USER MOD reduce.3.24.130724 H: found=0, std=0, add=782, rem=0, adj=21 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= -0.404 K(o=-0.4,f=-1.2) 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=-0.00391 USER MOD Set 3.1: A 13 ASN : amide:sc= -0.343 K(o=-0.34,f=-1.3) 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=-0.00549 USER MOD Single : A 1 MET CE :methyl 157:sc= -0.0279 (180deg=-0.23) USER MOD Single : A 1 MET N :NH3+ 147:sc= 0.0234 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 100:sc= 1.04 USER MOD Single : A 7 LYS NZ :NH3+ -155:sc= 1.22 (180deg=0.698) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN :FLIP amide:sc= -0.263 F(o=-0.78,f=-0.26) USER MOD Single : A 29 GLN : amide:sc= -0.358 K(o=-0.36,f=-1.3) USER MOD Single : A 35 ASN : amide:sc= -0.212 K(o=-0.21,f=-2.5!) USER MOD Single : A 38 LYS NZ :NH3+ 165:sc= -0.0175 (180deg=-0.261) USER MOD Single : A 43 HIS : no HE2:sc= -1.12 K(o=-1.1,f=-2) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl -155:sc= 0 (180deg=-0.0445) USER MOD Single : C 1 MET N :NH3+ 134:sc= 0.0333 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 26 SER OG : rot 48:sc= 0.312 USER MOD Single : C 28 GLN : amide:sc= -0.673 X(o=-0.67,f=-0.25) USER MOD Single : C 29 GLN : amide:sc= -0.809 K(o=-0.81,f=-1.9) USER MOD Single : C 35 ASN : amide:sc= -0.209 K(o=-0.21,f=-2.7!) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HE2:sc= -1.5 K(o=-1.5,f=-2.1) USER MOD Single : C 48 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.294 9.685 -2.053 1.00 0.00 N ATOM 2 CA MET A 1 6.819 9.707 -2.120 1.00 0.00 C ATOM 3 C MET A 1 6.349 9.440 -3.543 1.00 0.00 C ATOM 4 O MET A 1 6.958 9.937 -4.483 1.00 0.00 O ATOM 5 CB MET A 1 6.288 11.068 -1.650 1.00 0.00 C ATOM 6 CG MET A 1 4.760 11.124 -1.701 1.00 0.00 C ATOM 7 SD MET A 1 3.924 10.228 -0.374 1.00 0.00 S ATOM 8 CE MET A 1 2.274 10.171 -1.114 1.00 0.00 C ATOM 0 H1 MET A 1 8.619 10.362 -1.334 1.00 0.00 H new ATOM 0 H2 MET A 1 8.616 8.729 -1.799 1.00 0.00 H new ATOM 0 H3 MET A 1 8.688 9.948 -2.979 1.00 0.00 H new ATOM 0 HA MET A 1 6.433 8.925 -1.466 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.626 11.259 -0.631 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.703 11.857 -2.277 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.448 12.168 -1.669 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.427 10.721 -2.658 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.711 9.342 -0.685 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.752 11.106 -0.912 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.363 10.030 -2.191 1.00 0.00 H new ATOM 20 N LEU A 2 5.278 8.663 -3.709 1.00 0.00 N ATOM 21 CA LEU A 2 4.692 8.403 -5.013 1.00 0.00 C ATOM 22 C LEU A 2 3.172 8.396 -4.912 1.00 0.00 C ATOM 23 O LEU A 2 2.618 8.067 -3.866 1.00 0.00 O ATOM 24 CB LEU A 2 5.185 7.048 -5.526 1.00 0.00 C ATOM 25 CG LEU A 2 6.288 7.179 -6.571 1.00 0.00 C ATOM 26 CD1 LEU A 2 6.732 5.782 -6.989 1.00 0.00 C ATOM 27 CD2 LEU A 2 5.794 7.918 -7.811 1.00 0.00 C ATOM 0 H LEU A 2 4.796 8.199 -2.939 1.00 0.00 H new ATOM 0 HA LEU A 2 4.993 9.188 -5.707 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.554 6.459 -4.686 1.00 0.00 H new ATOM 0 HB3 LEU A 2 4.346 6.500 -5.956 1.00 0.00 H new ATOM 0 HG LEU A 2 7.111 7.743 -6.133 1.00 0.00 H new ATOM 0 HD11 LEU A 2 7.521 5.860 -7.737 1.00 0.00 H new ATOM 0 HD12 LEU A 2 7.108 5.244 -6.119 1.00 0.00 H new ATOM 0 HD13 LEU A 2 5.884 5.242 -7.411 1.00 0.00 H new ATOM 0 HD21 LEU A 2 6.604 7.994 -8.536 1.00 0.00 H new ATOM 0 HD22 LEU A 2 4.962 7.371 -8.253 1.00 0.00 H new ATOM 0 HD23 LEU A 2 5.463 8.918 -7.531 1.00 0.00 H new ATOM 39 N ILE A 3 2.495 8.756 -6.008 1.00 0.00 N ATOM 40 CA ILE A 3 1.043 8.732 -6.082 1.00 0.00 C ATOM 41 C ILE A 3 0.654 8.019 -7.375 1.00 0.00 C ATOM 42 O ILE A 3 1.351 8.142 -8.382 1.00 0.00 O ATOM 43 CB ILE A 3 0.469 10.157 -6.009 1.00 0.00 C ATOM 44 CG1 ILE A 3 0.780 10.828 -4.668 1.00 0.00 C ATOM 45 CG2 ILE A 3 -1.058 10.124 -6.133 1.00 0.00 C ATOM 46 CD1 ILE A 3 2.133 11.529 -4.671 1.00 0.00 C ATOM 0 H ILE A 3 2.946 9.072 -6.867 1.00 0.00 H new ATOM 0 HA ILE A 3 0.623 8.192 -5.233 1.00 0.00 H new ATOM 0 HB ILE A 3 0.928 10.714 -6.826 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -0.001 11.552 -4.437 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.764 10.078 -3.877 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.449 11.140 -6.080 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.336 9.678 -7.088 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.476 9.531 -5.320 1.00 0.00 H new ATOM 0 HD11 ILE A 3 2.307 11.989 -3.698 1.00 0.00 H new ATOM 0 HD12 ILE A 3 2.919 10.802 -4.874 1.00 0.00 H new ATOM 0 HD13 ILE A 3 2.142 12.299 -5.443 1.00 0.00 H new ATOM 58 N LEU A 4 -0.455 7.276 -7.343 1.00 0.00 N ATOM 59 CA LEU A 4 -0.897 6.429 -8.446 1.00 0.00 C ATOM 60 C LEU A 4 -2.421 6.384 -8.506 1.00 0.00 C ATOM 61 O LEU A 4 -3.089 6.781 -7.552 1.00 0.00 O ATOM 62 CB LEU A 4 -0.410 4.998 -8.213 1.00 0.00 C ATOM 63 CG LEU A 4 1.111 4.838 -8.193 1.00 0.00 C ATOM 64 CD1 LEU A 4 1.403 3.393 -7.798 1.00 0.00 C ATOM 65 CD2 LEU A 4 1.714 5.113 -9.568 1.00 0.00 C ATOM 0 H LEU A 4 -1.078 7.248 -6.536 1.00 0.00 H new ATOM 0 HA LEU A 4 -0.495 6.839 -9.372 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -0.812 4.641 -7.265 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.819 4.357 -8.994 1.00 0.00 H new ATOM 0 HG LEU A 4 1.548 5.548 -7.491 1.00 0.00 H new ATOM 0 HD11 LEU A 4 2.481 3.234 -7.771 1.00 0.00 H new ATOM 0 HD12 LEU A 4 0.982 3.193 -6.813 1.00 0.00 H new ATOM 0 HD13 LEU A 4 0.955 2.719 -8.528 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.796 4.991 -9.522 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.301 4.412 -10.293 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.476 6.132 -9.872 1.00 0.00 H new ATOM 77 N THR A 5 -2.974 5.896 -9.621 1.00 0.00 N ATOM 78 CA THR A 5 -4.411 5.678 -9.721 1.00 0.00 C ATOM 79 C THR A 5 -4.679 4.284 -10.281 1.00 0.00 C ATOM 80 O THR A 5 -4.666 4.061 -11.489 1.00 0.00 O ATOM 81 CB THR A 5 -5.101 6.764 -10.551 1.00 0.00 C ATOM 82 OG1 THR A 5 -4.434 7.997 -10.395 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.533 6.927 -10.059 1.00 0.00 C ATOM 0 H THR A 5 -2.448 5.647 -10.459 1.00 0.00 H new ATOM 0 HA THR A 5 -4.840 5.743 -8.721 1.00 0.00 H new ATOM 0 HB THR A 5 -5.083 6.471 -11.601 1.00 0.00 H new ATOM 0 HG1 THR A 5 -3.848 8.151 -11.165 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.033 7.699 -10.644 1.00 0.00 H new ATOM 0 HG22 THR A 5 -7.066 5.983 -10.172 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.526 7.216 -9.008 1.00 0.00 H new ATOM 91 N ARG A 6 -4.924 3.353 -9.357 1.00 0.00 N ATOM 92 CA ARG A 6 -5.186 1.940 -9.607 1.00 0.00 C ATOM 93 C ARG A 6 -6.700 1.703 -9.556 1.00 0.00 C ATOM 94 O ARG A 6 -7.414 2.553 -9.032 1.00 0.00 O ATOM 95 CB ARG A 6 -4.486 1.199 -8.462 1.00 0.00 C ATOM 96 CG ARG A 6 -4.372 -0.318 -8.593 1.00 0.00 C ATOM 97 CD ARG A 6 -3.179 -0.737 -9.456 1.00 0.00 C ATOM 98 NE ARG A 6 -3.447 -0.588 -10.886 1.00 0.00 N ATOM 99 CZ ARG A 6 -2.616 -0.987 -11.848 1.00 0.00 C ATOM 100 NH1 ARG A 6 -1.457 -1.571 -11.553 1.00 0.00 N ATOM 101 NH2 ARG A 6 -2.950 -0.799 -13.121 1.00 0.00 N ATOM 0 H ARG A 6 -4.945 3.580 -8.363 1.00 0.00 H new ATOM 0 HA ARG A 6 -4.827 1.602 -10.579 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -3.481 1.608 -8.357 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -5.019 1.421 -7.537 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -4.274 -0.760 -7.601 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -5.290 -0.713 -9.029 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -2.310 -0.136 -9.187 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -2.926 -1.776 -9.243 1.00 0.00 H new ATOM 0 HE ARG A 6 -4.326 -0.151 -11.164 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -1.194 -1.719 -10.579 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.832 -1.871 -12.301 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -3.837 -0.352 -13.355 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.320 -1.101 -13.864 1.00 0.00 H new ATOM 115 N LYS A 7 -7.218 0.586 -10.079 1.00 0.00 N ATOM 116 CA LYS A 7 -8.629 0.241 -9.884 1.00 0.00 C ATOM 117 C LYS A 7 -8.763 -1.172 -9.339 1.00 0.00 C ATOM 118 O LYS A 7 -7.797 -1.932 -9.306 1.00 0.00 O ATOM 119 CB LYS A 7 -9.480 0.415 -11.147 1.00 0.00 C ATOM 120 CG LYS A 7 -8.983 -0.410 -12.331 1.00 0.00 C ATOM 121 CD LYS A 7 -10.020 -0.330 -13.453 1.00 0.00 C ATOM 122 CE LYS A 7 -9.670 -1.270 -14.604 1.00 0.00 C ATOM 123 NZ LYS A 7 -8.349 -0.958 -15.178 1.00 0.00 N ATOM 0 H LYS A 7 -6.688 -0.087 -10.634 1.00 0.00 H new ATOM 0 HA LYS A 7 -9.019 0.950 -9.153 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -10.509 0.134 -10.924 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.491 1.468 -11.427 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.021 -0.032 -12.678 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -8.829 -1.447 -12.031 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -11.004 -0.585 -13.060 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -10.080 0.694 -13.823 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -9.678 -2.300 -14.248 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -10.431 -1.195 -15.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -8.313 -1.286 -16.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -8.192 0.070 -15.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -7.609 -1.437 -14.626 1.00 0.00 H new ATOM 137 N VAL A 8 -9.975 -1.519 -8.903 1.00 0.00 N ATOM 138 CA VAL A 8 -10.204 -2.755 -8.175 1.00 0.00 C ATOM 139 C VAL A 8 -9.766 -3.977 -8.973 1.00 0.00 C ATOM 140 O VAL A 8 -10.070 -4.114 -10.157 1.00 0.00 O ATOM 141 CB VAL A 8 -11.652 -2.857 -7.702 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.041 -1.577 -6.966 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.672 -3.073 -8.815 1.00 0.00 C ATOM 0 H VAL A 8 -10.813 -0.955 -9.045 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.577 -2.733 -7.284 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.681 -3.737 -7.059 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.075 -1.651 -6.629 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.387 -1.440 -6.105 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.939 -0.725 -7.638 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.672 -3.133 -8.385 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -12.628 -2.239 -9.516 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.446 -4.001 -9.340 1.00 0.00 H new ATOM 153 N GLY A 9 -9.041 -4.875 -8.298 1.00 0.00 N ATOM 154 CA GLY A 9 -8.578 -6.123 -8.882 1.00 0.00 C ATOM 155 C GLY A 9 -7.147 -6.027 -9.415 1.00 0.00 C ATOM 156 O GLY A 9 -6.616 -7.016 -9.922 1.00 0.00 O ATOM 0 H GLY A 9 -8.761 -4.749 -7.325 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.630 -6.912 -8.132 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -9.246 -6.410 -9.694 1.00 0.00 H new ATOM 160 N GLU A 10 -6.517 -4.853 -9.310 1.00 0.00 N ATOM 161 CA GLU A 10 -5.155 -4.640 -9.785 1.00 0.00 C ATOM 162 C GLU A 10 -4.185 -4.559 -8.602 1.00 0.00 C ATOM 163 O GLU A 10 -4.607 -4.661 -7.449 1.00 0.00 O ATOM 164 CB GLU A 10 -5.106 -3.360 -10.627 1.00 0.00 C ATOM 165 CG GLU A 10 -6.073 -3.420 -11.810 1.00 0.00 C ATOM 166 CD GLU A 10 -6.052 -2.125 -12.620 1.00 0.00 C ATOM 167 OE1 GLU A 10 -5.863 -1.050 -12.008 1.00 0.00 O ATOM 168 OE2 GLU A 10 -6.229 -2.220 -13.856 1.00 0.00 O ATOM 0 H GLU A 10 -6.942 -4.025 -8.892 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.850 -5.481 -10.407 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.352 -2.503 -10.000 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.092 -3.205 -10.994 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.808 -4.258 -12.455 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.083 -3.606 -11.446 1.00 0.00 H new ATOM 175 N SER A 11 -2.887 -4.377 -8.873 1.00 0.00 N ATOM 176 CA SER A 11 -1.859 -4.452 -7.839 1.00 0.00 C ATOM 177 C SER A 11 -0.736 -3.432 -8.035 1.00 0.00 C ATOM 178 O SER A 11 -0.627 -2.791 -9.083 1.00 0.00 O ATOM 179 CB SER A 11 -1.258 -5.860 -7.830 1.00 0.00 C ATOM 180 OG SER A 11 -2.253 -6.823 -7.549 1.00 0.00 O ATOM 0 H SER A 11 -2.527 -4.176 -9.806 1.00 0.00 H new ATOM 0 HA SER A 11 -2.342 -4.222 -6.889 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.801 -6.073 -8.797 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.466 -5.919 -7.083 1.00 0.00 H new ATOM 0 HG SER A 11 -1.852 -7.717 -7.549 1.00 0.00 H new ATOM 186 N ILE A 12 0.096 -3.296 -6.999 1.00 0.00 N ATOM 187 CA ILE A 12 1.246 -2.399 -6.933 1.00 0.00 C ATOM 188 C ILE A 12 2.345 -3.143 -6.161 1.00 0.00 C ATOM 189 O ILE A 12 2.054 -4.154 -5.520 1.00 0.00 O ATOM 190 CB ILE A 12 0.842 -1.088 -6.224 1.00 0.00 C ATOM 191 CG1 ILE A 12 -0.404 -0.487 -6.894 1.00 0.00 C ATOM 192 CG2 ILE A 12 1.981 -0.060 -6.251 1.00 0.00 C ATOM 193 CD1 ILE A 12 -0.934 0.739 -6.142 1.00 0.00 C ATOM 0 H ILE A 12 -0.023 -3.837 -6.142 1.00 0.00 H new ATOM 0 HA ILE A 12 1.607 -2.128 -7.925 1.00 0.00 H new ATOM 0 HB ILE A 12 0.622 -1.329 -5.184 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -0.163 -0.206 -7.919 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.186 -1.244 -6.947 1.00 0.00 H new ATOM 0 HG21 ILE A 12 1.662 0.850 -5.743 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.854 -0.471 -5.744 1.00 0.00 H new ATOM 0 HG23 ILE A 12 2.237 0.172 -7.285 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -1.814 1.127 -6.654 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.202 0.454 -5.125 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -0.163 1.509 -6.112 1.00 0.00 H new ATOM 205 N ASN A 13 3.599 -2.681 -6.196 1.00 0.00 N ATOM 206 CA ASN A 13 4.699 -3.394 -5.559 1.00 0.00 C ATOM 207 C ASN A 13 5.671 -2.445 -4.862 1.00 0.00 C ATOM 208 O ASN A 13 5.770 -1.273 -5.226 1.00 0.00 O ATOM 209 CB ASN A 13 5.445 -4.217 -6.613 1.00 0.00 C ATOM 210 CG ASN A 13 4.578 -5.331 -7.183 1.00 0.00 C ATOM 211 OD1 ASN A 13 3.775 -5.110 -8.083 1.00 0.00 O ATOM 212 ND2 ASN A 13 4.739 -6.543 -6.657 1.00 0.00 N ATOM 0 H ASN A 13 3.873 -1.815 -6.660 1.00 0.00 H new ATOM 0 HA ASN A 13 4.278 -4.048 -4.796 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.771 -3.562 -7.421 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.343 -4.647 -6.169 1.00 0.00 H new ATOM 0 HD21 ASN A 13 4.184 -7.326 -7.002 1.00 0.00 H new ATOM 0 HD22 ASN A 13 5.417 -6.688 -5.909 1.00 0.00 H new ATOM 219 N ILE A 14 6.381 -2.969 -3.859 1.00 0.00 N ATOM 220 CA ILE A 14 7.394 -2.235 -3.106 1.00 0.00 C ATOM 221 C ILE A 14 8.580 -3.166 -2.829 1.00 0.00 C ATOM 222 O ILE A 14 8.402 -4.375 -2.665 1.00 0.00 O ATOM 223 CB ILE A 14 6.805 -1.697 -1.790 1.00 0.00 C ATOM 224 CG1 ILE A 14 5.545 -0.862 -2.062 1.00 0.00 C ATOM 225 CG2 ILE A 14 7.850 -0.848 -1.051 1.00 0.00 C ATOM 226 CD1 ILE A 14 4.924 -0.311 -0.778 1.00 0.00 C ATOM 0 H ILE A 14 6.264 -3.932 -3.544 1.00 0.00 H new ATOM 0 HA ILE A 14 7.734 -1.380 -3.691 1.00 0.00 H new ATOM 0 HB ILE A 14 6.529 -2.546 -1.164 1.00 0.00 H new ATOM 0 HG12 ILE A 14 5.797 -0.034 -2.725 1.00 0.00 H new ATOM 0 HG13 ILE A 14 4.811 -1.476 -2.583 1.00 0.00 H new ATOM 0 HG21 ILE A 14 7.422 -0.473 -0.121 1.00 0.00 H new ATOM 0 HG22 ILE A 14 8.724 -1.460 -0.827 1.00 0.00 H new ATOM 0 HG23 ILE A 14 8.147 -0.008 -1.679 1.00 0.00 H new ATOM 0 HD11 ILE A 14 4.036 0.272 -1.024 1.00 0.00 H new ATOM 0 HD12 ILE A 14 4.645 -1.138 -0.125 1.00 0.00 H new ATOM 0 HD13 ILE A 14 5.647 0.326 -0.269 1.00 0.00 H new ATOM 238 N GLY A 15 9.791 -2.603 -2.770 1.00 0.00 N ATOM 239 CA GLY A 15 11.005 -3.370 -2.552 1.00 0.00 C ATOM 240 C GLY A 15 11.097 -4.513 -3.559 1.00 0.00 C ATOM 241 O GLY A 15 10.782 -4.340 -4.735 1.00 0.00 O ATOM 0 H GLY A 15 9.949 -1.601 -2.873 1.00 0.00 H new ATOM 0 HA2 GLY A 15 11.875 -2.721 -2.648 1.00 0.00 H new ATOM 0 HA3 GLY A 15 11.014 -3.768 -1.537 1.00 0.00 H new ATOM 245 N ASP A 16 11.530 -5.681 -3.088 1.00 0.00 N ATOM 246 CA ASP A 16 11.620 -6.882 -3.903 1.00 0.00 C ATOM 247 C ASP A 16 10.937 -8.048 -3.188 1.00 0.00 C ATOM 248 O ASP A 16 11.064 -9.194 -3.616 1.00 0.00 O ATOM 249 CB ASP A 16 13.085 -7.197 -4.202 1.00 0.00 C ATOM 250 CG ASP A 16 13.750 -6.078 -4.999 1.00 0.00 C ATOM 251 OD1 ASP A 16 13.612 -6.090 -6.243 1.00 0.00 O ATOM 252 OD2 ASP A 16 14.395 -5.216 -4.358 1.00 0.00 O ATOM 0 H ASP A 16 11.829 -5.817 -2.123 1.00 0.00 H new ATOM 0 HA ASP A 16 11.107 -6.719 -4.851 1.00 0.00 H new ATOM 0 HB2 ASP A 16 13.624 -7.347 -3.266 1.00 0.00 H new ATOM 0 HB3 ASP A 16 13.150 -8.131 -4.761 1.00 0.00 H new ATOM 257 N ASP A 17 10.212 -7.760 -2.097 1.00 0.00 N ATOM 258 CA ASP A 17 9.543 -8.771 -1.290 1.00 0.00 C ATOM 259 C ASP A 17 8.168 -8.296 -0.815 1.00 0.00 C ATOM 260 O ASP A 17 7.569 -8.947 0.040 1.00 0.00 O ATOM 261 CB ASP A 17 10.413 -9.150 -0.087 1.00 0.00 C ATOM 262 CG ASP A 17 11.794 -9.644 -0.507 1.00 0.00 C ATOM 263 OD1 ASP A 17 11.905 -10.848 -0.836 1.00 0.00 O ATOM 264 OD2 ASP A 17 12.733 -8.815 -0.495 1.00 0.00 O ATOM 0 H ASP A 17 10.077 -6.809 -1.754 1.00 0.00 H new ATOM 0 HA ASP A 17 9.394 -9.649 -1.918 1.00 0.00 H new ATOM 0 HB2 ASP A 17 10.522 -8.285 0.567 1.00 0.00 H new ATOM 0 HB3 ASP A 17 9.912 -9.926 0.491 1.00 0.00 H new ATOM 269 N ILE A 18 7.649 -7.178 -1.342 1.00 0.00 N ATOM 270 CA ILE A 18 6.350 -6.671 -0.919 1.00 0.00 C ATOM 271 C ILE A 18 5.467 -6.393 -2.131 1.00 0.00 C ATOM 272 O ILE A 18 5.941 -5.978 -3.188 1.00 0.00 O ATOM 273 CB ILE A 18 6.512 -5.402 -0.064 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.422 -5.624 1.151 1.00 0.00 C ATOM 275 CG2 ILE A 18 5.141 -4.941 0.437 1.00 0.00 C ATOM 276 CD1 ILE A 18 8.876 -5.278 0.819 1.00 0.00 C ATOM 0 H ILE A 18 8.111 -6.616 -2.057 1.00 0.00 H new ATOM 0 HA ILE A 18 5.867 -7.433 -0.307 1.00 0.00 H new ATOM 0 HB ILE A 18 6.973 -4.647 -0.701 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.079 -5.009 1.983 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.356 -6.663 1.474 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.258 -4.042 1.042 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.497 -4.723 -0.415 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.691 -5.729 1.041 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.499 -5.444 1.698 1.00 0.00 H new ATOM 0 HD12 ILE A 18 9.223 -5.911 0.003 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.942 -4.232 0.520 1.00 0.00 H new ATOM 288 N THR A 19 4.163 -6.624 -1.958 1.00 0.00 N ATOM 289 CA THR A 19 3.157 -6.391 -2.976 1.00 0.00 C ATOM 290 C THR A 19 1.913 -5.812 -2.306 1.00 0.00 C ATOM 291 O THR A 19 1.698 -6.008 -1.112 1.00 0.00 O ATOM 292 CB THR A 19 2.841 -7.712 -3.688 1.00 0.00 C ATOM 293 OG1 THR A 19 4.025 -8.261 -4.222 1.00 0.00 O ATOM 294 CG2 THR A 19 1.847 -7.528 -4.833 1.00 0.00 C ATOM 0 H THR A 19 3.778 -6.986 -1.085 1.00 0.00 H new ATOM 0 HA THR A 19 3.517 -5.682 -3.722 1.00 0.00 H new ATOM 0 HB THR A 19 2.399 -8.375 -2.945 1.00 0.00 H new ATOM 0 HG1 THR A 19 3.819 -9.105 -4.675 1.00 0.00 H new ATOM 0 HG21 THR A 19 1.655 -8.491 -5.306 1.00 0.00 H new ATOM 0 HG22 THR A 19 0.913 -7.123 -4.443 1.00 0.00 H new ATOM 0 HG23 THR A 19 2.262 -6.839 -5.568 1.00 0.00 H new ATOM 302 N ILE A 20 1.095 -5.099 -3.082 1.00 0.00 N ATOM 303 CA ILE A 20 -0.120 -4.454 -2.610 1.00 0.00 C ATOM 304 C ILE A 20 -1.224 -4.749 -3.621 1.00 0.00 C ATOM 305 O ILE A 20 -0.949 -4.892 -4.812 1.00 0.00 O ATOM 306 CB ILE A 20 0.118 -2.939 -2.511 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.272 -2.585 -1.562 1.00 0.00 C ATOM 308 CG2 ILE A 20 -1.155 -2.207 -2.072 1.00 0.00 C ATOM 309 CD1 ILE A 20 0.969 -2.909 -0.097 1.00 0.00 C ATOM 0 H ILE A 20 1.267 -4.954 -4.077 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.405 -4.826 -1.626 1.00 0.00 H new ATOM 0 HB ILE A 20 0.397 -2.608 -3.512 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.166 -3.127 -1.870 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.496 -1.522 -1.654 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.957 -1.137 -2.011 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.948 -2.388 -2.798 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -1.467 -2.575 -1.095 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.824 -2.635 0.521 1.00 0.00 H new ATOM 0 HD12 ILE A 20 0.093 -2.347 0.226 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.774 -3.976 0.007 1.00 0.00 H new ATOM 321 N THR A 21 -2.471 -4.841 -3.156 1.00 0.00 N ATOM 322 CA THR A 21 -3.602 -5.137 -4.026 1.00 0.00 C ATOM 323 C THR A 21 -4.830 -4.364 -3.558 1.00 0.00 C ATOM 324 O THR A 21 -5.004 -4.126 -2.364 1.00 0.00 O ATOM 325 CB THR A 21 -3.889 -6.644 -3.984 1.00 0.00 C ATOM 326 OG1 THR A 21 -2.707 -7.377 -4.207 1.00 0.00 O ATOM 327 CG2 THR A 21 -4.896 -7.049 -5.059 1.00 0.00 C ATOM 0 H THR A 21 -2.720 -4.713 -2.175 1.00 0.00 H new ATOM 0 HA THR A 21 -3.365 -4.839 -5.047 1.00 0.00 H new ATOM 0 HB THR A 21 -4.296 -6.862 -2.997 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.906 -8.336 -4.176 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.077 -8.122 -5.002 1.00 0.00 H new ATOM 0 HG22 THR A 21 -5.832 -6.514 -4.900 1.00 0.00 H new ATOM 0 HG23 THR A 21 -4.498 -6.800 -6.043 1.00 0.00 H new ATOM 335 N ILE A 22 -5.682 -3.968 -4.504 1.00 0.00 N ATOM 336 CA ILE A 22 -6.918 -3.246 -4.231 1.00 0.00 C ATOM 337 C ILE A 22 -8.082 -4.209 -4.456 1.00 0.00 C ATOM 338 O ILE A 22 -8.584 -4.341 -5.569 1.00 0.00 O ATOM 339 CB ILE A 22 -6.961 -1.964 -5.082 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.330 -1.278 -5.105 1.00 0.00 C ATOM 341 CG2 ILE A 22 -6.540 -2.219 -6.534 1.00 0.00 C ATOM 342 CD1 ILE A 22 -8.894 -1.077 -3.705 1.00 0.00 C ATOM 0 H ILE A 22 -5.527 -4.144 -5.497 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.986 -2.905 -3.198 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.250 -1.301 -4.590 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.243 -0.312 -5.602 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.025 -1.877 -5.693 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.586 -1.286 -7.095 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -5.521 -2.605 -6.555 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.213 -2.948 -6.985 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -9.866 -0.587 -3.771 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -9.008 -2.045 -3.216 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.213 -0.455 -3.124 1.00 0.00 H new ATOM 354 N LEU A 23 -8.516 -4.891 -3.391 1.00 0.00 N ATOM 355 CA LEU A 23 -9.516 -5.943 -3.509 1.00 0.00 C ATOM 356 C LEU A 23 -10.870 -5.397 -3.965 1.00 0.00 C ATOM 357 O LEU A 23 -11.650 -6.131 -4.570 1.00 0.00 O ATOM 358 CB LEU A 23 -9.677 -6.704 -2.183 1.00 0.00 C ATOM 359 CG LEU A 23 -8.362 -7.103 -1.509 1.00 0.00 C ATOM 360 CD1 LEU A 23 -8.671 -8.066 -0.362 1.00 0.00 C ATOM 361 CD2 LEU A 23 -7.390 -7.801 -2.452 1.00 0.00 C ATOM 0 H LEU A 23 -8.187 -4.729 -2.439 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.157 -6.634 -4.272 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.250 -6.085 -1.492 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.263 -7.605 -2.366 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.891 -6.182 -1.165 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.742 -8.359 0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.323 -7.574 0.360 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.169 -8.952 -0.755 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.479 -8.057 -1.911 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.849 -8.710 -2.840 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.146 -7.136 -3.280 1.00 0.00 H new ATOM 373 N GLY A 24 -11.163 -4.119 -3.686 1.00 0.00 N ATOM 374 CA GLY A 24 -12.393 -3.496 -4.160 1.00 0.00 C ATOM 375 C GLY A 24 -12.776 -2.253 -3.358 1.00 0.00 C ATOM 376 O GLY A 24 -12.012 -1.803 -2.507 1.00 0.00 O ATOM 0 H GLY A 24 -10.563 -3.504 -3.136 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.276 -3.224 -5.209 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.205 -4.221 -4.108 1.00 0.00 H new ATOM 380 N VAL A 25 -13.964 -1.697 -3.631 1.00 0.00 N ATOM 381 CA VAL A 25 -14.463 -0.518 -2.929 1.00 0.00 C ATOM 382 C VAL A 25 -15.940 -0.672 -2.586 1.00 0.00 C ATOM 383 O VAL A 25 -16.637 -1.507 -3.162 1.00 0.00 O ATOM 384 CB VAL A 25 -14.258 0.754 -3.768 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.822 0.862 -4.282 1.00 0.00 C ATOM 386 CG2 VAL A 25 -15.231 0.813 -4.945 1.00 0.00 C ATOM 0 H VAL A 25 -14.601 -2.054 -4.343 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.893 -0.424 -2.005 1.00 0.00 H new ATOM 0 HB VAL A 25 -14.457 1.599 -3.108 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.714 1.773 -4.871 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.134 0.892 -3.437 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.593 -0.002 -4.905 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -15.057 1.725 -5.516 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -15.076 -0.053 -5.589 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -16.255 0.809 -4.571 1.00 0.00 H new ATOM 396 N SER A 26 -16.416 0.147 -1.640 1.00 0.00 N ATOM 397 CA SER A 26 -17.815 0.197 -1.238 1.00 0.00 C ATOM 398 C SER A 26 -18.135 1.609 -0.760 1.00 0.00 C ATOM 399 O SER A 26 -18.000 1.911 0.426 1.00 0.00 O ATOM 400 CB SER A 26 -18.085 -0.810 -0.117 1.00 0.00 C ATOM 401 OG SER A 26 -17.949 -2.135 -0.590 1.00 0.00 O ATOM 0 H SER A 26 -15.825 0.802 -1.128 1.00 0.00 H new ATOM 0 HA SER A 26 -18.448 -0.061 -2.087 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.391 -0.640 0.706 1.00 0.00 H new ATOM 0 HB3 SER A 26 -19.090 -0.661 0.278 1.00 0.00 H new ATOM 0 HG SER A 26 -18.124 -2.763 0.142 1.00 0.00 H new ATOM 407 N GLY A 27 -18.562 2.482 -1.678 1.00 0.00 N ATOM 408 CA GLY A 27 -18.844 3.870 -1.342 1.00 0.00 C ATOM 409 C GLY A 27 -17.538 4.636 -1.172 1.00 0.00 C ATOM 410 O GLY A 27 -16.903 4.995 -2.163 1.00 0.00 O ATOM 0 H GLY A 27 -18.718 2.246 -2.658 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -19.446 4.329 -2.127 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -19.428 3.920 -0.423 1.00 0.00 H new ATOM 414 N GLN A 28 -17.131 4.888 0.079 1.00 0.00 N ATOM 415 CA GLN A 28 -15.847 5.514 0.358 1.00 0.00 C ATOM 416 C GLN A 28 -14.877 4.476 0.885 1.00 0.00 C ATOM 417 O GLN A 28 -13.671 4.717 0.904 1.00 0.00 O ATOM 418 CB GLN A 28 -15.974 6.613 1.414 1.00 0.00 C ATOM 419 CG GLN A 28 -16.911 7.747 1.012 1.00 0.00 C ATOM 420 CD GLN A 28 -16.701 8.188 -0.432 1.00 0.00 C ATOM 421 OE1 GLN A 28 -15.471 8.552 -0.794 1.00 0.00 O flip ATOM 422 NE2 GLN A 28 -17.637 8.206 -1.227 1.00 0.00 N flip ATOM 0 H GLN A 28 -17.679 4.665 0.910 1.00 0.00 H new ATOM 0 HA GLN A 28 -15.489 5.951 -0.574 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -16.332 6.171 2.344 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -14.986 7.025 1.617 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -17.944 7.426 1.145 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -16.754 8.597 1.676 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -18.569 7.922 -0.924 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -17.483 8.505 -2.190 1.00 0.00 H new ATOM 431 N GLN A 29 -15.396 3.323 1.310 1.00 0.00 N ATOM 432 CA GLN A 29 -14.553 2.257 1.803 1.00 0.00 C ATOM 433 C GLN A 29 -13.763 1.686 0.630 1.00 0.00 C ATOM 434 O GLN A 29 -14.244 1.652 -0.500 1.00 0.00 O ATOM 435 CB GLN A 29 -15.396 1.178 2.477 1.00 0.00 C ATOM 436 CG GLN A 29 -16.063 1.706 3.749 1.00 0.00 C ATOM 437 CD GLN A 29 -15.060 1.905 4.879 1.00 0.00 C ATOM 438 OE1 GLN A 29 -14.149 1.105 5.069 1.00 0.00 O ATOM 439 NE2 GLN A 29 -15.218 2.984 5.640 1.00 0.00 N ATOM 0 H GLN A 29 -16.394 3.113 1.319 1.00 0.00 H new ATOM 0 HA GLN A 29 -13.861 2.642 2.552 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -16.159 0.824 1.784 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -14.767 0.322 2.722 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -16.558 2.653 3.533 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -16.836 1.008 4.069 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -15.986 3.630 5.456 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -14.571 3.166 6.408 1.00 0.00 H new ATOM 448 N VAL A 30 -12.546 1.239 0.918 1.00 0.00 N ATOM 449 CA VAL A 30 -11.609 0.725 -0.057 1.00 0.00 C ATOM 450 C VAL A 30 -10.918 -0.452 0.610 1.00 0.00 C ATOM 451 O VAL A 30 -10.125 -0.271 1.536 1.00 0.00 O ATOM 452 CB VAL A 30 -10.617 1.833 -0.443 1.00 0.00 C ATOM 453 CG1 VAL A 30 -9.574 1.354 -1.447 1.00 0.00 C ATOM 454 CG2 VAL A 30 -11.349 3.005 -1.092 1.00 0.00 C ATOM 0 H VAL A 30 -12.179 1.227 1.869 1.00 0.00 H new ATOM 0 HA VAL A 30 -12.093 0.402 -0.979 1.00 0.00 H new ATOM 0 HB VAL A 30 -10.126 2.131 0.483 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -8.897 2.174 -1.687 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -9.006 0.529 -1.016 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -10.072 1.016 -2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -10.630 3.780 -1.359 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -11.862 2.661 -1.990 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -12.078 3.412 -0.391 1.00 0.00 H new ATOM 464 N ARG A 31 -11.226 -1.660 0.141 1.00 0.00 N ATOM 465 CA ARG A 31 -10.660 -2.878 0.689 1.00 0.00 C ATOM 466 C ARG A 31 -9.323 -3.124 0.013 1.00 0.00 C ATOM 467 O ARG A 31 -9.250 -3.191 -1.213 1.00 0.00 O ATOM 468 CB ARG A 31 -11.633 -4.033 0.464 1.00 0.00 C ATOM 469 CG ARG A 31 -11.167 -5.267 1.235 1.00 0.00 C ATOM 470 CD ARG A 31 -12.211 -6.376 1.125 1.00 0.00 C ATOM 471 NE ARG A 31 -13.459 -5.996 1.797 1.00 0.00 N ATOM 472 CZ ARG A 31 -13.689 -6.149 3.106 1.00 0.00 C ATOM 473 NH1 ARG A 31 -12.770 -6.704 3.891 1.00 0.00 N ATOM 474 NH2 ARG A 31 -14.839 -5.744 3.631 1.00 0.00 N ATOM 0 H ARG A 31 -11.876 -1.815 -0.630 1.00 0.00 H new ATOM 0 HA ARG A 31 -10.497 -2.791 1.763 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -12.633 -3.746 0.791 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -11.699 -4.262 -0.600 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -10.212 -5.614 0.839 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -11.004 -5.012 2.282 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -12.410 -6.589 0.075 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -11.821 -7.292 1.568 1.00 0.00 H new ATOM 0 HE ARG A 31 -14.201 -5.588 1.228 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -11.883 -7.016 3.496 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -12.952 -6.817 4.888 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -15.548 -5.316 3.036 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -15.013 -5.861 4.629 1.00 0.00 H new ATOM 488 N ILE A 32 -8.269 -3.255 0.814 1.00 0.00 N ATOM 489 CA ILE A 32 -6.907 -3.322 0.314 1.00 0.00 C ATOM 490 C ILE A 32 -6.218 -4.541 0.908 1.00 0.00 C ATOM 491 O ILE A 32 -6.602 -5.012 1.977 1.00 0.00 O ATOM 492 CB ILE A 32 -6.151 -2.036 0.694 1.00 0.00 C ATOM 493 CG1 ILE A 32 -7.064 -0.808 0.572 1.00 0.00 C ATOM 494 CG2 ILE A 32 -4.907 -1.881 -0.189 1.00 0.00 C ATOM 495 CD1 ILE A 32 -6.320 0.519 0.709 1.00 0.00 C ATOM 0 H ILE A 32 -8.340 -3.317 1.830 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.914 -3.411 -0.772 1.00 0.00 H new ATOM 0 HB ILE A 32 -5.834 -2.112 1.734 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -7.569 -0.835 -0.394 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -7.838 -0.863 1.338 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.377 -0.969 0.086 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.250 -2.739 -0.046 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.208 -1.825 -1.235 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -7.026 1.344 0.613 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -5.838 0.567 1.685 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -5.565 0.595 -0.073 1.00 0.00 H new ATOM 507 N GLY A 33 -5.199 -5.044 0.218 1.00 0.00 N ATOM 508 CA GLY A 33 -4.422 -6.183 0.677 1.00 0.00 C ATOM 509 C GLY A 33 -2.940 -5.842 0.645 1.00 0.00 C ATOM 510 O GLY A 33 -2.508 -4.972 -0.115 1.00 0.00 O ATOM 0 H GLY A 33 -4.890 -4.669 -0.679 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.720 -6.454 1.690 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -4.619 -7.048 0.044 1.00 0.00 H new ATOM 514 N ILE A 34 -2.161 -6.540 1.475 1.00 0.00 N ATOM 515 CA ILE A 34 -0.735 -6.297 1.625 1.00 0.00 C ATOM 516 C ILE A 34 -0.044 -7.636 1.753 1.00 0.00 C ATOM 517 O ILE A 34 -0.467 -8.489 2.533 1.00 0.00 O ATOM 518 CB ILE A 34 -0.475 -5.459 2.884 1.00 0.00 C ATOM 519 CG1 ILE A 34 -1.299 -4.166 2.861 1.00 0.00 C ATOM 520 CG2 ILE A 34 1.024 -5.152 2.993 1.00 0.00 C ATOM 521 CD1 ILE A 34 -1.230 -3.457 4.210 1.00 0.00 C ATOM 0 H ILE A 34 -2.511 -7.295 2.064 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.354 -5.752 0.762 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.785 -6.029 3.760 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.926 -3.505 2.078 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -2.337 -4.395 2.618 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.209 -4.557 3.887 1.00 0.00 H new ATOM 0 HG22 ILE A 34 1.583 -6.086 3.056 1.00 0.00 H new ATOM 0 HG23 ILE A 34 1.346 -4.595 2.113 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.822 -2.542 4.171 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.626 -4.112 4.986 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.193 -3.209 4.438 1.00 0.00 H new ATOM 533 N ASN A 35 1.022 -7.830 0.980 1.00 0.00 N ATOM 534 CA ASN A 35 1.685 -9.114 0.906 1.00 0.00 C ATOM 535 C ASN A 35 3.184 -8.939 1.099 1.00 0.00 C ATOM 536 O ASN A 35 3.909 -8.577 0.174 1.00 0.00 O ATOM 537 CB ASN A 35 1.338 -9.755 -0.435 1.00 0.00 C ATOM 538 CG ASN A 35 1.796 -11.203 -0.524 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.548 -11.690 0.317 1.00 0.00 O ATOM 540 ND2 ASN A 35 1.333 -11.907 -1.552 1.00 0.00 N ATOM 0 H ASN A 35 1.441 -7.106 0.396 1.00 0.00 H new ATOM 0 HA ASN A 35 1.344 -9.776 1.702 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.260 -9.708 -0.588 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.799 -9.181 -1.239 1.00 0.00 H new ATOM 0 HD21 ASN A 35 1.600 -12.885 -1.662 1.00 0.00 H new ATOM 0 HD22 ASN A 35 0.710 -11.469 -2.231 1.00 0.00 H new ATOM 547 N ALA A 36 3.635 -9.204 2.322 1.00 0.00 N ATOM 548 CA ALA A 36 5.030 -9.145 2.704 1.00 0.00 C ATOM 549 C ALA A 36 5.314 -10.279 3.676 1.00 0.00 C ATOM 550 O ALA A 36 4.402 -10.751 4.358 1.00 0.00 O ATOM 551 CB ALA A 36 5.325 -7.808 3.384 1.00 0.00 C ATOM 0 H ALA A 36 3.019 -9.472 3.090 1.00 0.00 H new ATOM 0 HA ALA A 36 5.660 -9.240 1.819 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.376 -7.769 3.669 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.106 -6.993 2.694 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.704 -7.707 4.274 1.00 0.00 H new ATOM 557 N PRO A 37 6.573 -10.723 3.748 1.00 0.00 N ATOM 558 CA PRO A 37 6.967 -11.769 4.661 1.00 0.00 C ATOM 559 C PRO A 37 6.688 -11.340 6.096 1.00 0.00 C ATOM 560 O PRO A 37 6.642 -10.150 6.399 1.00 0.00 O ATOM 561 CB PRO A 37 8.461 -11.981 4.417 1.00 0.00 C ATOM 562 CG PRO A 37 8.935 -10.705 3.725 1.00 0.00 C ATOM 563 CD PRO A 37 7.699 -10.246 2.969 1.00 0.00 C ATOM 0 HA PRO A 37 6.412 -12.693 4.502 1.00 0.00 H new ATOM 0 HB2 PRO A 37 8.994 -12.143 5.354 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.638 -12.857 3.793 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.270 -9.957 4.444 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.771 -10.897 3.053 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.678 -9.161 2.872 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.681 -10.657 1.959 1.00 0.00 H new ATOM 571 N LYS A 38 6.503 -12.321 6.981 1.00 0.00 N ATOM 572 CA LYS A 38 6.313 -12.061 8.404 1.00 0.00 C ATOM 573 C LYS A 38 7.577 -11.418 8.991 1.00 0.00 C ATOM 574 O LYS A 38 7.621 -11.066 10.168 1.00 0.00 O ATOM 575 CB LYS A 38 5.981 -13.382 9.101 1.00 0.00 C ATOM 576 CG LYS A 38 4.795 -14.107 8.448 1.00 0.00 C ATOM 577 CD LYS A 38 3.446 -13.467 8.764 1.00 0.00 C ATOM 578 CE LYS A 38 2.345 -14.281 8.078 1.00 0.00 C ATOM 579 NZ LYS A 38 2.167 -15.601 8.711 1.00 0.00 N ATOM 0 H LYS A 38 6.481 -13.310 6.732 1.00 0.00 H new ATOM 0 HA LYS A 38 5.489 -11.364 8.558 1.00 0.00 H new ATOM 0 HB2 LYS A 38 6.856 -14.031 9.079 1.00 0.00 H new ATOM 0 HB3 LYS A 38 5.753 -13.189 10.149 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.938 -14.122 7.367 1.00 0.00 H new ATOM 0 HG3 LYS A 38 4.784 -15.144 8.782 1.00 0.00 H new ATOM 0 HD2 LYS A 38 3.282 -13.442 9.841 1.00 0.00 H new ATOM 0 HD3 LYS A 38 3.426 -12.435 8.415 1.00 0.00 H new ATOM 0 HE2 LYS A 38 1.406 -13.729 8.118 1.00 0.00 H new ATOM 0 HE3 LYS A 38 2.593 -14.413 7.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.266 -16.017 8.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.951 -16.227 8.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.159 -15.492 9.745 1.00 0.00 H new ATOM 593 N ASP A 39 8.599 -11.283 8.141 1.00 0.00 N ATOM 594 CA ASP A 39 9.892 -10.684 8.418 1.00 0.00 C ATOM 595 C ASP A 39 9.806 -9.166 8.607 1.00 0.00 C ATOM 596 O ASP A 39 10.760 -8.553 9.086 1.00 0.00 O ATOM 597 CB ASP A 39 10.800 -10.979 7.224 1.00 0.00 C ATOM 598 CG ASP A 39 12.277 -10.820 7.579 1.00 0.00 C ATOM 599 OD1 ASP A 39 12.730 -11.525 8.507 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.946 -9.996 6.918 1.00 0.00 O ATOM 0 H ASP A 39 8.532 -11.614 7.179 1.00 0.00 H new ATOM 0 HA ASP A 39 10.278 -11.105 9.346 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.618 -11.995 6.872 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.550 -10.307 6.403 1.00 0.00 H new ATOM 605 N VAL A 40 8.676 -8.557 8.232 1.00 0.00 N ATOM 606 CA VAL A 40 8.499 -7.109 8.317 1.00 0.00 C ATOM 607 C VAL A 40 7.182 -6.792 9.012 1.00 0.00 C ATOM 608 O VAL A 40 6.349 -7.676 9.200 1.00 0.00 O ATOM 609 CB VAL A 40 8.530 -6.468 6.919 1.00 0.00 C ATOM 610 CG1 VAL A 40 9.801 -6.866 6.170 1.00 0.00 C ATOM 611 CG2 VAL A 40 7.312 -6.873 6.094 1.00 0.00 C ATOM 0 H VAL A 40 7.865 -9.053 7.864 1.00 0.00 H new ATOM 0 HA VAL A 40 9.322 -6.693 8.898 1.00 0.00 H new ATOM 0 HB VAL A 40 8.515 -5.387 7.059 1.00 0.00 H new ATOM 0 HG11 VAL A 40 9.803 -6.402 5.184 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.674 -6.531 6.730 1.00 0.00 H new ATOM 0 HG13 VAL A 40 9.835 -7.950 6.061 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.365 -6.403 5.112 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.296 -7.957 5.977 1.00 0.00 H new ATOM 0 HG23 VAL A 40 6.404 -6.549 6.603 1.00 0.00 H new ATOM 621 N ALA A 41 6.997 -5.528 9.394 1.00 0.00 N ATOM 622 CA ALA A 41 5.802 -5.114 10.105 1.00 0.00 C ATOM 623 C ALA A 41 4.817 -4.430 9.164 1.00 0.00 C ATOM 624 O ALA A 41 5.216 -3.817 8.176 1.00 0.00 O ATOM 625 CB ALA A 41 6.203 -4.176 11.243 1.00 0.00 C ATOM 0 H ALA A 41 7.665 -4.777 9.219 1.00 0.00 H new ATOM 0 HA ALA A 41 5.305 -5.993 10.515 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.312 -3.859 11.784 1.00 0.00 H new ATOM 0 HB2 ALA A 41 6.875 -4.697 11.925 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.709 -3.302 10.833 1.00 0.00 H new ATOM 631 N VAL A 42 3.526 -4.539 9.477 1.00 0.00 N ATOM 632 CA VAL A 42 2.468 -3.851 8.747 1.00 0.00 C ATOM 633 C VAL A 42 1.248 -3.699 9.652 1.00 0.00 C ATOM 634 O VAL A 42 0.784 -4.676 10.243 1.00 0.00 O ATOM 635 CB VAL A 42 2.132 -4.612 7.455 1.00 0.00 C ATOM 636 CG1 VAL A 42 2.203 -6.124 7.633 1.00 0.00 C ATOM 637 CG2 VAL A 42 0.741 -4.257 6.934 1.00 0.00 C ATOM 0 H VAL A 42 3.185 -5.111 10.250 1.00 0.00 H new ATOM 0 HA VAL A 42 2.803 -2.855 8.457 1.00 0.00 H new ATOM 0 HB VAL A 42 2.888 -4.302 6.733 1.00 0.00 H new ATOM 0 HG11 VAL A 42 1.957 -6.613 6.691 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.211 -6.408 7.937 1.00 0.00 H new ATOM 0 HG13 VAL A 42 1.492 -6.434 8.399 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.541 -4.816 6.020 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -0.005 -4.513 7.686 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.693 -3.188 6.724 1.00 0.00 H new ATOM 647 N HIS A 43 0.732 -2.473 9.758 1.00 0.00 N ATOM 648 CA HIS A 43 -0.426 -2.169 10.593 1.00 0.00 C ATOM 649 C HIS A 43 -1.152 -0.941 10.048 1.00 0.00 C ATOM 650 O HIS A 43 -0.666 -0.292 9.123 1.00 0.00 O ATOM 651 CB HIS A 43 0.019 -1.873 12.032 1.00 0.00 C ATOM 652 CG HIS A 43 1.094 -2.776 12.568 1.00 0.00 C ATOM 653 ND1 HIS A 43 0.881 -3.945 13.303 1.00 0.00 N ATOM 654 CD2 HIS A 43 2.440 -2.577 12.421 1.00 0.00 C ATOM 655 CE1 HIS A 43 2.107 -4.419 13.583 1.00 0.00 C ATOM 656 NE2 HIS A 43 3.058 -3.621 13.070 1.00 0.00 N ATOM 0 H HIS A 43 1.108 -1.663 9.265 1.00 0.00 H new ATOM 0 HA HIS A 43 -1.091 -3.032 10.584 1.00 0.00 H new ATOM 0 HB2 HIS A 43 0.374 -0.844 12.081 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -0.851 -1.942 12.686 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -0.015 -4.352 13.570 1.00 0.00 H new ATOM 0 HD2 HIS A 43 2.921 -1.763 11.900 1.00 0.00 H new ATOM 0 HE1 HIS A 43 2.302 -5.320 14.145 1.00 0.00 H new ATOM 664 N ARG A 44 -2.316 -0.615 10.619 1.00 0.00 N ATOM 665 CA ARG A 44 -3.029 0.604 10.269 1.00 0.00 C ATOM 666 C ARG A 44 -2.298 1.767 10.923 1.00 0.00 C ATOM 667 O ARG A 44 -1.508 1.561 11.845 1.00 0.00 O ATOM 668 CB ARG A 44 -4.476 0.525 10.762 1.00 0.00 C ATOM 669 CG ARG A 44 -5.221 -0.610 10.054 1.00 0.00 C ATOM 670 CD ARG A 44 -6.684 -0.644 10.488 1.00 0.00 C ATOM 671 NE ARG A 44 -6.805 -0.898 11.930 1.00 0.00 N ATOM 672 CZ ARG A 44 -7.253 -0.012 12.824 1.00 0.00 C ATOM 673 NH1 ARG A 44 -7.640 1.205 12.463 1.00 0.00 N ATOM 674 NH2 ARG A 44 -7.320 -0.348 14.104 1.00 0.00 N ATOM 0 H ARG A 44 -2.780 -1.184 11.327 1.00 0.00 H new ATOM 0 HA ARG A 44 -3.056 0.740 9.188 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.491 0.362 11.840 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.982 1.472 10.576 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.159 -0.475 8.974 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.745 -1.564 10.284 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -7.161 0.305 10.242 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -7.212 -1.420 9.934 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.527 -1.817 12.273 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -7.599 1.483 11.483 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.978 1.862 13.166 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -7.030 -1.279 14.403 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -7.661 0.325 14.791 1.00 0.00 H new ATOM 688 N GLU A 45 -2.556 2.991 10.463 1.00 0.00 N ATOM 689 CA GLU A 45 -1.892 4.155 11.027 1.00 0.00 C ATOM 690 C GLU A 45 -2.221 4.285 12.515 1.00 0.00 C ATOM 691 O GLU A 45 -1.468 4.893 13.270 1.00 0.00 O ATOM 692 CB GLU A 45 -2.315 5.391 10.222 1.00 0.00 C ATOM 693 CG GLU A 45 -1.393 6.599 10.410 1.00 0.00 C ATOM 694 CD GLU A 45 -1.560 7.291 11.756 1.00 0.00 C ATOM 695 OE1 GLU A 45 -2.722 7.535 12.148 1.00 0.00 O ATOM 696 OE2 GLU A 45 -0.513 7.574 12.382 1.00 0.00 O ATOM 0 H GLU A 45 -3.213 3.196 9.710 1.00 0.00 H new ATOM 0 HA GLU A 45 -0.809 4.052 10.958 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.345 5.131 9.164 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.328 5.671 10.510 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -0.358 6.275 10.304 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.585 7.319 9.615 1.00 0.00 H new ATOM 703 N GLU A 46 -3.347 3.707 12.943 1.00 0.00 N ATOM 704 CA GLU A 46 -3.779 3.760 14.328 1.00 0.00 C ATOM 705 C GLU A 46 -2.904 2.880 15.221 1.00 0.00 C ATOM 706 O GLU A 46 -2.661 3.221 16.375 1.00 0.00 O ATOM 707 CB GLU A 46 -5.234 3.290 14.383 1.00 0.00 C ATOM 708 CG GLU A 46 -5.794 3.393 15.805 1.00 0.00 C ATOM 709 CD GLU A 46 -7.301 3.122 15.833 1.00 0.00 C ATOM 710 OE1 GLU A 46 -7.737 2.160 15.163 1.00 0.00 O ATOM 711 OE2 GLU A 46 -8.007 3.883 16.527 1.00 0.00 O ATOM 0 H GLU A 46 -3.980 3.190 12.332 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.689 4.781 14.699 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.840 3.892 13.706 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.299 2.258 14.037 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.283 2.680 16.452 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.594 4.387 16.205 1.00 0.00 H new ATOM 718 N ILE A 47 -2.429 1.745 14.697 1.00 0.00 N ATOM 719 CA ILE A 47 -1.639 0.796 15.473 1.00 0.00 C ATOM 720 C ILE A 47 -0.157 1.121 15.334 1.00 0.00 C ATOM 721 O ILE A 47 0.618 0.873 16.255 1.00 0.00 O ATOM 722 CB ILE A 47 -1.932 -0.630 14.980 1.00 0.00 C ATOM 723 CG1 ILE A 47 -3.219 -1.194 15.593 1.00 0.00 C ATOM 724 CG2 ILE A 47 -0.815 -1.599 15.380 1.00 0.00 C ATOM 725 CD1 ILE A 47 -4.444 -0.309 15.382 1.00 0.00 C ATOM 0 H ILE A 47 -2.583 1.464 13.729 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.907 0.867 16.527 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.021 -0.550 13.897 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.414 -2.176 15.163 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.067 -1.339 16.663 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.053 -2.599 15.016 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.127 -1.269 14.943 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.723 -1.620 16.466 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -5.314 -0.776 15.844 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -4.271 0.666 15.837 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -4.623 -0.185 14.314 1.00 0.00 H new ATOM 737 N TYR A 48 0.245 1.680 14.190 1.00 0.00 N ATOM 738 CA TYR A 48 1.641 1.980 13.919 1.00 0.00 C ATOM 739 C TYR A 48 2.254 2.865 15.000 1.00 0.00 C ATOM 740 O TYR A 48 3.456 2.797 15.244 1.00 0.00 O ATOM 741 CB TYR A 48 1.739 2.683 12.569 1.00 0.00 C ATOM 742 CG TYR A 48 3.155 3.038 12.194 1.00 0.00 C ATOM 743 CD1 TYR A 48 4.019 2.054 11.689 1.00 0.00 C ATOM 744 CD2 TYR A 48 3.605 4.353 12.362 1.00 0.00 C ATOM 745 CE1 TYR A 48 5.331 2.389 11.336 1.00 0.00 C ATOM 746 CE2 TYR A 48 4.916 4.699 12.005 1.00 0.00 C ATOM 747 CZ TYR A 48 5.786 3.715 11.492 1.00 0.00 C ATOM 748 OH TYR A 48 7.063 4.041 11.144 1.00 0.00 O ATOM 0 H TYR A 48 -0.390 1.934 13.433 1.00 0.00 H new ATOM 0 HA TYR A 48 2.197 1.042 13.908 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.315 2.039 11.798 1.00 0.00 H new ATOM 0 HB3 TYR A 48 1.136 3.591 12.593 1.00 0.00 H new ATOM 0 HD1 TYR A 48 3.671 1.038 11.573 1.00 0.00 H new ATOM 0 HD2 TYR A 48 2.941 5.102 12.767 1.00 0.00 H new ATOM 0 HE1 TYR A 48 5.995 1.633 10.944 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.259 5.716 12.123 1.00 0.00 H new ATOM 0 HH TYR A 48 7.215 4.994 11.313 1.00 0.00 H new ATOM 1211 N MET C 1 0.468 -12.222 4.645 1.00 0.00 N ATOM 1212 CA MET C 1 -0.620 -11.530 3.927 1.00 0.00 C ATOM 1213 C MET C 1 -1.544 -10.833 4.909 1.00 0.00 C ATOM 1214 O MET C 1 -1.811 -11.372 5.978 1.00 0.00 O ATOM 1215 CB MET C 1 -1.428 -12.530 3.097 1.00 0.00 C ATOM 1216 CG MET C 1 -2.520 -11.850 2.271 1.00 0.00 C ATOM 1217 SD MET C 1 -1.956 -10.605 1.090 1.00 0.00 S ATOM 1218 CE MET C 1 -3.572 -10.210 0.381 1.00 0.00 C ATOM 0 H1 MET C 1 0.583 -13.181 4.260 1.00 0.00 H new ATOM 0 H2 MET C 1 1.355 -11.692 4.525 1.00 0.00 H new ATOM 0 H3 MET C 1 0.234 -12.281 5.657 1.00 0.00 H new ATOM 0 HA MET C 1 -0.173 -10.788 3.266 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.757 -13.072 2.431 1.00 0.00 H new ATOM 0 HB3 MET C 1 -1.882 -13.266 3.760 1.00 0.00 H new ATOM 0 HG2 MET C 1 -3.068 -12.619 1.725 1.00 0.00 H new ATOM 0 HG3 MET C 1 -3.227 -11.380 2.955 1.00 0.00 H new ATOM 0 HE1 MET C 1 -3.441 -9.819 -0.628 1.00 0.00 H new ATOM 0 HE2 MET C 1 -4.183 -11.112 0.344 1.00 0.00 H new ATOM 0 HE3 MET C 1 -4.067 -9.461 0.999 1.00 0.00 H new ATOM 1230 N LEU C 2 -2.030 -9.643 4.559 1.00 0.00 N ATOM 1231 CA LEU C 2 -2.998 -8.927 5.368 1.00 0.00 C ATOM 1232 C LEU C 2 -4.027 -8.265 4.454 1.00 0.00 C ATOM 1233 O LEU C 2 -3.745 -8.001 3.286 1.00 0.00 O ATOM 1234 CB LEU C 2 -2.261 -7.875 6.203 1.00 0.00 C ATOM 1235 CG LEU C 2 -2.094 -8.259 7.669 1.00 0.00 C ATOM 1236 CD1 LEU C 2 -1.320 -7.157 8.383 1.00 0.00 C ATOM 1237 CD2 LEU C 2 -3.441 -8.426 8.368 1.00 0.00 C ATOM 0 H LEU C 2 -1.760 -9.154 3.706 1.00 0.00 H new ATOM 0 HA LEU C 2 -3.518 -9.613 6.037 1.00 0.00 H new ATOM 0 HB2 LEU C 2 -1.277 -7.704 5.768 1.00 0.00 H new ATOM 0 HB3 LEU C 2 -2.804 -6.932 6.144 1.00 0.00 H new ATOM 0 HG LEU C 2 -1.562 -9.210 7.708 1.00 0.00 H new ATOM 0 HD11 LEU C 2 -1.195 -7.422 9.433 1.00 0.00 H new ATOM 0 HD12 LEU C 2 -0.341 -7.041 7.919 1.00 0.00 H new ATOM 0 HD13 LEU C 2 -1.870 -6.219 8.308 1.00 0.00 H new ATOM 0 HD21 LEU C 2 -3.278 -8.700 9.411 1.00 0.00 H new ATOM 0 HD22 LEU C 2 -3.994 -7.488 8.321 1.00 0.00 H new ATOM 0 HD23 LEU C 2 -4.013 -9.210 7.872 1.00 0.00 H new ATOM 1249 N ILE C 3 -5.217 -8.000 4.993 1.00 0.00 N ATOM 1250 CA ILE C 3 -6.285 -7.314 4.283 1.00 0.00 C ATOM 1251 C ILE C 3 -6.906 -6.310 5.246 1.00 0.00 C ATOM 1252 O ILE C 3 -6.953 -6.554 6.453 1.00 0.00 O ATOM 1253 CB ILE C 3 -7.335 -8.306 3.759 1.00 0.00 C ATOM 1254 CG1 ILE C 3 -6.761 -9.266 2.706 1.00 0.00 C ATOM 1255 CG2 ILE C 3 -8.481 -7.557 3.076 1.00 0.00 C ATOM 1256 CD1 ILE C 3 -6.213 -10.537 3.342 1.00 0.00 C ATOM 0 H ILE C 3 -5.465 -8.261 5.947 1.00 0.00 H new ATOM 0 HA ILE C 3 -5.885 -6.800 3.409 1.00 0.00 H new ATOM 0 HB ILE C 3 -7.674 -8.868 4.630 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -7.538 -9.525 1.987 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -5.968 -8.765 2.151 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -9.217 -8.273 2.710 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -8.954 -6.885 3.792 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -8.090 -6.979 2.239 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -5.816 -11.191 2.565 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -5.418 -10.280 4.042 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -7.013 -11.051 3.875 1.00 0.00 H new ATOM 1268 N LEU C 4 -7.380 -5.183 4.713 1.00 0.00 N ATOM 1269 CA LEU C 4 -7.942 -4.090 5.492 1.00 0.00 C ATOM 1270 C LEU C 4 -9.082 -3.432 4.724 1.00 0.00 C ATOM 1271 O LEU C 4 -9.224 -3.657 3.522 1.00 0.00 O ATOM 1272 CB LEU C 4 -6.856 -3.037 5.723 1.00 0.00 C ATOM 1273 CG LEU C 4 -5.688 -3.505 6.594 1.00 0.00 C ATOM 1274 CD1 LEU C 4 -4.661 -2.377 6.603 1.00 0.00 C ATOM 1275 CD2 LEU C 4 -6.134 -3.785 8.025 1.00 0.00 C ATOM 0 H LEU C 4 -7.382 -5.006 3.709 1.00 0.00 H new ATOM 0 HA LEU C 4 -8.313 -4.483 6.439 1.00 0.00 H new ATOM 0 HB2 LEU C 4 -6.466 -2.719 4.756 1.00 0.00 H new ATOM 0 HB3 LEU C 4 -7.310 -2.162 6.187 1.00 0.00 H new ATOM 0 HG LEU C 4 -5.277 -4.431 6.191 1.00 0.00 H new ATOM 0 HD11 LEU C 4 -3.807 -2.668 7.215 1.00 0.00 H new ATOM 0 HD12 LEU C 4 -4.328 -2.180 5.584 1.00 0.00 H new ATOM 0 HD13 LEU C 4 -5.114 -1.476 7.017 1.00 0.00 H new ATOM 0 HD21 LEU C 4 -5.279 -4.115 8.615 1.00 0.00 H new ATOM 0 HD22 LEU C 4 -6.547 -2.876 8.462 1.00 0.00 H new ATOM 0 HD23 LEU C 4 -6.896 -4.565 8.023 1.00 0.00 H new ATOM 1287 N THR C 5 -9.891 -2.616 5.406 1.00 0.00 N ATOM 1288 CA THR C 5 -10.918 -1.827 4.742 1.00 0.00 C ATOM 1289 C THR C 5 -10.929 -0.421 5.328 1.00 0.00 C ATOM 1290 O THR C 5 -11.538 -0.170 6.365 1.00 0.00 O ATOM 1291 CB THR C 5 -12.303 -2.481 4.835 1.00 0.00 C ATOM 1292 OG1 THR C 5 -12.199 -3.882 4.951 1.00 0.00 O ATOM 1293 CG2 THR C 5 -13.104 -2.159 3.577 1.00 0.00 C ATOM 0 H THR C 5 -9.850 -2.489 6.417 1.00 0.00 H new ATOM 0 HA THR C 5 -10.678 -1.774 3.680 1.00 0.00 H new ATOM 0 HB THR C 5 -12.801 -2.087 5.721 1.00 0.00 H new ATOM 0 HG1 THR C 5 -13.096 -4.273 5.010 1.00 0.00 H new ATOM 0 HG21 THR C 5 -14.088 -2.624 3.643 1.00 0.00 H new ATOM 0 HG22 THR C 5 -13.218 -1.079 3.485 1.00 0.00 H new ATOM 0 HG23 THR C 5 -12.579 -2.544 2.703 1.00 0.00 H new ATOM 1301 N ARG C 6 -10.238 0.496 4.643 1.00 0.00 N ATOM 1302 CA ARG C 6 -10.138 1.898 5.033 1.00 0.00 C ATOM 1303 C ARG C 6 -11.030 2.736 4.131 1.00 0.00 C ATOM 1304 O ARG C 6 -11.666 2.189 3.233 1.00 0.00 O ATOM 1305 CB ARG C 6 -8.686 2.351 4.877 1.00 0.00 C ATOM 1306 CG ARG C 6 -7.777 1.630 5.878 1.00 0.00 C ATOM 1307 CD ARG C 6 -7.074 2.657 6.760 1.00 0.00 C ATOM 1308 NE ARG C 6 -8.051 3.415 7.545 1.00 0.00 N ATOM 1309 CZ ARG C 6 -7.848 3.809 8.807 1.00 0.00 C ATOM 1310 NH1 ARG C 6 -6.681 3.602 9.410 1.00 0.00 N ATOM 1311 NH2 ARG C 6 -8.821 4.416 9.478 1.00 0.00 N ATOM 0 H ARG C 6 -9.726 0.277 3.789 1.00 0.00 H new ATOM 0 HA ARG C 6 -10.455 2.020 6.069 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -8.346 2.151 3.861 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -8.619 3.428 5.029 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -8.364 0.948 6.493 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -7.041 1.026 5.347 1.00 0.00 H new ATOM 0 HD2 ARG C 6 -6.375 2.154 7.427 1.00 0.00 H new ATOM 0 HD3 ARG C 6 -6.490 3.338 6.141 1.00 0.00 H new ATOM 0 HE ARG C 6 -8.938 3.657 7.103 1.00 0.00 H new ATOM 0 HH11 ARG C 6 -5.924 3.136 8.910 1.00 0.00 H new ATOM 0 HH12 ARG C 6 -6.543 3.909 10.373 1.00 0.00 H new ATOM 0 HH21 ARG C 6 -9.723 4.581 9.031 1.00 0.00 H new ATOM 0 HH22 ARG C 6 -8.666 4.716 10.440 1.00 0.00 H new ATOM 1325 N LYS C 7 -11.089 4.049 4.358 1.00 0.00 N ATOM 1326 CA LYS C 7 -11.794 4.936 3.447 1.00 0.00 C ATOM 1327 C LYS C 7 -10.913 6.104 3.034 1.00 0.00 C ATOM 1328 O LYS C 7 -9.816 6.284 3.567 1.00 0.00 O ATOM 1329 CB LYS C 7 -13.144 5.415 3.992 1.00 0.00 C ATOM 1330 CG LYS C 7 -13.017 6.305 5.224 1.00 0.00 C ATOM 1331 CD LYS C 7 -14.412 6.826 5.575 1.00 0.00 C ATOM 1332 CE LYS C 7 -14.317 7.955 6.593 1.00 0.00 C ATOM 1333 NZ LYS C 7 -15.653 8.356 7.074 1.00 0.00 N ATOM 0 H LYS C 7 -10.660 4.513 5.158 1.00 0.00 H new ATOM 0 HA LYS C 7 -12.024 4.347 2.559 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -13.670 5.962 3.210 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -13.756 4.548 4.241 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -12.599 5.743 6.059 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -12.338 7.135 5.027 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -14.912 7.182 4.674 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -15.019 6.015 5.977 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -13.705 7.636 7.437 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -13.818 8.813 6.143 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -15.556 9.126 7.766 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -16.228 8.682 6.271 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -16.118 7.542 7.525 1.00 0.00 H new ATOM 1347 N VAL C 8 -11.397 6.900 2.078 1.00 0.00 N ATOM 1348 CA VAL C 8 -10.594 7.957 1.485 1.00 0.00 C ATOM 1349 C VAL C 8 -10.086 8.944 2.527 1.00 0.00 C ATOM 1350 O VAL C 8 -10.844 9.437 3.362 1.00 0.00 O ATOM 1351 CB VAL C 8 -11.352 8.660 0.352 1.00 0.00 C ATOM 1352 CG1 VAL C 8 -11.810 7.624 -0.671 1.00 0.00 C ATOM 1353 CG2 VAL C 8 -12.577 9.456 0.792 1.00 0.00 C ATOM 0 H VAL C 8 -12.342 6.828 1.702 1.00 0.00 H new ATOM 0 HA VAL C 8 -9.713 7.488 1.048 1.00 0.00 H new ATOM 0 HB VAL C 8 -10.643 9.376 -0.063 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -12.349 8.122 -1.477 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -10.941 7.108 -1.080 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -12.467 6.901 -0.188 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -13.044 9.915 -0.079 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -13.290 8.789 1.277 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -12.273 10.233 1.493 1.00 0.00 H new ATOM 1363 N GLY C 9 -8.780 9.225 2.461 1.00 0.00 N ATOM 1364 CA GLY C 9 -8.133 10.211 3.310 1.00 0.00 C ATOM 1365 C GLY C 9 -7.395 9.571 4.484 1.00 0.00 C ATOM 1366 O GLY C 9 -6.680 10.266 5.205 1.00 0.00 O ATOM 0 H GLY C 9 -8.144 8.766 1.809 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -7.429 10.793 2.715 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -8.881 10.907 3.690 1.00 0.00 H new ATOM 1370 N GLU C 10 -7.557 8.264 4.685 1.00 0.00 N ATOM 1371 CA GLU C 10 -6.917 7.553 5.786 1.00 0.00 C ATOM 1372 C GLU C 10 -5.568 6.977 5.347 1.00 0.00 C ATOM 1373 O GLU C 10 -5.163 7.141 4.195 1.00 0.00 O ATOM 1374 CB GLU C 10 -7.861 6.467 6.294 1.00 0.00 C ATOM 1375 CG GLU C 10 -9.183 7.094 6.754 1.00 0.00 C ATOM 1376 CD GLU C 10 -10.125 6.061 7.369 1.00 0.00 C ATOM 1377 OE1 GLU C 10 -10.196 4.936 6.825 1.00 0.00 O ATOM 1378 OE2 GLU C 10 -10.771 6.402 8.384 1.00 0.00 O ATOM 0 H GLU C 10 -8.135 7.671 4.089 1.00 0.00 H new ATOM 0 HA GLU C 10 -6.714 8.245 6.603 1.00 0.00 H new ATOM 0 HB2 GLU C 10 -8.049 5.739 5.505 1.00 0.00 H new ATOM 0 HB3 GLU C 10 -7.398 5.928 7.120 1.00 0.00 H new ATOM 0 HG2 GLU C 10 -8.978 7.877 7.484 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -9.673 7.570 5.905 1.00 0.00 H new ATOM 1385 N SER C 11 -4.874 6.298 6.264 1.00 0.00 N ATOM 1386 CA SER C 11 -3.516 5.827 6.015 1.00 0.00 C ATOM 1387 C SER C 11 -3.239 4.455 6.625 1.00 0.00 C ATOM 1388 O SER C 11 -4.003 3.960 7.457 1.00 0.00 O ATOM 1389 CB SER C 11 -2.520 6.847 6.577 1.00 0.00 C ATOM 1390 OG SER C 11 -2.713 8.112 5.974 1.00 0.00 O ATOM 0 H SER C 11 -5.235 6.063 7.188 1.00 0.00 H new ATOM 0 HA SER C 11 -3.401 5.723 4.936 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.645 6.929 7.657 1.00 0.00 H new ATOM 0 HB3 SER C 11 -1.501 6.505 6.399 1.00 0.00 H new ATOM 0 HG SER C 11 -2.071 8.753 6.345 1.00 0.00 H new ATOM 1396 N ILE C 12 -2.131 3.848 6.196 1.00 0.00 N ATOM 1397 CA ILE C 12 -1.661 2.528 6.619 1.00 0.00 C ATOM 1398 C ILE C 12 -0.126 2.590 6.662 1.00 0.00 C ATOM 1399 O ILE C 12 0.452 3.541 6.145 1.00 0.00 O ATOM 1400 CB ILE C 12 -2.172 1.463 5.626 1.00 0.00 C ATOM 1401 CG1 ILE C 12 -3.690 1.585 5.427 1.00 0.00 C ATOM 1402 CG2 ILE C 12 -1.834 0.049 6.109 1.00 0.00 C ATOM 1403 CD1 ILE C 12 -4.204 0.680 4.307 1.00 0.00 C ATOM 0 H ILE C 12 -1.509 4.283 5.514 1.00 0.00 H new ATOM 0 HA ILE C 12 -2.038 2.253 7.604 1.00 0.00 H new ATOM 0 HB ILE C 12 -1.671 1.639 4.674 1.00 0.00 H new ATOM 0 HG12 ILE C 12 -4.198 1.331 6.358 1.00 0.00 H new ATOM 0 HG13 ILE C 12 -3.942 2.621 5.199 1.00 0.00 H new ATOM 0 HG21 ILE C 12 -2.206 -0.680 5.389 1.00 0.00 H new ATOM 0 HG22 ILE C 12 -0.753 -0.054 6.204 1.00 0.00 H new ATOM 0 HG23 ILE C 12 -2.302 -0.126 7.078 1.00 0.00 H new ATOM 0 HD11 ILE C 12 -5.282 0.803 4.206 1.00 0.00 H new ATOM 0 HD12 ILE C 12 -3.719 0.950 3.369 1.00 0.00 H new ATOM 0 HD13 ILE C 12 -3.978 -0.359 4.546 1.00 0.00 H new ATOM 1415 N ASN C 13 0.549 1.605 7.267 1.00 0.00 N ATOM 1416 CA ASN C 13 2.002 1.641 7.408 1.00 0.00 C ATOM 1417 C ASN C 13 2.646 0.267 7.219 1.00 0.00 C ATOM 1418 O ASN C 13 2.007 -0.766 7.411 1.00 0.00 O ATOM 1419 CB ASN C 13 2.370 2.181 8.790 1.00 0.00 C ATOM 1420 CG ASN C 13 1.989 3.644 8.958 1.00 0.00 C ATOM 1421 OD1 ASN C 13 0.837 3.962 9.232 1.00 0.00 O ATOM 1422 ND2 ASN C 13 2.953 4.539 8.787 1.00 0.00 N ATOM 0 H ASN C 13 0.109 0.776 7.665 1.00 0.00 H new ATOM 0 HA ASN C 13 2.384 2.295 6.624 1.00 0.00 H new ATOM 0 HB2 ASN C 13 1.869 1.587 9.555 1.00 0.00 H new ATOM 0 HB3 ASN C 13 3.442 2.066 8.949 1.00 0.00 H new ATOM 0 HD21 ASN C 13 2.748 5.534 8.883 1.00 0.00 H new ATOM 0 HD22 ASN C 13 3.899 4.233 8.560 1.00 0.00 H new ATOM 1429 N ILE C 14 3.930 0.274 6.840 1.00 0.00 N ATOM 1430 CA ILE C 14 4.731 -0.927 6.632 1.00 0.00 C ATOM 1431 C ILE C 14 6.161 -0.656 7.105 1.00 0.00 C ATOM 1432 O ILE C 14 6.644 0.475 7.035 1.00 0.00 O ATOM 1433 CB ILE C 14 4.734 -1.320 5.143 1.00 0.00 C ATOM 1434 CG1 ILE C 14 3.296 -1.438 4.610 1.00 0.00 C ATOM 1435 CG2 ILE C 14 5.478 -2.648 4.956 1.00 0.00 C ATOM 1436 CD1 ILE C 14 3.246 -1.830 3.133 1.00 0.00 C ATOM 0 H ILE C 14 4.447 1.136 6.667 1.00 0.00 H new ATOM 0 HA ILE C 14 4.303 -1.752 7.202 1.00 0.00 H new ATOM 0 HB ILE C 14 5.246 -0.541 4.578 1.00 0.00 H new ATOM 0 HG12 ILE C 14 2.755 -2.180 5.197 1.00 0.00 H new ATOM 0 HG13 ILE C 14 2.783 -0.486 4.747 1.00 0.00 H new ATOM 0 HG21 ILE C 14 5.477 -2.920 3.901 1.00 0.00 H new ATOM 0 HG22 ILE C 14 6.506 -2.541 5.302 1.00 0.00 H new ATOM 0 HG23 ILE C 14 4.981 -3.428 5.533 1.00 0.00 H new ATOM 0 HD11 ILE C 14 2.207 -1.899 2.810 1.00 0.00 H new ATOM 0 HD12 ILE C 14 3.762 -1.076 2.539 1.00 0.00 H new ATOM 0 HD13 ILE C 14 3.733 -2.795 2.996 1.00 0.00 H new ATOM 1448 N GLY C 15 6.841 -1.698 7.588 1.00 0.00 N ATOM 1449 CA GLY C 15 8.205 -1.597 8.078 1.00 0.00 C ATOM 1450 C GLY C 15 8.320 -0.522 9.149 1.00 0.00 C ATOM 1451 O GLY C 15 7.427 -0.358 9.982 1.00 0.00 O ATOM 0 H GLY C 15 6.452 -2.639 7.648 1.00 0.00 H new ATOM 0 HA2 GLY C 15 8.521 -2.557 8.486 1.00 0.00 H new ATOM 0 HA3 GLY C 15 8.876 -1.365 7.251 1.00 0.00 H new ATOM 1455 N ASP C 16 9.429 0.220 9.120 1.00 0.00 N ATOM 1456 CA ASP C 16 9.683 1.326 10.032 1.00 0.00 C ATOM 1457 C ASP C 16 10.086 2.573 9.240 1.00 0.00 C ATOM 1458 O ASP C 16 10.522 3.562 9.823 1.00 0.00 O ATOM 1459 CB ASP C 16 10.775 0.930 11.027 1.00 0.00 C ATOM 1460 CG ASP C 16 10.362 -0.274 11.871 1.00 0.00 C ATOM 1461 OD1 ASP C 16 9.655 -0.056 12.880 1.00 0.00 O ATOM 1462 OD2 ASP C 16 10.758 -1.402 11.503 1.00 0.00 O ATOM 0 H ASP C 16 10.183 0.064 8.451 1.00 0.00 H new ATOM 0 HA ASP C 16 8.775 1.557 10.590 1.00 0.00 H new ATOM 0 HB2 ASP C 16 11.693 0.698 10.487 1.00 0.00 H new ATOM 0 HB3 ASP C 16 10.995 1.774 11.681 1.00 0.00 H new ATOM 1467 N ASP C 17 9.937 2.520 7.911 1.00 0.00 N ATOM 1468 CA ASP C 17 10.316 3.604 7.022 1.00 0.00 C ATOM 1469 C ASP C 17 9.323 3.755 5.867 1.00 0.00 C ATOM 1470 O ASP C 17 9.607 4.493 4.922 1.00 0.00 O ATOM 1471 CB ASP C 17 11.727 3.371 6.469 1.00 0.00 C ATOM 1472 CG ASP C 17 12.769 3.268 7.578 1.00 0.00 C ATOM 1473 OD1 ASP C 17 13.216 4.337 8.053 1.00 0.00 O ATOM 1474 OD2 ASP C 17 13.115 2.121 7.944 1.00 0.00 O ATOM 0 H ASP C 17 9.546 1.712 7.426 1.00 0.00 H new ATOM 0 HA ASP C 17 10.304 4.527 7.602 1.00 0.00 H new ATOM 0 HB2 ASP C 17 11.737 2.456 5.877 1.00 0.00 H new ATOM 0 HB3 ASP C 17 11.992 4.188 5.798 1.00 0.00 H new ATOM 1479 N ILE C 18 8.171 3.070 5.916 1.00 0.00 N ATOM 1480 CA ILE C 18 7.185 3.174 4.848 1.00 0.00 C ATOM 1481 C ILE C 18 5.805 3.503 5.411 1.00 0.00 C ATOM 1482 O ILE C 18 5.438 3.068 6.502 1.00 0.00 O ATOM 1483 CB ILE C 18 7.131 1.876 4.021 1.00 0.00 C ATOM 1484 CG1 ILE C 18 8.506 1.486 3.457 1.00 0.00 C ATOM 1485 CG2 ILE C 18 6.157 2.042 2.851 1.00 0.00 C ATOM 1486 CD1 ILE C 18 9.232 0.520 4.392 1.00 0.00 C ATOM 0 H ILE C 18 7.907 2.446 6.679 1.00 0.00 H new ATOM 0 HA ILE C 18 7.491 3.988 4.190 1.00 0.00 H new ATOM 0 HB ILE C 18 6.798 1.086 4.694 1.00 0.00 H new ATOM 0 HG12 ILE C 18 8.383 1.025 2.477 1.00 0.00 H new ATOM 0 HG13 ILE C 18 9.111 2.381 3.314 1.00 0.00 H new ATOM 0 HG21 ILE C 18 6.125 1.120 2.271 1.00 0.00 H new ATOM 0 HG22 ILE C 18 5.161 2.264 3.235 1.00 0.00 H new ATOM 0 HG23 ILE C 18 6.491 2.860 2.213 1.00 0.00 H new ATOM 0 HD11 ILE C 18 10.202 0.262 3.967 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.376 0.993 5.363 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.637 -0.385 4.514 1.00 0.00 H new ATOM 1498 N THR C 19 5.047 4.279 4.637 1.00 0.00 N ATOM 1499 CA THR C 19 3.682 4.666 4.952 1.00 0.00 C ATOM 1500 C THR C 19 2.874 4.620 3.661 1.00 0.00 C ATOM 1501 O THR C 19 3.431 4.720 2.567 1.00 0.00 O ATOM 1502 CB THR C 19 3.680 6.066 5.574 1.00 0.00 C ATOM 1503 OG1 THR C 19 4.496 6.079 6.724 1.00 0.00 O ATOM 1504 CG2 THR C 19 2.278 6.520 5.974 1.00 0.00 C ATOM 0 H THR C 19 5.378 4.663 3.752 1.00 0.00 H new ATOM 0 HA THR C 19 3.233 3.986 5.676 1.00 0.00 H new ATOM 0 HB THR C 19 4.061 6.751 4.817 1.00 0.00 H new ATOM 0 HG1 THR C 19 4.493 6.977 7.117 1.00 0.00 H new ATOM 0 HG21 THR C 19 2.329 7.518 6.410 1.00 0.00 H new ATOM 0 HG22 THR C 19 1.637 6.542 5.093 1.00 0.00 H new ATOM 0 HG23 THR C 19 1.865 5.825 6.706 1.00 0.00 H new ATOM 1512 N ILE C 20 1.556 4.475 3.788 1.00 0.00 N ATOM 1513 CA ILE C 20 0.639 4.359 2.668 1.00 0.00 C ATOM 1514 C ILE C 20 -0.558 5.255 2.945 1.00 0.00 C ATOM 1515 O ILE C 20 -0.938 5.454 4.098 1.00 0.00 O ATOM 1516 CB ILE C 20 0.194 2.892 2.529 1.00 0.00 C ATOM 1517 CG1 ILE C 20 1.380 1.940 2.304 1.00 0.00 C ATOM 1518 CG2 ILE C 20 -0.825 2.732 1.397 1.00 0.00 C ATOM 1519 CD1 ILE C 20 2.067 2.152 0.956 1.00 0.00 C ATOM 0 H ILE C 20 1.091 4.435 4.695 1.00 0.00 H new ATOM 0 HA ILE C 20 1.118 4.665 1.738 1.00 0.00 H new ATOM 0 HB ILE C 20 -0.276 2.619 3.474 1.00 0.00 H new ATOM 0 HG12 ILE C 20 2.108 2.080 3.103 1.00 0.00 H new ATOM 0 HG13 ILE C 20 1.030 0.910 2.369 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -1.123 1.686 1.320 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.702 3.344 1.608 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -0.377 3.051 0.456 1.00 0.00 H new ATOM 0 HD11 ILE C 20 2.896 1.451 0.856 1.00 0.00 H new ATOM 0 HD12 ILE C 20 1.350 1.984 0.152 1.00 0.00 H new ATOM 0 HD13 ILE C 20 2.446 3.172 0.897 1.00 0.00 H new ATOM 1531 N THR C 21 -1.158 5.797 1.887 1.00 0.00 N ATOM 1532 CA THR C 21 -2.287 6.707 2.007 1.00 0.00 C ATOM 1533 C THR C 21 -3.260 6.430 0.874 1.00 0.00 C ATOM 1534 O THR C 21 -2.864 5.940 -0.182 1.00 0.00 O ATOM 1535 CB THR C 21 -1.790 8.159 1.943 1.00 0.00 C ATOM 1536 OG1 THR C 21 -0.677 8.332 2.794 1.00 0.00 O ATOM 1537 CG2 THR C 21 -2.880 9.138 2.380 1.00 0.00 C ATOM 0 H THR C 21 -0.873 5.616 0.925 1.00 0.00 H new ATOM 0 HA THR C 21 -2.791 6.556 2.962 1.00 0.00 H new ATOM 0 HB THR C 21 -1.514 8.362 0.908 1.00 0.00 H new ATOM 0 HG1 THR C 21 -0.368 9.261 2.744 1.00 0.00 H new ATOM 0 HG21 THR C 21 -2.498 10.157 2.324 1.00 0.00 H new ATOM 0 HG22 THR C 21 -3.744 9.038 1.723 1.00 0.00 H new ATOM 0 HG23 THR C 21 -3.177 8.918 3.405 1.00 0.00 H new ATOM 1545 N ILE C 22 -4.538 6.738 1.083 1.00 0.00 N ATOM 1546 CA ILE C 22 -5.571 6.541 0.077 1.00 0.00 C ATOM 1547 C ILE C 22 -6.221 7.900 -0.193 1.00 0.00 C ATOM 1548 O ILE C 22 -7.135 8.315 0.512 1.00 0.00 O ATOM 1549 CB ILE C 22 -6.495 5.402 0.550 1.00 0.00 C ATOM 1550 CG1 ILE C 22 -7.403 4.861 -0.559 1.00 0.00 C ATOM 1551 CG2 ILE C 22 -7.316 5.747 1.795 1.00 0.00 C ATOM 1552 CD1 ILE C 22 -8.224 5.914 -1.289 1.00 0.00 C ATOM 0 H ILE C 22 -4.884 7.132 1.958 1.00 0.00 H new ATOM 0 HA ILE C 22 -5.200 6.206 -0.892 1.00 0.00 H new ATOM 0 HB ILE C 22 -5.806 4.606 0.833 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -6.787 4.333 -1.287 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -8.083 4.128 -0.126 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -7.941 4.896 2.066 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -6.644 5.981 2.621 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -7.948 6.610 1.586 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -8.834 5.434 -2.054 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -8.872 6.427 -0.578 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -7.555 6.636 -1.758 1.00 0.00 H new ATOM 1564 N LEU C 23 -5.749 8.612 -1.227 1.00 0.00 N ATOM 1565 CA LEU C 23 -6.141 10.004 -1.426 1.00 0.00 C ATOM 1566 C LEU C 23 -7.619 10.152 -1.792 1.00 0.00 C ATOM 1567 O LEU C 23 -8.226 11.172 -1.465 1.00 0.00 O ATOM 1568 CB LEU C 23 -5.290 10.667 -2.517 1.00 0.00 C ATOM 1569 CG LEU C 23 -3.771 10.469 -2.414 1.00 0.00 C ATOM 1570 CD1 LEU C 23 -3.080 11.527 -3.266 1.00 0.00 C ATOM 1571 CD2 LEU C 23 -3.210 10.625 -1.001 1.00 0.00 C ATOM 0 H LEU C 23 -5.103 8.247 -1.927 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.973 10.502 -0.471 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -5.619 10.287 -3.484 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -5.496 11.737 -2.508 1.00 0.00 H new ATOM 0 HG LEU C 23 -3.584 9.447 -2.744 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -2.000 11.397 -3.202 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.397 11.422 -4.304 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -3.349 12.519 -2.903 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -2.131 10.469 -1.019 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -3.426 11.628 -0.632 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -3.672 9.889 -0.343 1.00 0.00 H new ATOM 1583 N GLY C 24 -8.217 9.159 -2.464 1.00 0.00 N ATOM 1584 CA GLY C 24 -9.628 9.221 -2.831 1.00 0.00 C ATOM 1585 C GLY C 24 -9.990 8.224 -3.923 1.00 0.00 C ATOM 1586 O GLY C 24 -9.177 7.381 -4.298 1.00 0.00 O ATOM 0 H GLY C 24 -7.742 8.307 -2.762 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -10.238 9.027 -1.949 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -9.868 10.229 -3.169 1.00 0.00 H new ATOM 1590 N VAL C 25 -11.222 8.314 -4.444 1.00 0.00 N ATOM 1591 CA VAL C 25 -11.681 7.425 -5.513 1.00 0.00 C ATOM 1592 C VAL C 25 -12.383 8.196 -6.623 1.00 0.00 C ATOM 1593 O VAL C 25 -12.807 9.336 -6.438 1.00 0.00 O ATOM 1594 CB VAL C 25 -12.620 6.339 -4.969 1.00 0.00 C ATOM 1595 CG1 VAL C 25 -12.009 5.616 -3.774 1.00 0.00 C ATOM 1596 CG2 VAL C 25 -13.982 6.910 -4.576 1.00 0.00 C ATOM 0 H VAL C 25 -11.917 8.996 -4.140 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.793 6.950 -5.929 1.00 0.00 H new ATOM 0 HB VAL C 25 -12.763 5.624 -5.779 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -12.702 4.855 -3.416 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -11.074 5.143 -4.074 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -11.814 6.333 -2.976 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -14.616 6.109 -4.196 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -13.850 7.666 -3.802 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -14.452 7.362 -5.449 1.00 0.00 H new ATOM 1606 N SER C 26 -12.500 7.551 -7.785 1.00 0.00 N ATOM 1607 CA SER C 26 -13.213 8.060 -8.943 1.00 0.00 C ATOM 1608 C SER C 26 -13.741 6.860 -9.725 1.00 0.00 C ATOM 1609 O SER C 26 -13.064 6.334 -10.610 1.00 0.00 O ATOM 1610 CB SER C 26 -12.291 8.940 -9.793 1.00 0.00 C ATOM 1611 OG SER C 26 -11.115 8.241 -10.147 1.00 0.00 O ATOM 0 H SER C 26 -12.086 6.632 -7.944 1.00 0.00 H new ATOM 0 HA SER C 26 -14.050 8.690 -8.641 1.00 0.00 H new ATOM 0 HB2 SER C 26 -12.815 9.259 -10.694 1.00 0.00 H new ATOM 0 HB3 SER C 26 -12.030 9.842 -9.240 1.00 0.00 H new ATOM 0 HG SER C 26 -11.352 7.356 -10.494 1.00 0.00 H new ATOM 1617 N GLY C 27 -14.956 6.414 -9.400 1.00 0.00 N ATOM 1618 CA GLY C 27 -15.503 5.218 -10.012 1.00 0.00 C ATOM 1619 C GLY C 27 -14.780 3.999 -9.456 1.00 0.00 C ATOM 1620 O GLY C 27 -14.707 3.832 -8.241 1.00 0.00 O ATOM 0 H GLY C 27 -15.570 6.864 -8.721 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.572 5.147 -9.809 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -15.387 5.263 -11.095 1.00 0.00 H new ATOM 1624 N GLN C 28 -14.242 3.145 -10.331 1.00 0.00 N ATOM 1625 CA GLN C 28 -13.477 1.992 -9.875 1.00 0.00 C ATOM 1626 C GLN C 28 -12.045 2.409 -9.604 1.00 0.00 C ATOM 1627 O GLN C 28 -11.315 1.691 -8.922 1.00 0.00 O ATOM 1628 CB GLN C 28 -13.452 0.873 -10.914 1.00 0.00 C ATOM 1629 CG GLN C 28 -14.843 0.321 -11.219 1.00 0.00 C ATOM 1630 CD GLN C 28 -15.670 0.125 -9.948 1.00 0.00 C ATOM 1631 OE1 GLN C 28 -16.739 0.713 -9.800 1.00 0.00 O ATOM 1632 NE2 GLN C 28 -15.186 -0.696 -9.021 1.00 0.00 N ATOM 0 H GLN C 28 -14.323 3.232 -11.344 1.00 0.00 H new ATOM 0 HA GLN C 28 -13.961 1.622 -8.971 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -13.004 1.247 -11.835 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -12.815 0.064 -10.556 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -15.365 1.003 -11.890 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -14.749 -0.631 -11.742 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -14.296 -1.169 -9.174 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -15.705 -0.853 -8.157 1.00 0.00 H new ATOM 1641 N GLN C 29 -11.637 3.565 -10.133 1.00 0.00 N ATOM 1642 CA GLN C 29 -10.297 4.057 -9.901 1.00 0.00 C ATOM 1643 C GLN C 29 -10.197 4.501 -8.448 1.00 0.00 C ATOM 1644 O GLN C 29 -11.166 4.976 -7.858 1.00 0.00 O ATOM 1645 CB GLN C 29 -9.981 5.211 -10.855 1.00 0.00 C ATOM 1646 CG GLN C 29 -8.935 4.813 -11.900 1.00 0.00 C ATOM 1647 CD GLN C 29 -9.450 3.782 -12.900 1.00 0.00 C ATOM 1648 OE1 GLN C 29 -8.728 2.864 -13.276 1.00 0.00 O ATOM 1649 NE2 GLN C 29 -10.698 3.916 -13.343 1.00 0.00 N ATOM 0 H GLN C 29 -12.217 4.166 -10.718 1.00 0.00 H new ATOM 0 HA GLN C 29 -9.567 3.270 -10.091 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -10.895 5.528 -11.358 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -9.618 6.066 -10.284 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -8.612 5.703 -12.439 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -8.058 4.412 -11.393 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -11.276 4.689 -13.013 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -11.076 3.246 -14.012 1.00 0.00 H new ATOM 1658 N VAL C 30 -9.007 4.335 -7.881 1.00 0.00 N ATOM 1659 CA VAL C 30 -8.698 4.654 -6.508 1.00 0.00 C ATOM 1660 C VAL C 30 -7.337 5.323 -6.538 1.00 0.00 C ATOM 1661 O VAL C 30 -6.348 4.695 -6.912 1.00 0.00 O ATOM 1662 CB VAL C 30 -8.673 3.361 -5.682 1.00 0.00 C ATOM 1663 CG1 VAL C 30 -8.333 3.641 -4.222 1.00 0.00 C ATOM 1664 CG2 VAL C 30 -10.033 2.665 -5.714 1.00 0.00 C ATOM 0 H VAL C 30 -8.207 3.960 -8.391 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.437 5.312 -6.051 1.00 0.00 H new ATOM 0 HB VAL C 30 -7.909 2.723 -6.127 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -8.324 2.704 -3.665 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.351 4.110 -4.161 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -9.081 4.309 -3.796 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.988 1.751 -5.121 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -10.792 3.329 -5.300 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.291 2.417 -6.744 1.00 0.00 H new ATOM 1674 N ARG C 31 -7.276 6.597 -6.150 1.00 0.00 N ATOM 1675 CA ARG C 31 -6.013 7.303 -6.127 1.00 0.00 C ATOM 1676 C ARG C 31 -5.349 7.015 -4.794 1.00 0.00 C ATOM 1677 O ARG C 31 -5.938 7.235 -3.736 1.00 0.00 O ATOM 1678 CB ARG C 31 -6.237 8.795 -6.372 1.00 0.00 C ATOM 1679 CG ARG C 31 -4.888 9.518 -6.430 1.00 0.00 C ATOM 1680 CD ARG C 31 -4.992 10.737 -7.346 1.00 0.00 C ATOM 1681 NE ARG C 31 -5.063 10.323 -8.753 1.00 0.00 N ATOM 1682 CZ ARG C 31 -5.516 11.075 -9.759 1.00 0.00 C ATOM 1683 NH1 ARG C 31 -5.986 12.303 -9.550 1.00 0.00 N ATOM 1684 NH2 ARG C 31 -5.503 10.591 -10.995 1.00 0.00 N ATOM 0 H ARG C 31 -8.081 7.148 -5.852 1.00 0.00 H new ATOM 0 HA ARG C 31 -5.352 6.964 -6.925 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -6.780 8.942 -7.306 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.852 9.216 -5.576 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -4.588 9.829 -5.429 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -4.117 8.840 -6.798 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -5.877 11.318 -7.087 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -4.129 11.386 -7.196 1.00 0.00 H new ATOM 0 HE ARG C 31 -4.739 9.383 -8.981 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.005 12.688 -8.606 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -6.327 12.859 -10.334 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -5.149 9.651 -11.171 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -5.847 11.159 -11.769 1.00 0.00 H new ATOM 1698 N ILE C 32 -4.117 6.525 -4.860 1.00 0.00 N ATOM 1699 CA ILE C 32 -3.407 6.023 -3.696 1.00 0.00 C ATOM 1700 C ILE C 32 -2.049 6.706 -3.624 1.00 0.00 C ATOM 1701 O ILE C 32 -1.523 7.157 -4.640 1.00 0.00 O ATOM 1702 CB ILE C 32 -3.237 4.496 -3.812 1.00 0.00 C ATOM 1703 CG1 ILE C 32 -4.539 3.844 -4.291 1.00 0.00 C ATOM 1704 CG2 ILE C 32 -2.800 3.895 -2.474 1.00 0.00 C ATOM 1705 CD1 ILE C 32 -4.493 2.317 -4.268 1.00 0.00 C ATOM 0 H ILE C 32 -3.583 6.466 -5.727 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.970 6.238 -2.788 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.458 4.296 -4.548 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.361 4.186 -3.662 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.753 4.179 -5.306 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -2.686 2.816 -2.580 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -1.848 4.332 -2.172 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -3.554 4.108 -1.716 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -5.445 1.919 -4.619 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.692 1.967 -4.919 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.309 1.974 -3.250 1.00 0.00 H new ATOM 1717 N GLY C 33 -1.486 6.787 -2.421 1.00 0.00 N ATOM 1718 CA GLY C 33 -0.184 7.381 -2.205 1.00 0.00 C ATOM 1719 C GLY C 33 0.699 6.417 -1.431 1.00 0.00 C ATOM 1720 O GLY C 33 0.215 5.562 -0.688 1.00 0.00 O ATOM 0 H GLY C 33 -1.928 6.439 -1.570 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.278 7.624 -3.162 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.287 8.316 -1.654 1.00 0.00 H new ATOM 1724 N ILE C 34 2.007 6.563 -1.612 1.00 0.00 N ATOM 1725 CA ILE C 34 3.005 5.697 -1.011 1.00 0.00 C ATOM 1726 C ILE C 34 4.163 6.570 -0.578 1.00 0.00 C ATOM 1727 O ILE C 34 4.560 7.477 -1.305 1.00 0.00 O ATOM 1728 CB ILE C 34 3.480 4.657 -2.039 1.00 0.00 C ATOM 1729 CG1 ILE C 34 2.301 3.831 -2.566 1.00 0.00 C ATOM 1730 CG2 ILE C 34 4.532 3.746 -1.394 1.00 0.00 C ATOM 1731 CD1 ILE C 34 2.731 2.928 -3.721 1.00 0.00 C ATOM 0 H ILE C 34 2.407 7.301 -2.192 1.00 0.00 H new ATOM 0 HA ILE C 34 2.590 5.163 -0.156 1.00 0.00 H new ATOM 0 HB ILE C 34 3.926 5.176 -2.887 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.890 3.224 -1.760 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.506 4.498 -2.899 1.00 0.00 H new ATOM 0 HG21 ILE C 34 4.870 3.008 -2.122 1.00 0.00 H new ATOM 0 HG22 ILE C 34 5.380 4.346 -1.065 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.094 3.236 -0.536 1.00 0.00 H new ATOM 0 HD11 ILE C 34 1.873 2.355 -4.073 1.00 0.00 H new ATOM 0 HD12 ILE C 34 3.119 3.539 -4.536 1.00 0.00 H new ATOM 0 HD13 ILE C 34 3.508 2.245 -3.379 1.00 0.00 H new ATOM 1743 N ASN C 35 4.708 6.301 0.604 1.00 0.00 N ATOM 1744 CA ASN C 35 5.731 7.148 1.173 1.00 0.00 C ATOM 1745 C ASN C 35 6.857 6.294 1.739 1.00 0.00 C ATOM 1746 O ASN C 35 6.761 5.770 2.846 1.00 0.00 O ATOM 1747 CB ASN C 35 5.079 8.038 2.226 1.00 0.00 C ATOM 1748 CG ASN C 35 6.001 9.161 2.686 1.00 0.00 C ATOM 1749 OD1 ASN C 35 7.215 9.095 2.523 1.00 0.00 O ATOM 1750 ND2 ASN C 35 5.419 10.201 3.267 1.00 0.00 N ATOM 0 H ASN C 35 4.453 5.500 1.181 1.00 0.00 H new ATOM 0 HA ASN C 35 6.181 7.788 0.414 1.00 0.00 H new ATOM 0 HB2 ASN C 35 4.163 8.467 1.819 1.00 0.00 H new ATOM 0 HB3 ASN C 35 4.793 7.431 3.085 1.00 0.00 H new ATOM 0 HD21 ASN C 35 5.984 10.983 3.597 1.00 0.00 H new ATOM 0 HD22 ASN C 35 4.406 10.219 3.384 1.00 0.00 H new ATOM 1757 N ALA C 36 7.920 6.166 0.947 1.00 0.00 N ATOM 1758 CA ALA C 36 9.130 5.464 1.322 1.00 0.00 C ATOM 1759 C ALA C 36 10.317 6.200 0.719 1.00 0.00 C ATOM 1760 O ALA C 36 10.171 6.876 -0.302 1.00 0.00 O ATOM 1761 CB ALA C 36 9.107 4.036 0.773 1.00 0.00 C ATOM 0 H ALA C 36 7.957 6.559 0.007 1.00 0.00 H new ATOM 0 HA ALA C 36 9.205 5.426 2.409 1.00 0.00 H new ATOM 0 HB1 ALA C 36 10.023 3.520 1.062 1.00 0.00 H new ATOM 0 HB2 ALA C 36 8.247 3.504 1.179 1.00 0.00 H new ATOM 0 HB3 ALA C 36 9.035 4.065 -0.314 1.00 0.00 H new ATOM 1767 N PRO C 37 11.491 6.081 1.342 1.00 0.00 N ATOM 1768 CA PRO C 37 12.707 6.674 0.834 1.00 0.00 C ATOM 1769 C PRO C 37 13.053 6.083 -0.527 1.00 0.00 C ATOM 1770 O PRO C 37 12.691 4.947 -0.828 1.00 0.00 O ATOM 1771 CB PRO C 37 13.771 6.356 1.885 1.00 0.00 C ATOM 1772 CG PRO C 37 13.216 5.178 2.684 1.00 0.00 C ATOM 1773 CD PRO C 37 11.710 5.356 2.576 1.00 0.00 C ATOM 0 HA PRO C 37 12.620 7.749 0.678 1.00 0.00 H new ATOM 0 HB2 PRO C 37 14.721 6.100 1.416 1.00 0.00 H new ATOM 0 HB3 PRO C 37 13.955 7.215 2.530 1.00 0.00 H new ATOM 0 HG2 PRO C 37 13.538 4.223 2.268 1.00 0.00 H new ATOM 0 HG3 PRO C 37 13.550 5.203 3.721 1.00 0.00 H new ATOM 0 HD2 PRO C 37 11.202 4.392 2.560 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.318 5.909 3.430 1.00 0.00 H new ATOM 1781 N LYS C 38 13.763 6.849 -1.357 1.00 0.00 N ATOM 1782 CA LYS C 38 14.217 6.382 -2.664 1.00 0.00 C ATOM 1783 C LYS C 38 15.207 5.232 -2.507 1.00 0.00 C ATOM 1784 O LYS C 38 15.599 4.593 -3.479 1.00 0.00 O ATOM 1785 CB LYS C 38 14.866 7.541 -3.409 1.00 0.00 C ATOM 1786 CG LYS C 38 13.838 8.383 -4.161 1.00 0.00 C ATOM 1787 CD LYS C 38 12.748 9.043 -3.305 1.00 0.00 C ATOM 1788 CE LYS C 38 13.344 10.103 -2.386 1.00 0.00 C ATOM 1789 NZ LYS C 38 12.306 10.754 -1.562 1.00 0.00 N ATOM 0 H LYS C 38 14.038 7.807 -1.141 1.00 0.00 H new ATOM 0 HA LYS C 38 13.362 6.016 -3.233 1.00 0.00 H new ATOM 0 HB2 LYS C 38 15.404 8.172 -2.701 1.00 0.00 H new ATOM 0 HB3 LYS C 38 15.602 7.153 -4.113 1.00 0.00 H new ATOM 0 HG2 LYS C 38 14.367 9.165 -4.705 1.00 0.00 H new ATOM 0 HG3 LYS C 38 13.354 7.750 -4.904 1.00 0.00 H new ATOM 0 HD2 LYS C 38 11.998 9.497 -3.952 1.00 0.00 H new ATOM 0 HD3 LYS C 38 12.239 8.285 -2.710 1.00 0.00 H new ATOM 0 HE2 LYS C 38 14.090 9.645 -1.737 1.00 0.00 H new ATOM 0 HE3 LYS C 38 13.860 10.855 -2.983 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 12.747 11.469 -0.949 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 11.608 11.212 -2.182 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 11.831 10.040 -0.974 1.00 0.00 H new ATOM 1803 N ASP C 39 15.600 4.988 -1.259 1.00 0.00 N ATOM 1804 CA ASP C 39 16.458 3.886 -0.840 1.00 0.00 C ATOM 1805 C ASP C 39 15.803 2.524 -1.066 1.00 0.00 C ATOM 1806 O ASP C 39 16.465 1.496 -0.923 1.00 0.00 O ATOM 1807 CB ASP C 39 16.775 4.048 0.645 1.00 0.00 C ATOM 1808 CG ASP C 39 17.759 5.190 0.880 1.00 0.00 C ATOM 1809 OD1 ASP C 39 18.980 4.920 0.847 1.00 0.00 O ATOM 1810 OD2 ASP C 39 17.285 6.328 1.086 1.00 0.00 O ATOM 0 H ASP C 39 15.316 5.580 -0.479 1.00 0.00 H new ATOM 0 HA ASP C 39 17.366 3.919 -1.442 1.00 0.00 H new ATOM 0 HB2 ASP C 39 15.855 4.239 1.197 1.00 0.00 H new ATOM 0 HB3 ASP C 39 17.193 3.119 1.033 1.00 0.00 H new ATOM 1815 N VAL C 40 14.510 2.510 -1.416 1.00 0.00 N ATOM 1816 CA VAL C 40 13.777 1.281 -1.700 1.00 0.00 C ATOM 1817 C VAL C 40 12.974 1.477 -2.979 1.00 0.00 C ATOM 1818 O VAL C 40 12.838 2.602 -3.459 1.00 0.00 O ATOM 1819 CB VAL C 40 12.859 0.916 -0.527 1.00 0.00 C ATOM 1820 CG1 VAL C 40 13.662 0.853 0.772 1.00 0.00 C ATOM 1821 CG2 VAL C 40 11.757 1.953 -0.352 1.00 0.00 C ATOM 0 H VAL C 40 13.947 3.355 -1.509 1.00 0.00 H new ATOM 0 HA VAL C 40 14.478 0.457 -1.835 1.00 0.00 H new ATOM 0 HB VAL C 40 12.416 -0.055 -0.748 1.00 0.00 H new ATOM 0 HG11 VAL C 40 12.999 0.593 1.597 1.00 0.00 H new ATOM 0 HG12 VAL C 40 14.442 0.097 0.681 1.00 0.00 H new ATOM 0 HG13 VAL C 40 14.118 1.824 0.965 1.00 0.00 H new ATOM 0 HG21 VAL C 40 11.121 1.670 0.486 1.00 0.00 H new ATOM 0 HG22 VAL C 40 12.203 2.928 -0.156 1.00 0.00 H new ATOM 0 HG23 VAL C 40 11.158 2.004 -1.261 1.00 0.00 H new ATOM 1831 N ALA C 41 12.436 0.394 -3.543 1.00 0.00 N ATOM 1832 CA ALA C 41 11.727 0.484 -4.806 1.00 0.00 C ATOM 1833 C ALA C 41 10.213 0.502 -4.615 1.00 0.00 C ATOM 1834 O ALA C 41 9.700 -0.008 -3.620 1.00 0.00 O ATOM 1835 CB ALA C 41 12.137 -0.702 -5.679 1.00 0.00 C ATOM 0 H ALA C 41 12.480 -0.544 -3.144 1.00 0.00 H new ATOM 0 HA ALA C 41 11.995 1.424 -5.289 1.00 0.00 H new ATOM 0 HB1 ALA C 41 11.613 -0.650 -6.633 1.00 0.00 H new ATOM 0 HB2 ALA C 41 13.212 -0.671 -5.854 1.00 0.00 H new ATOM 0 HB3 ALA C 41 11.879 -1.632 -5.173 1.00 0.00 H new ATOM 1841 N VAL C 42 9.497 1.096 -5.574 1.00 0.00 N ATOM 1842 CA VAL C 42 8.040 1.052 -5.626 1.00 0.00 C ATOM 1843 C VAL C 42 7.579 1.384 -7.043 1.00 0.00 C ATOM 1844 O VAL C 42 7.993 2.394 -7.612 1.00 0.00 O ATOM 1845 CB VAL C 42 7.423 2.010 -4.592 1.00 0.00 C ATOM 1846 CG1 VAL C 42 8.211 3.310 -4.454 1.00 0.00 C ATOM 1847 CG2 VAL C 42 5.978 2.357 -4.951 1.00 0.00 C ATOM 0 H VAL C 42 9.918 1.623 -6.339 1.00 0.00 H new ATOM 0 HA VAL C 42 7.699 0.049 -5.372 1.00 0.00 H new ATOM 0 HB VAL C 42 7.456 1.479 -3.641 1.00 0.00 H new ATOM 0 HG11 VAL C 42 7.732 3.949 -3.712 1.00 0.00 H new ATOM 0 HG12 VAL C 42 9.230 3.086 -4.137 1.00 0.00 H new ATOM 0 HG13 VAL C 42 8.235 3.825 -5.415 1.00 0.00 H new ATOM 0 HG21 VAL C 42 5.570 3.035 -4.202 1.00 0.00 H new ATOM 0 HG22 VAL C 42 5.951 2.838 -5.929 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.381 1.445 -4.979 1.00 0.00 H new ATOM 1857 N HIS C 43 6.724 0.528 -7.608 1.00 0.00 N ATOM 1858 CA HIS C 43 6.192 0.711 -8.953 1.00 0.00 C ATOM 1859 C HIS C 43 4.849 -0.005 -9.080 1.00 0.00 C ATOM 1860 O HIS C 43 4.448 -0.732 -8.171 1.00 0.00 O ATOM 1861 CB HIS C 43 7.150 0.132 -10.000 1.00 0.00 C ATOM 1862 CG HIS C 43 8.617 0.332 -9.716 1.00 0.00 C ATOM 1863 ND1 HIS C 43 9.411 1.345 -10.252 1.00 0.00 N ATOM 1864 CD2 HIS C 43 9.382 -0.451 -8.900 1.00 0.00 C ATOM 1865 CE1 HIS C 43 10.636 1.152 -9.735 1.00 0.00 C ATOM 1866 NE2 HIS C 43 10.647 0.080 -8.925 1.00 0.00 N ATOM 0 H HIS C 43 6.383 -0.312 -7.141 1.00 0.00 H new ATOM 0 HA HIS C 43 6.070 1.780 -9.125 1.00 0.00 H new ATOM 0 HB2 HIS C 43 6.958 -0.937 -10.092 1.00 0.00 H new ATOM 0 HB3 HIS C 43 6.920 0.581 -10.966 1.00 0.00 H new ATOM 0 HD1 HIS C 43 9.123 2.078 -10.900 1.00 0.00 H new ATOM 0 HD2 HIS C 43 9.056 -1.318 -8.344 1.00 0.00 H new ATOM 0 HE1 HIS C 43 11.495 1.774 -9.942 1.00 0.00 H new ATOM 1874 N ARG C 44 4.151 0.196 -10.200 1.00 0.00 N ATOM 1875 CA ARG C 44 2.917 -0.524 -10.476 1.00 0.00 C ATOM 1876 C ARG C 44 3.280 -1.961 -10.830 1.00 0.00 C ATOM 1877 O ARG C 44 4.430 -2.238 -11.172 1.00 0.00 O ATOM 1878 CB ARG C 44 2.169 0.145 -11.629 1.00 0.00 C ATOM 1879 CG ARG C 44 1.729 1.556 -11.230 1.00 0.00 C ATOM 1880 CD ARG C 44 0.965 2.229 -12.372 1.00 0.00 C ATOM 1881 NE ARG C 44 1.811 2.378 -13.560 1.00 0.00 N ATOM 1882 CZ ARG C 44 1.664 1.681 -14.690 1.00 0.00 C ATOM 1883 NH1 ARG C 44 0.699 0.780 -14.830 1.00 0.00 N ATOM 1884 NH2 ARG C 44 2.493 1.880 -15.705 1.00 0.00 N ATOM 0 H ARG C 44 4.425 0.855 -10.929 1.00 0.00 H new ATOM 0 HA ARG C 44 2.264 -0.512 -9.604 1.00 0.00 H new ATOM 0 HB2 ARG C 44 2.811 0.192 -12.509 1.00 0.00 H new ATOM 0 HB3 ARG C 44 1.298 -0.451 -11.901 1.00 0.00 H new ATOM 0 HG2 ARG C 44 1.098 1.508 -10.343 1.00 0.00 H new ATOM 0 HG3 ARG C 44 2.602 2.154 -10.968 1.00 0.00 H new ATOM 0 HD2 ARG C 44 0.084 1.638 -12.622 1.00 0.00 H new ATOM 0 HD3 ARG C 44 0.611 3.208 -12.049 1.00 0.00 H new ATOM 0 HE ARG C 44 2.566 3.063 -13.521 1.00 0.00 H new ATOM 0 HH11 ARG C 44 0.048 0.607 -14.064 1.00 0.00 H new ATOM 0 HH12 ARG C 44 0.609 0.261 -15.704 1.00 0.00 H new ATOM 0 HH21 ARG C 44 3.244 2.566 -15.623 1.00 0.00 H new ATOM 0 HH22 ARG C 44 2.380 1.347 -16.568 1.00 0.00 H new ATOM 1898 N GLU C 45 2.313 -2.877 -10.756 1.00 0.00 N ATOM 1899 CA GLU C 45 2.586 -4.275 -11.048 1.00 0.00 C ATOM 1900 C GLU C 45 3.077 -4.440 -12.490 1.00 0.00 C ATOM 1901 O GLU C 45 3.753 -5.415 -12.812 1.00 0.00 O ATOM 1902 CB GLU C 45 1.315 -5.082 -10.751 1.00 0.00 C ATOM 1903 CG GLU C 45 1.556 -6.586 -10.583 1.00 0.00 C ATOM 1904 CD GLU C 45 1.802 -7.317 -11.895 1.00 0.00 C ATOM 1905 OE1 GLU C 45 1.063 -7.041 -12.867 1.00 0.00 O ATOM 1906 OE2 GLU C 45 2.733 -8.155 -11.912 1.00 0.00 O ATOM 0 H GLU C 45 1.347 -2.675 -10.499 1.00 0.00 H new ATOM 0 HA GLU C 45 3.390 -4.654 -10.416 1.00 0.00 H new ATOM 0 HB2 GLU C 45 0.855 -4.694 -9.842 1.00 0.00 H new ATOM 0 HB3 GLU C 45 0.601 -4.927 -11.560 1.00 0.00 H new ATOM 0 HG2 GLU C 45 2.414 -6.736 -9.927 1.00 0.00 H new ATOM 0 HG3 GLU C 45 0.693 -7.030 -10.086 1.00 0.00 H new ATOM 1913 N GLU C 46 2.743 -3.484 -13.363 1.00 0.00 N ATOM 1914 CA GLU C 46 3.180 -3.503 -14.747 1.00 0.00 C ATOM 1915 C GLU C 46 4.684 -3.264 -14.845 1.00 0.00 C ATOM 1916 O GLU C 46 5.390 -3.992 -15.542 1.00 0.00 O ATOM 1917 CB GLU C 46 2.445 -2.392 -15.500 1.00 0.00 C ATOM 1918 CG GLU C 46 2.796 -2.412 -16.988 1.00 0.00 C ATOM 1919 CD GLU C 46 1.952 -1.413 -17.779 1.00 0.00 C ATOM 1920 OE1 GLU C 46 1.710 -0.305 -17.250 1.00 0.00 O ATOM 1921 OE2 GLU C 46 1.556 -1.764 -18.913 1.00 0.00 O ATOM 0 H GLU C 46 2.163 -2.680 -13.123 1.00 0.00 H new ATOM 0 HA GLU C 46 2.958 -4.478 -15.180 1.00 0.00 H new ATOM 0 HB2 GLU C 46 1.369 -2.514 -15.375 1.00 0.00 H new ATOM 0 HB3 GLU C 46 2.708 -1.424 -15.074 1.00 0.00 H new ATOM 0 HG2 GLU C 46 3.853 -2.178 -17.116 1.00 0.00 H new ATOM 0 HG3 GLU C 46 2.641 -3.415 -17.385 1.00 0.00 H new ATOM 1928 N ILE C 47 5.177 -2.240 -14.145 1.00 0.00 N ATOM 1929 CA ILE C 47 6.573 -1.836 -14.248 1.00 0.00 C ATOM 1930 C ILE C 47 7.465 -2.791 -13.459 1.00 0.00 C ATOM 1931 O ILE C 47 8.649 -2.933 -13.755 1.00 0.00 O ATOM 1932 CB ILE C 47 6.725 -0.408 -13.711 1.00 0.00 C ATOM 1933 CG1 ILE C 47 5.666 0.549 -14.274 1.00 0.00 C ATOM 1934 CG2 ILE C 47 8.125 0.131 -14.022 1.00 0.00 C ATOM 1935 CD1 ILE C 47 5.549 0.481 -15.793 1.00 0.00 C ATOM 0 H ILE C 47 4.624 -1.676 -13.499 1.00 0.00 H new ATOM 0 HA ILE C 47 6.879 -1.868 -15.294 1.00 0.00 H new ATOM 0 HB ILE C 47 6.579 -0.460 -12.632 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.699 0.314 -13.830 1.00 0.00 H new ATOM 0 HG13 ILE C 47 5.913 1.569 -13.979 1.00 0.00 H new ATOM 0 HG21 ILE C 47 8.219 1.146 -13.635 1.00 0.00 H new ATOM 0 HG22 ILE C 47 8.873 -0.507 -13.552 1.00 0.00 H new ATOM 0 HG23 ILE C 47 8.281 0.138 -15.101 1.00 0.00 H new ATOM 0 HD11 ILE C 47 4.784 1.180 -16.131 1.00 0.00 H new ATOM 0 HD12 ILE C 47 6.506 0.744 -16.244 1.00 0.00 H new ATOM 0 HD13 ILE C 47 5.273 -0.530 -16.092 1.00 0.00 H new ATOM 1947 N TYR C 48 6.893 -3.453 -12.453 1.00 0.00 N ATOM 1948 CA TYR C 48 7.627 -4.381 -11.610 1.00 0.00 C ATOM 1949 C TYR C 48 8.171 -5.566 -12.412 1.00 0.00 C ATOM 1950 O TYR C 48 9.209 -6.126 -12.061 1.00 0.00 O ATOM 1951 CB TYR C 48 6.676 -4.861 -10.515 1.00 0.00 C ATOM 1952 CG TYR C 48 7.308 -5.769 -9.488 1.00 0.00 C ATOM 1953 CD1 TYR C 48 8.093 -5.232 -8.460 1.00 0.00 C ATOM 1954 CD2 TYR C 48 7.096 -7.152 -9.566 1.00 0.00 C ATOM 1955 CE1 TYR C 48 8.647 -6.072 -7.485 1.00 0.00 C ATOM 1956 CE2 TYR C 48 7.635 -8.000 -8.595 1.00 0.00 C ATOM 1957 CZ TYR C 48 8.410 -7.462 -7.545 1.00 0.00 C ATOM 1958 OH TYR C 48 8.924 -8.290 -6.590 1.00 0.00 O ATOM 0 H TYR C 48 5.908 -3.357 -12.204 1.00 0.00 H new ATOM 0 HA TYR C 48 8.491 -3.878 -11.176 1.00 0.00 H new ATOM 0 HB2 TYR C 48 6.261 -3.991 -10.006 1.00 0.00 H new ATOM 0 HB3 TYR C 48 5.842 -5.386 -10.981 1.00 0.00 H new ATOM 0 HD1 TYR C 48 8.272 -4.168 -8.419 1.00 0.00 H new ATOM 0 HD2 TYR C 48 6.515 -7.563 -10.378 1.00 0.00 H new ATOM 0 HE1 TYR C 48 9.252 -5.658 -6.692 1.00 0.00 H new ATOM 0 HE2 TYR C 48 7.459 -9.064 -8.648 1.00 0.00 H new ATOM 0 HH TYR C 48 8.663 -9.215 -6.784 1.00 0.00 H new