USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 780 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= -0.0414 K(o=-0.041,f=-2.5) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0 USER MOD Set 2.2: C 21 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 13 ASN : amide:sc= -0.814 K(o=-0.81,f=-3.1) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 148:sc= 0.0189 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 156:sc= 1.25 (180deg=0.598) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.367 X(o=-0.37,f=-0.19) USER MOD Single : A 29 GLN : amide:sc= -1.41! K(o=-1.4!,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.277 K(o=-0.28,f=-3.2!) USER MOD Single : A 38 LYS NZ :NH3+ -159:sc= -0.0514 (180deg=-0.373) USER MOD Single : A 43 HIS : no HE2:sc= -0.801 X(o=-0.8,f=-1) USER MOD Single : A 48 TYR OH : rot -52:sc= 0.0368 USER MOD Single : C 1 MET CE :methyl 174:sc=-0.00363 (180deg=-0.0176) USER MOD Single : C 1 MET N :NH3+ 135:sc= 0.015 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0.818 USER MOD Single : C 7 LYS NZ :NH3+ -150:sc= 1.06 (180deg=0.5) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= -0.706 K(o=-0.71,f=-0.16) USER MOD Single : C 29 GLN : amide:sc= -0.681 K(o=-0.68,f=-4.2!) USER MOD Single : C 35 ASN : amide:sc= -0.14 K(o=-0.14,f=-2.2!) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HE2:sc= -0.885 K(o=-0.89,f=-1.4) USER MOD Single : C 48 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.305 9.739 -2.076 1.00 0.00 N ATOM 2 CA MET A 1 6.832 9.796 -2.148 1.00 0.00 C ATOM 3 C MET A 1 6.363 9.493 -3.560 1.00 0.00 C ATOM 4 O MET A 1 6.966 9.970 -4.513 1.00 0.00 O ATOM 5 CB MET A 1 6.335 11.181 -1.706 1.00 0.00 C ATOM 6 CG MET A 1 4.811 11.261 -1.659 1.00 0.00 C ATOM 7 SD MET A 1 4.069 10.228 -0.381 1.00 0.00 S ATOM 8 CE MET A 1 2.346 10.542 -0.804 1.00 0.00 C ATOM 0 H1 MET A 1 8.645 10.420 -1.367 1.00 0.00 H new ATOM 0 H2 MET A 1 8.602 8.780 -1.805 1.00 0.00 H new ATOM 0 H3 MET A 1 8.707 9.977 -3.005 1.00 0.00 H new ATOM 0 HA MET A 1 6.418 9.045 -1.476 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.739 11.412 -0.721 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.715 11.937 -2.392 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.516 12.297 -1.493 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.411 10.967 -2.629 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.698 9.989 -0.124 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.138 11.608 -0.716 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.158 10.219 -1.828 1.00 0.00 H new ATOM 20 N LEU A 2 5.297 8.705 -3.711 1.00 0.00 N ATOM 21 CA LEU A 2 4.726 8.413 -5.014 1.00 0.00 C ATOM 22 C LEU A 2 3.205 8.401 -4.925 1.00 0.00 C ATOM 23 O LEU A 2 2.646 8.120 -3.867 1.00 0.00 O ATOM 24 CB LEU A 2 5.229 7.050 -5.495 1.00 0.00 C ATOM 25 CG LEU A 2 6.326 7.146 -6.553 1.00 0.00 C ATOM 26 CD1 LEU A 2 6.728 5.732 -6.951 1.00 0.00 C ATOM 27 CD2 LEU A 2 5.843 7.875 -7.805 1.00 0.00 C ATOM 0 H LEU A 2 4.812 8.256 -2.934 1.00 0.00 H new ATOM 0 HA LEU A 2 5.031 9.183 -5.722 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.607 6.489 -4.641 1.00 0.00 H new ATOM 0 HB3 LEU A 2 4.391 6.485 -5.902 1.00 0.00 H new ATOM 0 HG LEU A 2 7.162 7.704 -6.132 1.00 0.00 H new ATOM 0 HD11 LEU A 2 7.512 5.776 -7.707 1.00 0.00 H new ATOM 0 HD12 LEU A 2 7.098 5.199 -6.075 1.00 0.00 H new ATOM 0 HD13 LEU A 2 5.862 5.208 -7.356 1.00 0.00 H new ATOM 0 HD21 LEU A 2 6.652 7.922 -8.533 1.00 0.00 H new ATOM 0 HD22 LEU A 2 4.998 7.338 -8.236 1.00 0.00 H new ATOM 0 HD23 LEU A 2 5.533 8.886 -7.541 1.00 0.00 H new ATOM 39 N ILE A 3 2.544 8.707 -6.041 1.00 0.00 N ATOM 40 CA ILE A 3 1.094 8.663 -6.139 1.00 0.00 C ATOM 41 C ILE A 3 0.731 7.979 -7.451 1.00 0.00 C ATOM 42 O ILE A 3 1.446 8.121 -8.443 1.00 0.00 O ATOM 43 CB ILE A 3 0.506 10.078 -6.068 1.00 0.00 C ATOM 44 CG1 ILE A 3 0.716 10.697 -4.684 1.00 0.00 C ATOM 45 CG2 ILE A 3 -1.002 10.035 -6.312 1.00 0.00 C ATOM 46 CD1 ILE A 3 2.054 11.421 -4.574 1.00 0.00 C ATOM 0 H ILE A 3 3.006 8.993 -6.904 1.00 0.00 H new ATOM 0 HA ILE A 3 0.675 8.101 -5.305 1.00 0.00 H new ATOM 0 HB ILE A 3 1.013 10.672 -6.828 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.093 11.397 -4.475 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.665 9.915 -3.926 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.408 11.045 -6.259 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.199 9.616 -7.299 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.476 9.413 -5.552 1.00 0.00 H new ATOM 0 HD11 ILE A 3 2.158 11.844 -3.575 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.865 10.716 -4.756 1.00 0.00 H new ATOM 0 HD13 ILE A 3 2.096 12.221 -5.313 1.00 0.00 H new ATOM 58 N LEU A 4 -0.381 7.242 -7.451 1.00 0.00 N ATOM 59 CA LEU A 4 -0.838 6.465 -8.591 1.00 0.00 C ATOM 60 C LEU A 4 -2.358 6.431 -8.611 1.00 0.00 C ATOM 61 O LEU A 4 -3.003 6.823 -7.638 1.00 0.00 O ATOM 62 CB LEU A 4 -0.346 5.020 -8.458 1.00 0.00 C ATOM 63 CG LEU A 4 1.174 4.848 -8.474 1.00 0.00 C ATOM 64 CD1 LEU A 4 1.460 3.370 -8.237 1.00 0.00 C ATOM 65 CD2 LEU A 4 1.775 5.234 -9.824 1.00 0.00 C ATOM 0 H LEU A 4 -0.997 7.171 -6.641 1.00 0.00 H new ATOM 0 HA LEU A 4 -0.451 6.922 -9.502 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -0.733 4.605 -7.528 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.771 4.431 -9.271 1.00 0.00 H new ATOM 0 HG LEU A 4 1.612 5.491 -7.711 1.00 0.00 H new ATOM 0 HD11 LEU A 4 2.537 3.203 -8.241 1.00 0.00 H new ATOM 0 HD12 LEU A 4 1.050 3.070 -7.273 1.00 0.00 H new ATOM 0 HD13 LEU A 4 0.998 2.779 -9.028 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.856 5.098 -9.793 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.351 4.602 -10.605 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.547 6.278 -10.039 1.00 0.00 H new ATOM 77 N THR A 5 -2.926 5.960 -9.723 1.00 0.00 N ATOM 78 CA THR A 5 -4.363 5.739 -9.817 1.00 0.00 C ATOM 79 C THR A 5 -4.614 4.342 -10.372 1.00 0.00 C ATOM 80 O THR A 5 -4.582 4.117 -11.580 1.00 0.00 O ATOM 81 CB THR A 5 -5.068 6.817 -10.645 1.00 0.00 C ATOM 82 OG1 THR A 5 -4.486 8.086 -10.435 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.516 6.878 -10.174 1.00 0.00 C ATOM 0 H THR A 5 -2.408 5.725 -10.570 1.00 0.00 H new ATOM 0 HA THR A 5 -4.792 5.811 -8.818 1.00 0.00 H new ATOM 0 HB THR A 5 -4.986 6.568 -11.703 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.955 8.755 -10.977 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.052 7.638 -10.743 1.00 0.00 H new ATOM 0 HG22 THR A 5 -6.990 5.908 -10.327 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.544 7.132 -9.114 1.00 0.00 H new ATOM 91 N ARG A 6 -4.862 3.408 -9.452 1.00 0.00 N ATOM 92 CA ARG A 6 -5.114 1.996 -9.713 1.00 0.00 C ATOM 93 C ARG A 6 -6.616 1.743 -9.561 1.00 0.00 C ATOM 94 O ARG A 6 -7.279 2.520 -8.875 1.00 0.00 O ATOM 95 CB ARG A 6 -4.330 1.253 -8.625 1.00 0.00 C ATOM 96 CG ARG A 6 -4.325 -0.274 -8.727 1.00 0.00 C ATOM 97 CD ARG A 6 -3.156 -0.801 -9.560 1.00 0.00 C ATOM 98 NE ARG A 6 -3.353 -0.603 -10.996 1.00 0.00 N ATOM 99 CZ ARG A 6 -2.565 -1.137 -11.935 1.00 0.00 C ATOM 100 NH1 ARG A 6 -1.512 -1.880 -11.603 1.00 0.00 N ATOM 101 NH2 ARG A 6 -2.830 -0.924 -13.219 1.00 0.00 N ATOM 0 H ARG A 6 -4.893 3.630 -8.457 1.00 0.00 H new ATOM 0 HA ARG A 6 -4.814 1.674 -10.710 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -3.298 1.602 -8.646 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -4.741 1.531 -7.655 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -4.275 -0.702 -7.726 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -5.263 -0.608 -9.170 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -2.239 -0.299 -9.250 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -3.022 -1.864 -9.359 1.00 0.00 H new ATOM 0 HE ARG A 6 -4.137 -0.024 -11.298 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -1.297 -2.049 -10.620 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.920 -2.280 -12.331 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -3.633 -0.354 -13.486 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.231 -1.330 -13.938 1.00 0.00 H new ATOM 115 N LYS A 7 -7.175 0.689 -10.167 1.00 0.00 N ATOM 116 CA LYS A 7 -8.578 0.352 -9.931 1.00 0.00 C ATOM 117 C LYS A 7 -8.720 -1.032 -9.318 1.00 0.00 C ATOM 118 O LYS A 7 -7.757 -1.795 -9.235 1.00 0.00 O ATOM 119 CB LYS A 7 -9.468 0.483 -11.166 1.00 0.00 C ATOM 120 CG LYS A 7 -9.052 -0.424 -12.317 1.00 0.00 C ATOM 121 CD LYS A 7 -10.256 -0.573 -13.243 1.00 0.00 C ATOM 122 CE LYS A 7 -9.927 -1.392 -14.490 1.00 0.00 C ATOM 123 NZ LYS A 7 -9.320 -2.694 -14.157 1.00 0.00 N ATOM 0 H LYS A 7 -6.687 0.067 -10.812 1.00 0.00 H new ATOM 0 HA LYS A 7 -8.934 1.098 -9.220 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -10.497 0.254 -10.888 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.452 1.518 -11.506 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.205 0.003 -12.855 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -8.734 -1.397 -11.943 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -11.072 -1.051 -12.701 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -10.607 0.415 -13.541 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -10.838 -1.554 -15.067 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -9.245 -0.826 -15.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -9.482 -3.362 -14.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -8.297 -2.573 -14.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -9.752 -3.066 -13.287 1.00 0.00 H new ATOM 137 N VAL A 8 -9.942 -1.347 -8.893 1.00 0.00 N ATOM 138 CA VAL A 8 -10.201 -2.574 -8.157 1.00 0.00 C ATOM 139 C VAL A 8 -9.776 -3.809 -8.942 1.00 0.00 C ATOM 140 O VAL A 8 -10.048 -3.924 -10.140 1.00 0.00 O ATOM 141 CB VAL A 8 -11.662 -2.647 -7.714 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.030 -1.366 -6.962 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.657 -2.824 -8.854 1.00 0.00 C ATOM 0 H VAL A 8 -10.766 -0.766 -9.048 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.587 -2.556 -7.257 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.734 -3.533 -7.084 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.072 -1.416 -6.645 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.389 -1.261 -6.086 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.891 -0.507 -7.618 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.669 -2.866 -8.451 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -12.575 -1.983 -9.542 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.440 -3.750 -9.386 1.00 0.00 H new ATOM 153 N GLY A 9 -9.110 -4.732 -8.245 1.00 0.00 N ATOM 154 CA GLY A 9 -8.688 -6.003 -8.812 1.00 0.00 C ATOM 155 C GLY A 9 -7.253 -5.955 -9.341 1.00 0.00 C ATOM 156 O GLY A 9 -6.754 -6.964 -9.838 1.00 0.00 O ATOM 0 H GLY A 9 -8.849 -4.613 -7.266 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.767 -6.781 -8.053 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -9.363 -6.279 -9.623 1.00 0.00 H new ATOM 160 N GLU A 10 -6.588 -4.802 -9.238 1.00 0.00 N ATOM 161 CA GLU A 10 -5.221 -4.635 -9.718 1.00 0.00 C ATOM 162 C GLU A 10 -4.243 -4.590 -8.539 1.00 0.00 C ATOM 163 O GLU A 10 -4.659 -4.717 -7.387 1.00 0.00 O ATOM 164 CB GLU A 10 -5.145 -3.369 -10.571 1.00 0.00 C ATOM 165 CG GLU A 10 -6.155 -3.440 -11.722 1.00 0.00 C ATOM 166 CD GLU A 10 -6.191 -2.162 -12.561 1.00 0.00 C ATOM 167 OE1 GLU A 10 -5.850 -1.081 -12.025 1.00 0.00 O ATOM 168 OE2 GLU A 10 -6.563 -2.281 -13.750 1.00 0.00 O ATOM 0 H GLU A 10 -6.985 -3.961 -8.819 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.935 -5.486 -10.337 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.348 -2.494 -9.954 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.137 -3.251 -10.969 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.907 -4.284 -12.365 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.148 -3.630 -11.316 1.00 0.00 H new ATOM 175 N SER A 11 -2.945 -4.406 -8.815 1.00 0.00 N ATOM 176 CA SER A 11 -1.916 -4.479 -7.786 1.00 0.00 C ATOM 177 C SER A 11 -0.814 -3.434 -7.969 1.00 0.00 C ATOM 178 O SER A 11 -0.725 -2.787 -9.011 1.00 0.00 O ATOM 179 CB SER A 11 -1.287 -5.875 -7.797 1.00 0.00 C ATOM 180 OG SER A 11 -2.280 -6.869 -7.648 1.00 0.00 O ATOM 0 H SER A 11 -2.588 -4.205 -9.749 1.00 0.00 H new ATOM 0 HA SER A 11 -2.403 -4.275 -6.832 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.748 -6.029 -8.732 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.558 -5.958 -6.991 1.00 0.00 H new ATOM 0 HG SER A 11 -1.861 -7.755 -7.659 1.00 0.00 H new ATOM 186 N ILE A 12 0.022 -3.288 -6.937 1.00 0.00 N ATOM 187 CA ILE A 12 1.183 -2.401 -6.878 1.00 0.00 C ATOM 188 C ILE A 12 2.290 -3.159 -6.136 1.00 0.00 C ATOM 189 O ILE A 12 2.014 -4.181 -5.507 1.00 0.00 O ATOM 190 CB ILE A 12 0.803 -1.090 -6.155 1.00 0.00 C ATOM 191 CG1 ILE A 12 -0.289 -0.312 -6.909 1.00 0.00 C ATOM 192 CG2 ILE A 12 2.010 -0.166 -5.947 1.00 0.00 C ATOM 193 CD1 ILE A 12 0.180 0.179 -8.280 1.00 0.00 C ATOM 0 H ILE A 12 -0.102 -3.816 -6.073 1.00 0.00 H new ATOM 0 HA ILE A 12 1.530 -2.125 -7.874 1.00 0.00 H new ATOM 0 HB ILE A 12 0.421 -1.397 -5.181 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -1.163 -0.950 -7.035 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -0.602 0.542 -6.309 1.00 0.00 H new ATOM 0 HG21 ILE A 12 1.690 0.741 -5.435 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.760 -0.677 -5.344 1.00 0.00 H new ATOM 0 HG23 ILE A 12 2.439 0.096 -6.914 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -0.629 0.721 -8.769 1.00 0.00 H new ATOM 0 HD12 ILE A 12 1.037 0.841 -8.156 1.00 0.00 H new ATOM 0 HD13 ILE A 12 0.467 -0.675 -8.894 1.00 0.00 H new ATOM 205 N ASN A 13 3.541 -2.692 -6.188 1.00 0.00 N ATOM 206 CA ASN A 13 4.661 -3.424 -5.610 1.00 0.00 C ATOM 207 C ASN A 13 5.653 -2.487 -4.925 1.00 0.00 C ATOM 208 O ASN A 13 5.753 -1.314 -5.282 1.00 0.00 O ATOM 209 CB ASN A 13 5.358 -4.211 -6.725 1.00 0.00 C ATOM 210 CG ASN A 13 4.393 -5.138 -7.451 1.00 0.00 C ATOM 211 OD1 ASN A 13 3.727 -4.725 -8.396 1.00 0.00 O ATOM 212 ND2 ASN A 13 4.303 -6.395 -7.024 1.00 0.00 N ATOM 0 H ASN A 13 3.799 -1.808 -6.626 1.00 0.00 H new ATOM 0 HA ASN A 13 4.282 -4.104 -4.847 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.800 -3.516 -7.439 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.175 -4.796 -6.301 1.00 0.00 H new ATOM 0 HD21 ASN A 13 3.667 -7.046 -7.485 1.00 0.00 H new ATOM 0 HD22 ASN A 13 4.870 -6.708 -6.236 1.00 0.00 H new ATOM 219 N ILE A 14 6.385 -3.019 -3.940 1.00 0.00 N ATOM 220 CA ILE A 14 7.401 -2.283 -3.193 1.00 0.00 C ATOM 221 C ILE A 14 8.586 -3.210 -2.917 1.00 0.00 C ATOM 222 O ILE A 14 8.411 -4.420 -2.750 1.00 0.00 O ATOM 223 CB ILE A 14 6.816 -1.743 -1.874 1.00 0.00 C ATOM 224 CG1 ILE A 14 5.551 -0.913 -2.137 1.00 0.00 C ATOM 225 CG2 ILE A 14 7.862 -0.892 -1.144 1.00 0.00 C ATOM 226 CD1 ILE A 14 4.937 -0.366 -0.848 1.00 0.00 C ATOM 0 H ILE A 14 6.284 -3.988 -3.638 1.00 0.00 H new ATOM 0 HA ILE A 14 7.739 -1.430 -3.782 1.00 0.00 H new ATOM 0 HB ILE A 14 6.545 -2.592 -1.246 1.00 0.00 H new ATOM 0 HG12 ILE A 14 5.795 -0.084 -2.801 1.00 0.00 H new ATOM 0 HG13 ILE A 14 4.816 -1.530 -2.654 1.00 0.00 H new ATOM 0 HG21 ILE A 14 7.439 -0.515 -0.213 1.00 0.00 H new ATOM 0 HG22 ILE A 14 8.738 -1.502 -0.924 1.00 0.00 H new ATOM 0 HG23 ILE A 14 8.154 -0.053 -1.776 1.00 0.00 H new ATOM 0 HD11 ILE A 14 4.045 0.214 -1.087 1.00 0.00 H new ATOM 0 HD12 ILE A 14 4.666 -1.195 -0.194 1.00 0.00 H new ATOM 0 HD13 ILE A 14 5.661 0.274 -0.343 1.00 0.00 H new ATOM 238 N GLY A 15 9.800 -2.649 -2.870 1.00 0.00 N ATOM 239 CA GLY A 15 11.013 -3.416 -2.654 1.00 0.00 C ATOM 240 C GLY A 15 11.093 -4.581 -3.636 1.00 0.00 C ATOM 241 O GLY A 15 10.748 -4.435 -4.809 1.00 0.00 O ATOM 0 H GLY A 15 9.960 -1.648 -2.982 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.884 -2.771 -2.774 1.00 0.00 H new ATOM 0 HA3 GLY A 15 11.034 -3.793 -1.631 1.00 0.00 H new ATOM 245 N ASP A 16 11.544 -5.736 -3.153 1.00 0.00 N ATOM 246 CA ASP A 16 11.606 -6.959 -3.937 1.00 0.00 C ATOM 247 C ASP A 16 10.960 -8.117 -3.166 1.00 0.00 C ATOM 248 O ASP A 16 11.082 -9.275 -3.559 1.00 0.00 O ATOM 249 CB ASP A 16 13.053 -7.252 -4.350 1.00 0.00 C ATOM 250 CG ASP A 16 13.965 -7.556 -3.163 1.00 0.00 C ATOM 251 OD1 ASP A 16 14.123 -6.660 -2.302 1.00 0.00 O ATOM 252 OD2 ASP A 16 14.502 -8.686 -3.131 1.00 0.00 O ATOM 0 H ASP A 16 11.879 -5.847 -2.196 1.00 0.00 H new ATOM 0 HA ASP A 16 11.034 -6.834 -4.857 1.00 0.00 H new ATOM 0 HB2 ASP A 16 13.064 -8.099 -5.036 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.449 -6.395 -4.895 1.00 0.00 H new ATOM 257 N ASP A 17 10.269 -7.795 -2.065 1.00 0.00 N ATOM 258 CA ASP A 17 9.601 -8.777 -1.222 1.00 0.00 C ATOM 259 C ASP A 17 8.225 -8.286 -0.758 1.00 0.00 C ATOM 260 O ASP A 17 7.622 -8.917 0.108 1.00 0.00 O ATOM 261 CB ASP A 17 10.465 -9.111 -0.004 1.00 0.00 C ATOM 262 CG ASP A 17 11.787 -9.771 -0.382 1.00 0.00 C ATOM 263 OD1 ASP A 17 11.731 -10.914 -0.891 1.00 0.00 O ATOM 264 OD2 ASP A 17 12.840 -9.130 -0.160 1.00 0.00 O ATOM 0 H ASP A 17 10.161 -6.835 -1.737 1.00 0.00 H new ATOM 0 HA ASP A 17 9.456 -9.675 -1.823 1.00 0.00 H new ATOM 0 HB2 ASP A 17 10.667 -8.197 0.555 1.00 0.00 H new ATOM 0 HB3 ASP A 17 9.909 -9.774 0.659 1.00 0.00 H new ATOM 269 N ILE A 18 7.714 -7.178 -1.311 1.00 0.00 N ATOM 270 CA ILE A 18 6.418 -6.656 -0.892 1.00 0.00 C ATOM 271 C ILE A 18 5.523 -6.402 -2.101 1.00 0.00 C ATOM 272 O ILE A 18 5.993 -6.010 -3.169 1.00 0.00 O ATOM 273 CB ILE A 18 6.589 -5.375 -0.060 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.522 -5.572 1.142 1.00 0.00 C ATOM 275 CG2 ILE A 18 5.225 -4.910 0.464 1.00 0.00 C ATOM 276 CD1 ILE A 18 8.968 -5.222 0.786 1.00 0.00 C ATOM 0 H ILE A 18 8.176 -6.635 -2.041 1.00 0.00 H new ATOM 0 HA ILE A 18 5.936 -7.405 -0.264 1.00 0.00 H new ATOM 0 HB ILE A 18 7.033 -4.630 -0.720 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.188 -4.948 1.971 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.469 -6.607 1.481 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.352 -4.002 1.053 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.562 -4.707 -0.377 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.790 -5.690 1.089 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.604 -5.372 1.658 1.00 0.00 H new ATOM 0 HD12 ILE A 18 9.309 -5.864 -0.026 1.00 0.00 H new ATOM 0 HD13 ILE A 18 9.023 -4.180 0.472 1.00 0.00 H new ATOM 288 N THR A 19 4.221 -6.631 -1.917 1.00 0.00 N ATOM 289 CA THR A 19 3.205 -6.400 -2.933 1.00 0.00 C ATOM 290 C THR A 19 1.963 -5.832 -2.255 1.00 0.00 C ATOM 291 O THR A 19 1.756 -6.038 -1.058 1.00 0.00 O ATOM 292 CB THR A 19 2.895 -7.715 -3.661 1.00 0.00 C ATOM 293 OG1 THR A 19 4.060 -8.180 -4.311 1.00 0.00 O ATOM 294 CG2 THR A 19 1.800 -7.561 -4.711 1.00 0.00 C ATOM 0 H THR A 19 3.842 -6.989 -1.040 1.00 0.00 H new ATOM 0 HA THR A 19 3.559 -5.685 -3.676 1.00 0.00 H new ATOM 0 HB THR A 19 2.549 -8.420 -2.905 1.00 0.00 H new ATOM 0 HG1 THR A 19 3.863 -9.020 -4.775 1.00 0.00 H new ATOM 0 HG21 THR A 19 1.622 -8.522 -5.194 1.00 0.00 H new ATOM 0 HG22 THR A 19 0.882 -7.220 -4.232 1.00 0.00 H new ATOM 0 HG23 THR A 19 2.112 -6.831 -5.458 1.00 0.00 H new ATOM 302 N ILE A 20 1.135 -5.116 -3.019 1.00 0.00 N ATOM 303 CA ILE A 20 -0.073 -4.466 -2.530 1.00 0.00 C ATOM 304 C ILE A 20 -1.196 -4.742 -3.529 1.00 0.00 C ATOM 305 O ILE A 20 -0.941 -4.876 -4.722 1.00 0.00 O ATOM 306 CB ILE A 20 0.179 -2.951 -2.415 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.337 -2.621 -1.461 1.00 0.00 C ATOM 308 CG2 ILE A 20 -1.089 -2.215 -1.973 1.00 0.00 C ATOM 309 CD1 ILE A 20 1.027 -2.961 -0.003 1.00 0.00 C ATOM 0 H ILE A 20 1.293 -4.972 -4.016 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.350 -4.849 -1.548 1.00 0.00 H new ATOM 0 HB ILE A 20 0.462 -2.608 -3.410 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.226 -3.169 -1.775 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.573 -1.560 -1.538 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.883 -1.147 -1.900 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.880 -2.383 -2.704 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -1.407 -2.591 -1.001 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.884 -2.705 0.620 1.00 0.00 H new ATOM 0 HD12 ILE A 20 0.156 -2.394 0.326 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.820 -4.027 0.086 1.00 0.00 H new ATOM 321 N THR A 21 -2.437 -4.827 -3.048 1.00 0.00 N ATOM 322 CA THR A 21 -3.583 -5.124 -3.895 1.00 0.00 C ATOM 323 C THR A 21 -4.769 -4.255 -3.487 1.00 0.00 C ATOM 324 O THR A 21 -4.844 -3.802 -2.348 1.00 0.00 O ATOM 325 CB THR A 21 -3.938 -6.611 -3.784 1.00 0.00 C ATOM 326 OG1 THR A 21 -2.764 -7.394 -3.842 1.00 0.00 O ATOM 327 CG2 THR A 21 -4.861 -7.059 -4.911 1.00 0.00 C ATOM 0 H THR A 21 -2.671 -4.692 -2.064 1.00 0.00 H new ATOM 0 HA THR A 21 -3.334 -4.903 -4.933 1.00 0.00 H new ATOM 0 HB THR A 21 -4.449 -6.747 -2.831 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.999 -8.342 -3.769 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.088 -8.119 -4.796 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.786 -6.483 -4.874 1.00 0.00 H new ATOM 0 HG23 THR A 21 -4.370 -6.896 -5.870 1.00 0.00 H new ATOM 335 N ILE A 22 -5.693 -4.023 -4.416 1.00 0.00 N ATOM 336 CA ILE A 22 -6.889 -3.221 -4.197 1.00 0.00 C ATOM 337 C ILE A 22 -8.100 -4.108 -4.483 1.00 0.00 C ATOM 338 O ILE A 22 -8.616 -4.133 -5.595 1.00 0.00 O ATOM 339 CB ILE A 22 -6.812 -1.941 -5.049 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.129 -1.161 -5.120 1.00 0.00 C ATOM 341 CG2 ILE A 22 -6.366 -2.232 -6.483 1.00 0.00 C ATOM 342 CD1 ILE A 22 -8.701 -0.880 -3.740 1.00 0.00 C ATOM 0 H ILE A 22 -5.627 -4.397 -5.363 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.980 -2.875 -3.167 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.073 -1.328 -4.534 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -7.964 -0.219 -5.643 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.854 -1.727 -5.704 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.326 -1.301 -7.048 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -5.378 -2.692 -6.470 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.076 -2.911 -6.954 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -9.634 -0.325 -3.839 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -8.892 -1.822 -3.226 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -7.988 -0.291 -3.164 1.00 0.00 H new ATOM 354 N LEU A 23 -8.563 -4.849 -3.472 1.00 0.00 N ATOM 355 CA LEU A 23 -9.588 -5.863 -3.689 1.00 0.00 C ATOM 356 C LEU A 23 -10.909 -5.251 -4.163 1.00 0.00 C ATOM 357 O LEU A 23 -11.666 -5.916 -4.870 1.00 0.00 O ATOM 358 CB LEU A 23 -9.847 -6.687 -2.425 1.00 0.00 C ATOM 359 CG LEU A 23 -8.621 -7.185 -1.650 1.00 0.00 C ATOM 360 CD1 LEU A 23 -9.084 -8.313 -0.735 1.00 0.00 C ATOM 361 CD2 LEU A 23 -7.505 -7.744 -2.530 1.00 0.00 C ATOM 0 H LEU A 23 -8.246 -4.764 -2.506 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.201 -6.517 -4.470 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.453 -6.085 -1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.446 -7.554 -2.704 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.211 -6.325 -1.120 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -8.235 -8.692 -0.167 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.841 -7.936 -0.048 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.507 -9.118 -1.336 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.677 -8.073 -1.902 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.884 -8.590 -3.104 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.157 -6.969 -3.212 1.00 0.00 H new ATOM 373 N GLY A 24 -11.201 -4.000 -3.791 1.00 0.00 N ATOM 374 CA GLY A 24 -12.435 -3.348 -4.217 1.00 0.00 C ATOM 375 C GLY A 24 -12.791 -2.126 -3.371 1.00 0.00 C ATOM 376 O GLY A 24 -12.015 -1.717 -2.508 1.00 0.00 O ATOM 0 H GLY A 24 -10.601 -3.425 -3.199 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.337 -3.045 -5.259 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.253 -4.066 -4.169 1.00 0.00 H new ATOM 380 N VAL A 25 -13.971 -1.547 -3.622 1.00 0.00 N ATOM 381 CA VAL A 25 -14.457 -0.390 -2.871 1.00 0.00 C ATOM 382 C VAL A 25 -15.913 -0.568 -2.456 1.00 0.00 C ATOM 383 O VAL A 25 -16.625 -1.423 -2.984 1.00 0.00 O ATOM 384 CB VAL A 25 -14.311 0.903 -3.692 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.904 1.053 -4.262 1.00 0.00 C ATOM 386 CG2 VAL A 25 -15.321 0.962 -4.840 1.00 0.00 C ATOM 0 H VAL A 25 -14.611 -1.868 -4.349 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.845 -0.312 -1.973 1.00 0.00 H new ATOM 0 HB VAL A 25 -14.506 1.724 -3.003 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.840 1.978 -4.835 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.182 1.082 -3.446 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.683 0.207 -4.913 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.186 1.890 -5.396 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -15.165 0.114 -5.506 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -16.333 0.925 -4.437 1.00 0.00 H new ATOM 396 N SER A 26 -16.352 0.252 -1.503 1.00 0.00 N ATOM 397 CA SER A 26 -17.732 0.296 -1.040 1.00 0.00 C ATOM 398 C SER A 26 -18.040 1.704 -0.538 1.00 0.00 C ATOM 399 O SER A 26 -17.853 2.004 0.640 1.00 0.00 O ATOM 400 CB SER A 26 -17.942 -0.744 0.059 1.00 0.00 C ATOM 401 OG SER A 26 -19.293 -0.741 0.469 1.00 0.00 O ATOM 0 H SER A 26 -15.744 0.916 -1.024 1.00 0.00 H new ATOM 0 HA SER A 26 -18.413 0.059 -1.858 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.666 -1.733 -0.306 1.00 0.00 H new ATOM 0 HB3 SER A 26 -17.294 -0.525 0.908 1.00 0.00 H new ATOM 0 HG SER A 26 -19.423 -1.411 1.173 1.00 0.00 H new ATOM 407 N GLY A 27 -18.512 2.575 -1.434 1.00 0.00 N ATOM 408 CA GLY A 27 -18.788 3.962 -1.087 1.00 0.00 C ATOM 409 C GLY A 27 -17.475 4.730 -0.947 1.00 0.00 C ATOM 410 O GLY A 27 -16.862 5.094 -1.951 1.00 0.00 O ATOM 0 H GLY A 27 -18.710 2.338 -2.406 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -19.409 4.422 -1.855 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -19.349 4.009 -0.153 1.00 0.00 H new ATOM 414 N GLN A 28 -17.039 4.980 0.294 1.00 0.00 N ATOM 415 CA GLN A 28 -15.748 5.606 0.545 1.00 0.00 C ATOM 416 C GLN A 28 -14.772 4.569 1.070 1.00 0.00 C ATOM 417 O GLN A 28 -13.567 4.798 1.050 1.00 0.00 O ATOM 418 CB GLN A 28 -15.851 6.710 1.598 1.00 0.00 C ATOM 419 CG GLN A 28 -16.835 7.809 1.225 1.00 0.00 C ATOM 420 CD GLN A 28 -16.664 8.266 -0.222 1.00 0.00 C ATOM 421 OE1 GLN A 28 -17.623 8.295 -0.985 1.00 0.00 O ATOM 422 NE2 GLN A 28 -15.444 8.631 -0.617 1.00 0.00 N ATOM 0 H GLN A 28 -17.567 4.755 1.137 1.00 0.00 H new ATOM 0 HA GLN A 28 -15.408 6.034 -0.398 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -16.153 6.269 2.548 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -14.866 7.151 1.750 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -17.853 7.449 1.373 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -16.698 8.660 1.892 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -14.664 8.597 0.039 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -15.291 8.944 -1.575 1.00 0.00 H new ATOM 431 N GLN A 29 -15.292 3.432 1.537 1.00 0.00 N ATOM 432 CA GLN A 29 -14.447 2.370 2.040 1.00 0.00 C ATOM 433 C GLN A 29 -13.713 1.749 0.859 1.00 0.00 C ATOM 434 O GLN A 29 -14.241 1.689 -0.252 1.00 0.00 O ATOM 435 CB GLN A 29 -15.291 1.332 2.785 1.00 0.00 C ATOM 436 CG GLN A 29 -16.012 1.940 3.994 1.00 0.00 C ATOM 437 CD GLN A 29 -15.217 1.796 5.290 1.00 0.00 C ATOM 438 OE1 GLN A 29 -15.763 1.382 6.306 1.00 0.00 O ATOM 439 NE2 GLN A 29 -13.928 2.131 5.274 1.00 0.00 N ATOM 0 H GLN A 29 -16.292 3.232 1.573 1.00 0.00 H new ATOM 0 HA GLN A 29 -13.719 2.762 2.750 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -16.025 0.904 2.102 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -14.651 0.515 3.118 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -16.202 2.997 3.805 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -16.982 1.458 4.113 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -13.501 2.473 4.413 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -13.368 2.046 6.122 1.00 0.00 H new ATOM 448 N VAL A 30 -12.492 1.282 1.109 1.00 0.00 N ATOM 449 CA VAL A 30 -11.654 0.667 0.107 1.00 0.00 C ATOM 450 C VAL A 30 -11.031 -0.559 0.750 1.00 0.00 C ATOM 451 O VAL A 30 -10.318 -0.448 1.749 1.00 0.00 O ATOM 452 CB VAL A 30 -10.595 1.676 -0.357 1.00 0.00 C ATOM 453 CG1 VAL A 30 -9.742 1.069 -1.462 1.00 0.00 C ATOM 454 CG2 VAL A 30 -11.239 2.941 -0.927 1.00 0.00 C ATOM 0 H VAL A 30 -12.059 1.325 2.031 1.00 0.00 H new ATOM 0 HA VAL A 30 -12.218 0.368 -0.777 1.00 0.00 H new ATOM 0 HB VAL A 30 -9.992 1.927 0.515 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.994 1.794 -1.784 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.244 0.175 -1.087 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -10.377 0.803 -2.307 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -10.460 3.634 -1.246 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -11.863 2.678 -1.781 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -11.853 3.414 -0.161 1.00 0.00 H new ATOM 464 N ARG A 31 -11.309 -1.730 0.172 1.00 0.00 N ATOM 465 CA ARG A 31 -10.787 -2.997 0.649 1.00 0.00 C ATOM 466 C ARG A 31 -9.434 -3.202 -0.015 1.00 0.00 C ATOM 467 O ARG A 31 -9.353 -3.286 -1.239 1.00 0.00 O ATOM 468 CB ARG A 31 -11.786 -4.112 0.307 1.00 0.00 C ATOM 469 CG ARG A 31 -12.307 -4.800 1.569 1.00 0.00 C ATOM 470 CD ARG A 31 -11.206 -5.655 2.198 1.00 0.00 C ATOM 471 NE ARG A 31 -11.591 -6.142 3.527 1.00 0.00 N ATOM 472 CZ ARG A 31 -11.693 -7.426 3.883 1.00 0.00 C ATOM 473 NH1 ARG A 31 -11.545 -8.410 2.999 1.00 0.00 N ATOM 474 NH2 ARG A 31 -11.946 -7.730 5.154 1.00 0.00 N ATOM 0 H ARG A 31 -11.909 -1.818 -0.648 1.00 0.00 H new ATOM 0 HA ARG A 31 -10.655 -3.011 1.731 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -12.622 -3.694 -0.253 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -11.306 -4.847 -0.338 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -12.650 -4.052 2.284 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -13.166 -5.424 1.323 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -10.988 -6.503 1.549 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -10.290 -5.069 2.276 1.00 0.00 H new ATOM 0 HE ARG A 31 -11.798 -5.442 4.239 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -11.348 -8.193 2.022 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -11.628 -9.381 3.299 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -12.060 -6.987 5.843 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -12.026 -8.706 5.439 1.00 0.00 H new ATOM 488 N ILE A 32 -8.379 -3.282 0.796 1.00 0.00 N ATOM 489 CA ILE A 32 -7.007 -3.288 0.308 1.00 0.00 C ATOM 490 C ILE A 32 -6.286 -4.510 0.857 1.00 0.00 C ATOM 491 O ILE A 32 -6.626 -4.990 1.938 1.00 0.00 O ATOM 492 CB ILE A 32 -6.297 -2.000 0.762 1.00 0.00 C ATOM 493 CG1 ILE A 32 -7.209 -0.780 0.555 1.00 0.00 C ATOM 494 CG2 ILE A 32 -4.979 -1.822 -0.002 1.00 0.00 C ATOM 495 CD1 ILE A 32 -6.487 0.547 0.791 1.00 0.00 C ATOM 0 H ILE A 32 -8.456 -3.344 1.811 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.999 -3.329 -0.781 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.073 -2.084 1.825 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -7.606 -0.797 -0.460 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -8.061 -0.850 1.231 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.487 -0.907 0.329 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.328 -2.674 0.192 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.184 -1.758 -1.071 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -7.181 1.372 0.630 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -6.113 0.581 1.814 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -5.651 0.635 0.097 1.00 0.00 H new ATOM 507 N GLY A 33 -5.296 -5.012 0.119 1.00 0.00 N ATOM 508 CA GLY A 33 -4.522 -6.170 0.530 1.00 0.00 C ATOM 509 C GLY A 33 -3.034 -5.848 0.524 1.00 0.00 C ATOM 510 O GLY A 33 -2.584 -4.945 -0.179 1.00 0.00 O ATOM 0 H GLY A 33 -5.012 -4.623 -0.780 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.828 -6.483 1.528 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -4.722 -7.005 -0.141 1.00 0.00 H new ATOM 514 N ILE A 34 -2.274 -6.596 1.322 1.00 0.00 N ATOM 515 CA ILE A 34 -0.845 -6.395 1.500 1.00 0.00 C ATOM 516 C ILE A 34 -0.178 -7.754 1.612 1.00 0.00 C ATOM 517 O ILE A 34 -0.741 -8.677 2.197 1.00 0.00 O ATOM 518 CB ILE A 34 -0.587 -5.588 2.782 1.00 0.00 C ATOM 519 CG1 ILE A 34 -1.377 -4.270 2.770 1.00 0.00 C ATOM 520 CG2 ILE A 34 0.914 -5.319 2.935 1.00 0.00 C ATOM 521 CD1 ILE A 34 -1.254 -3.540 4.106 1.00 0.00 C ATOM 0 H ILE A 34 -2.645 -7.372 1.871 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.439 -5.845 0.651 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.929 -6.173 3.636 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -1.010 -3.630 1.968 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -2.427 -4.474 2.559 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.090 -4.747 3.846 1.00 0.00 H new ATOM 0 HG22 ILE A 34 1.449 -6.267 2.993 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.272 -4.752 2.075 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.823 -2.611 4.067 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.645 -4.172 4.903 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.206 -3.315 4.302 1.00 0.00 H new ATOM 533 N ASN A 35 1.022 -7.879 1.050 1.00 0.00 N ATOM 534 CA ASN A 35 1.733 -9.140 1.048 1.00 0.00 C ATOM 535 C ASN A 35 3.216 -8.893 1.296 1.00 0.00 C ATOM 536 O ASN A 35 3.921 -8.392 0.423 1.00 0.00 O ATOM 537 CB ASN A 35 1.472 -9.826 -0.292 1.00 0.00 C ATOM 538 CG ASN A 35 1.946 -11.271 -0.309 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.886 -11.643 0.383 1.00 0.00 O ATOM 540 ND2 ASN A 35 1.286 -12.105 -1.109 1.00 0.00 N ATOM 0 H ASN A 35 1.518 -7.115 0.590 1.00 0.00 H new ATOM 0 HA ASN A 35 1.384 -9.795 1.847 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.405 -9.795 -0.511 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.976 -9.272 -1.084 1.00 0.00 H new ATOM 0 HD21 ASN A 35 1.559 -13.087 -1.159 1.00 0.00 H new ATOM 0 HD22 ASN A 35 0.508 -11.763 -1.672 1.00 0.00 H new ATOM 547 N ALA A 36 3.681 -9.247 2.496 1.00 0.00 N ATOM 548 CA ALA A 36 5.068 -9.096 2.895 1.00 0.00 C ATOM 549 C ALA A 36 5.454 -10.196 3.881 1.00 0.00 C ATOM 550 O ALA A 36 4.590 -10.759 4.555 1.00 0.00 O ATOM 551 CB ALA A 36 5.257 -7.734 3.563 1.00 0.00 C ATOM 0 H ALA A 36 3.091 -9.652 3.223 1.00 0.00 H new ATOM 0 HA ALA A 36 5.702 -9.169 2.011 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.298 -7.618 3.864 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.992 -6.944 2.860 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.616 -7.668 4.442 1.00 0.00 H new ATOM 557 N PRO A 37 6.753 -10.506 3.973 1.00 0.00 N ATOM 558 CA PRO A 37 7.286 -11.461 4.926 1.00 0.00 C ATOM 559 C PRO A 37 7.108 -10.972 6.360 1.00 0.00 C ATOM 560 O PRO A 37 6.938 -9.778 6.601 1.00 0.00 O ATOM 561 CB PRO A 37 8.770 -11.591 4.572 1.00 0.00 C ATOM 562 CG PRO A 37 9.111 -10.304 3.824 1.00 0.00 C ATOM 563 CD PRO A 37 7.800 -9.944 3.141 1.00 0.00 C ATOM 0 HA PRO A 37 6.767 -12.418 4.870 1.00 0.00 H new ATOM 0 HB2 PRO A 37 9.381 -11.701 5.468 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.953 -12.468 3.952 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.441 -9.518 4.504 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.913 -10.458 3.102 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.690 -8.863 3.051 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.760 -10.354 2.132 1.00 0.00 H new ATOM 571 N LYS A 38 7.149 -11.897 7.322 1.00 0.00 N ATOM 572 CA LYS A 38 7.106 -11.551 8.743 1.00 0.00 C ATOM 573 C LYS A 38 8.435 -10.942 9.185 1.00 0.00 C ATOM 574 O LYS A 38 8.600 -10.568 10.348 1.00 0.00 O ATOM 575 CB LYS A 38 6.745 -12.792 9.564 1.00 0.00 C ATOM 576 CG LYS A 38 5.329 -13.263 9.226 1.00 0.00 C ATOM 577 CD LYS A 38 4.284 -12.267 9.730 1.00 0.00 C ATOM 578 CE LYS A 38 3.961 -12.470 11.211 1.00 0.00 C ATOM 579 NZ LYS A 38 3.282 -13.760 11.445 1.00 0.00 N ATOM 0 H LYS A 38 7.212 -12.899 7.139 1.00 0.00 H new ATOM 0 HA LYS A 38 6.336 -10.799 8.912 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.459 -13.590 9.361 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.815 -12.565 10.628 1.00 0.00 H new ATOM 0 HG2 LYS A 38 5.230 -13.384 8.147 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.151 -14.240 9.674 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.648 -11.251 9.575 1.00 0.00 H new ATOM 0 HD3 LYS A 38 3.372 -12.372 9.143 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.881 -12.431 11.794 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.327 -11.655 11.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.769 -13.723 12.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.610 -13.944 10.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.988 -14.523 11.479 1.00 0.00 H new ATOM 593 N ASP A 39 9.374 -10.848 8.245 1.00 0.00 N ATOM 594 CA ASP A 39 10.644 -10.161 8.432 1.00 0.00 C ATOM 595 C ASP A 39 10.436 -8.644 8.492 1.00 0.00 C ATOM 596 O ASP A 39 11.379 -7.901 8.762 1.00 0.00 O ATOM 597 CB ASP A 39 11.573 -10.509 7.269 1.00 0.00 C ATOM 598 CG ASP A 39 12.031 -11.964 7.341 1.00 0.00 C ATOM 599 OD1 ASP A 39 12.974 -12.236 8.115 1.00 0.00 O ATOM 600 OD2 ASP A 39 11.433 -12.798 6.623 1.00 0.00 O ATOM 0 H ASP A 39 9.268 -11.256 7.316 1.00 0.00 H new ATOM 0 HA ASP A 39 11.088 -10.483 9.374 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.058 -10.334 6.324 1.00 0.00 H new ATOM 0 HB3 ASP A 39 12.442 -9.851 7.285 1.00 0.00 H new ATOM 605 N VAL A 40 9.205 -8.186 8.241 1.00 0.00 N ATOM 606 CA VAL A 40 8.842 -6.776 8.271 1.00 0.00 C ATOM 607 C VAL A 40 7.480 -6.626 8.939 1.00 0.00 C ATOM 608 O VAL A 40 6.781 -7.618 9.154 1.00 0.00 O ATOM 609 CB VAL A 40 8.819 -6.188 6.851 1.00 0.00 C ATOM 610 CG1 VAL A 40 10.155 -6.401 6.141 1.00 0.00 C ATOM 611 CG2 VAL A 40 7.735 -6.837 5.995 1.00 0.00 C ATOM 0 H VAL A 40 8.424 -8.800 8.008 1.00 0.00 H new ATOM 0 HA VAL A 40 9.588 -6.225 8.844 1.00 0.00 H new ATOM 0 HB VAL A 40 8.618 -5.123 6.965 1.00 0.00 H new ATOM 0 HG11 VAL A 40 10.107 -5.974 5.139 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.949 -5.913 6.706 1.00 0.00 H new ATOM 0 HG13 VAL A 40 10.364 -7.469 6.071 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.747 -6.397 4.998 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.922 -7.908 5.922 1.00 0.00 H new ATOM 0 HG23 VAL A 40 6.760 -6.669 6.453 1.00 0.00 H new ATOM 621 N ALA A 41 7.094 -5.393 9.271 1.00 0.00 N ATOM 622 CA ALA A 41 5.847 -5.156 9.974 1.00 0.00 C ATOM 623 C ALA A 41 4.833 -4.459 9.072 1.00 0.00 C ATOM 624 O ALA A 41 5.199 -3.831 8.080 1.00 0.00 O ATOM 625 CB ALA A 41 6.136 -4.315 11.218 1.00 0.00 C ATOM 0 H ALA A 41 7.630 -4.550 9.062 1.00 0.00 H new ATOM 0 HA ALA A 41 5.413 -6.111 10.271 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.206 -4.130 11.756 1.00 0.00 H new ATOM 0 HB2 ALA A 41 6.830 -4.851 11.866 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.578 -3.365 10.920 1.00 0.00 H new ATOM 631 N VAL A 42 3.551 -4.575 9.419 1.00 0.00 N ATOM 632 CA VAL A 42 2.477 -3.878 8.726 1.00 0.00 C ATOM 633 C VAL A 42 1.265 -3.782 9.646 1.00 0.00 C ATOM 634 O VAL A 42 0.861 -4.777 10.247 1.00 0.00 O ATOM 635 CB VAL A 42 2.136 -4.598 7.413 1.00 0.00 C ATOM 636 CG1 VAL A 42 2.188 -6.118 7.559 1.00 0.00 C ATOM 637 CG2 VAL A 42 0.748 -4.211 6.901 1.00 0.00 C ATOM 0 H VAL A 42 3.231 -5.158 10.192 1.00 0.00 H new ATOM 0 HA VAL A 42 2.796 -2.868 8.470 1.00 0.00 H new ATOM 0 HB VAL A 42 2.894 -4.281 6.697 1.00 0.00 H new ATOM 0 HG11 VAL A 42 1.940 -6.584 6.605 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.191 -6.420 7.860 1.00 0.00 H new ATOM 0 HG13 VAL A 42 1.470 -6.436 8.316 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.543 -4.740 5.971 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -0.002 -4.480 7.645 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.713 -3.136 6.722 1.00 0.00 H new ATOM 647 N HIS A 43 0.685 -2.581 9.754 1.00 0.00 N ATOM 648 CA HIS A 43 -0.508 -2.346 10.555 1.00 0.00 C ATOM 649 C HIS A 43 -1.271 -1.157 9.996 1.00 0.00 C ATOM 650 O HIS A 43 -0.768 -0.451 9.122 1.00 0.00 O ATOM 651 CB HIS A 43 -0.137 -2.030 12.009 1.00 0.00 C ATOM 652 CG HIS A 43 0.956 -2.878 12.591 1.00 0.00 C ATOM 653 ND1 HIS A 43 0.764 -4.067 13.301 1.00 0.00 N ATOM 654 CD2 HIS A 43 2.292 -2.607 12.509 1.00 0.00 C ATOM 655 CE1 HIS A 43 2.000 -4.483 13.625 1.00 0.00 C ATOM 656 NE2 HIS A 43 2.935 -3.627 13.170 1.00 0.00 N ATOM 0 H HIS A 43 1.036 -1.746 9.284 1.00 0.00 H new ATOM 0 HA HIS A 43 -1.118 -3.249 10.522 1.00 0.00 H new ATOM 0 HB2 HIS A 43 0.165 -0.985 12.071 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -1.028 -2.141 12.626 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -0.122 -4.520 13.525 1.00 0.00 H new ATOM 0 HD2 HIS A 43 2.752 -1.760 12.022 1.00 0.00 H new ATOM 0 HE1 HIS A 43 2.215 -5.385 14.178 1.00 0.00 H new ATOM 664 N ARG A 44 -2.488 -0.925 10.500 1.00 0.00 N ATOM 665 CA ARG A 44 -3.226 0.284 10.175 1.00 0.00 C ATOM 666 C ARG A 44 -2.442 1.451 10.768 1.00 0.00 C ATOM 667 O ARG A 44 -1.741 1.274 11.762 1.00 0.00 O ATOM 668 CB ARG A 44 -4.620 0.192 10.794 1.00 0.00 C ATOM 669 CG ARG A 44 -5.441 -0.929 10.144 1.00 0.00 C ATOM 670 CD ARG A 44 -6.729 -1.190 10.926 1.00 0.00 C ATOM 671 NE ARG A 44 -7.557 0.019 11.037 1.00 0.00 N ATOM 672 CZ ARG A 44 -7.934 0.577 12.194 1.00 0.00 C ATOM 673 NH1 ARG A 44 -7.591 0.033 13.361 1.00 0.00 N ATOM 674 NH2 ARG A 44 -8.660 1.690 12.190 1.00 0.00 N ATOM 0 H ARG A 44 -2.975 -1.561 11.132 1.00 0.00 H new ATOM 0 HA ARG A 44 -3.342 0.419 9.100 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.534 0.010 11.865 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -5.138 1.143 10.673 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.684 -0.658 9.117 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.847 -1.842 10.101 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -7.300 -1.977 10.433 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -6.481 -1.553 11.923 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.866 0.464 10.173 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.033 -0.821 13.381 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.886 0.470 14.234 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -8.930 2.119 11.305 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -8.947 2.115 13.072 1.00 0.00 H new ATOM 688 N GLU A 45 -2.548 2.641 10.178 1.00 0.00 N ATOM 689 CA GLU A 45 -1.840 3.797 10.713 1.00 0.00 C ATOM 690 C GLU A 45 -2.368 4.156 12.104 1.00 0.00 C ATOM 691 O GLU A 45 -1.781 4.974 12.806 1.00 0.00 O ATOM 692 CB GLU A 45 -1.941 4.953 9.714 1.00 0.00 C ATOM 693 CG GLU A 45 -1.119 6.187 10.102 1.00 0.00 C ATOM 694 CD GLU A 45 0.322 5.837 10.456 1.00 0.00 C ATOM 695 OE1 GLU A 45 0.911 5.026 9.709 1.00 0.00 O ATOM 696 OE2 GLU A 45 0.823 6.382 11.465 1.00 0.00 O ATOM 0 H GLU A 45 -3.107 2.826 9.345 1.00 0.00 H new ATOM 0 HA GLU A 45 -0.783 3.566 10.844 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -1.612 4.603 8.735 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -2.987 5.243 9.614 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -1.125 6.899 9.276 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.589 6.681 10.952 1.00 0.00 H new ATOM 703 N GLU A 46 -3.483 3.537 12.507 1.00 0.00 N ATOM 704 CA GLU A 46 -4.032 3.684 13.842 1.00 0.00 C ATOM 705 C GLU A 46 -3.192 2.885 14.840 1.00 0.00 C ATOM 706 O GLU A 46 -2.814 3.395 15.892 1.00 0.00 O ATOM 707 CB GLU A 46 -5.463 3.139 13.814 1.00 0.00 C ATOM 708 CG GLU A 46 -6.161 3.305 15.163 1.00 0.00 C ATOM 709 CD GLU A 46 -7.572 2.726 15.107 1.00 0.00 C ATOM 710 OE1 GLU A 46 -8.451 3.384 14.511 1.00 0.00 O ATOM 711 OE2 GLU A 46 -7.769 1.621 15.662 1.00 0.00 O ATOM 0 H GLU A 46 -4.027 2.918 11.906 1.00 0.00 H new ATOM 0 HA GLU A 46 -4.025 4.730 14.147 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.034 3.657 13.043 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.445 2.084 13.542 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.586 2.803 15.941 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.205 4.361 15.429 1.00 0.00 H new ATOM 718 N ILE A 47 -2.898 1.623 14.504 1.00 0.00 N ATOM 719 CA ILE A 47 -2.136 0.725 15.365 1.00 0.00 C ATOM 720 C ILE A 47 -0.663 1.123 15.376 1.00 0.00 C ATOM 721 O ILE A 47 0.032 0.907 16.368 1.00 0.00 O ATOM 722 CB ILE A 47 -2.307 -0.718 14.864 1.00 0.00 C ATOM 723 CG1 ILE A 47 -3.613 -1.346 15.365 1.00 0.00 C ATOM 724 CG2 ILE A 47 -1.178 -1.625 15.357 1.00 0.00 C ATOM 725 CD1 ILE A 47 -4.868 -0.556 14.997 1.00 0.00 C ATOM 0 H ILE A 47 -3.186 1.199 13.622 1.00 0.00 H new ATOM 0 HA ILE A 47 -2.509 0.795 16.387 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.304 -0.647 13.776 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.699 -2.353 14.958 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.564 -1.444 16.449 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.334 -2.637 14.982 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.222 -1.247 14.994 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.172 -1.639 16.447 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -5.748 -1.067 15.388 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -4.808 0.444 15.427 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -4.945 -0.480 13.912 1.00 0.00 H new ATOM 737 N TYR A 48 -0.175 1.704 14.279 1.00 0.00 N ATOM 738 CA TYR A 48 1.218 2.096 14.176 1.00 0.00 C ATOM 739 C TYR A 48 1.580 3.150 15.220 1.00 0.00 C ATOM 740 O TYR A 48 2.721 3.211 15.672 1.00 0.00 O ATOM 741 CB TYR A 48 1.453 2.622 12.761 1.00 0.00 C ATOM 742 CG TYR A 48 2.892 2.966 12.458 1.00 0.00 C ATOM 743 CD1 TYR A 48 3.807 1.956 12.115 1.00 0.00 C ATOM 744 CD2 TYR A 48 3.306 4.302 12.514 1.00 0.00 C ATOM 745 CE1 TYR A 48 5.128 2.287 11.786 1.00 0.00 C ATOM 746 CE2 TYR A 48 4.624 4.641 12.188 1.00 0.00 C ATOM 747 CZ TYR A 48 5.543 3.638 11.816 1.00 0.00 C ATOM 748 OH TYR A 48 6.823 3.969 11.487 1.00 0.00 O ATOM 0 H TYR A 48 -0.732 1.911 13.450 1.00 0.00 H new ATOM 0 HA TYR A 48 1.859 1.236 14.369 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.112 1.873 12.046 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.839 3.510 12.609 1.00 0.00 H new ATOM 0 HD1 TYR A 48 3.491 0.923 12.105 1.00 0.00 H new ATOM 0 HD2 TYR A 48 2.608 5.071 12.809 1.00 0.00 H new ATOM 0 HE1 TYR A 48 5.828 1.512 11.510 1.00 0.00 H new ATOM 0 HE2 TYR A 48 4.938 5.674 12.221 1.00 0.00 H new ATOM 0 HH TYR A 48 7.447 3.419 12.006 1.00 0.00 H new ATOM 1211 N MET C 1 0.457 -12.270 4.598 1.00 0.00 N ATOM 1212 CA MET C 1 -0.658 -11.643 3.861 1.00 0.00 C ATOM 1213 C MET C 1 -1.583 -10.909 4.822 1.00 0.00 C ATOM 1214 O MET C 1 -1.899 -11.438 5.878 1.00 0.00 O ATOM 1215 CB MET C 1 -1.447 -12.703 3.086 1.00 0.00 C ATOM 1216 CG MET C 1 -2.553 -12.068 2.245 1.00 0.00 C ATOM 1217 SD MET C 1 -1.944 -11.053 0.878 1.00 0.00 S ATOM 1218 CE MET C 1 -3.488 -10.190 0.504 1.00 0.00 C ATOM 0 H1 MET C 1 0.598 -13.241 4.254 1.00 0.00 H new ATOM 0 H2 MET C 1 1.326 -11.720 4.446 1.00 0.00 H new ATOM 0 H3 MET C 1 0.234 -12.291 5.613 1.00 0.00 H new ATOM 0 HA MET C 1 -0.242 -10.925 3.154 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.771 -13.262 2.439 1.00 0.00 H new ATOM 0 HB3 MET C 1 -1.883 -13.417 3.784 1.00 0.00 H new ATOM 0 HG2 MET C 1 -3.189 -12.857 1.843 1.00 0.00 H new ATOM 0 HG3 MET C 1 -3.179 -11.452 2.891 1.00 0.00 H new ATOM 0 HE1 MET C 1 -3.304 -9.427 -0.253 1.00 0.00 H new ATOM 0 HE2 MET C 1 -4.222 -10.903 0.129 1.00 0.00 H new ATOM 0 HE3 MET C 1 -3.870 -9.719 1.410 1.00 0.00 H new ATOM 1230 N LEU C 2 -2.023 -9.698 4.472 1.00 0.00 N ATOM 1231 CA LEU C 2 -2.971 -8.946 5.278 1.00 0.00 C ATOM 1232 C LEU C 2 -3.974 -8.237 4.382 1.00 0.00 C ATOM 1233 O LEU C 2 -3.672 -7.921 3.234 1.00 0.00 O ATOM 1234 CB LEU C 2 -2.216 -7.911 6.117 1.00 0.00 C ATOM 1235 CG LEU C 2 -2.032 -8.343 7.569 1.00 0.00 C ATOM 1236 CD1 LEU C 2 -1.233 -7.271 8.304 1.00 0.00 C ATOM 1237 CD2 LEU C 2 -3.370 -8.501 8.289 1.00 0.00 C ATOM 0 H LEU C 2 -1.729 -9.217 3.622 1.00 0.00 H new ATOM 0 HA LEU C 2 -3.505 -9.634 5.934 1.00 0.00 H new ATOM 0 HB2 LEU C 2 -1.238 -7.732 5.670 1.00 0.00 H new ATOM 0 HB3 LEU C 2 -2.757 -6.965 6.090 1.00 0.00 H new ATOM 0 HG LEU C 2 -1.517 -9.304 7.567 1.00 0.00 H new ATOM 0 HD11 LEU C 2 -1.095 -7.569 9.343 1.00 0.00 H new ATOM 0 HD12 LEU C 2 -0.260 -7.152 7.828 1.00 0.00 H new ATOM 0 HD13 LEU C 2 -1.773 -6.325 8.266 1.00 0.00 H new ATOM 0 HD21 LEU C 2 -3.194 -8.809 9.320 1.00 0.00 H new ATOM 0 HD22 LEU C 2 -3.902 -7.550 8.281 1.00 0.00 H new ATOM 0 HD23 LEU C 2 -3.969 -9.257 7.781 1.00 0.00 H new ATOM 1249 N ILE C 3 -5.173 -7.991 4.910 1.00 0.00 N ATOM 1250 CA ILE C 3 -6.221 -7.268 4.211 1.00 0.00 C ATOM 1251 C ILE C 3 -6.856 -6.292 5.197 1.00 0.00 C ATOM 1252 O ILE C 3 -6.919 -6.573 6.395 1.00 0.00 O ATOM 1253 CB ILE C 3 -7.252 -8.254 3.635 1.00 0.00 C ATOM 1254 CG1 ILE C 3 -6.630 -9.205 2.608 1.00 0.00 C ATOM 1255 CG2 ILE C 3 -8.352 -7.508 2.880 1.00 0.00 C ATOM 1256 CD1 ILE C 3 -6.051 -10.469 3.236 1.00 0.00 C ATOM 0 H ILE C 3 -5.441 -8.294 5.846 1.00 0.00 H new ATOM 0 HA ILE C 3 -5.813 -6.710 3.368 1.00 0.00 H new ATOM 0 HB ILE C 3 -7.639 -8.805 4.492 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -7.387 -9.485 1.875 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -5.842 -8.681 2.068 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -9.070 -8.225 2.481 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -8.861 -6.825 3.560 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -7.911 -6.942 2.060 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -5.626 -11.101 2.456 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -5.272 -10.197 3.948 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -6.841 -11.013 3.753 1.00 0.00 H new ATOM 1268 N LEU C 4 -7.322 -5.146 4.699 1.00 0.00 N ATOM 1269 CA LEU C 4 -7.863 -4.070 5.514 1.00 0.00 C ATOM 1270 C LEU C 4 -8.988 -3.362 4.769 1.00 0.00 C ATOM 1271 O LEU C 4 -9.139 -3.538 3.563 1.00 0.00 O ATOM 1272 CB LEU C 4 -6.766 -3.040 5.791 1.00 0.00 C ATOM 1273 CG LEU C 4 -5.619 -3.546 6.664 1.00 0.00 C ATOM 1274 CD1 LEU C 4 -4.583 -2.425 6.729 1.00 0.00 C ATOM 1275 CD2 LEU C 4 -6.095 -3.874 8.077 1.00 0.00 C ATOM 0 H LEU C 4 -7.332 -4.941 3.700 1.00 0.00 H new ATOM 0 HA LEU C 4 -8.239 -4.496 6.444 1.00 0.00 H new ATOM 0 HB2 LEU C 4 -6.357 -2.700 4.839 1.00 0.00 H new ATOM 0 HB3 LEU C 4 -7.215 -2.172 6.273 1.00 0.00 H new ATOM 0 HG LEU C 4 -5.206 -4.460 6.238 1.00 0.00 H new ATOM 0 HD11 LEU C 4 -3.742 -2.742 7.345 1.00 0.00 H new ATOM 0 HD12 LEU C 4 -4.231 -2.196 5.723 1.00 0.00 H new ATOM 0 HD13 LEU C 4 -5.037 -1.535 7.165 1.00 0.00 H new ATOM 0 HD21 LEU C 4 -5.254 -4.231 8.671 1.00 0.00 H new ATOM 0 HD22 LEU C 4 -6.510 -2.978 8.538 1.00 0.00 H new ATOM 0 HD23 LEU C 4 -6.862 -4.648 8.032 1.00 0.00 H new ATOM 1287 N THR C 5 -9.774 -2.556 5.489 1.00 0.00 N ATOM 1288 CA THR C 5 -10.804 -1.741 4.860 1.00 0.00 C ATOM 1289 C THR C 5 -10.761 -0.331 5.434 1.00 0.00 C ATOM 1290 O THR C 5 -11.334 -0.053 6.486 1.00 0.00 O ATOM 1291 CB THR C 5 -12.201 -2.356 5.007 1.00 0.00 C ATOM 1292 OG1 THR C 5 -12.142 -3.766 4.988 1.00 0.00 O ATOM 1293 CG2 THR C 5 -13.060 -1.880 3.842 1.00 0.00 C ATOM 0 H THR C 5 -9.713 -2.454 6.502 1.00 0.00 H new ATOM 0 HA THR C 5 -10.597 -1.700 3.791 1.00 0.00 H new ATOM 0 HB THR C 5 -12.626 -2.044 5.961 1.00 0.00 H new ATOM 0 HG1 THR C 5 -13.046 -4.133 5.085 1.00 0.00 H new ATOM 0 HG21 THR C 5 -14.059 -2.307 3.928 1.00 0.00 H new ATOM 0 HG22 THR C 5 -13.127 -0.792 3.860 1.00 0.00 H new ATOM 0 HG23 THR C 5 -12.609 -2.200 2.903 1.00 0.00 H new ATOM 1301 N ARG C 6 -10.072 0.557 4.721 1.00 0.00 N ATOM 1302 CA ARG C 6 -9.920 1.961 5.085 1.00 0.00 C ATOM 1303 C ARG C 6 -10.882 2.794 4.248 1.00 0.00 C ATOM 1304 O ARG C 6 -11.629 2.247 3.448 1.00 0.00 O ATOM 1305 CB ARG C 6 -8.471 2.368 4.810 1.00 0.00 C ATOM 1306 CG ARG C 6 -7.516 1.698 5.796 1.00 0.00 C ATOM 1307 CD ARG C 6 -7.085 2.669 6.891 1.00 0.00 C ATOM 1308 NE ARG C 6 -8.235 3.205 7.634 1.00 0.00 N ATOM 1309 CZ ARG C 6 -8.141 3.775 8.836 1.00 0.00 C ATOM 1310 NH1 ARG C 6 -6.959 3.937 9.423 1.00 0.00 N ATOM 1311 NH2 ARG C 6 -9.236 4.189 9.466 1.00 0.00 N ATOM 0 H ARG C 6 -9.593 0.313 3.854 1.00 0.00 H new ATOM 0 HA ARG C 6 -10.147 2.122 6.139 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -8.199 2.092 3.791 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -8.374 3.451 4.884 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -8.001 0.831 6.245 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -6.638 1.332 5.264 1.00 0.00 H new ATOM 0 HD2 ARG C 6 -6.412 2.161 7.582 1.00 0.00 H new ATOM 0 HD3 ARG C 6 -6.525 3.492 6.447 1.00 0.00 H new ATOM 0 HE ARG C 6 -9.158 3.137 7.205 1.00 0.00 H new ATOM 0 HH11 ARG C 6 -6.109 3.624 8.954 1.00 0.00 H new ATOM 0 HH12 ARG C 6 -6.902 4.375 10.343 1.00 0.00 H new ATOM 0 HH21 ARG C 6 -10.151 4.071 9.030 1.00 0.00 H new ATOM 0 HH22 ARG C 6 -9.162 4.625 10.385 1.00 0.00 H new ATOM 1325 N LYS C 7 -10.872 4.119 4.424 1.00 0.00 N ATOM 1326 CA LYS C 7 -11.645 5.008 3.566 1.00 0.00 C ATOM 1327 C LYS C 7 -10.777 6.173 3.123 1.00 0.00 C ATOM 1328 O LYS C 7 -9.651 6.321 3.591 1.00 0.00 O ATOM 1329 CB LYS C 7 -12.940 5.506 4.222 1.00 0.00 C ATOM 1330 CG LYS C 7 -12.683 6.351 5.470 1.00 0.00 C ATOM 1331 CD LYS C 7 -14.016 6.935 5.931 1.00 0.00 C ATOM 1332 CE LYS C 7 -13.822 8.028 6.982 1.00 0.00 C ATOM 1333 NZ LYS C 7 -13.152 7.519 8.196 1.00 0.00 N ATOM 0 H LYS C 7 -10.338 4.594 5.152 1.00 0.00 H new ATOM 0 HA LYS C 7 -11.955 4.430 2.696 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -13.505 6.095 3.500 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -13.559 4.650 4.489 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -12.242 5.741 6.258 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -11.974 7.149 5.250 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -14.549 7.345 5.074 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -14.638 6.141 6.343 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -13.232 8.839 6.556 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -14.791 8.447 7.252 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -13.471 8.063 9.023 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -13.391 6.516 8.329 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -12.122 7.619 8.092 1.00 0.00 H new ATOM 1347 N VAL C 8 -11.294 7.006 2.223 1.00 0.00 N ATOM 1348 CA VAL C 8 -10.497 8.084 1.662 1.00 0.00 C ATOM 1349 C VAL C 8 -10.030 9.051 2.749 1.00 0.00 C ATOM 1350 O VAL C 8 -10.810 9.481 3.596 1.00 0.00 O ATOM 1351 CB VAL C 8 -11.234 8.781 0.516 1.00 0.00 C ATOM 1352 CG1 VAL C 8 -11.718 7.731 -0.485 1.00 0.00 C ATOM 1353 CG2 VAL C 8 -12.449 9.595 0.947 1.00 0.00 C ATOM 0 H VAL C 8 -12.250 6.954 1.872 1.00 0.00 H new ATOM 0 HA VAL C 8 -9.595 7.653 1.228 1.00 0.00 H new ATOM 0 HB VAL C 8 -10.512 9.475 0.086 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -12.244 8.223 -1.303 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -10.862 7.184 -0.881 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -12.393 7.036 0.014 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -12.909 10.053 0.072 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -13.171 8.940 1.436 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -12.137 10.374 1.643 1.00 0.00 H new ATOM 1363 N GLY C 9 -8.739 9.384 2.705 1.00 0.00 N ATOM 1364 CA GLY C 9 -8.105 10.294 3.650 1.00 0.00 C ATOM 1365 C GLY C 9 -7.363 9.542 4.759 1.00 0.00 C ATOM 1366 O GLY C 9 -6.639 10.166 5.535 1.00 0.00 O ATOM 0 H GLY C 9 -8.098 9.021 1.999 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -7.406 10.939 3.119 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -8.862 10.941 4.094 1.00 0.00 H new ATOM 1370 N GLU C 10 -7.531 8.218 4.841 1.00 0.00 N ATOM 1371 CA GLU C 10 -6.891 7.404 5.867 1.00 0.00 C ATOM 1372 C GLU C 10 -5.499 6.949 5.428 1.00 0.00 C ATOM 1373 O GLU C 10 -5.059 7.245 4.317 1.00 0.00 O ATOM 1374 CB GLU C 10 -7.759 6.182 6.172 1.00 0.00 C ATOM 1375 CG GLU C 10 -9.170 6.553 6.638 1.00 0.00 C ATOM 1376 CD GLU C 10 -9.204 7.201 8.023 1.00 0.00 C ATOM 1377 OE1 GLU C 10 -8.132 7.318 8.658 1.00 0.00 O ATOM 1378 OE2 GLU C 10 -10.325 7.575 8.439 1.00 0.00 O ATOM 0 H GLU C 10 -8.115 7.686 4.196 1.00 0.00 H new ATOM 0 HA GLU C 10 -6.782 8.014 6.764 1.00 0.00 H new ATOM 0 HB2 GLU C 10 -7.829 5.560 5.279 1.00 0.00 H new ATOM 0 HB3 GLU C 10 -7.274 5.581 6.942 1.00 0.00 H new ATOM 0 HG2 GLU C 10 -9.615 7.236 5.915 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -9.788 5.655 6.650 1.00 0.00 H new ATOM 1385 N SER C 11 -4.805 6.218 6.307 1.00 0.00 N ATOM 1386 CA SER C 11 -3.438 5.767 6.065 1.00 0.00 C ATOM 1387 C SER C 11 -3.175 4.388 6.676 1.00 0.00 C ATOM 1388 O SER C 11 -3.974 3.873 7.457 1.00 0.00 O ATOM 1389 CB SER C 11 -2.457 6.787 6.648 1.00 0.00 C ATOM 1390 OG SER C 11 -2.587 8.034 5.999 1.00 0.00 O ATOM 0 H SER C 11 -5.181 5.924 7.208 1.00 0.00 H new ATOM 0 HA SER C 11 -3.297 5.682 4.988 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.641 6.907 7.716 1.00 0.00 H new ATOM 0 HB3 SER C 11 -1.436 6.420 6.540 1.00 0.00 H new ATOM 0 HG SER C 11 -1.953 8.672 6.387 1.00 0.00 H new ATOM 1396 N ILE C 12 -2.032 3.803 6.302 1.00 0.00 N ATOM 1397 CA ILE C 12 -1.572 2.477 6.719 1.00 0.00 C ATOM 1398 C ILE C 12 -0.041 2.540 6.810 1.00 0.00 C ATOM 1399 O ILE C 12 0.554 3.475 6.276 1.00 0.00 O ATOM 1400 CB ILE C 12 -2.034 1.423 5.692 1.00 0.00 C ATOM 1401 CG1 ILE C 12 -3.532 1.573 5.386 1.00 0.00 C ATOM 1402 CG2 ILE C 12 -1.749 -0.003 6.181 1.00 0.00 C ATOM 1403 CD1 ILE C 12 -4.004 0.591 4.313 1.00 0.00 C ATOM 0 H ILE C 12 -1.374 4.263 5.672 1.00 0.00 H new ATOM 0 HA ILE C 12 -1.988 2.192 7.685 1.00 0.00 H new ATOM 0 HB ILE C 12 -1.464 1.596 4.779 1.00 0.00 H new ATOM 0 HG12 ILE C 12 -4.105 1.414 6.299 1.00 0.00 H new ATOM 0 HG13 ILE C 12 -3.734 2.592 5.057 1.00 0.00 H new ATOM 0 HG21 ILE C 12 -2.088 -0.719 5.432 1.00 0.00 H new ATOM 0 HG22 ILE C 12 -0.678 -0.125 6.342 1.00 0.00 H new ATOM 0 HG23 ILE C 12 -2.279 -0.179 7.117 1.00 0.00 H new ATOM 0 HD11 ILE C 12 -5.069 0.735 4.131 1.00 0.00 H new ATOM 0 HD12 ILE C 12 -3.451 0.767 3.390 1.00 0.00 H new ATOM 0 HD13 ILE C 12 -3.829 -0.430 4.652 1.00 0.00 H new ATOM 1415 N ASN C 13 0.617 1.576 7.466 1.00 0.00 N ATOM 1416 CA ASN C 13 2.073 1.607 7.606 1.00 0.00 C ATOM 1417 C ASN C 13 2.704 0.252 7.299 1.00 0.00 C ATOM 1418 O ASN C 13 2.063 -0.788 7.452 1.00 0.00 O ATOM 1419 CB ASN C 13 2.472 2.049 9.020 1.00 0.00 C ATOM 1420 CG ASN C 13 3.682 2.968 8.965 1.00 0.00 C ATOM 1421 OD1 ASN C 13 4.818 2.513 8.893 1.00 0.00 O ATOM 1422 ND2 ASN C 13 3.430 4.273 9.000 1.00 0.00 N ATOM 0 H ASN C 13 0.166 0.772 7.904 1.00 0.00 H new ATOM 0 HA ASN C 13 2.447 2.329 6.880 1.00 0.00 H new ATOM 0 HB2 ASN C 13 1.638 2.564 9.496 1.00 0.00 H new ATOM 0 HB3 ASN C 13 2.698 1.175 9.631 1.00 0.00 H new ATOM 0 HD21 ASN C 13 4.199 4.942 8.967 1.00 0.00 H new ATOM 0 HD22 ASN C 13 2.467 4.605 9.060 1.00 0.00 H new ATOM 1429 N ILE C 14 3.970 0.278 6.868 1.00 0.00 N ATOM 1430 CA ILE C 14 4.750 -0.916 6.567 1.00 0.00 C ATOM 1431 C ILE C 14 6.188 -0.676 7.027 1.00 0.00 C ATOM 1432 O ILE C 14 6.720 0.426 6.884 1.00 0.00 O ATOM 1433 CB ILE C 14 4.726 -1.221 5.062 1.00 0.00 C ATOM 1434 CG1 ILE C 14 3.279 -1.304 4.550 1.00 0.00 C ATOM 1435 CG2 ILE C 14 5.454 -2.544 4.793 1.00 0.00 C ATOM 1436 CD1 ILE C 14 3.210 -1.611 3.052 1.00 0.00 C ATOM 0 H ILE C 14 4.485 1.146 6.718 1.00 0.00 H new ATOM 0 HA ILE C 14 4.321 -1.772 7.087 1.00 0.00 H new ATOM 0 HB ILE C 14 5.233 -0.414 4.532 1.00 0.00 H new ATOM 0 HG12 ILE C 14 2.744 -2.077 5.102 1.00 0.00 H new ATOM 0 HG13 ILE C 14 2.771 -0.361 4.749 1.00 0.00 H new ATOM 0 HG21 ILE C 14 5.436 -2.759 3.724 1.00 0.00 H new ATOM 0 HG22 ILE C 14 6.488 -2.466 5.130 1.00 0.00 H new ATOM 0 HG23 ILE C 14 4.957 -3.349 5.333 1.00 0.00 H new ATOM 0 HD11 ILE C 14 2.167 -1.659 2.738 1.00 0.00 H new ATOM 0 HD12 ILE C 14 3.720 -0.825 2.496 1.00 0.00 H new ATOM 0 HD13 ILE C 14 3.693 -2.568 2.854 1.00 0.00 H new ATOM 1448 N GLY C 15 6.824 -1.710 7.582 1.00 0.00 N ATOM 1449 CA GLY C 15 8.156 -1.580 8.145 1.00 0.00 C ATOM 1450 C GLY C 15 8.170 -0.453 9.172 1.00 0.00 C ATOM 1451 O GLY C 15 7.233 -0.299 9.957 1.00 0.00 O ATOM 0 H GLY C 15 6.430 -2.648 7.650 1.00 0.00 H new ATOM 0 HA2 GLY C 15 8.456 -2.517 8.614 1.00 0.00 H new ATOM 0 HA3 GLY C 15 8.877 -1.374 7.354 1.00 0.00 H new ATOM 1455 N ASP C 16 9.244 0.333 9.160 1.00 0.00 N ATOM 1456 CA ASP C 16 9.378 1.505 10.010 1.00 0.00 C ATOM 1457 C ASP C 16 9.830 2.706 9.168 1.00 0.00 C ATOM 1458 O ASP C 16 10.190 3.751 9.706 1.00 0.00 O ATOM 1459 CB ASP C 16 10.340 1.168 11.148 1.00 0.00 C ATOM 1460 CG ASP C 16 10.485 2.302 12.157 1.00 0.00 C ATOM 1461 OD1 ASP C 16 9.459 2.643 12.786 1.00 0.00 O ATOM 1462 OD2 ASP C 16 11.615 2.820 12.296 1.00 0.00 O ATOM 0 H ASP C 16 10.049 0.170 8.555 1.00 0.00 H new ATOM 0 HA ASP C 16 8.423 1.785 10.456 1.00 0.00 H new ATOM 0 HB2 ASP C 16 9.988 0.274 11.662 1.00 0.00 H new ATOM 0 HB3 ASP C 16 11.319 0.931 10.731 1.00 0.00 H new ATOM 1467 N ASP C 17 9.809 2.554 7.837 1.00 0.00 N ATOM 1468 CA ASP C 17 10.247 3.586 6.907 1.00 0.00 C ATOM 1469 C ASP C 17 9.309 3.698 5.704 1.00 0.00 C ATOM 1470 O ASP C 17 9.635 4.401 4.749 1.00 0.00 O ATOM 1471 CB ASP C 17 11.679 3.303 6.427 1.00 0.00 C ATOM 1472 CG ASP C 17 12.661 3.152 7.590 1.00 0.00 C ATOM 1473 OD1 ASP C 17 13.140 4.200 8.076 1.00 0.00 O ATOM 1474 OD2 ASP C 17 12.920 1.990 7.984 1.00 0.00 O ATOM 0 H ASP C 17 9.484 1.703 7.379 1.00 0.00 H new ATOM 0 HA ASP C 17 10.226 4.536 7.441 1.00 0.00 H new ATOM 0 HB2 ASP C 17 11.686 2.392 5.828 1.00 0.00 H new ATOM 0 HB3 ASP C 17 12.009 4.114 5.778 1.00 0.00 H new ATOM 1479 N ILE C 18 8.152 3.028 5.729 1.00 0.00 N ATOM 1480 CA ILE C 18 7.201 3.100 4.625 1.00 0.00 C ATOM 1481 C ILE C 18 5.804 3.382 5.166 1.00 0.00 C ATOM 1482 O ILE C 18 5.412 2.859 6.207 1.00 0.00 O ATOM 1483 CB ILE C 18 7.198 1.799 3.808 1.00 0.00 C ATOM 1484 CG1 ILE C 18 8.587 1.432 3.278 1.00 0.00 C ATOM 1485 CG2 ILE C 18 6.233 1.946 2.625 1.00 0.00 C ATOM 1486 CD1 ILE C 18 9.270 0.461 4.240 1.00 0.00 C ATOM 0 H ILE C 18 7.856 2.432 6.502 1.00 0.00 H new ATOM 0 HA ILE C 18 7.505 3.911 3.964 1.00 0.00 H new ATOM 0 HB ILE C 18 6.879 0.998 4.475 1.00 0.00 H new ATOM 0 HG12 ILE C 18 8.501 0.979 2.290 1.00 0.00 H new ATOM 0 HG13 ILE C 18 9.192 2.332 3.165 1.00 0.00 H new ATOM 0 HG21 ILE C 18 6.228 1.025 2.043 1.00 0.00 H new ATOM 0 HG22 ILE C 18 5.228 2.145 2.998 1.00 0.00 H new ATOM 0 HG23 ILE C 18 6.556 2.773 1.993 1.00 0.00 H new ATOM 0 HD11 ILE C 18 10.258 0.204 3.857 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.371 0.929 5.219 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.669 -0.444 4.331 1.00 0.00 H new ATOM 1498 N THR C 19 5.047 4.212 4.447 1.00 0.00 N ATOM 1499 CA THR C 19 3.683 4.569 4.810 1.00 0.00 C ATOM 1500 C THR C 19 2.832 4.551 3.546 1.00 0.00 C ATOM 1501 O THR C 19 3.359 4.685 2.443 1.00 0.00 O ATOM 1502 CB THR C 19 3.671 5.954 5.474 1.00 0.00 C ATOM 1503 OG1 THR C 19 4.598 5.993 6.537 1.00 0.00 O ATOM 1504 CG2 THR C 19 2.296 6.317 6.034 1.00 0.00 C ATOM 0 H THR C 19 5.371 4.658 3.588 1.00 0.00 H new ATOM 0 HA THR C 19 3.273 3.856 5.525 1.00 0.00 H new ATOM 0 HB THR C 19 3.936 6.672 4.698 1.00 0.00 H new ATOM 0 HG1 THR C 19 4.583 6.881 6.952 1.00 0.00 H new ATOM 0 HG21 THR C 19 2.339 7.305 6.493 1.00 0.00 H new ATOM 0 HG22 THR C 19 1.564 6.324 5.226 1.00 0.00 H new ATOM 0 HG23 THR C 19 2.002 5.581 6.783 1.00 0.00 H new ATOM 1512 N ILE C 20 1.520 4.385 3.705 1.00 0.00 N ATOM 1513 CA ILE C 20 0.581 4.320 2.597 1.00 0.00 C ATOM 1514 C ILE C 20 -0.596 5.228 2.920 1.00 0.00 C ATOM 1515 O ILE C 20 -0.957 5.383 4.085 1.00 0.00 O ATOM 1516 CB ILE C 20 0.107 2.869 2.411 1.00 0.00 C ATOM 1517 CG1 ILE C 20 1.269 1.893 2.179 1.00 0.00 C ATOM 1518 CG2 ILE C 20 -0.900 2.771 1.260 1.00 0.00 C ATOM 1519 CD1 ILE C 20 1.974 2.108 0.839 1.00 0.00 C ATOM 0 H ILE C 20 1.078 4.291 4.620 1.00 0.00 H new ATOM 0 HA ILE C 20 1.054 4.648 1.671 1.00 0.00 H new ATOM 0 HB ILE C 20 -0.379 2.578 3.342 1.00 0.00 H new ATOM 0 HG12 ILE C 20 1.994 2.002 2.986 1.00 0.00 H new ATOM 0 HG13 ILE C 20 0.892 0.871 2.225 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -1.222 1.736 1.146 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.764 3.398 1.478 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -0.431 3.109 0.336 1.00 0.00 H new ATOM 0 HD11 ILE C 20 2.785 1.388 0.735 1.00 0.00 H new ATOM 0 HD12 ILE C 20 1.261 1.971 0.026 1.00 0.00 H new ATOM 0 HD13 ILE C 20 2.379 3.119 0.799 1.00 0.00 H new ATOM 1531 N THR C 21 -1.190 5.825 1.887 1.00 0.00 N ATOM 1532 CA THR C 21 -2.311 6.734 2.060 1.00 0.00 C ATOM 1533 C THR C 21 -3.290 6.552 0.908 1.00 0.00 C ATOM 1534 O THR C 21 -2.885 6.303 -0.227 1.00 0.00 O ATOM 1535 CB THR C 21 -1.794 8.178 2.092 1.00 0.00 C ATOM 1536 OG1 THR C 21 -0.781 8.309 3.065 1.00 0.00 O ATOM 1537 CG2 THR C 21 -2.909 9.167 2.435 1.00 0.00 C ATOM 0 H THR C 21 -0.907 5.691 0.916 1.00 0.00 H new ATOM 0 HA THR C 21 -2.822 6.518 2.998 1.00 0.00 H new ATOM 0 HB THR C 21 -1.407 8.402 1.098 1.00 0.00 H new ATOM 0 HG1 THR C 21 -0.456 9.234 3.077 1.00 0.00 H new ATOM 0 HG21 THR C 21 -2.506 10.180 2.449 1.00 0.00 H new ATOM 0 HG22 THR C 21 -3.698 9.100 1.686 1.00 0.00 H new ATOM 0 HG23 THR C 21 -3.319 8.927 3.416 1.00 0.00 H new ATOM 1545 N ILE C 22 -4.585 6.674 1.199 1.00 0.00 N ATOM 1546 CA ILE C 22 -5.641 6.585 0.203 1.00 0.00 C ATOM 1547 C ILE C 22 -6.170 8.000 -0.037 1.00 0.00 C ATOM 1548 O ILE C 22 -6.957 8.512 0.755 1.00 0.00 O ATOM 1549 CB ILE C 22 -6.707 5.577 0.676 1.00 0.00 C ATOM 1550 CG1 ILE C 22 -8.008 5.679 -0.120 1.00 0.00 C ATOM 1551 CG2 ILE C 22 -7.039 5.740 2.161 1.00 0.00 C ATOM 1552 CD1 ILE C 22 -7.782 5.466 -1.607 1.00 0.00 C ATOM 0 H ILE C 22 -4.929 6.839 2.145 1.00 0.00 H new ATOM 0 HA ILE C 22 -5.284 6.204 -0.754 1.00 0.00 H new ATOM 0 HB ILE C 22 -6.261 4.597 0.507 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -8.718 4.939 0.249 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -8.457 6.659 0.042 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -7.794 5.008 2.447 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -6.138 5.583 2.755 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -7.421 6.745 2.340 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -8.732 5.547 -2.135 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -7.093 6.223 -1.982 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -7.358 4.475 -1.772 1.00 0.00 H new ATOM 1564 N LEU C 23 -5.741 8.645 -1.127 1.00 0.00 N ATOM 1565 CA LEU C 23 -6.097 10.039 -1.358 1.00 0.00 C ATOM 1566 C LEU C 23 -7.573 10.181 -1.733 1.00 0.00 C ATOM 1567 O LEU C 23 -8.174 11.218 -1.450 1.00 0.00 O ATOM 1568 CB LEU C 23 -5.250 10.657 -2.475 1.00 0.00 C ATOM 1569 CG LEU C 23 -3.736 10.428 -2.411 1.00 0.00 C ATOM 1570 CD1 LEU C 23 -3.086 11.378 -3.417 1.00 0.00 C ATOM 1571 CD2 LEU C 23 -3.111 10.736 -1.057 1.00 0.00 C ATOM 0 H LEU C 23 -5.156 8.227 -1.850 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.905 10.566 -0.424 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -5.611 10.269 -3.427 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -5.430 11.732 -2.480 1.00 0.00 H new ATOM 0 HG LEU C 23 -3.571 9.370 -2.617 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -2.005 11.243 -3.399 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.462 11.162 -4.417 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -3.327 12.408 -3.153 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -2.038 10.547 -1.100 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -3.285 11.782 -0.805 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -3.561 10.100 -0.295 1.00 0.00 H new ATOM 1583 N GLY C 24 -8.169 9.160 -2.362 1.00 0.00 N ATOM 1584 CA GLY C 24 -9.579 9.207 -2.737 1.00 0.00 C ATOM 1585 C GLY C 24 -9.946 8.198 -3.819 1.00 0.00 C ATOM 1586 O GLY C 24 -9.121 7.377 -4.212 1.00 0.00 O ATOM 0 H GLY C 24 -7.694 8.295 -2.619 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -10.190 9.021 -1.854 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -9.822 10.210 -3.087 1.00 0.00 H new ATOM 1590 N VAL C 25 -11.194 8.264 -4.301 1.00 0.00 N ATOM 1591 CA VAL C 25 -11.693 7.355 -5.332 1.00 0.00 C ATOM 1592 C VAL C 25 -12.434 8.107 -6.438 1.00 0.00 C ATOM 1593 O VAL C 25 -12.835 9.256 -6.264 1.00 0.00 O ATOM 1594 CB VAL C 25 -12.628 6.297 -4.729 1.00 0.00 C ATOM 1595 CG1 VAL C 25 -11.992 5.614 -3.519 1.00 0.00 C ATOM 1596 CG2 VAL C 25 -13.970 6.898 -4.325 1.00 0.00 C ATOM 0 H VAL C 25 -11.882 8.948 -3.986 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.822 6.864 -5.766 1.00 0.00 H new ATOM 0 HB VAL C 25 -12.798 5.552 -5.506 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -12.681 4.871 -3.117 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -11.067 5.124 -3.822 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -11.774 6.359 -2.754 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -14.605 6.119 -3.902 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -13.810 7.679 -3.582 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -14.456 7.326 -5.202 1.00 0.00 H new ATOM 1606 N SER C 26 -12.607 7.436 -7.581 1.00 0.00 N ATOM 1607 CA SER C 26 -13.376 7.937 -8.711 1.00 0.00 C ATOM 1608 C SER C 26 -13.959 6.746 -9.466 1.00 0.00 C ATOM 1609 O SER C 26 -13.340 6.226 -10.393 1.00 0.00 O ATOM 1610 CB SER C 26 -12.482 8.785 -9.613 1.00 0.00 C ATOM 1611 OG SER C 26 -13.257 9.340 -10.655 1.00 0.00 O ATOM 0 H SER C 26 -12.206 6.512 -7.744 1.00 0.00 H new ATOM 0 HA SER C 26 -14.192 8.572 -8.366 1.00 0.00 H new ATOM 0 HB2 SER C 26 -12.010 9.579 -9.033 1.00 0.00 H new ATOM 0 HB3 SER C 26 -11.680 8.174 -10.027 1.00 0.00 H new ATOM 0 HG SER C 26 -12.684 9.886 -11.234 1.00 0.00 H new ATOM 1617 N GLY C 27 -15.158 6.305 -9.076 1.00 0.00 N ATOM 1618 CA GLY C 27 -15.787 5.141 -9.682 1.00 0.00 C ATOM 1619 C GLY C 27 -15.083 3.868 -9.222 1.00 0.00 C ATOM 1620 O GLY C 27 -15.305 3.418 -8.098 1.00 0.00 O ATOM 0 H GLY C 27 -15.711 6.743 -8.339 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.841 5.103 -9.407 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -15.743 5.218 -10.768 1.00 0.00 H new ATOM 1624 N GLN C 28 -14.235 3.291 -10.078 1.00 0.00 N ATOM 1625 CA GLN C 28 -13.434 2.132 -9.705 1.00 0.00 C ATOM 1626 C GLN C 28 -11.982 2.542 -9.538 1.00 0.00 C ATOM 1627 O GLN C 28 -11.212 1.825 -8.904 1.00 0.00 O ATOM 1628 CB GLN C 28 -13.480 1.037 -10.771 1.00 0.00 C ATOM 1629 CG GLN C 28 -14.883 0.534 -11.074 1.00 0.00 C ATOM 1630 CD GLN C 28 -15.705 0.306 -9.806 1.00 0.00 C ATOM 1631 OE1 GLN C 28 -16.777 0.884 -9.646 1.00 0.00 O ATOM 1632 NE2 GLN C 28 -15.215 -0.532 -8.898 1.00 0.00 N ATOM 0 H GLN C 28 -14.089 3.612 -11.035 1.00 0.00 H new ATOM 0 HA GLN C 28 -13.850 1.747 -8.774 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -13.035 1.418 -11.690 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -12.866 0.198 -10.443 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -15.395 1.255 -11.711 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -14.819 -0.398 -11.635 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -14.322 -0.996 -9.062 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -15.732 -0.711 -8.037 1.00 0.00 H new ATOM 1641 N GLN C 29 -11.601 3.689 -10.104 1.00 0.00 N ATOM 1642 CA GLN C 29 -10.255 4.196 -9.942 1.00 0.00 C ATOM 1643 C GLN C 29 -10.077 4.643 -8.503 1.00 0.00 C ATOM 1644 O GLN C 29 -11.020 5.101 -7.859 1.00 0.00 O ATOM 1645 CB GLN C 29 -10.001 5.351 -10.911 1.00 0.00 C ATOM 1646 CG GLN C 29 -9.858 4.835 -12.342 1.00 0.00 C ATOM 1647 CD GLN C 29 -8.648 3.919 -12.504 1.00 0.00 C ATOM 1648 OE1 GLN C 29 -7.670 4.016 -11.770 1.00 0.00 O ATOM 1649 NE2 GLN C 29 -8.709 3.019 -13.479 1.00 0.00 N ATOM 0 H GLN C 29 -12.210 4.276 -10.675 1.00 0.00 H new ATOM 0 HA GLN C 29 -9.532 3.413 -10.169 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -10.823 6.065 -10.857 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -9.096 5.884 -10.619 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -10.762 4.294 -12.624 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -9.766 5.680 -13.024 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -9.537 2.965 -14.072 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -7.928 2.382 -13.635 1.00 0.00 H new ATOM 1658 N VAL C 30 -8.853 4.504 -8.003 1.00 0.00 N ATOM 1659 CA VAL C 30 -8.512 4.829 -6.633 1.00 0.00 C ATOM 1660 C VAL C 30 -7.168 5.539 -6.643 1.00 0.00 C ATOM 1661 O VAL C 30 -6.159 4.955 -7.033 1.00 0.00 O ATOM 1662 CB VAL C 30 -8.467 3.535 -5.805 1.00 0.00 C ATOM 1663 CG1 VAL C 30 -8.214 3.850 -4.339 1.00 0.00 C ATOM 1664 CG2 VAL C 30 -9.789 2.772 -5.879 1.00 0.00 C ATOM 0 H VAL C 30 -8.064 4.158 -8.549 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.255 5.485 -6.180 1.00 0.00 H new ATOM 0 HB VAL C 30 -7.663 2.928 -6.221 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -8.185 2.922 -3.767 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.261 4.369 -4.238 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -9.015 4.485 -3.960 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.719 1.863 -5.281 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -10.593 3.399 -5.493 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.000 2.509 -6.916 1.00 0.00 H new ATOM 1674 N ARG C 31 -7.161 6.802 -6.217 1.00 0.00 N ATOM 1675 CA ARG C 31 -5.941 7.585 -6.105 1.00 0.00 C ATOM 1676 C ARG C 31 -5.268 7.175 -4.805 1.00 0.00 C ATOM 1677 O ARG C 31 -5.817 7.396 -3.724 1.00 0.00 O ATOM 1678 CB ARG C 31 -6.284 9.075 -6.090 1.00 0.00 C ATOM 1679 CG ARG C 31 -6.071 9.723 -7.461 1.00 0.00 C ATOM 1680 CD ARG C 31 -4.582 9.993 -7.692 1.00 0.00 C ATOM 1681 NE ARG C 31 -4.365 10.788 -8.906 1.00 0.00 N ATOM 1682 CZ ARG C 31 -3.524 11.824 -8.999 1.00 0.00 C ATOM 1683 NH1 ARG C 31 -2.791 12.210 -7.958 1.00 0.00 N ATOM 1684 NH2 ARG C 31 -3.415 12.479 -10.149 1.00 0.00 N ATOM 0 H ARG C 31 -8.003 7.307 -5.941 1.00 0.00 H new ATOM 0 HA ARG C 31 -5.276 7.407 -6.950 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -7.322 9.206 -5.784 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -5.667 9.582 -5.349 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -6.455 9.069 -8.244 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -6.631 10.656 -7.521 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -4.168 10.519 -6.832 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -4.047 9.047 -7.774 1.00 0.00 H new ATOM 0 HE ARG C 31 -4.894 10.532 -9.740 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -2.865 11.714 -7.070 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -2.155 13.002 -8.048 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -3.971 12.191 -10.954 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -2.776 13.270 -10.227 1.00 0.00 H new ATOM 1698 N ILE C 32 -4.079 6.584 -4.914 1.00 0.00 N ATOM 1699 CA ILE C 32 -3.352 6.059 -3.766 1.00 0.00 C ATOM 1700 C ILE C 32 -1.975 6.705 -3.713 1.00 0.00 C ATOM 1701 O ILE C 32 -1.421 7.082 -4.743 1.00 0.00 O ATOM 1702 CB ILE C 32 -3.212 4.528 -3.869 1.00 0.00 C ATOM 1703 CG1 ILE C 32 -4.521 3.899 -4.359 1.00 0.00 C ATOM 1704 CG2 ILE C 32 -2.802 3.950 -2.510 1.00 0.00 C ATOM 1705 CD1 ILE C 32 -4.523 2.373 -4.273 1.00 0.00 C ATOM 0 H ILE C 32 -3.595 6.457 -5.803 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.904 6.291 -2.855 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.435 4.292 -4.596 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.349 4.291 -3.768 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.697 4.199 -5.392 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -2.705 2.867 -2.590 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -1.847 4.379 -2.205 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -3.562 4.192 -1.767 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -5.477 1.989 -4.634 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.715 1.973 -4.886 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.378 2.067 -3.237 1.00 0.00 H new ATOM 1717 N GLY C 33 -1.422 6.829 -2.509 1.00 0.00 N ATOM 1718 CA GLY C 33 -0.112 7.406 -2.292 1.00 0.00 C ATOM 1719 C GLY C 33 0.749 6.450 -1.483 1.00 0.00 C ATOM 1720 O GLY C 33 0.241 5.618 -0.733 1.00 0.00 O ATOM 0 H GLY C 33 -1.882 6.526 -1.651 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.365 7.617 -3.249 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.207 8.357 -1.767 1.00 0.00 H new ATOM 1724 N ILE C 34 2.062 6.580 -1.652 1.00 0.00 N ATOM 1725 CA ILE C 34 3.054 5.709 -1.042 1.00 0.00 C ATOM 1726 C ILE C 34 4.213 6.582 -0.607 1.00 0.00 C ATOM 1727 O ILE C 34 4.626 7.476 -1.341 1.00 0.00 O ATOM 1728 CB ILE C 34 3.535 4.675 -2.071 1.00 0.00 C ATOM 1729 CG1 ILE C 34 2.354 3.865 -2.619 1.00 0.00 C ATOM 1730 CG2 ILE C 34 4.573 3.746 -1.427 1.00 0.00 C ATOM 1731 CD1 ILE C 34 2.780 2.987 -3.793 1.00 0.00 C ATOM 0 H ILE C 34 2.472 7.312 -2.231 1.00 0.00 H new ATOM 0 HA ILE C 34 2.633 5.176 -0.190 1.00 0.00 H new ATOM 0 HB ILE C 34 3.999 5.200 -2.906 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.940 3.241 -1.827 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.562 4.543 -2.938 1.00 0.00 H new ATOM 0 HG21 ILE C 34 4.911 3.014 -2.161 1.00 0.00 H new ATOM 0 HG22 ILE C 34 5.424 4.334 -1.082 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.122 3.229 -0.580 1.00 0.00 H new ATOM 0 HD11 ILE C 34 1.920 2.426 -4.158 1.00 0.00 H new ATOM 0 HD12 ILE C 34 3.171 3.615 -4.594 1.00 0.00 H new ATOM 0 HD13 ILE C 34 3.554 2.293 -3.466 1.00 0.00 H new ATOM 1743 N ASN C 35 4.745 6.325 0.583 1.00 0.00 N ATOM 1744 CA ASN C 35 5.777 7.170 1.143 1.00 0.00 C ATOM 1745 C ASN C 35 6.909 6.310 1.691 1.00 0.00 C ATOM 1746 O ASN C 35 6.822 5.789 2.801 1.00 0.00 O ATOM 1747 CB ASN C 35 5.147 8.057 2.217 1.00 0.00 C ATOM 1748 CG ASN C 35 6.102 9.118 2.739 1.00 0.00 C ATOM 1749 OD1 ASN C 35 7.280 9.141 2.394 1.00 0.00 O ATOM 1750 ND2 ASN C 35 5.593 10.009 3.584 1.00 0.00 N ATOM 0 H ASN C 35 4.475 5.538 1.173 1.00 0.00 H new ATOM 0 HA ASN C 35 6.210 7.814 0.378 1.00 0.00 H new ATOM 0 HB2 ASN C 35 4.261 8.542 1.807 1.00 0.00 H new ATOM 0 HB3 ASN C 35 4.814 7.434 3.047 1.00 0.00 H new ATOM 0 HD21 ASN C 35 6.186 10.744 3.969 1.00 0.00 H new ATOM 0 HD22 ASN C 35 4.609 9.958 3.847 1.00 0.00 H new ATOM 1757 N ALA C 36 7.965 6.173 0.888 1.00 0.00 N ATOM 1758 CA ALA C 36 9.171 5.451 1.252 1.00 0.00 C ATOM 1759 C ALA C 36 10.367 6.188 0.673 1.00 0.00 C ATOM 1760 O ALA C 36 10.241 6.882 -0.339 1.00 0.00 O ATOM 1761 CB ALA C 36 9.133 4.034 0.681 1.00 0.00 C ATOM 0 H ALA C 36 8.000 6.571 -0.051 1.00 0.00 H new ATOM 0 HA ALA C 36 9.245 5.392 2.338 1.00 0.00 H new ATOM 0 HB1 ALA C 36 10.043 3.504 0.962 1.00 0.00 H new ATOM 0 HB2 ALA C 36 8.267 3.504 1.079 1.00 0.00 H new ATOM 0 HB3 ALA C 36 9.061 4.081 -0.406 1.00 0.00 H new ATOM 1767 N PRO C 37 11.534 6.043 1.304 1.00 0.00 N ATOM 1768 CA PRO C 37 12.758 6.634 0.816 1.00 0.00 C ATOM 1769 C PRO C 37 13.107 6.046 -0.549 1.00 0.00 C ATOM 1770 O PRO C 37 12.753 4.912 -0.851 1.00 0.00 O ATOM 1771 CB PRO C 37 13.814 6.298 1.869 1.00 0.00 C ATOM 1772 CG PRO C 37 13.247 5.115 2.653 1.00 0.00 C ATOM 1773 CD PRO C 37 11.740 5.300 2.531 1.00 0.00 C ATOM 0 HA PRO C 37 12.682 7.712 0.675 1.00 0.00 H new ATOM 0 HB2 PRO C 37 14.765 6.040 1.403 1.00 0.00 H new ATOM 0 HB3 PRO C 37 14.000 7.149 2.524 1.00 0.00 H new ATOM 0 HG2 PRO C 37 13.570 4.163 2.233 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.571 5.130 3.694 1.00 0.00 H new ATOM 0 HD2 PRO C 37 11.229 4.338 2.497 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.341 5.842 3.389 1.00 0.00 H new ATOM 1781 N LYS C 38 13.809 6.821 -1.380 1.00 0.00 N ATOM 1782 CA LYS C 38 14.255 6.358 -2.691 1.00 0.00 C ATOM 1783 C LYS C 38 15.238 5.197 -2.552 1.00 0.00 C ATOM 1784 O LYS C 38 15.620 4.560 -3.530 1.00 0.00 O ATOM 1785 CB LYS C 38 14.907 7.517 -3.438 1.00 0.00 C ATOM 1786 CG LYS C 38 13.872 8.353 -4.186 1.00 0.00 C ATOM 1787 CD LYS C 38 12.798 9.038 -3.333 1.00 0.00 C ATOM 1788 CE LYS C 38 13.408 10.108 -2.438 1.00 0.00 C ATOM 1789 NZ LYS C 38 12.387 10.765 -1.596 1.00 0.00 N ATOM 0 H LYS C 38 14.081 7.780 -1.163 1.00 0.00 H new ATOM 0 HA LYS C 38 13.392 6.001 -3.253 1.00 0.00 H new ATOM 0 HB2 LYS C 38 15.446 8.149 -2.732 1.00 0.00 H new ATOM 0 HB3 LYS C 38 15.642 7.129 -4.144 1.00 0.00 H new ATOM 0 HG2 LYS C 38 14.399 9.121 -4.752 1.00 0.00 H new ATOM 0 HG3 LYS C 38 13.373 7.709 -4.910 1.00 0.00 H new ATOM 0 HD2 LYS C 38 12.046 9.488 -3.982 1.00 0.00 H new ATOM 0 HD3 LYS C 38 12.287 8.295 -2.720 1.00 0.00 H new ATOM 0 HE2 LYS C 38 14.170 9.659 -1.801 1.00 0.00 H new ATOM 0 HE3 LYS C 38 13.908 10.856 -3.054 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 12.840 11.487 -1.001 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 11.673 11.215 -2.204 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 11.928 10.055 -0.990 1.00 0.00 H new ATOM 1803 N ASP C 39 15.634 4.949 -1.307 1.00 0.00 N ATOM 1804 CA ASP C 39 16.486 3.843 -0.896 1.00 0.00 C ATOM 1805 C ASP C 39 15.819 2.484 -1.125 1.00 0.00 C ATOM 1806 O ASP C 39 16.474 1.452 -0.982 1.00 0.00 O ATOM 1807 CB ASP C 39 16.813 3.995 0.588 1.00 0.00 C ATOM 1808 CG ASP C 39 17.801 5.132 0.818 1.00 0.00 C ATOM 1809 OD1 ASP C 39 17.334 6.278 0.989 1.00 0.00 O ATOM 1810 OD2 ASP C 39 19.020 4.846 0.825 1.00 0.00 O ATOM 0 H ASP C 39 15.356 5.541 -0.524 1.00 0.00 H new ATOM 0 HA ASP C 39 17.392 3.875 -1.502 1.00 0.00 H new ATOM 0 HB2 ASP C 39 15.897 4.186 1.148 1.00 0.00 H new ATOM 0 HB3 ASP C 39 17.231 3.063 0.969 1.00 0.00 H new ATOM 1815 N VAL C 40 14.532 2.475 -1.475 1.00 0.00 N ATOM 1816 CA VAL C 40 13.790 1.250 -1.758 1.00 0.00 C ATOM 1817 C VAL C 40 12.990 1.464 -3.037 1.00 0.00 C ATOM 1818 O VAL C 40 12.874 2.593 -3.509 1.00 0.00 O ATOM 1819 CB VAL C 40 12.867 0.891 -0.584 1.00 0.00 C ATOM 1820 CG1 VAL C 40 13.664 0.815 0.720 1.00 0.00 C ATOM 1821 CG2 VAL C 40 11.765 1.925 -0.407 1.00 0.00 C ATOM 0 H VAL C 40 13.974 3.323 -1.570 1.00 0.00 H new ATOM 0 HA VAL C 40 14.480 0.417 -1.891 1.00 0.00 H new ATOM 0 HB VAL C 40 12.421 -0.077 -0.813 1.00 0.00 H new ATOM 0 HG11 VAL C 40 12.994 0.560 1.541 1.00 0.00 H new ATOM 0 HG12 VAL C 40 14.436 0.051 0.630 1.00 0.00 H new ATOM 0 HG13 VAL C 40 14.130 1.780 0.918 1.00 0.00 H new ATOM 0 HG21 VAL C 40 11.130 1.640 0.432 1.00 0.00 H new ATOM 0 HG22 VAL C 40 12.210 2.901 -0.211 1.00 0.00 H new ATOM 0 HG23 VAL C 40 11.165 1.976 -1.315 1.00 0.00 H new ATOM 1831 N ALA C 41 12.434 0.394 -3.607 1.00 0.00 N ATOM 1832 CA ALA C 41 11.754 0.504 -4.883 1.00 0.00 C ATOM 1833 C ALA C 41 10.237 0.481 -4.726 1.00 0.00 C ATOM 1834 O ALA C 41 9.719 -0.069 -3.758 1.00 0.00 O ATOM 1835 CB ALA C 41 12.218 -0.641 -5.785 1.00 0.00 C ATOM 0 H ALA C 41 12.444 -0.544 -3.206 1.00 0.00 H new ATOM 0 HA ALA C 41 12.008 1.464 -5.333 1.00 0.00 H new ATOM 0 HB1 ALA C 41 11.715 -0.571 -6.749 1.00 0.00 H new ATOM 0 HB2 ALA C 41 13.296 -0.574 -5.933 1.00 0.00 H new ATOM 0 HB3 ALA C 41 11.975 -1.595 -5.317 1.00 0.00 H new ATOM 1841 N VAL C 42 9.530 1.078 -5.686 1.00 0.00 N ATOM 1842 CA VAL C 42 8.073 1.030 -5.747 1.00 0.00 C ATOM 1843 C VAL C 42 7.611 1.364 -7.163 1.00 0.00 C ATOM 1844 O VAL C 42 8.045 2.360 -7.744 1.00 0.00 O ATOM 1845 CB VAL C 42 7.451 1.976 -4.708 1.00 0.00 C ATOM 1846 CG1 VAL C 42 8.254 3.267 -4.555 1.00 0.00 C ATOM 1847 CG2 VAL C 42 6.014 2.341 -5.072 1.00 0.00 C ATOM 0 H VAL C 42 9.956 1.610 -6.445 1.00 0.00 H new ATOM 0 HA VAL C 42 7.735 0.023 -5.503 1.00 0.00 H new ATOM 0 HB VAL C 42 7.464 1.433 -3.763 1.00 0.00 H new ATOM 0 HG11 VAL C 42 7.778 3.905 -3.811 1.00 0.00 H new ATOM 0 HG12 VAL C 42 9.268 3.029 -4.234 1.00 0.00 H new ATOM 0 HG13 VAL C 42 8.290 3.789 -5.511 1.00 0.00 H new ATOM 0 HG21 VAL C 42 5.606 3.011 -4.315 1.00 0.00 H new ATOM 0 HG22 VAL C 42 5.999 2.838 -6.042 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.409 1.435 -5.119 1.00 0.00 H new ATOM 1857 N HIS C 43 6.729 0.528 -7.715 1.00 0.00 N ATOM 1858 CA HIS C 43 6.169 0.688 -9.054 1.00 0.00 C ATOM 1859 C HIS C 43 4.842 -0.061 -9.127 1.00 0.00 C ATOM 1860 O HIS C 43 4.501 -0.786 -8.192 1.00 0.00 O ATOM 1861 CB HIS C 43 7.101 0.075 -10.105 1.00 0.00 C ATOM 1862 CG HIS C 43 8.575 0.251 -9.854 1.00 0.00 C ATOM 1863 ND1 HIS C 43 9.370 1.275 -10.377 1.00 0.00 N ATOM 1864 CD2 HIS C 43 9.346 -0.573 -9.086 1.00 0.00 C ATOM 1865 CE1 HIS C 43 10.607 1.030 -9.912 1.00 0.00 C ATOM 1866 NE2 HIS C 43 10.621 -0.066 -9.137 1.00 0.00 N ATOM 0 H HIS C 43 6.378 -0.298 -7.230 1.00 0.00 H new ATOM 0 HA HIS C 43 6.039 1.753 -9.249 1.00 0.00 H new ATOM 0 HB2 HIS C 43 6.888 -0.992 -10.174 1.00 0.00 H new ATOM 0 HB3 HIS C 43 6.862 0.512 -11.075 1.00 0.00 H new ATOM 0 HD1 HIS C 43 9.075 2.042 -10.981 1.00 0.00 H new ATOM 0 HD2 HIS C 43 9.018 -1.449 -8.546 1.00 0.00 H new ATOM 0 HE1 HIS C 43 11.474 1.635 -10.133 1.00 0.00 H new ATOM 1874 N ARG C 44 4.085 0.097 -10.220 1.00 0.00 N ATOM 1875 CA ARG C 44 2.909 -0.741 -10.402 1.00 0.00 C ATOM 1876 C ARG C 44 3.358 -2.075 -10.983 1.00 0.00 C ATOM 1877 O ARG C 44 4.479 -2.181 -11.482 1.00 0.00 O ATOM 1878 CB ARG C 44 1.840 -0.040 -11.252 1.00 0.00 C ATOM 1879 CG ARG C 44 2.220 0.153 -12.721 1.00 0.00 C ATOM 1880 CD ARG C 44 1.007 0.770 -13.422 1.00 0.00 C ATOM 1881 NE ARG C 44 1.192 0.859 -14.873 1.00 0.00 N ATOM 1882 CZ ARG C 44 0.220 1.239 -15.709 1.00 0.00 C ATOM 1883 NH1 ARG C 44 -0.992 1.552 -15.260 1.00 0.00 N ATOM 1884 NH2 ARG C 44 0.464 1.311 -17.013 1.00 0.00 N ATOM 0 H ARG C 44 4.261 0.773 -10.963 1.00 0.00 H new ATOM 0 HA ARG C 44 2.427 -0.926 -9.442 1.00 0.00 H new ATOM 0 HB2 ARG C 44 0.918 -0.619 -11.202 1.00 0.00 H new ATOM 0 HB3 ARG C 44 1.628 0.935 -10.814 1.00 0.00 H new ATOM 0 HG2 ARG C 44 3.090 0.804 -12.812 1.00 0.00 H new ATOM 0 HG3 ARG C 44 2.486 -0.800 -13.179 1.00 0.00 H new ATOM 0 HD2 ARG C 44 0.122 0.172 -13.206 1.00 0.00 H new ATOM 0 HD3 ARG C 44 0.824 1.766 -13.019 1.00 0.00 H new ATOM 0 HE ARG C 44 2.104 0.620 -15.263 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -1.194 1.505 -14.261 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -1.720 1.840 -15.914 1.00 0.00 H new ATOM 0 HH21 ARG C 44 1.389 1.077 -17.372 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -0.274 1.600 -17.655 1.00 0.00 H new ATOM 1898 N GLU C 45 2.504 -3.095 -10.930 1.00 0.00 N ATOM 1899 CA GLU C 45 2.910 -4.428 -11.354 1.00 0.00 C ATOM 1900 C GLU C 45 3.395 -4.474 -12.802 1.00 0.00 C ATOM 1901 O GLU C 45 4.131 -5.391 -13.160 1.00 0.00 O ATOM 1902 CB GLU C 45 1.802 -5.459 -11.088 1.00 0.00 C ATOM 1903 CG GLU C 45 0.400 -5.005 -11.497 1.00 0.00 C ATOM 1904 CD GLU C 45 0.275 -4.665 -12.977 1.00 0.00 C ATOM 1905 OE1 GLU C 45 0.409 -5.595 -13.801 1.00 0.00 O ATOM 1906 OE2 GLU C 45 0.046 -3.468 -13.263 1.00 0.00 O ATOM 0 H GLU C 45 1.541 -3.024 -10.602 1.00 0.00 H new ATOM 0 HA GLU C 45 3.771 -4.698 -10.743 1.00 0.00 H new ATOM 0 HB2 GLU C 45 2.043 -6.378 -11.623 1.00 0.00 H new ATOM 0 HB3 GLU C 45 1.796 -5.701 -10.025 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -0.313 -5.792 -11.252 1.00 0.00 H new ATOM 0 HG3 GLU C 45 0.124 -4.131 -10.908 1.00 0.00 H new ATOM 1913 N GLU C 46 3.008 -3.514 -13.646 1.00 0.00 N ATOM 1914 CA GLU C 46 3.442 -3.506 -15.032 1.00 0.00 C ATOM 1915 C GLU C 46 4.953 -3.295 -15.105 1.00 0.00 C ATOM 1916 O GLU C 46 5.637 -3.963 -15.879 1.00 0.00 O ATOM 1917 CB GLU C 46 2.711 -2.383 -15.768 1.00 0.00 C ATOM 1918 CG GLU C 46 3.111 -2.351 -17.244 1.00 0.00 C ATOM 1919 CD GLU C 46 2.381 -1.228 -17.976 1.00 0.00 C ATOM 1920 OE1 GLU C 46 2.724 -0.053 -17.717 1.00 0.00 O ATOM 1921 OE2 GLU C 46 1.486 -1.546 -18.790 1.00 0.00 O ATOM 0 H GLU C 46 2.398 -2.738 -13.389 1.00 0.00 H new ATOM 0 HA GLU C 46 3.208 -4.462 -15.501 1.00 0.00 H new ATOM 0 HB2 GLU C 46 1.634 -2.526 -15.681 1.00 0.00 H new ATOM 0 HB3 GLU C 46 2.944 -1.425 -15.303 1.00 0.00 H new ATOM 0 HG2 GLU C 46 4.188 -2.209 -17.331 1.00 0.00 H new ATOM 0 HG3 GLU C 46 2.877 -3.308 -17.710 1.00 0.00 H new ATOM 1928 N ILE C 47 5.473 -2.366 -14.299 1.00 0.00 N ATOM 1929 CA ILE C 47 6.893 -2.045 -14.305 1.00 0.00 C ATOM 1930 C ILE C 47 7.643 -3.065 -13.452 1.00 0.00 C ATOM 1931 O ILE C 47 8.814 -3.339 -13.707 1.00 0.00 O ATOM 1932 CB ILE C 47 7.090 -0.618 -13.771 1.00 0.00 C ATOM 1933 CG1 ILE C 47 6.736 0.450 -14.815 1.00 0.00 C ATOM 1934 CG2 ILE C 47 8.545 -0.379 -13.368 1.00 0.00 C ATOM 1935 CD1 ILE C 47 5.304 0.363 -15.335 1.00 0.00 C ATOM 0 H ILE C 47 4.924 -1.823 -13.632 1.00 0.00 H new ATOM 0 HA ILE C 47 7.289 -2.090 -15.319 1.00 0.00 H new ATOM 0 HB ILE C 47 6.424 -0.532 -12.913 1.00 0.00 H new ATOM 0 HG12 ILE C 47 6.893 1.436 -14.378 1.00 0.00 H new ATOM 0 HG13 ILE C 47 7.423 0.361 -15.657 1.00 0.00 H new ATOM 0 HG21 ILE C 47 8.656 0.639 -12.994 1.00 0.00 H new ATOM 0 HG22 ILE C 47 8.827 -1.086 -12.588 1.00 0.00 H new ATOM 0 HG23 ILE C 47 9.190 -0.519 -14.235 1.00 0.00 H new ATOM 0 HD11 ILE C 47 5.135 1.152 -16.068 1.00 0.00 H new ATOM 0 HD12 ILE C 47 5.146 -0.608 -15.804 1.00 0.00 H new ATOM 0 HD13 ILE C 47 4.608 0.483 -14.505 1.00 0.00 H new ATOM 1947 N TYR C 48 6.981 -3.633 -12.440 1.00 0.00 N ATOM 1948 CA TYR C 48 7.624 -4.614 -11.585 1.00 0.00 C ATOM 1949 C TYR C 48 8.010 -5.859 -12.377 1.00 0.00 C ATOM 1950 O TYR C 48 9.040 -6.464 -12.096 1.00 0.00 O ATOM 1951 CB TYR C 48 6.682 -4.987 -10.447 1.00 0.00 C ATOM 1952 CG TYR C 48 7.355 -5.852 -9.410 1.00 0.00 C ATOM 1953 CD1 TYR C 48 8.083 -5.251 -8.370 1.00 0.00 C ATOM 1954 CD2 TYR C 48 7.258 -7.250 -9.486 1.00 0.00 C ATOM 1955 CE1 TYR C 48 8.713 -6.047 -7.400 1.00 0.00 C ATOM 1956 CE2 TYR C 48 7.877 -8.049 -8.518 1.00 0.00 C ATOM 1957 CZ TYR C 48 8.607 -7.452 -7.468 1.00 0.00 C ATOM 1958 OH TYR C 48 9.212 -8.221 -6.519 1.00 0.00 O ATOM 0 H TYR C 48 6.011 -3.428 -12.201 1.00 0.00 H new ATOM 0 HA TYR C 48 8.536 -4.179 -11.177 1.00 0.00 H new ATOM 0 HB2 TYR C 48 6.309 -4.079 -9.974 1.00 0.00 H new ATOM 0 HB3 TYR C 48 5.817 -5.513 -10.851 1.00 0.00 H new ATOM 0 HD1 TYR C 48 8.158 -4.175 -8.316 1.00 0.00 H new ATOM 0 HD2 TYR C 48 6.705 -7.710 -10.292 1.00 0.00 H new ATOM 0 HE1 TYR C 48 9.277 -5.585 -6.604 1.00 0.00 H new ATOM 0 HE2 TYR C 48 7.796 -9.124 -8.575 1.00 0.00 H new ATOM 0 HH TYR C 48 9.043 -9.168 -6.708 1.00 0.00 H new