE A 51 17.303 11.956 -1.331 1.00 0.00 H new ATOM 0 HB ILE A 51 15.329 9.662 -1.495 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.315 12.160 0.262 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.413 12.024 -1.234 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.816 9.325 0.923 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.262 9.058 -0.081 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.080 10.574 0.833 1.00 0.00 H new ATOM 0 HD11 ILE A 51 12.977 11.500 0.705 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.178 10.065 -0.328 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.094 10.203 1.192 1.00 0.00 H new ATOM 818 N GLN A 52 17.511 9.140 -3.089 1.00 0.00 N ATOM 819 CA GLN A 52 18.390 8.062 -3.516 1.00 0.00 C ATOM 820 C GLN A 52 19.398 8.536 -4.562 1.00 0.00 C ATOM 821 O GLN A 52 20.151 7.732 -5.109 1.00 0.00 O ATOM 822 CB GLN A 52 17.546 6.885 -4.007 1.00 0.00 C ATOM 823 CG GLN A 52 16.720 6.336 -2.844 1.00 0.00 C ATOM 824 CD GLN A 52 17.551 6.173 -1.579 1.00 0.00 C ATOM 825 OE1 GLN A 52 18.548 5.456 -1.561 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.135 6.845 -0.511 1.00 0.00 N ATOM 0 H GLN A 52 16.565 9.074 -3.464 1.00 0.00 H new ATOM 0 HA GLN A 52 18.983 7.726 -2.665 1.00 0.00 H new ATOM 0 HB2 GLN A 52 16.889 7.206 -4.815 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.190 6.104 -4.411 1.00 0.00 H new ATOM 0 HG2 GLN A 52 15.885 7.007 -2.645 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.295 5.372 -3.125 1.00 0.00 H new ATOM 0 HE21 GLN A 52 16.301 7.430 -0.569 1.00 0.00 H new ATOM 0 HE22 GLN A 52 17.649 6.776 0.367 1.00 0.00 H new ATOM 835 N ALA A 53 19.418 9.843 -4.845 1.00 0.00 N ATOM 836 CA ALA A 53 20.367 10.407 -5.778 1.00 0.00 C ATOM 837 C ALA A 53 21.781 10.436 -5.187 1.00 0.00 C ATOM 838 O ALA A 53 22.752 10.571 -5.932 1.00 0.00 O ATOM 839 CB ALA A 53 19.922 11.819 -6.161 1.00 0.00 C ATOM 0 H ALA A 53 18.779 10.523 -4.433 1.00 0.00 H new ATOM 0 HA ALA A 53 20.396 9.778 -6.668 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.636 12.247 -6.865 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.936 11.777 -6.625 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.876 12.441 -5.267 1.00 0.00 H new ATOM 845 N GLY A 54 21.907 10.312 -3.860 1.00 0.00 N ATOM 846 CA GLY A 54 23.204 10.293 -3.197 1.00 0.00 C ATOM 847 C GLY A 54 23.220 11.115 -1.910 1.00 0.00 C ATOM 848 O GLY A 54 24.294 11.428 -1.399 1.00 0.00 O ATOM 0 H GLY A 54 21.114 10.223 -3.224 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.476 9.262 -2.968 1.00 0.00 H new ATOM 0 HA3 GLY A 54 23.962 10.679 -3.879 1.00 0.00 H new ATOM 852 N LEU A 55 22.043 11.468 -1.385 1.00 0.00 N ATOM 853 CA LEU A 55 21.911 12.337 -0.226 1.00 0.00 C ATOM 854 C LEU A 55 20.829 11.827 0.722 1.00 0.00 C ATOM 855 O LEU A 55 20.309 10.727 0.546 1.00 0.00 O ATOM 856 CB LEU A 55 21.619 13.756 -0.724 1.00 0.00 C ATOM 857 CG LEU A 55 20.385 13.830 -1.633 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.077 13.683 -0.860 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.379 15.185 -2.335 1.00 0.00 C ATOM 0 H LEU A 55 21.149 11.152 -1.761 1.00 0.00 H new ATOM 0 HA LEU A 55 22.838 12.343 0.348 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.472 14.413 0.133 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.487 14.130 -1.267 1.00 0.00 H new ATOM 0 HG LEU A 55 20.448 13.005 -2.342 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.237 13.743 -1.552 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.061 12.719 -0.352 1.00 0.00 H new ATOM 0 HD13 LEU A 55 18.998 14.482 -0.123 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.507 15.254 -2.986 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.340 15.980 -1.591 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.286 15.290 -2.931 1.00 0.00 H new ATOM 871 N THR A 56 20.489 12.626 1.737 1.00 0.00 N ATOM 872 CA THR A 56 19.445 12.293 2.696 1.00 0.00 C ATOM 873 C THR A 56 18.605 13.531 3.013 1.00 0.00 C ATOM 874 O THR A 56 18.941 14.638 2.594 1.00 0.00 O ATOM 875 CB THR A 56 20.061 11.701 3.967 1.00 0.00 C ATOM 876 OG1 THR A 56 20.971 12.621 4.528 1.00 0.00 O ATOM 877 CG2 THR A 56 20.794 10.402 3.639 1.00 0.00 C ATOM 0 H THR A 56 20.936 13.526 1.913 1.00 0.00 H new ATOM 0 HA THR A 56 18.788 11.541 2.259 1.00 0.00 H new ATOM 0 HB THR A 56 19.264 11.493 4.681 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.362 12.240 5.342 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.228 9.989 4.550 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.091 9.685 3.215 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.586 10.603 2.918 1.00 0.00 H new ATOM 885 N ALA A 57 17.508 13.341 3.756 1.00 0.00 N ATOM 886 CA ALA A 57 16.574 14.409 4.091 1.00 0.00 C ATOM 887 C ALA A 57 17.277 15.603 4.747 1.00 0.00 C ATOM 888 O ALA A 57 18.281 15.428 5.437 1.00 0.00 O ATOM 889 CB ALA A 57 15.505 13.852 5.025 1.00 0.00 C ATOM 0 H ALA A 57 17.247 12.434 4.142 1.00 0.00 H new ATOM 0 HA ALA A 57 16.121 14.772 3.169 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.800 14.642 5.283 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.974 13.040 4.528 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.976 13.475 5.933 1.00 0.00 H new ATOM 895 N PRO A 58 16.746 16.812 4.533 1.00 0.00 N ATOM 896 CA PRO A 58 17.258 18.045 5.105 1.00 0.00 C ATOM 897 C PRO A 58 16.878 18.168 6.576 1.00 0.00 C ATOM 898 O PRO A 58 16.400 17.221 7.198 1.00 0.00 O ATOM 899 CB PRO A 58 16.622 19.162 4.279 1.00 0.00 C ATOM 900 CG PRO A 58 15.289 18.560 3.846 1.00 0.00 C ATOM 901 CD PRO A 58 15.586 17.070 3.701 1.00 0.00 C ATOM 0 HA PRO A 58 18.347 18.085 5.072 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.482 20.068 4.868 1.00 0.00 H new ATOM 0 HB3 PRO A 58 17.240 19.431 3.422 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.510 18.741 4.586 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.943 18.991 2.907 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.735 16.469 4.021 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.786 16.811 2.661 1.00 0.00 H new ATOM 909 N ASP A 59 17.104 19.365 7.129 1.00 0.00 N ATOM 910 CA ASP A 59 16.855 19.664 8.530 1.00 0.00 C ATOM 911 C ASP A 59 16.095 20.986 8.693 1.00 0.00 C ATOM 912 O ASP A 59 15.582 21.276 9.771 1.00 0.00 O ATOM 913 CB ASP A 59 18.220 19.716 9.216 1.00 0.00 C ATOM 914 CG ASP A 59 18.126 20.124 10.683 1.00 0.00 C ATOM 915 OD1 ASP A 59 17.620 19.305 11.481 1.00 0.00 O ATOM 916 OD2 ASP A 59 18.563 21.254 11.000 1.00 0.00 O ATOM 0 H ASP A 59 17.470 20.159 6.603 1.00 0.00 H new ATOM 0 HA ASP A 59 16.225 18.899 8.983 1.00 0.00 H new ATOM 0 HB2 ASP A 59 18.695 18.738 9.145 1.00 0.00 H new ATOM 0 HB3 ASP A 59 18.861 20.421 8.687 1.00 0.00 H new ATOM 1635 N MET C 1 1.656 6.994 12.534 1.00 0.00 N ATOM 1636 CA MET C 1 1.347 6.539 11.166 1.00 0.00 C ATOM 1637 C MET C 1 1.601 7.668 10.178 1.00 0.00 C ATOM 1638 O MET C 1 1.151 8.788 10.404 1.00 0.00 O ATOM 1639 CB MET C 1 -0.104 6.060 11.069 1.00 0.00 C ATOM 1640 CG MET C 1 -0.297 5.165 9.848 1.00 0.00 C ATOM 1641 SD MET C 1 -1.968 4.484 9.685 1.00 0.00 S ATOM 1642 CE MET C 1 -2.873 6.005 9.310 1.00 0.00 C ATOM 0 H1 MET C 1 1.481 6.219 13.205 1.00 0.00 H new ATOM 0 H2 MET C 1 2.655 7.280 12.588 1.00 0.00 H new ATOM 0 H3 MET C 1 1.051 7.805 12.775 1.00 0.00 H new ATOM 0 HA MET C 1 1.997 5.699 10.921 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.373 5.513 11.973 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.772 6.919 11.006 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.061 5.737 8.951 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.416 4.342 9.898 1.00 0.00 H new ATOM 0 HE1 MET C 1 -3.917 5.766 9.106 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.815 6.682 10.162 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.433 6.484 8.435 1.00 0.00 H new ATOM 1654 N LEU C 2 2.313 7.383 9.083 1.00 0.00 N ATOM 1655 CA LEU C 2 2.629 8.385 8.074 1.00 0.00 C ATOM 1656 C LEU C 2 1.545 8.337 6.992 1.00 0.00 C ATOM 1657 O LEU C 2 1.159 7.253 6.562 1.00 0.00 O ATOM 1658 CB LEU C 2 4.020 8.058 7.502 1.00 0.00 C ATOM 1659 CG LEU C 2 4.775 9.217 6.826 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.655 8.658 5.715 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.890 10.300 6.222 1.00 0.00 C ATOM 0 H LEU C 2 2.682 6.455 8.877 1.00 0.00 H new ATOM 0 HA LEU C 2 2.651 9.392 8.490 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.640 7.673 8.312 1.00 0.00 H new ATOM 0 HB3 LEU C 2 3.909 7.253 6.775 1.00 0.00 H new ATOM 0 HG LEU C 2 5.348 9.691 7.623 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.193 9.474 5.232 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.370 7.952 6.138 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.033 8.148 4.980 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.515 11.071 5.770 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.247 9.861 5.459 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.274 10.744 7.004 1.00 0.00 H new ATOM 1673 N ILE C 3 1.055 9.499 6.551 1.00 0.00 N ATOM 1674 CA ILE C 3 0.063 9.597 5.488 1.00 0.00 C ATOM 1675 C ILE C 3 0.617 10.414 4.333 1.00 0.00 C ATOM 1676 O ILE C 3 1.329 11.396 4.537 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.229 10.249 5.996 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.046 9.266 6.833 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.124 10.670 4.831 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.723 9.356 8.317 1.00 0.00 C ATOM 0 H ILE C 3 1.341 10.403 6.928 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.166 8.587 5.149 1.00 0.00 H new ATOM 0 HB ILE C 3 -0.927 11.112 6.590 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.108 9.461 6.683 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.856 8.251 6.484 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.033 11.129 5.218 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.593 11.387 4.205 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.385 9.794 4.237 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.331 8.637 8.866 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.668 9.134 8.474 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -1.939 10.362 8.676 1.00 0.00 H new ATOM 1692 N LEU C 4 0.271 9.992 3.119 1.00 0.00 N ATOM 1693 CA LEU C 4 0.611 10.682 1.889 1.00 0.00 C ATOM 1694 C LEU C 4 -0.676 10.889 1.097 1.00 0.00 C ATOM 1695 O LEU C 4 -1.723 10.324 1.416 1.00 0.00 O ATOM 1696 CB LEU C 4 1.589 9.845 1.052 1.00 0.00 C ATOM 1697 CG LEU C 4 3.083 10.010 1.365 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.548 11.437 1.087 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.437 9.670 2.802 1.00 0.00 C ATOM 0 H LEU C 4 -0.267 9.139 2.966 1.00 0.00 H new ATOM 0 HA LEU C 4 1.086 11.635 2.122 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.330 8.794 1.177 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.433 10.089 0.001 1.00 0.00 H new ATOM 0 HG LEU C 4 3.592 9.304 0.709 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.610 11.525 1.317 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.384 11.675 0.036 1.00 0.00 H new ATOM 0 HD13 LEU C 4 2.983 12.131 1.709 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.507 9.808 2.955 1.00 0.00 H new ATOM 0 HD22 LEU C 4 2.886 10.325 3.477 1.00 0.00 H new ATOM 0 HD23 LEU C 4 3.172 8.633 3.006 1.00 0.00 H new ATOM 1711 N THR C 5 -0.580 11.707 0.056 1.00 0.00 N ATOM 1712 CA THR C 5 -1.671 11.974 -0.856 1.00 0.00 C ATOM 1713 C THR C 5 -1.108 11.726 -2.246 1.00 0.00 C ATOM 1714 O THR C 5 -0.010 12.174 -2.568 1.00 0.00 O ATOM 1715 CB THR C 5 -2.165 13.410 -0.657 1.00 0.00 C ATOM 1716 OG1 THR C 5 -2.652 13.535 0.659 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.300 13.762 -1.618 1.00 0.00 C ATOM 0 H THR C 5 0.276 12.210 -0.177 1.00 0.00 H new ATOM 0 HA THR C 5 -2.539 11.336 -0.689 1.00 0.00 H new ATOM 0 HB THR C 5 -1.330 14.084 -0.848 1.00 0.00 H new ATOM 0 HG1 THR C 5 -2.971 14.450 0.804 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.620 14.789 -1.442 1.00 0.00 H new ATOM 0 HG22 THR C 5 -2.951 13.661 -2.646 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.140 13.087 -1.452 1.00 0.00 H new ATOM 1725 N ARG C 6 -1.863 11.004 -3.069 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.364 10.521 -4.343 1.00 0.00 C ATOM 1727 C ARG C 6 -2.464 10.646 -5.385 1.00 0.00 C ATOM 1728 O ARG C 6 -3.607 10.928 -5.035 1.00 0.00 O ATOM 1729 CB ARG C 6 -0.919 9.068 -4.128 1.00 0.00 C ATOM 1730 CG ARG C 6 0.022 8.499 -5.196 1.00 0.00 C ATOM 1731 CD ARG C 6 1.407 9.150 -5.150 1.00 0.00 C ATOM 1732 NE ARG C 6 1.424 10.461 -5.803 1.00 0.00 N ATOM 1733 CZ ARG C 6 2.064 11.541 -5.354 1.00 0.00 C ATOM 1734 NH1 ARG C 6 2.758 11.513 -4.220 1.00 0.00 N ATOM 1735 NH2 ARG C 6 2.001 12.664 -6.058 1.00 0.00 N ATOM 0 H ARG C 6 -2.828 10.742 -2.870 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.516 11.101 -4.706 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -0.425 8.998 -3.159 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -1.807 8.438 -4.079 1.00 0.00 H new ATOM 0 HG2 ARG C 6 0.123 7.423 -5.053 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -0.416 8.650 -6.182 1.00 0.00 H new ATOM 0 HD2 ARG C 6 1.721 9.259 -4.112 1.00 0.00 H new ATOM 0 HD3 ARG C 6 2.131 8.495 -5.635 1.00 0.00 H new ATOM 0 HE ARG C 6 0.902 10.556 -6.674 1.00 0.00 H new ATOM 0 HH11 ARG C 6 2.809 10.653 -3.674 1.00 0.00 H new ATOM 0 HH12 ARG C 6 3.240 12.352 -3.896 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.469 12.691 -6.928 1.00 0.00 H new ATOM 0 HH22 ARG C 6 2.485 13.500 -5.729 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.130 10.432 -6.656 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.108 10.530 -7.724 1.00 0.00 C ATOM 1751 C LYS C 7 -2.997 9.285 -8.589 1.00 0.00 C ATOM 1752 O LYS C 7 -1.915 8.710 -8.709 1.00 0.00 O ATOM 1753 CB LYS C 7 -2.886 11.827 -8.513 1.00 0.00 C ATOM 1754 CG LYS C 7 -2.589 12.981 -7.547 1.00 0.00 C ATOM 1755 CD LYS C 7 -2.580 14.332 -8.255 1.00 0.00 C ATOM 1756 CE LYS C 7 -1.853 15.336 -7.362 1.00 0.00 C ATOM 1757 NZ LYS C 7 -1.746 16.657 -8.010 1.00 0.00 N ATOM 0 H LYS C 7 -1.189 10.190 -6.966 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.123 10.577 -7.329 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.057 11.702 -9.210 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -3.770 12.057 -9.108 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -3.337 12.992 -6.755 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -1.623 12.815 -7.070 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -2.081 14.251 -9.221 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -3.599 14.665 -8.450 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -2.385 15.436 -6.416 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -0.856 14.962 -7.129 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -1.247 17.315 -7.377 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -1.217 16.565 -8.900 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -2.698 17.024 -8.210 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.108 8.857 -9.193 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.116 7.586 -9.898 1.00 0.00 C ATOM 1773 C VAL C 8 -3.127 7.600 -11.056 1.00 0.00 C ATOM 1774 O VAL C 8 -3.270 8.370 -12.004 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.528 7.170 -10.311 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -6.394 7.088 -9.055 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.241 8.090 -11.295 1.00 0.00 C ATOM 0 H VAL C 8 -4.993 9.364 -9.206 1.00 0.00 H new ATOM 0 HA VAL C 8 -3.776 6.813 -9.209 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.400 6.219 -10.828 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -7.406 6.792 -9.330 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -5.974 6.351 -8.371 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -6.421 8.062 -8.567 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.232 7.692 -11.512 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.337 9.085 -10.859 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -5.665 8.152 -12.218 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.116 6.732 -10.958 1.00 0.00 N ATOM 1788 CA GLY C 9 -1.044 6.641 -11.940 1.00 0.00 C ATOM 1789 C GLY C 9 0.325 6.959 -11.333 1.00 0.00 C ATOM 1790 O GLY C 9 1.308 7.044 -12.071 1.00 0.00 O ATOM 0 H GLY C 9 -2.022 6.070 -10.188 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -1.027 5.637 -12.365 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -1.245 7.331 -12.760 1.00 0.00 H new ATOM 1794 N GLU C 10 0.406 7.133 -10.008 1.00 0.00 N ATOM 1795 CA GLU C 10 1.649 7.481 -9.324 1.00 0.00 C ATOM 1796 C GLU C 10 1.999 6.432 -8.265 1.00 0.00 C ATOM 1797 O GLU C 10 1.305 5.424 -8.139 1.00 0.00 O ATOM 1798 CB GLU C 10 1.514 8.874 -8.710 1.00 0.00 C ATOM 1799 CG GLU C 10 1.212 9.925 -9.782 1.00 0.00 C ATOM 1800 CD GLU C 10 1.074 11.315 -9.167 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.407 11.413 -8.114 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.636 12.266 -9.750 1.00 0.00 O ATOM 0 H GLU C 10 -0.393 7.035 -9.382 1.00 0.00 H new ATOM 0 HA GLU C 10 2.467 7.495 -10.044 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.718 8.871 -7.966 1.00 0.00 H new ATOM 0 HB3 GLU C 10 2.435 9.136 -8.190 1.00 0.00 H new ATOM 0 HG2 GLU C 10 2.010 9.930 -10.525 1.00 0.00 H new ATOM 0 HG3 GLU C 10 0.292 9.662 -10.304 1.00 0.00 H new ATOM 1809 N SER C 11 3.073 6.654 -7.499 1.00 0.00 N ATOM 1810 CA SER C 11 3.576 5.655 -6.566 1.00 0.00 C ATOM 1811 C SER C 11 4.147 6.244 -5.279 1.00 0.00 C ATOM 1812 O SER C 11 4.295 7.455 -5.126 1.00 0.00 O ATOM 1813 CB SER C 11 4.644 4.808 -7.255 1.00 0.00 C ATOM 1814 OG SER C 11 5.609 5.630 -7.871 1.00 0.00 O ATOM 0 H SER C 11 3.608 7.522 -7.512 1.00 0.00 H new ATOM 0 HA SER C 11 2.720 5.047 -6.274 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.126 4.157 -6.526 1.00 0.00 H new ATOM 0 HB3 SER C 11 4.179 4.163 -8.000 1.00 0.00 H new ATOM 0 HG SER C 11 6.286 5.070 -8.306 1.00 0.00 H new ATOM 1820 N ILE C 12 4.469 5.334 -4.354 1.00 0.00 N ATOM 1821 CA ILE C 12 4.990 5.598 -3.022 1.00 0.00 C ATOM 1822 C ILE C 12 6.126 4.597 -2.779 1.00 0.00 C ATOM 1823 O ILE C 12 6.216 3.597 -3.489 1.00 0.00 O ATOM 1824 CB ILE C 12 3.843 5.409 -2.013 1.00 0.00 C ATOM 1825 CG1 ILE C 12 2.728 6.446 -2.204 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.351 5.466 -0.573 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.204 7.880 -1.970 1.00 0.00 C ATOM 0 H ILE C 12 4.364 4.335 -4.533 1.00 0.00 H new ATOM 0 HA ILE C 12 5.374 6.612 -2.914 1.00 0.00 H new ATOM 0 HB ILE C 12 3.428 4.420 -2.205 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.329 6.361 -3.215 1.00 0.00 H new ATOM 0 HG13 ILE C 12 1.910 6.223 -1.519 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.515 5.329 0.113 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.084 4.675 -0.414 1.00 0.00 H new ATOM 0 HG23 ILE C 12 4.816 6.434 -0.389 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.372 8.568 -2.119 1.00 0.00 H new ATOM 0 HD12 ILE C 12 3.577 7.978 -0.951 1.00 0.00 H new ATOM 0 HD13 ILE C 12 4.002 8.118 -2.673 1.00 0.00 H new ATOM 1839 N ASN C 13 6.996 4.831 -1.793 1.00 0.00 N ATOM 1840 CA ASN C 13 8.154 3.968 -1.587 1.00 0.00 C ATOM 1841 C ASN C 13 8.426 3.720 -0.103 1.00 0.00 C ATOM 1842 O ASN C 13 8.147 4.575 0.737 1.00 0.00 O ATOM 1843 CB ASN C 13 9.356 4.618 -2.278 1.00 0.00 C ATOM 1844 CG ASN C 13 10.545 3.670 -2.349 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.211 3.417 -1.348 1.00 0.00 O ATOM 1846 ND2 ASN C 13 10.816 3.140 -3.537 1.00 0.00 N ATOM 0 H ASN C 13 6.919 5.604 -1.132 1.00 0.00 H new ATOM 0 HA ASN C 13 7.960 2.987 -2.021 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.075 4.925 -3.285 1.00 0.00 H new ATOM 0 HB3 ASN C 13 9.642 5.521 -1.738 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.601 2.498 -3.642 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.239 3.376 -4.344 1.00 0.00 H new ATOM 1853 N ILE C 14 8.978 2.540 0.211 1.00 0.00 N ATOM 1854 CA ILE C 14 9.289 2.123 1.570 1.00 0.00 C ATOM 1855 C ILE C 14 10.606 1.346 1.588 1.00 0.00 C ATOM 1856 O ILE C 14 10.945 0.647 0.631 1.00 0.00 O ATOM 1857 CB ILE C 14 8.151 1.246 2.124 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.824 2.017 2.114 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.497 0.775 3.540 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.653 1.177 2.618 1.00 0.00 C ATOM 0 H ILE C 14 9.222 1.841 -0.491 1.00 0.00 H new ATOM 0 HA ILE C 14 9.391 3.007 2.199 1.00 0.00 H new ATOM 0 HB ILE C 14 8.036 0.371 1.485 1.00 0.00 H new ATOM 0 HG12 ILE C 14 6.921 2.908 2.735 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.613 2.356 1.100 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.687 0.155 3.925 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.419 0.194 3.515 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.631 1.641 4.189 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.740 1.772 2.590 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.535 0.299 1.982 1.00 0.00 H new ATOM 0 HD13 ILE C 14 5.847 0.859 3.642 1.00 0.00 H new ATOM 1872 N GLY C 15 11.353 1.469 2.687 1.00 0.00 N ATOM 1873 CA GLY C 15 12.615 0.766 2.857 1.00 0.00 C ATOM 1874 C GLY C 15 13.578 1.107 1.727 1.00 0.00 C ATOM 1875 O GLY C 15 13.701 2.266 1.336 1.00 0.00 O ATOM 0 H GLY C 15 11.096 2.058 3.479 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.061 1.035 3.815 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.438 -0.309 2.879 1.00 0.00 H new ATOM 1879 N ASP C 16 14.256 0.082 1.206 1.00 0.00 N ATOM 1880 CA ASP C 16 15.190 0.214 0.097 1.00 0.00 C ATOM 1881 C ASP C 16 14.883 -0.832 -0.978 1.00 0.00 C ATOM 1882 O ASP C 16 15.626 -0.955 -1.949 1.00 0.00 O ATOM 1883 CB ASP C 16 16.624 0.071 0.610 1.00 0.00 C ATOM 1884 CG ASP C 16 16.979 1.168 1.607 1.00 0.00 C ATOM 1885 OD1 ASP C 16 17.382 2.260 1.148 1.00 0.00 O ATOM 1886 OD2 ASP C 16 16.843 0.914 2.825 1.00 0.00 O ATOM 0 H ASP C 16 14.167 -0.874 1.551 1.00 0.00 H new ATOM 0 HA ASP C 16 15.081 1.201 -0.352 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.746 -0.904 1.083 1.00 0.00 H new ATOM 0 HB3 ASP C 16 17.316 0.106 -0.231 1.00 0.00 H new ATOM 1891 N ASP C 17 13.789 -1.587 -0.805 1.00 0.00 N ATOM 1892 CA ASP C 17 13.423 -2.682 -1.695 1.00 0.00 C ATOM 1893 C ASP C 17 11.908 -2.800 -1.868 1.00 0.00 C ATOM 1894 O ASP C 17 11.445 -3.813 -2.386 1.00 0.00 O ATOM 1895 CB ASP C 17 13.978 -3.997 -1.131 1.00 0.00 C ATOM 1896 CG ASP C 17 15.504 -3.992 -1.044 1.00 0.00 C ATOM 1897 OD1 ASP C 17 16.143 -4.243 -2.090 1.00 0.00 O ATOM 1898 OD2 ASP C 17 16.020 -3.735 0.068 1.00 0.00 O ATOM 0 H ASP C 17 13.133 -1.449 -0.036 1.00 0.00 H new ATOM 0 HA ASP C 17 13.851 -2.475 -2.676 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.560 -4.169 -0.139 1.00 0.00 H new ATOM 0 HB3 ASP C 17 13.655 -4.825 -1.761 1.00 0.00 H new ATOM 1903 N ILE C 18 11.129 -1.798 -1.446 1.00 0.00 N ATOM 1904 CA ILE C 18 9.677 -1.857 -1.560 1.00 0.00 C ATOM 1905 C ILE C 18 9.145 -0.572 -2.191 1.00 0.00 C ATOM 1906 O ILE C 18 9.597 0.526 -1.871 1.00 0.00 O ATOM 1907 CB ILE C 18 9.061 -2.075 -0.171 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.616 -3.356 0.469 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.536 -2.145 -0.276 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.143 -3.511 1.917 1.00 0.00 C ATOM 0 H ILE C 18 11.484 -0.940 -1.024 1.00 0.00 H new ATOM 0 HA ILE C 18 9.399 -2.692 -2.203 1.00 0.00 H new ATOM 0 HB ILE C 18 9.328 -1.232 0.465 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.299 -4.221 -0.113 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.705 -3.335 0.441 1.00 0.00 H new ATOM 0 HG21 ILE C 18 7.110 -2.300 0.715 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.157 -1.212 -0.692 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.254 -2.973 -0.926 1.00 0.00 H new ATOM 0 HD11 ILE C 18 9.555 -4.428 2.338 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.483 -2.658 2.504 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.054 -3.558 1.941 1.00 0.00 H new ATOM 1922 N THR C 19 8.176 -0.720 -3.095 1.00 0.00 N ATOM 1923 CA THR C 19 7.524 0.399 -3.762 1.00 0.00 C ATOM 1924 C THR C 19 6.062 0.032 -3.977 1.00 0.00 C ATOM 1925 O THR C 19 5.751 -1.143 -4.148 1.00 0.00 O ATOM 1926 CB THR C 19 8.215 0.698 -5.099 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.618 0.712 -4.943 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.799 2.056 -5.652 1.00 0.00 C ATOM 0 H THR C 19 7.821 -1.631 -3.385 1.00 0.00 H new ATOM 0 HA THR C 19 7.593 1.298 -3.150 1.00 0.00 H new ATOM 0 HB THR C 19 7.913 -0.090 -5.789 1.00 0.00 H new ATOM 0 HG1 THR C 19 10.041 0.903 -5.806 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.308 2.234 -6.599 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.721 2.069 -5.811 1.00 0.00 H new ATOM 0 HG23 THR C 19 8.071 2.837 -4.942 1.00 0.00 H new ATOM 1936 N ILE C 20 5.166 1.019 -3.971 1.00 0.00 N ATOM 1937 CA ILE C 20 3.725 0.788 -4.034 1.00 0.00 C ATOM 1938 C ILE C 20 3.128 1.712 -5.092 1.00 0.00 C ATOM 1939 O ILE C 20 3.649 2.804 -5.312 1.00 0.00 O ATOM 1940 CB ILE C 20 3.092 1.064 -2.660 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.852 0.394 -1.506 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.635 0.602 -2.651 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.796 -1.131 -1.543 1.00 0.00 C ATOM 0 H ILE C 20 5.422 2.005 -3.922 1.00 0.00 H new ATOM 0 HA ILE C 20 3.523 -0.249 -4.302 1.00 0.00 H new ATOM 0 HB ILE C 20 3.147 2.141 -2.500 1.00 0.00 H new ATOM 0 HG12 ILE C 20 4.894 0.712 -1.535 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.439 0.742 -0.559 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.196 0.802 -1.674 1.00 0.00 H new ATOM 0 HG22 ILE C 20 1.077 1.142 -3.416 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.591 -0.468 -2.857 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.354 -1.536 -0.699 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.758 -1.459 -1.483 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.236 -1.489 -2.474 1.00 0.00 H new ATOM 1955 N THR C 21 2.043 1.287 -5.742 1.00 0.00 N ATOM 1956 CA THR C 21 1.465 2.048 -6.845 1.00 0.00 C ATOM 1957 C THR C 21 -0.056 2.066 -6.745 1.00 0.00 C ATOM 1958 O THR C 21 -0.659 1.104 -6.272 1.00 0.00 O ATOM 1959 CB THR C 21 1.903 1.424 -8.172 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.310 1.318 -8.201 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.476 2.267 -9.368 1.00 0.00 C ATOM 0 H THR C 21 1.550 0.422 -5.522 1.00 0.00 H new ATOM 0 HA THR C 21 1.819 3.078 -6.794 1.00 0.00 H new ATOM 0 HB THR C 21 1.427 0.446 -8.240 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.590 0.917 -9.050 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.808 1.787 -10.289 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.390 2.360 -9.378 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.925 3.258 -9.294 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.665 3.164 -7.194 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.112 3.337 -7.216 1.00 0.00 C ATOM 1971 C ILE C 22 -2.576 3.296 -8.669 1.00 0.00 C ATOM 1972 O ILE C 22 -2.488 4.287 -9.392 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.508 4.628 -6.474 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -3.985 4.991 -6.671 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -1.667 5.836 -6.891 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -4.913 3.902 -6.133 1.00 0.00 C ATOM 0 H ILE C 22 -0.156 3.969 -7.558 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.616 2.529 -6.685 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.322 4.404 -5.424 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.198 5.933 -6.166 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.183 5.146 -7.732 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -1.992 6.715 -6.335 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.616 5.639 -6.677 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.792 6.015 -7.959 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -5.950 4.197 -6.291 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -4.718 2.966 -6.657 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -4.734 3.765 -5.067 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.076 2.135 -9.096 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.486 1.932 -10.481 1.00 0.00 C ATOM 1990 C LEU C 23 -4.730 2.755 -10.797 1.00 0.00 C ATOM 1991 O LEU C 23 -4.901 3.203 -11.929 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.756 0.446 -10.730 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.589 -0.444 -10.297 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.890 -1.884 -10.700 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -1.269 -0.010 -10.933 1.00 0.00 C ATOM 0 H LEU C 23 -3.206 1.320 -8.497 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.681 2.262 -11.137 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.655 0.148 -10.190 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.954 0.289 -11.790 1.00 0.00 H new ATOM 0 HG LEU C 23 -2.481 -0.356 -9.216 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -2.064 -2.527 -10.396 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.806 -2.215 -10.211 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -3.015 -1.941 -11.781 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.469 -0.670 -10.597 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -1.353 -0.064 -12.018 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -1.042 1.014 -10.638 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.595 2.962 -9.801 1.00 0.00 N ATOM 2008 CA GLY C 24 -6.738 3.845 -9.943 1.00 0.00 C ATOM 2009 C GLY C 24 -7.876 3.510 -8.988 1.00 0.00 C ATOM 2010 O GLY C 24 -7.714 2.735 -8.047 1.00 0.00 O ATOM 0 H GLY C 24 -5.518 2.523 -8.884 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.419 4.873 -9.771 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.105 3.792 -10.968 1.00 0.00 H new ATOM 2014 N VAL C 25 -9.035 4.116 -9.252 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.196 4.060 -8.378 1.00 0.00 C ATOM 2016 C VAL C 25 -11.390 3.478 -9.133 1.00 0.00 C ATOM 2017 O VAL C 25 -11.446 3.531 -10.361 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.467 5.473 -7.842 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -10.590 6.498 -8.972 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -11.741 5.527 -7.000 1.00 0.00 C ATOM 0 H VAL C 25 -9.190 4.668 -10.096 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.014 3.402 -7.528 1.00 0.00 H new ATOM 0 HB VAL C 25 -9.609 5.723 -7.218 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -10.782 7.484 -8.549 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -9.662 6.522 -9.544 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -11.414 6.218 -9.629 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -11.896 6.544 -6.640 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -12.593 5.224 -7.609 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.644 4.852 -6.150 1.00 0.00 H new ATOM 2030 N SER C 26 -12.341 2.920 -8.380 1.00 0.00 N ATOM 2031 CA SER C 26 -13.532 2.283 -8.919 1.00 0.00 C ATOM 2032 C SER C 26 -14.678 2.520 -7.937 1.00 0.00 C ATOM 2033 O SER C 26 -15.215 1.581 -7.345 1.00 0.00 O ATOM 2034 CB SER C 26 -13.263 0.792 -9.135 1.00 0.00 C ATOM 2035 OG SER C 26 -14.363 0.193 -9.783 1.00 0.00 O ATOM 0 H SER C 26 -12.299 2.901 -7.361 1.00 0.00 H new ATOM 0 HA SER C 26 -13.803 2.706 -9.886 1.00 0.00 H new ATOM 0 HB2 SER C 26 -12.362 0.660 -9.733 1.00 0.00 H new ATOM 0 HB3 SER C 26 -13.084 0.304 -8.177 1.00 0.00 H new ATOM 0 HG SER C 26 -14.183 -0.761 -9.919 1.00 0.00 H new ATOM 2041 N GLY C 27 -15.057 3.789 -7.766 1.00 0.00 N ATOM 2042 CA GLY C 27 -16.083 4.150 -6.808 1.00 0.00 C ATOM 2043 C GLY C 27 -15.517 4.048 -5.401 1.00 0.00 C ATOM 2044 O GLY C 27 -14.414 4.527 -5.132 1.00 0.00 O ATOM 0 H GLY C 27 -14.664 4.576 -8.282 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.433 5.164 -6.998 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -16.944 3.490 -6.914 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.265 3.422 -4.493 1.00 0.00 N ATOM 2049 CA GLN C 28 -15.817 3.193 -3.130 1.00 0.00 C ATOM 2050 C GLN C 28 -14.650 2.200 -3.101 1.00 0.00 C ATOM 2051 O GLN C 28 -13.998 2.051 -2.065 1.00 0.00 O ATOM 2052 CB GLN C 28 -17.010 2.678 -2.315 1.00 0.00 C ATOM 2053 CG GLN C 28 -16.769 2.688 -0.802 1.00 0.00 C ATOM 2054 CD GLN C 28 -16.696 4.097 -0.218 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -16.718 5.092 -0.934 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -16.611 4.191 1.107 1.00 0.00 N ATOM 0 H GLN C 28 -17.199 3.061 -4.687 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.452 4.123 -2.694 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -17.884 3.290 -2.539 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.243 1.661 -2.631 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -17.570 2.137 -0.309 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -15.839 2.162 -0.584 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -16.595 3.346 1.678 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -16.562 5.108 1.551 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.369 1.522 -4.222 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.272 0.570 -4.295 1.00 0.00 C ATOM 2067 C GLN C 29 -12.042 1.196 -4.943 1.00 0.00 C ATOM 2068 O GLN C 29 -12.113 2.263 -5.554 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.681 -0.684 -5.068 1.00 0.00 C ATOM 2070 CG GLN C 29 -14.911 -1.350 -4.448 1.00 0.00 C ATOM 2071 CD GLN C 29 -14.954 -2.827 -4.809 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -14.576 -3.683 -4.016 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -15.420 -3.139 -6.011 1.00 0.00 N ATOM 0 H GLN C 29 -14.894 1.622 -5.091 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.022 0.286 -3.273 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -13.892 -0.421 -6.104 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -12.851 -1.391 -5.081 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -14.887 -1.235 -3.364 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -15.816 -0.856 -4.801 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -15.726 -2.402 -6.646 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -15.472 -4.116 -6.300 1.00 0.00 H new ATOM 2082 N VAL C 30 -10.904 0.516 -4.800 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.608 0.991 -5.257 1.00 0.00 C ATOM 2084 C VAL C 30 -8.766 -0.182 -5.761 1.00 0.00 C ATOM 2085 O VAL C 30 -8.902 -1.305 -5.274 1.00 0.00 O ATOM 2086 CB VAL C 30 -8.906 1.702 -4.093 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.474 2.082 -4.457 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.654 2.983 -3.715 1.00 0.00 C ATOM 0 H VAL C 30 -10.862 -0.400 -4.353 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.738 1.691 -6.083 1.00 0.00 H new ATOM 0 HB VAL C 30 -8.897 1.006 -3.254 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -7.005 2.584 -3.611 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -6.910 1.182 -4.704 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.483 2.752 -5.317 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.141 3.473 -2.888 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -9.682 3.654 -4.573 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.672 2.735 -3.415 1.00 0.00 H new ATOM 2098 N ARG C 31 -7.896 0.091 -6.741 1.00 0.00 N ATOM 2099 CA ARG C 31 -6.981 -0.883 -7.331 1.00 0.00 C ATOM 2100 C ARG C 31 -5.556 -0.389 -7.107 1.00 0.00 C ATOM 2101 O ARG C 31 -5.190 0.696 -7.557 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.286 -1.030 -8.824 1.00 0.00 C ATOM 2103 CG ARG C 31 -7.920 -2.375 -9.186 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.881 -3.498 -9.184 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.468 -4.762 -9.650 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.714 -5.052 -10.933 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.411 -4.189 -11.896 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.271 -6.212 -11.264 1.00 0.00 N ATOM 0 H ARG C 31 -7.810 1.020 -7.153 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.100 -1.862 -6.867 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -7.956 -0.227 -9.131 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.362 -0.908 -9.390 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -8.713 -2.609 -8.475 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.384 -2.308 -10.170 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -6.043 -3.224 -9.826 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.483 -3.627 -8.178 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.703 -5.465 -8.949 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.985 -3.292 -11.662 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.604 -4.423 -12.870 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.513 -6.887 -10.539 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -8.456 -6.428 -12.244 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.757 -1.194 -6.409 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.395 -0.848 -6.027 1.00 0.00 C ATOM 2124 C ILE C 32 -2.464 -2.028 -6.265 1.00 0.00 C ATOM 2125 O ILE C 32 -2.912 -3.172 -6.341 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.339 -0.428 -4.550 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.145 -1.407 -3.682 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -3.844 1.005 -4.403 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -4.045 -1.055 -2.199 1.00 0.00 C ATOM 0 H ILE C 32 -5.045 -2.119 -6.089 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.069 -0.009 -6.642 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.306 -0.461 -4.203 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.190 -1.392 -3.991 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -3.780 -2.422 -3.841 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -3.803 1.299 -3.354 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.217 1.674 -4.993 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -4.873 1.066 -4.757 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.627 -1.768 -1.616 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.002 -1.095 -1.885 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.434 -0.050 -2.037 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.165 -1.748 -6.379 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.172 -2.780 -6.616 1.00 0.00 C ATOM 2143 C GLY C 33 1.047 -2.581 -5.727 1.00 0.00 C ATOM 2144 O GLY C 33 1.236 -1.514 -5.145 1.00 0.00 O ATOM 0 H GLY C 33 -0.781 -0.806 -6.309 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.609 -3.760 -6.425 1.00 0.00 H new ATOM 0 HA3 GLY C 33 0.131 -2.764 -7.663 1.00 0.00 H new ATOM 2148 N ILE C 34 1.875 -3.621 -5.626 1.00 0.00 N ATOM 2149 CA ILE C 34 3.037 -3.636 -4.750 1.00 0.00 C ATOM 2150 C ILE C 34 4.239 -4.170 -5.524 1.00 0.00 C ATOM 2151 O ILE C 34 4.108 -5.067 -6.355 1.00 0.00 O ATOM 2152 CB ILE C 34 2.758 -4.533 -3.532 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.625 -3.992 -2.648 1.00 0.00 C ATOM 2154 CG2 ILE C 34 4.018 -4.645 -2.663 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.259 -4.539 -3.071 1.00 0.00 C ATOM 0 H ILE C 34 1.753 -4.483 -6.157 1.00 0.00 H new ATOM 0 HA ILE C 34 3.248 -2.625 -4.402 1.00 0.00 H new ATOM 0 HB ILE C 34 2.460 -5.505 -3.926 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.817 -4.259 -1.609 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.612 -2.903 -2.700 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.811 -5.282 -1.803 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.827 -5.079 -3.250 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.311 -3.654 -2.318 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.514 -4.131 -2.420 1.00 0.00 H new ATOM 0 HD12 ILE C 34 0.055 -4.250 -4.102 1.00 0.00 H new ATOM 0 HD13 ILE C 34 0.262 -5.626 -2.993 1.00 0.00 H new ATOM 2167 N ASN C 35 5.414 -3.605 -5.238 1.00 0.00 N ATOM 2168 CA ASN C 35 6.661 -3.929 -5.908 1.00 0.00 C ATOM 2169 C ASN C 35 7.718 -4.271 -4.866 1.00 0.00 C ATOM 2170 O ASN C 35 8.607 -3.473 -4.575 1.00 0.00 O ATOM 2171 CB ASN C 35 7.105 -2.752 -6.776 1.00 0.00 C ATOM 2172 CG ASN C 35 6.147 -2.498 -7.930 1.00 0.00 C ATOM 2173 OD1 ASN C 35 6.274 -3.102 -8.989 1.00 0.00 O ATOM 2174 ND2 ASN C 35 5.186 -1.602 -7.730 1.00 0.00 N ATOM 0 H ASN C 35 5.520 -2.893 -4.515 1.00 0.00 H new ATOM 0 HA ASN C 35 6.520 -4.793 -6.557 1.00 0.00 H new ATOM 0 HB2 ASN C 35 7.176 -1.855 -6.161 1.00 0.00 H new ATOM 0 HB3 ASN C 35 8.102 -2.949 -7.170 1.00 0.00 H new ATOM 0 HD21 ASN C 35 4.519 -1.395 -8.473 1.00 0.00 H new ATOM 0 HD22 ASN C 35 5.115 -1.121 -6.833 1.00 0.00 H new ATOM 2181 N ALA C 36 7.606 -5.478 -4.307 1.00 0.00 N ATOM 2182 CA ALA C 36 8.573 -6.014 -3.368 1.00 0.00 C ATOM 2183 C ALA C 36 9.029 -7.377 -3.878 1.00 0.00 C ATOM 2184 O ALA C 36 8.301 -8.014 -4.643 1.00 0.00 O ATOM 2185 CB ALA C 36 7.910 -6.149 -1.995 1.00 0.00 C ATOM 0 H ALA C 36 6.830 -6.111 -4.501 1.00 0.00 H new ATOM 0 HA ALA C 36 9.436 -5.354 -3.277 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.629 -6.551 -1.282 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.572 -5.170 -1.656 1.00 0.00 H new ATOM 0 HB3 ALA C 36 7.056 -6.822 -2.068 1.00 0.00 H new ATOM 2191 N PRO C 37 10.218 -7.839 -3.475 1.00 0.00 N ATOM 2192 CA PRO C 37 10.715 -9.142 -3.861 1.00 0.00 C ATOM 2193 C PRO C 37 9.961 -10.197 -3.065 1.00 0.00 C ATOM 2194 O PRO C 37 9.511 -9.922 -1.956 1.00 0.00 O ATOM 2195 CB PRO C 37 12.198 -9.117 -3.497 1.00 0.00 C ATOM 2196 CG PRO C 37 12.241 -8.178 -2.294 1.00 0.00 C ATOM 2197 CD PRO C 37 11.161 -7.152 -2.614 1.00 0.00 C ATOM 0 HA PRO C 37 10.579 -9.372 -4.918 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.569 -10.111 -3.247 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.809 -8.747 -4.320 1.00 0.00 H new ATOM 0 HG2 PRO C 37 12.032 -8.706 -1.364 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.220 -7.711 -2.182 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.676 -6.796 -1.705 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.584 -6.279 -3.112 1.00 0.00 H new ATOM 2205 N LYS C 38 9.819 -11.407 -3.611 1.00 0.00 N ATOM 2206 CA LYS C 38 9.136 -12.479 -2.898 1.00 0.00 C ATOM 2207 C LYS C 38 9.948 -12.954 -1.697 1.00 0.00 C ATOM 2208 O LYS C 38 9.526 -13.862 -0.983 1.00 0.00 O ATOM 2209 CB LYS C 38 8.742 -13.582 -3.876 1.00 0.00 C ATOM 2210 CG LYS C 38 7.582 -13.001 -4.683 1.00 0.00 C ATOM 2211 CD LYS C 38 6.915 -14.008 -5.614 1.00 0.00 C ATOM 2212 CE LYS C 38 7.828 -14.340 -6.790 1.00 0.00 C ATOM 2213 NZ LYS C 38 7.142 -15.190 -7.778 1.00 0.00 N ATOM 0 H LYS C 38 10.165 -11.664 -4.535 1.00 0.00 H new ATOM 0 HA LYS C 38 8.206 -12.105 -2.469 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.577 -13.852 -4.523 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.441 -14.488 -3.349 1.00 0.00 H new ATOM 0 HG2 LYS C 38 6.835 -12.606 -3.995 1.00 0.00 H new ATOM 0 HG3 LYS C 38 7.947 -12.161 -5.273 1.00 0.00 H new ATOM 0 HD2 LYS C 38 6.677 -14.918 -5.063 1.00 0.00 H new ATOM 0 HD3 LYS C 38 5.973 -13.602 -5.982 1.00 0.00 H new ATOM 0 HE2 LYS C 38 8.159 -13.418 -7.268 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.721 -14.849 -6.427 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 7.789 -15.398 -8.565 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 6.849 -16.080 -7.326 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 6.304 -14.693 -8.141 1.00 0.00 H new ATOM 2227 N ASP C 39 11.113 -12.345 -1.474 1.00 0.00 N ATOM 2228 CA ASP C 39 11.888 -12.543 -0.262 1.00 0.00 C ATOM 2229 C ASP C 39 11.152 -11.901 0.915 1.00 0.00 C ATOM 2230 O ASP C 39 11.482 -12.174 2.068 1.00 0.00 O ATOM 2231 CB ASP C 39 13.278 -11.932 -0.424 1.00 0.00 C ATOM 2232 CG ASP C 39 14.082 -12.659 -1.498 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.595 -13.758 -1.192 1.00 0.00 O ATOM 2234 OD2 ASP C 39 14.181 -12.110 -2.619 1.00 0.00 O ATOM 0 H ASP C 39 11.542 -11.699 -2.136 1.00 0.00 H new ATOM 0 HA ASP C 39 12.005 -13.610 -0.071 1.00 0.00 H new ATOM 0 HB2 ASP C 39 13.186 -10.878 -0.687 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.811 -11.978 0.526 1.00 0.00 H new ATOM 2239 N VAL C 40 10.158 -11.051 0.626 1.00 0.00 N ATOM 2240 CA VAL C 40 9.262 -10.495 1.628 1.00 0.00 C ATOM 2241 C VAL C 40 7.819 -10.671 1.162 1.00 0.00 C ATOM 2242 O VAL C 40 7.515 -10.589 -0.029 1.00 0.00 O ATOM 2243 CB VAL C 40 9.596 -9.025 1.908 1.00 0.00 C ATOM 2244 CG1 VAL C 40 11.061 -8.874 2.308 1.00 0.00 C ATOM 2245 CG2 VAL C 40 9.315 -8.123 0.709 1.00 0.00 C ATOM 0 H VAL C 40 9.958 -10.732 -0.322 1.00 0.00 H new ATOM 0 HA VAL C 40 9.391 -11.030 2.569 1.00 0.00 H new ATOM 0 HB VAL C 40 8.948 -8.713 2.727 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.279 -7.824 2.503 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.254 -9.457 3.208 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.698 -9.233 1.499 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.569 -7.093 0.961 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.917 -8.448 -0.140 1.00 0.00 H new ATOM 0 HG23 VAL C 40 8.258 -8.183 0.448 1.00 0.00 H new ATOM 2255 N ALA C 41 6.921 -10.914 2.111 1.00 0.00 N ATOM 2256 CA ALA C 41 5.537 -11.235 1.813 1.00 0.00 C ATOM 2257 C ALA C 41 4.695 -9.986 1.561 1.00 0.00 C ATOM 2258 O ALA C 41 5.020 -8.902 2.036 1.00 0.00 O ATOM 2259 CB ALA C 41 4.965 -12.009 3.000 1.00 0.00 C ATOM 0 H ALA C 41 7.136 -10.893 3.108 1.00 0.00 H new ATOM 0 HA ALA C 41 5.506 -11.830 0.900 1.00 0.00 H new ATOM 0 HB1 ALA C 41 3.924 -12.263 2.801 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.539 -12.923 3.149 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.023 -11.394 3.898 1.00 0.00 H new ATOM 2265 N VAL C 42 3.607 -10.153 0.806 1.00 0.00 N ATOM 2266 CA VAL C 42 2.560 -9.152 0.655 1.00 0.00 C ATOM 2267 C VAL C 42 1.250 -9.885 0.383 1.00 0.00 C ATOM 2268 O VAL C 42 1.172 -10.716 -0.521 1.00 0.00 O ATOM 2269 CB VAL C 42 2.867 -8.114 -0.438 1.00 0.00 C ATOM 2270 CG1 VAL C 42 3.418 -8.726 -1.716 1.00 0.00 C ATOM 2271 CG2 VAL C 42 1.603 -7.351 -0.834 1.00 0.00 C ATOM 0 H VAL C 42 3.430 -11.005 0.274 1.00 0.00 H new ATOM 0 HA VAL C 42 2.490 -8.574 1.576 1.00 0.00 H new ATOM 0 HB VAL C 42 3.619 -7.459 0.003 1.00 0.00 H new ATOM 0 HG11 VAL C 42 3.612 -7.937 -2.443 1.00 0.00 H new ATOM 0 HG12 VAL C 42 4.346 -9.253 -1.496 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.691 -9.427 -2.126 1.00 0.00 H new ATOM 0 HG21 VAL C 42 1.845 -6.623 -1.608 1.00 0.00 H new ATOM 0 HG22 VAL C 42 0.859 -8.051 -1.214 1.00 0.00 H new ATOM 0 HG23 VAL C 42 1.202 -6.834 0.038 1.00 0.00 H new ATOM 2281 N HIS C 43 0.233 -9.559 1.185 1.00 0.00 N ATOM 2282 CA HIS C 43 -1.094 -10.156 1.114 1.00 0.00 C ATOM 2283 C HIS C 43 -2.162 -9.151 1.557 1.00 0.00 C ATOM 2284 O HIS C 43 -1.851 -8.112 2.142 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.188 -11.371 2.047 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.130 -12.428 1.868 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.324 -13.667 1.257 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.168 -12.333 2.283 1.00 0.00 C ATOM 2289 CE1 HIS C 43 0.864 -14.288 1.318 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.776 -13.510 1.923 1.00 0.00 N ATOM 0 H HIS C 43 0.316 -8.855 1.918 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.261 -10.456 0.079 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -1.148 -11.016 3.077 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -2.164 -11.836 1.908 1.00 0.00 H new ATOM 0 HD1 HIS C 43 -1.188 -14.026 0.849 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.625 -11.498 2.793 1.00 0.00 H new ATOM 0 HE1 HIS C 43 1.060 -15.278 0.933 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.426 -9.478 1.272 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.590 -8.718 1.725 1.00 0.00 C ATOM 2300 C ARG C 44 -4.697 -8.806 3.249 1.00 0.00 C ATOM 2301 O ARG C 44 -4.263 -9.794 3.838 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.834 -9.326 1.061 1.00 0.00 C ATOM 2303 CG ARG C 44 -6.017 -10.767 1.543 1.00 0.00 C ATOM 2304 CD ARG C 44 -6.733 -11.657 0.524 1.00 0.00 C ATOM 2305 NE ARG C 44 -8.185 -11.675 0.723 1.00 0.00 N ATOM 2306 CZ ARG C 44 -9.010 -12.524 0.100 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -8.538 -13.425 -0.756 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -10.318 -12.478 0.327 1.00 0.00 N ATOM 0 H ARG C 44 -3.671 -10.293 0.710 1.00 0.00 H new ATOM 0 HA ARG C 44 -4.499 -7.667 1.451 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.716 -8.734 1.306 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.727 -9.305 -0.024 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -5.040 -11.195 1.767 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.584 -10.763 2.474 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -6.511 -11.303 -0.483 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -6.346 -12.673 0.598 1.00 0.00 H new ATOM 0 HE ARG C 44 -8.590 -11.002 1.374 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -7.537 -13.474 -0.944 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -9.177 -14.067 -1.225 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -10.699 -11.793 0.979 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -10.942 -13.128 -0.151 1.00 0.00 H new ATOM 2322 N GLU C 45 -5.266 -7.790 3.901 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.408 -7.824 5.353 1.00 0.00 C ATOM 2324 C GLU C 45 -6.395 -8.905 5.802 1.00 0.00 C ATOM 2325 O GLU C 45 -6.327 -9.370 6.937 1.00 0.00 O ATOM 2326 CB GLU C 45 -5.797 -6.438 5.888 1.00 0.00 C ATOM 2327 CG GLU C 45 -7.199 -5.986 5.473 1.00 0.00 C ATOM 2328 CD GLU C 45 -8.301 -6.593 6.336 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -8.163 -6.548 7.580 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -9.282 -7.099 5.748 1.00 0.00 O ATOM 0 H GLU C 45 -5.629 -6.948 3.454 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.441 -8.089 5.780 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -5.736 -6.449 6.976 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -5.070 -5.706 5.536 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -7.256 -4.899 5.532 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -7.369 -6.259 4.431 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.309 -9.305 4.915 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.326 -10.305 5.218 1.00 0.00 C ATOM 2339 C GLU C 46 -7.726 -11.711 5.338 1.00 0.00 C ATOM 2340 O GLU C 46 -8.408 -12.639 5.768 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.385 -10.242 4.113 1.00 0.00 C ATOM 2342 CG GLU C 46 -10.610 -11.102 4.427 1.00 0.00 C ATOM 2343 CD GLU C 46 -11.718 -10.844 3.407 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -11.385 -10.774 2.201 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -12.885 -10.718 3.840 1.00 0.00 O ATOM 0 H GLU C 46 -7.362 -8.941 3.964 1.00 0.00 H new ATOM 0 HA GLU C 46 -8.778 -10.089 6.186 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.698 -9.207 3.972 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -8.944 -10.573 3.172 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -10.335 -12.157 4.415 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -10.972 -10.878 5.431 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.453 -11.876 4.962 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.785 -13.172 4.983 1.00 0.00 C ATOM 2354 C ILE C 47 -4.403 -13.061 5.619 1.00 0.00 C ATOM 2355 O ILE C 47 -3.872 -14.061 6.094 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.729 -13.716 3.542 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -7.076 -14.357 3.192 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.586 -14.705 3.311 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.998 -15.187 1.910 1.00 0.00 C ATOM 0 H ILE C 47 -5.861 -11.112 4.635 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.345 -13.876 5.599 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.530 -12.871 2.883 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.401 -14.992 4.016 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.829 -13.578 3.074 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.605 -15.048 2.277 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.634 -14.214 3.513 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.703 -15.559 3.979 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.974 -15.623 1.699 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.699 -14.547 1.080 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.264 -15.983 2.036 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.789 -11.878 5.650 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.467 -11.774 6.233 1.00 0.00 C ATOM 2373 C TYR C 48 -2.514 -12.137 7.715 1.00 0.00 C ATOM 2374 O TYR C 48 -1.578 -12.719 8.253 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.929 -10.356 6.065 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.559 -10.221 6.677 1.00 0.00 C ATOM 2377 CD1 TYR C 48 0.574 -10.545 5.917 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.423 -9.790 8.003 1.00 0.00 C ATOM 2379 CE1 TYR C 48 1.852 -10.451 6.485 1.00 0.00 C ATOM 2380 CE2 TYR C 48 0.849 -9.692 8.581 1.00 0.00 C ATOM 2381 CZ TYR C 48 1.992 -10.010 7.817 1.00 0.00 C ATOM 2382 OH TYR C 48 3.232 -9.899 8.371 1.00 0.00 O ATOM 0 H TYR C 48 -4.178 -11.007 5.288 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.804 -12.470 5.719 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.884 -10.104 5.006 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.612 -9.647 6.533 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.462 -10.867 4.892 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -1.299 -9.533 8.580 1.00 0.00 H new ATOM 0 HE1 TYR C 48 2.724 -10.715 5.906 1.00 0.00 H new ATOM 0 HE2 TYR C 48 0.955 -9.374 9.608 1.00 0.00 H new ATOM 0 HH TYR C 48 3.896 -9.767 7.663 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.628 -11.793 8.370 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.803 -12.027 9.793 1.00 0.00 C ATOM 2394 C GLN C 49 -4.040 -13.508 10.084 1.00 0.00 C ATOM 2395 O GLN C 49 -3.973 -13.930 11.238 1.00 0.00 O ATOM 2396 CB GLN C 49 -4.977 -11.172 10.279 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.707 -9.710 9.929 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.820 -8.799 10.430 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.971 -8.589 11.632 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -6.605 -8.251 9.511 1.00 0.00 N ATOM 0 H GLN C 49 -4.428 -11.346 7.922 1.00 0.00 H new ATOM 0 HA GLN C 49 -2.896 -11.744 10.327 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -5.904 -11.506 9.813 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -5.104 -11.284 11.356 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.758 -9.400 10.366 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.610 -9.606 8.848 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -6.448 -8.449 8.523 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -7.365 -7.632 9.793 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.319 -14.298 9.040 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.493 -15.739 9.179 1.00 0.00 C ATOM 2411 C ARG C 50 -3.171 -16.458 8.907 1.00 0.00 C ATOM 2412 O ARG C 50 -2.941 -17.528 9.458 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.641 -16.217 8.274 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.174 -16.861 6.966 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.367 -17.093 6.038 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.293 -18.098 6.576 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.411 -18.492 5.956 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.762 -17.975 4.784 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.189 -19.414 6.516 1.00 0.00 N ATOM 0 H ARG C 50 -4.429 -13.955 8.086 1.00 0.00 H new ATOM 0 HA ARG C 50 -4.775 -15.985 10.203 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.249 -16.935 8.824 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.284 -15.368 8.040 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.442 -16.218 6.476 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.677 -17.808 7.175 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.898 -16.153 5.888 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -6.009 -17.416 5.060 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.070 -18.521 7.477 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.176 -17.266 4.343 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.618 -18.287 4.325 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -8.933 -19.819 7.416 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -10.042 -19.716 6.045 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.312 -15.874 8.065 1.00 0.00 N ATOM 2434 CA ILE C 51 -0.979 -16.393 7.786 1.00 0.00 C ATOM 2435 C ILE C 51 -0.115 -16.226 9.026 1.00 0.00 C ATOM 2436 O ILE C 51 0.560 -17.156 9.460 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.372 -15.609 6.611 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.173 -15.883 5.340 1.00 0.00 C ATOM 2439 CG2 ILE C 51 1.093 -15.991 6.369 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.749 -14.921 4.237 1.00 0.00 C ATOM 0 H ILE C 51 -2.530 -15.018 7.555 1.00 0.00 H new ATOM 0 HA ILE C 51 -1.031 -17.450 7.523 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.413 -14.550 6.866 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -1.016 -16.912 5.016 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.238 -15.771 5.541 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.485 -15.415 5.531 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.678 -15.775 7.263 1.00 0.00 H new ATOM 0 HG23 ILE C 51 1.159 -17.055 6.141 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.326 -15.125 3.335 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -0.929 -13.896 4.559 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.312 -15.054 4.027 1.00 0.00 H new ATOM 2452 N GLN C 52 -0.137 -15.020 9.597 1.00 0.00 N ATOM 2453 CA GLN C 52 0.679 -14.693 10.755 1.00 0.00 C ATOM 2454 C GLN C 52 0.104 -15.299 12.030 1.00 0.00 C ATOM 2455 O GLN C 52 0.618 -15.040 13.119 1.00 0.00 O ATOM 2456 CB GLN C 52 0.843 -13.174 10.844 1.00 0.00 C ATOM 2457 CG GLN C 52 1.601 -12.673 9.617 1.00 0.00 C ATOM 2458 CD GLN C 52 2.904 -13.430 9.411 1.00 0.00 C ATOM 2459 OE1 GLN C 52 3.876 -13.230 10.138 1.00 0.00 O ATOM 2460 NE2 GLN C 52 2.928 -14.307 8.414 1.00 0.00 N ATOM 0 H GLN C 52 -0.720 -14.250 9.268 1.00 0.00 H new ATOM 0 HA GLN C 52 1.669 -15.134 10.638 1.00 0.00 H new ATOM 0 HB2 GLN C 52 -0.134 -12.694 10.902 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.383 -12.908 11.753 1.00 0.00 H new ATOM 0 HG2 GLN C 52 0.973 -12.782 8.732 1.00 0.00 H new ATOM 0 HG3 GLN C 52 1.812 -11.610 9.729 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.100 -14.443 7.834 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.775 -14.845 8.228 1.00 0.00 H new ATOM 2469 N ALA C 53 -0.957 -16.104 11.915 1.00 0.00 N ATOM 2470 CA ALA C 53 -1.524 -16.787 13.061 1.00 0.00 C ATOM 2471 C ALA C 53 -0.614 -17.921 13.539 1.00 0.00 C ATOM 2472 O ALA C 53 -0.750 -18.382 14.671 1.00 0.00 O ATOM 2473 CB ALA C 53 -2.905 -17.326 12.692 1.00 0.00 C ATOM 0 H ALA C 53 -1.435 -16.293 11.034 1.00 0.00 H new ATOM 0 HA ALA C 53 -1.617 -16.077 13.882 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.336 -17.841 13.551 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -3.553 -16.499 12.402 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -2.813 -18.024 11.860 1.00 0.00 H new ATOM 2479 N GLY C 54 0.310 -18.376 12.684 1.00 0.00 N ATOM 2480 CA GLY C 54 1.227 -19.457 13.024 1.00 0.00 C ATOM 2481 C GLY C 54 1.255 -20.538 11.948 1.00 0.00 C ATOM 2482 O GLY C 54 1.698 -21.655 12.212 1.00 0.00 O ATOM 0 H GLY C 54 0.438 -18.004 11.743 1.00 0.00 H new ATOM 0 HA2 GLY C 54 2.230 -19.053 13.159 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.931 -19.899 13.975 1.00 0.00 H new ATOM 2486 N LEU C 55 0.783 -20.217 10.740 1.00 0.00 N ATOM 2487 CA LEU C 55 0.622 -21.181 9.662 1.00 0.00 C ATOM 2488 C LEU C 55 1.029 -20.578 8.322 1.00 0.00 C ATOM 2489 O LEU C 55 1.554 -19.466 8.270 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.838 -21.653 9.660 1.00 0.00 C ATOM 2491 CG LEU C 55 -1.850 -20.508 9.482 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -1.978 -20.065 8.022 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.215 -21.001 9.947 1.00 0.00 C ATOM 0 H LEU C 55 0.501 -19.270 10.486 1.00 0.00 H new ATOM 0 HA LEU C 55 1.277 -22.038 9.821 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.976 -22.378 8.858 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -1.046 -22.170 10.597 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.498 -19.657 10.065 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.704 -19.255 7.950 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -1.010 -19.718 7.661 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.311 -20.906 7.414 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -3.949 -20.204 9.830 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.514 -21.861 9.348 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -3.159 -21.291 10.996 1.00 0.00 H new ATOM 2505 N THR C 56 0.791 -21.311 7.230 1.00 0.00 N ATOM 2506 CA THR C 56 1.075 -20.839 5.881 1.00 0.00 C ATOM 2507 C THR C 56 -0.032 -21.278 4.929 1.00 0.00 C ATOM 2508 O THR C 56 -0.865 -22.114 5.278 1.00 0.00 O ATOM 2509 CB THR C 56 2.440 -21.354 5.415 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.471 -22.766 5.459 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.555 -20.810 6.303 1.00 0.00 C ATOM 0 H THR C 56 0.395 -22.250 7.262 1.00 0.00 H new ATOM 0 HA THR C 56 1.109 -19.750 5.884 1.00 0.00 H new ATOM 0 HB THR C 56 2.594 -21.012 4.392 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.348 -23.084 5.157 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.516 -21.189 5.954 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.557 -19.721 6.259 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.391 -21.131 7.331 1.00 0.00 H new ATOM 2519 N ALA C 57 -0.042 -20.712 3.720 1.00 0.00 N ATOM 2520 CA ALA C 57 -1.082 -20.973 2.736 1.00 0.00 C ATOM 2521 C ALA C 57 -1.164 -22.454 2.356 1.00 0.00 C ATOM 2522 O ALA C 57 -0.161 -23.168 2.417 1.00 0.00 O ATOM 2523 CB ALA C 57 -0.797 -20.129 1.496 1.00 0.00 C ATOM 0 H ALA C 57 0.674 -20.060 3.400 1.00 0.00 H new ATOM 0 HA ALA C 57 -2.045 -20.706 3.172 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -1.567 -20.312 0.747 1.00 0.00 H new ATOM 0 HB2 ALA C 57 -0.797 -19.073 1.767 1.00 0.00 H new ATOM 0 HB3 ALA C 57 0.177 -20.399 1.088 1.00 0.00 H new