USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 748 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: A 1 MET N :NH3+ -151:sc= 0.0223 (180deg=0) USER MOD Set 1.2: B 35 ASN : amide:sc= 0.0183 K(o=0.041,f=-3.7!) USER MOD Set 2.1: B 13 ASN : amide:sc= 0 X(o=0,f=0.37) USER MOD Set 2.2: B 19 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: B 11 SER OG : rot 180:sc= 0 USER MOD Set 3.2: B 21 THR OG1 : rot 180:sc= -0.0281 USER MOD Set 4.1: A 35 ASN : amide:sc= 0 K(o=0.041,f=-2!) USER MOD Set 4.2: B 1 MET N :NH3+ 132:sc= 0.0414 (180deg=0) USER MOD Set 5.1: A 11 SER OG : rot -118:sc= 0.862 USER MOD Set 5.2: A 21 THR OG1 : rot 180:sc= 0.765 USER MOD Set 6.1: A 13 ASN : amide:sc=-0.00598 K(o=-0.006,f=0.83) USER MOD Set 6.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 7 LYS NZ :NH3+ 170:sc= 1.21 (180deg=-0.0761) USER MOD Set 7.2: B 29 GLN : amide:sc= 1.01 K(o=2.2,f=-4.7) USER MOD Single : A 1 MET CE :methyl -179:sc= -0.174 (180deg=-0.181) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.171 K(o=-0.17,f=-0.91) USER MOD Single : A 29 GLN : amide:sc= -1.37 K(o=-1.4,f=-4.7!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.916 K(o=-0.92,f=-0.18) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -173:sc= -0.252 (180deg=-0.404) USER MOD Single : B 5 THR OG1 : rot 120:sc= 0.436 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 SER OG : rot 180:sc= 0 USER MOD Single : B 28 GLN : amide:sc= -0.382 X(o=-0.38,f=-0.19) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 HIS : no HE2:sc= -0.693 X(o=-0.69,f=-0.77) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.382 -2.632 -6.679 1.00 0.00 N ATOM 2 CA MET A 1 22.349 -1.842 -7.376 1.00 0.00 C ATOM 3 C MET A 1 22.994 -0.797 -8.278 1.00 0.00 C ATOM 4 O MET A 1 24.072 -0.298 -7.963 1.00 0.00 O ATOM 5 CB MET A 1 21.411 -1.186 -6.358 1.00 0.00 C ATOM 6 CG MET A 1 20.275 -0.431 -7.049 1.00 0.00 C ATOM 7 SD MET A 1 18.843 -0.081 -5.991 1.00 0.00 S ATOM 8 CE MET A 1 19.640 0.853 -4.659 1.00 0.00 C ATOM 0 H1 MET A 1 23.016 -3.586 -6.483 1.00 0.00 H new ATOM 0 H2 MET A 1 24.229 -2.702 -7.279 1.00 0.00 H new ATOM 0 H3 MET A 1 23.630 -2.166 -5.783 1.00 0.00 H new ATOM 0 HA MET A 1 21.759 -2.509 -8.005 1.00 0.00 H new ATOM 0 HB2 MET A 1 20.995 -1.949 -5.700 1.00 0.00 H new ATOM 0 HB3 MET A 1 21.977 -0.498 -5.730 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.665 0.512 -7.433 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.941 -1.012 -7.909 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.895 1.129 -3.912 1.00 0.00 H new ATOM 0 HE2 MET A 1 20.410 0.238 -4.193 1.00 0.00 H new ATOM 0 HE3 MET A 1 20.095 1.755 -5.069 1.00 0.00 H new ATOM 20 N LEU A 2 22.336 -0.469 -9.394 1.00 0.00 N ATOM 21 CA LEU A 2 22.795 0.546 -10.328 1.00 0.00 C ATOM 22 C LEU A 2 21.832 1.732 -10.276 1.00 0.00 C ATOM 23 O LEU A 2 20.779 1.720 -10.911 1.00 0.00 O ATOM 24 CB LEU A 2 22.876 -0.040 -11.744 1.00 0.00 C ATOM 25 CG LEU A 2 23.889 0.671 -12.655 1.00 0.00 C ATOM 26 CD1 LEU A 2 23.390 0.700 -14.089 1.00 0.00 C ATOM 27 CD2 LEU A 2 24.233 2.101 -12.267 1.00 0.00 C ATOM 0 H LEU A 2 21.459 -0.910 -9.671 1.00 0.00 H new ATOM 0 HA LEU A 2 23.793 0.886 -10.053 1.00 0.00 H new ATOM 0 HB2 LEU A 2 23.142 -1.095 -11.675 1.00 0.00 H new ATOM 0 HB3 LEU A 2 21.889 0.011 -12.205 1.00 0.00 H new ATOM 0 HG LEU A 2 24.797 0.079 -12.540 1.00 0.00 H new ATOM 0 HD11 LEU A 2 24.121 1.207 -14.718 1.00 0.00 H new ATOM 0 HD12 LEU A 2 23.250 -0.320 -14.446 1.00 0.00 H new ATOM 0 HD13 LEU A 2 22.441 1.234 -14.133 1.00 0.00 H new ATOM 0 HD21 LEU A 2 24.955 2.507 -12.976 1.00 0.00 H new ATOM 0 HD22 LEU A 2 23.329 2.710 -12.282 1.00 0.00 H new ATOM 0 HD23 LEU A 2 24.662 2.113 -11.265 1.00 0.00 H new ATOM 39 N ILE A 3 22.200 2.761 -9.515 1.00 0.00 N ATOM 40 CA ILE A 3 21.386 3.949 -9.338 1.00 0.00 C ATOM 41 C ILE A 3 21.659 4.912 -10.486 1.00 0.00 C ATOM 42 O ILE A 3 22.815 5.165 -10.815 1.00 0.00 O ATOM 43 CB ILE A 3 21.734 4.615 -7.999 1.00 0.00 C ATOM 44 CG1 ILE A 3 21.407 3.704 -6.810 1.00 0.00 C ATOM 45 CG2 ILE A 3 20.923 5.902 -7.836 1.00 0.00 C ATOM 46 CD1 ILE A 3 22.505 2.682 -6.533 1.00 0.00 C ATOM 0 H ILE A 3 23.081 2.788 -9.002 1.00 0.00 H new ATOM 0 HA ILE A 3 20.330 3.679 -9.334 1.00 0.00 H new ATOM 0 HB ILE A 3 22.804 4.821 -8.010 1.00 0.00 H new ATOM 0 HG12 ILE A 3 21.252 4.315 -5.921 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.470 3.181 -7.005 1.00 0.00 H new ATOM 0 HG21 ILE A 3 21.173 6.371 -6.885 1.00 0.00 H new ATOM 0 HG22 ILE A 3 21.159 6.586 -8.651 1.00 0.00 H new ATOM 0 HG23 ILE A 3 19.859 5.667 -7.856 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.221 2.064 -5.681 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.643 2.050 -7.410 1.00 0.00 H new ATOM 0 HD13 ILE A 3 23.437 3.201 -6.309 1.00 0.00 H new ATOM 58 N LEU A 4 20.598 5.446 -11.092 1.00 0.00 N ATOM 59 CA LEU A 4 20.703 6.437 -12.154 1.00 0.00 C ATOM 60 C LEU A 4 19.654 7.520 -11.916 1.00 0.00 C ATOM 61 O LEU A 4 18.775 7.366 -11.070 1.00 0.00 O ATOM 62 CB LEU A 4 20.479 5.785 -13.528 1.00 0.00 C ATOM 63 CG LEU A 4 21.512 4.711 -13.893 1.00 0.00 C ATOM 64 CD1 LEU A 4 21.167 4.113 -15.257 1.00 0.00 C ATOM 65 CD2 LEU A 4 22.919 5.290 -14.010 1.00 0.00 C ATOM 0 H LEU A 4 19.637 5.199 -10.855 1.00 0.00 H new ATOM 0 HA LEU A 4 21.702 6.873 -12.144 1.00 0.00 H new ATOM 0 HB2 LEU A 4 19.485 5.338 -13.547 1.00 0.00 H new ATOM 0 HB3 LEU A 4 20.494 6.562 -14.293 1.00 0.00 H new ATOM 0 HG LEU A 4 21.487 3.964 -13.100 1.00 0.00 H new ATOM 0 HD11 LEU A 4 21.901 3.350 -15.516 1.00 0.00 H new ATOM 0 HD12 LEU A 4 20.175 3.663 -15.217 1.00 0.00 H new ATOM 0 HD13 LEU A 4 21.179 4.899 -16.012 1.00 0.00 H new ATOM 0 HD21 LEU A 4 23.619 4.496 -14.270 1.00 0.00 H new ATOM 0 HD22 LEU A 4 22.934 6.055 -14.786 1.00 0.00 H new ATOM 0 HD23 LEU A 4 23.210 5.733 -13.058 1.00 0.00 H new ATOM 77 N THR A 5 19.739 8.622 -12.664 1.00 0.00 N ATOM 78 CA THR A 5 18.743 9.684 -12.596 1.00 0.00 C ATOM 79 C THR A 5 18.101 9.820 -13.971 1.00 0.00 C ATOM 80 O THR A 5 18.776 9.660 -14.984 1.00 0.00 O ATOM 81 CB THR A 5 19.397 10.983 -12.116 1.00 0.00 C ATOM 82 OG1 THR A 5 19.917 10.795 -10.817 1.00 0.00 O ATOM 83 CG2 THR A 5 18.396 12.130 -12.061 1.00 0.00 C ATOM 0 H THR A 5 20.494 8.799 -13.327 1.00 0.00 H new ATOM 0 HA THR A 5 17.961 9.447 -11.875 1.00 0.00 H new ATOM 0 HB THR A 5 20.186 11.235 -12.825 1.00 0.00 H new ATOM 0 HG1 THR A 5 20.337 11.625 -10.510 1.00 0.00 H new ATOM 0 HG21 THR A 5 18.897 13.034 -11.716 1.00 0.00 H new ATOM 0 HG22 THR A 5 17.983 12.301 -13.055 1.00 0.00 H new ATOM 0 HG23 THR A 5 17.590 11.877 -11.372 1.00 0.00 H new ATOM 91 N ARG A 6 16.799 10.115 -14.019 1.00 0.00 N ATOM 92 CA ARG A 6 16.070 10.175 -15.279 1.00 0.00 C ATOM 93 C ARG A 6 15.101 11.352 -15.281 1.00 0.00 C ATOM 94 O ARG A 6 14.409 11.576 -14.290 1.00 0.00 O ATOM 95 CB ARG A 6 15.327 8.842 -15.425 1.00 0.00 C ATOM 96 CG ARG A 6 14.676 8.619 -16.791 1.00 0.00 C ATOM 97 CD ARG A 6 15.691 8.229 -17.868 1.00 0.00 C ATOM 98 NE ARG A 6 16.432 9.384 -18.383 1.00 0.00 N ATOM 99 CZ ARG A 6 17.760 9.523 -18.387 1.00 0.00 C ATOM 100 NH1 ARG A 6 18.552 8.591 -17.864 1.00 0.00 N ATOM 101 NH2 ARG A 6 18.292 10.614 -18.926 1.00 0.00 N ATOM 0 H ARG A 6 16.231 10.316 -13.196 1.00 0.00 H new ATOM 0 HA ARG A 6 16.748 10.327 -16.119 1.00 0.00 H new ATOM 0 HB2 ARG A 6 16.027 8.029 -15.234 1.00 0.00 H new ATOM 0 HB3 ARG A 6 14.556 8.785 -14.657 1.00 0.00 H new ATOM 0 HG2 ARG A 6 13.922 7.837 -16.707 1.00 0.00 H new ATOM 0 HG3 ARG A 6 14.159 9.529 -17.096 1.00 0.00 H new ATOM 0 HD2 ARG A 6 16.394 7.505 -17.456 1.00 0.00 H new ATOM 0 HD3 ARG A 6 15.172 7.737 -18.691 1.00 0.00 H new ATOM 0 HE ARG A 6 15.884 10.151 -18.773 1.00 0.00 H new ATOM 0 HH11 ARG A 6 18.147 7.751 -17.450 1.00 0.00 H new ATOM 0 HH12 ARG A 6 19.564 8.716 -17.877 1.00 0.00 H new ATOM 0 HH21 ARG A 6 17.688 11.330 -19.329 1.00 0.00 H new ATOM 0 HH22 ARG A 6 19.305 10.736 -18.937 1.00 0.00 H new ATOM 115 N LYS A 7 15.045 12.105 -16.386 1.00 0.00 N ATOM 116 CA LYS A 7 14.079 13.187 -16.522 1.00 0.00 C ATOM 117 C LYS A 7 12.702 12.581 -16.786 1.00 0.00 C ATOM 118 O LYS A 7 12.595 11.500 -17.364 1.00 0.00 O ATOM 119 CB LYS A 7 14.442 14.104 -17.698 1.00 0.00 C ATOM 120 CG LYS A 7 15.669 14.999 -17.485 1.00 0.00 C ATOM 121 CD LYS A 7 16.987 14.220 -17.433 1.00 0.00 C ATOM 122 CE LYS A 7 18.164 15.137 -17.781 1.00 0.00 C ATOM 123 NZ LYS A 7 18.245 16.308 -16.888 1.00 0.00 N ATOM 0 H LYS A 7 15.657 11.981 -17.193 1.00 0.00 H new ATOM 0 HA LYS A 7 14.081 13.775 -15.604 1.00 0.00 H new ATOM 0 HB2 LYS A 7 14.614 13.485 -18.579 1.00 0.00 H new ATOM 0 HB3 LYS A 7 13.584 14.740 -17.918 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.720 15.731 -18.291 1.00 0.00 H new ATOM 0 HG3 LYS A 7 15.547 15.555 -16.556 1.00 0.00 H new ATOM 0 HD2 LYS A 7 17.128 13.798 -16.438 1.00 0.00 H new ATOM 0 HD3 LYS A 7 16.950 13.384 -18.131 1.00 0.00 H new ATOM 0 HE2 LYS A 7 19.093 14.571 -17.719 1.00 0.00 H new ATOM 0 HE3 LYS A 7 18.065 15.476 -18.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 19.144 16.806 -17.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 17.453 16.952 -17.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 18.196 15.994 -15.898 1.00 0.00 H new ATOM 137 N VAL A 8 11.645 13.275 -16.366 1.00 0.00 N ATOM 138 CA VAL A 8 10.281 12.848 -16.652 1.00 0.00 C ATOM 139 C VAL A 8 10.090 12.760 -18.164 1.00 0.00 C ATOM 140 O VAL A 8 10.503 13.657 -18.898 1.00 0.00 O ATOM 141 CB VAL A 8 9.305 13.857 -16.043 1.00 0.00 C ATOM 142 CG1 VAL A 8 7.883 13.598 -16.538 1.00 0.00 C ATOM 143 CG2 VAL A 8 9.351 13.740 -14.519 1.00 0.00 C ATOM 0 H VAL A 8 11.710 14.137 -15.825 1.00 0.00 H new ATOM 0 HA VAL A 8 10.091 11.867 -16.217 1.00 0.00 H new ATOM 0 HB VAL A 8 9.597 14.862 -16.348 1.00 0.00 H new ATOM 0 HG11 VAL A 8 7.205 14.326 -16.093 1.00 0.00 H new ATOM 0 HG12 VAL A 8 7.853 13.690 -17.624 1.00 0.00 H new ATOM 0 HG13 VAL A 8 7.575 12.593 -16.251 1.00 0.00 H new ATOM 0 HG21 VAL A 8 8.658 14.456 -14.078 1.00 0.00 H new ATOM 0 HG22 VAL A 8 9.067 12.730 -14.223 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.361 13.950 -14.168 1.00 0.00 H new ATOM 153 N GLY A 9 9.464 11.677 -18.629 1.00 0.00 N ATOM 154 CA GLY A 9 9.173 11.477 -20.041 1.00 0.00 C ATOM 155 C GLY A 9 10.228 10.623 -20.743 1.00 0.00 C ATOM 156 O GLY A 9 10.090 10.340 -21.932 1.00 0.00 O ATOM 0 H GLY A 9 9.146 10.914 -18.031 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.198 11.000 -20.143 1.00 0.00 H new ATOM 0 HA3 GLY A 9 9.107 12.446 -20.536 1.00 0.00 H new ATOM 160 N GLU A 10 11.276 10.211 -20.024 1.00 0.00 N ATOM 161 CA GLU A 10 12.321 9.353 -20.574 1.00 0.00 C ATOM 162 C GLU A 10 12.201 7.946 -19.984 1.00 0.00 C ATOM 163 O GLU A 10 11.278 7.674 -19.217 1.00 0.00 O ATOM 164 CB GLU A 10 13.694 9.971 -20.305 1.00 0.00 C ATOM 165 CG GLU A 10 13.802 11.350 -20.959 1.00 0.00 C ATOM 166 CD GLU A 10 15.193 11.961 -20.781 1.00 0.00 C ATOM 167 OE1 GLU A 10 15.829 11.671 -19.743 1.00 0.00 O ATOM 168 OE2 GLU A 10 15.609 12.715 -21.687 1.00 0.00 O ATOM 0 H GLU A 10 11.421 10.464 -19.047 1.00 0.00 H new ATOM 0 HA GLU A 10 12.202 9.270 -21.654 1.00 0.00 H new ATOM 0 HB2 GLU A 10 13.855 10.059 -19.231 1.00 0.00 H new ATOM 0 HB3 GLU A 10 14.475 9.317 -20.692 1.00 0.00 H new ATOM 0 HG2 GLU A 10 13.576 11.266 -22.022 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.055 12.016 -20.526 1.00 0.00 H new ATOM 175 N SER A 11 13.126 7.044 -20.331 1.00 0.00 N ATOM 176 CA SER A 11 13.084 5.674 -19.835 1.00 0.00 C ATOM 177 C SER A 11 14.478 5.109 -19.574 1.00 0.00 C ATOM 178 O SER A 11 15.490 5.726 -19.901 1.00 0.00 O ATOM 179 CB SER A 11 12.371 4.778 -20.850 1.00 0.00 C ATOM 180 OG SER A 11 11.064 5.246 -21.104 1.00 0.00 O ATOM 0 H SER A 11 13.910 7.243 -20.953 1.00 0.00 H new ATOM 0 HA SER A 11 12.543 5.692 -18.889 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.939 4.751 -21.780 1.00 0.00 H new ATOM 0 HB3 SER A 11 12.329 3.756 -20.473 1.00 0.00 H new ATOM 0 HG SER A 11 10.414 4.566 -20.831 1.00 0.00 H new ATOM 186 N ILE A 12 14.506 3.916 -18.974 1.00 0.00 N ATOM 187 CA ILE A 12 15.702 3.135 -18.696 1.00 0.00 C ATOM 188 C ILE A 12 15.452 1.723 -19.223 1.00 0.00 C ATOM 189 O ILE A 12 14.312 1.377 -19.526 1.00 0.00 O ATOM 190 CB ILE A 12 15.982 3.174 -17.184 1.00 0.00 C ATOM 191 CG1 ILE A 12 16.334 4.617 -16.798 1.00 0.00 C ATOM 192 CG2 ILE A 12 17.114 2.228 -16.770 1.00 0.00 C ATOM 193 CD1 ILE A 12 16.697 4.737 -15.320 1.00 0.00 C ATOM 0 H ILE A 12 13.655 3.452 -18.657 1.00 0.00 H new ATOM 0 HA ILE A 12 16.588 3.535 -19.189 1.00 0.00 H new ATOM 0 HB ILE A 12 15.088 2.836 -16.660 1.00 0.00 H new ATOM 0 HG12 ILE A 12 17.170 4.962 -17.407 1.00 0.00 H new ATOM 0 HG13 ILE A 12 15.489 5.269 -17.019 1.00 0.00 H new ATOM 0 HG21 ILE A 12 17.269 2.296 -15.693 1.00 0.00 H new ATOM 0 HG22 ILE A 12 16.848 1.205 -17.035 1.00 0.00 H new ATOM 0 HG23 ILE A 12 18.031 2.510 -17.287 1.00 0.00 H new ATOM 0 HD11 ILE A 12 16.940 5.774 -15.088 1.00 0.00 H new ATOM 0 HD12 ILE A 12 15.852 4.417 -14.711 1.00 0.00 H new ATOM 0 HD13 ILE A 12 17.559 4.106 -15.105 1.00 0.00 H new ATOM 205 N ASN A 13 16.495 0.899 -19.339 1.00 0.00 N ATOM 206 CA ASN A 13 16.358 -0.446 -19.879 1.00 0.00 C ATOM 207 C ASN A 13 16.991 -1.484 -18.967 1.00 0.00 C ATOM 208 O ASN A 13 17.873 -1.172 -18.168 1.00 0.00 O ATOM 209 CB ASN A 13 17.011 -0.520 -21.261 1.00 0.00 C ATOM 210 CG ASN A 13 16.304 0.357 -22.277 1.00 0.00 C ATOM 211 OD1 ASN A 13 16.909 1.253 -22.856 1.00 0.00 O ATOM 212 ND2 ASN A 13 15.018 0.104 -22.500 1.00 0.00 N ATOM 0 H ASN A 13 17.446 1.145 -19.064 1.00 0.00 H new ATOM 0 HA ASN A 13 15.293 -0.665 -19.956 1.00 0.00 H new ATOM 0 HB2 ASN A 13 18.055 -0.215 -21.184 1.00 0.00 H new ATOM 0 HB3 ASN A 13 17.005 -1.553 -21.609 1.00 0.00 H new ATOM 0 HD21 ASN A 13 14.497 0.665 -23.174 1.00 0.00 H new ATOM 0 HD22 ASN A 13 14.552 -0.651 -21.997 1.00 0.00 H new ATOM 219 N ILE A 14 16.518 -2.725 -19.110 1.00 0.00 N ATOM 220 CA ILE A 14 17.037 -3.884 -18.399 1.00 0.00 C ATOM 221 C ILE A 14 17.013 -5.074 -19.358 1.00 0.00 C ATOM 222 O ILE A 14 16.133 -5.164 -20.216 1.00 0.00 O ATOM 223 CB ILE A 14 16.198 -4.167 -17.143 1.00 0.00 C ATOM 224 CG1 ILE A 14 16.111 -2.916 -16.257 1.00 0.00 C ATOM 225 CG2 ILE A 14 16.825 -5.325 -16.361 1.00 0.00 C ATOM 226 CD1 ILE A 14 15.215 -3.142 -15.038 1.00 0.00 C ATOM 0 H ILE A 14 15.747 -2.951 -19.738 1.00 0.00 H new ATOM 0 HA ILE A 14 18.059 -3.699 -18.067 1.00 0.00 H new ATOM 0 HB ILE A 14 15.187 -4.440 -17.447 1.00 0.00 H new ATOM 0 HG12 ILE A 14 17.111 -2.635 -15.926 1.00 0.00 H new ATOM 0 HG13 ILE A 14 15.724 -2.082 -16.843 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.230 -5.526 -15.470 1.00 0.00 H new ATOM 0 HG22 ILE A 14 16.851 -6.216 -16.989 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.840 -5.058 -16.067 1.00 0.00 H new ATOM 0 HD11 ILE A 14 15.181 -2.233 -14.438 1.00 0.00 H new ATOM 0 HD12 ILE A 14 14.208 -3.397 -15.369 1.00 0.00 H new ATOM 0 HD13 ILE A 14 15.617 -3.958 -14.437 1.00 0.00 H new ATOM 238 N GLY A 15 17.977 -5.988 -19.218 1.00 0.00 N ATOM 239 CA GLY A 15 18.092 -7.140 -20.095 1.00 0.00 C ATOM 240 C GLY A 15 18.130 -6.683 -21.550 1.00 0.00 C ATOM 241 O GLY A 15 18.954 -5.849 -21.920 1.00 0.00 O ATOM 0 H GLY A 15 18.694 -5.944 -18.494 1.00 0.00 H new ATOM 0 HA2 GLY A 15 18.996 -7.700 -19.857 1.00 0.00 H new ATOM 0 HA3 GLY A 15 17.249 -7.813 -19.938 1.00 0.00 H new ATOM 245 N ASP A 16 17.233 -7.233 -22.372 1.00 0.00 N ATOM 246 CA ASP A 16 17.088 -6.840 -23.767 1.00 0.00 C ATOM 247 C ASP A 16 15.613 -6.783 -24.178 1.00 0.00 C ATOM 248 O ASP A 16 15.307 -6.586 -25.353 1.00 0.00 O ATOM 249 CB ASP A 16 17.900 -7.781 -24.663 1.00 0.00 C ATOM 250 CG ASP A 16 17.363 -9.213 -24.673 1.00 0.00 C ATOM 251 OD1 ASP A 16 17.361 -9.843 -23.591 1.00 0.00 O ATOM 252 OD2 ASP A 16 16.957 -9.666 -25.767 1.00 0.00 O ATOM 0 H ASP A 16 16.586 -7.967 -22.083 1.00 0.00 H new ATOM 0 HA ASP A 16 17.484 -5.832 -23.892 1.00 0.00 H new ATOM 0 HB2 ASP A 16 17.900 -7.393 -25.681 1.00 0.00 H new ATOM 0 HB3 ASP A 16 18.936 -7.790 -24.325 1.00 0.00 H new ATOM 257 N ASP A 17 14.699 -6.954 -23.215 1.00 0.00 N ATOM 258 CA ASP A 17 13.260 -6.949 -23.459 1.00 0.00 C ATOM 259 C ASP A 17 12.497 -6.133 -22.412 1.00 0.00 C ATOM 260 O ASP A 17 11.267 -6.105 -22.446 1.00 0.00 O ATOM 261 CB ASP A 17 12.730 -8.387 -23.469 1.00 0.00 C ATOM 262 CG ASP A 17 13.259 -9.196 -24.651 1.00 0.00 C ATOM 263 OD1 ASP A 17 12.961 -8.802 -25.801 1.00 0.00 O ATOM 264 OD2 ASP A 17 13.958 -10.201 -24.393 1.00 0.00 O ATOM 0 H ASP A 17 14.945 -7.101 -22.236 1.00 0.00 H new ATOM 0 HA ASP A 17 13.097 -6.479 -24.429 1.00 0.00 H new ATOM 0 HB2 ASP A 17 13.012 -8.881 -22.539 1.00 0.00 H new ATOM 0 HB3 ASP A 17 11.641 -8.369 -23.503 1.00 0.00 H new ATOM 269 N ILE A 18 13.195 -5.467 -21.482 1.00 0.00 N ATOM 270 CA ILE A 18 12.535 -4.743 -20.403 1.00 0.00 C ATOM 271 C ILE A 18 12.889 -3.255 -20.458 1.00 0.00 C ATOM 272 O ILE A 18 14.014 -2.885 -20.792 1.00 0.00 O ATOM 273 CB ILE A 18 12.925 -5.372 -19.059 1.00 0.00 C ATOM 274 CG1 ILE A 18 12.491 -6.845 -19.024 1.00 0.00 C ATOM 275 CG2 ILE A 18 12.285 -4.606 -17.897 1.00 0.00 C ATOM 276 CD1 ILE A 18 13.034 -7.568 -17.789 1.00 0.00 C ATOM 0 H ILE A 18 14.214 -5.419 -21.461 1.00 0.00 H new ATOM 0 HA ILE A 18 11.454 -4.818 -20.518 1.00 0.00 H new ATOM 0 HB ILE A 18 14.008 -5.316 -18.952 1.00 0.00 H new ATOM 0 HG12 ILE A 18 11.403 -6.904 -19.030 1.00 0.00 H new ATOM 0 HG13 ILE A 18 12.843 -7.349 -19.924 1.00 0.00 H new ATOM 0 HG21 ILE A 18 12.574 -5.068 -16.953 1.00 0.00 H new ATOM 0 HG22 ILE A 18 12.625 -3.570 -17.913 1.00 0.00 H new ATOM 0 HG23 ILE A 18 11.200 -4.633 -17.997 1.00 0.00 H new ATOM 0 HD11 ILE A 18 12.705 -8.607 -17.802 1.00 0.00 H new ATOM 0 HD12 ILE A 18 14.123 -7.532 -17.796 1.00 0.00 H new ATOM 0 HD13 ILE A 18 12.661 -7.080 -16.888 1.00 0.00 H new ATOM 288 N THR A 19 11.913 -2.401 -20.127 1.00 0.00 N ATOM 289 CA THR A 19 12.073 -0.954 -20.118 1.00 0.00 C ATOM 290 C THR A 19 11.341 -0.369 -18.919 1.00 0.00 C ATOM 291 O THR A 19 10.271 -0.850 -18.555 1.00 0.00 O ATOM 292 CB THR A 19 11.510 -0.378 -21.422 1.00 0.00 C ATOM 293 OG1 THR A 19 12.184 -0.944 -22.523 1.00 0.00 O ATOM 294 CG2 THR A 19 11.666 1.140 -21.496 1.00 0.00 C ATOM 0 H THR A 19 10.979 -2.707 -19.855 1.00 0.00 H new ATOM 0 HA THR A 19 13.129 -0.696 -20.042 1.00 0.00 H new ATOM 0 HB THR A 19 10.448 -0.620 -21.446 1.00 0.00 H new ATOM 0 HG1 THR A 19 11.820 -0.574 -23.355 1.00 0.00 H new ATOM 0 HG21 THR A 19 11.253 1.503 -22.437 1.00 0.00 H new ATOM 0 HG22 THR A 19 11.134 1.601 -20.664 1.00 0.00 H new ATOM 0 HG23 THR A 19 12.723 1.400 -21.439 1.00 0.00 H new ATOM 302 N ILE A 20 11.917 0.670 -18.308 1.00 0.00 N ATOM 303 CA ILE A 20 11.366 1.315 -17.123 1.00 0.00 C ATOM 304 C ILE A 20 11.192 2.808 -17.399 1.00 0.00 C ATOM 305 O ILE A 20 12.129 3.589 -17.241 1.00 0.00 O ATOM 306 CB ILE A 20 12.271 1.079 -15.906 1.00 0.00 C ATOM 307 CG1 ILE A 20 12.710 -0.384 -15.750 1.00 0.00 C ATOM 308 CG2 ILE A 20 11.547 1.550 -14.644 1.00 0.00 C ATOM 309 CD1 ILE A 20 11.550 -1.353 -15.513 1.00 0.00 C ATOM 0 H ILE A 20 12.790 1.089 -18.630 1.00 0.00 H new ATOM 0 HA ILE A 20 10.393 0.881 -16.894 1.00 0.00 H new ATOM 0 HB ILE A 20 13.183 1.655 -16.063 1.00 0.00 H new ATOM 0 HG12 ILE A 20 13.250 -0.690 -16.646 1.00 0.00 H new ATOM 0 HG13 ILE A 20 13.409 -0.457 -14.917 1.00 0.00 H new ATOM 0 HG21 ILE A 20 12.185 1.385 -13.776 1.00 0.00 H new ATOM 0 HG22 ILE A 20 11.319 2.612 -14.730 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.620 0.989 -14.525 1.00 0.00 H new ATOM 0 HD11 ILE A 20 11.938 -2.367 -15.413 1.00 0.00 H new ATOM 0 HD12 ILE A 20 11.023 -1.074 -14.600 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.862 -1.310 -16.357 1.00 0.00 H new ATOM 321 N THR A 21 9.987 3.204 -17.815 1.00 0.00 N ATOM 322 CA THR A 21 9.672 4.589 -18.135 1.00 0.00 C ATOM 323 C THR A 21 9.332 5.371 -16.866 1.00 0.00 C ATOM 324 O THR A 21 8.983 4.782 -15.844 1.00 0.00 O ATOM 325 CB THR A 21 8.489 4.598 -19.111 1.00 0.00 C ATOM 326 OG1 THR A 21 8.802 3.798 -20.229 1.00 0.00 O ATOM 327 CG2 THR A 21 8.157 6.002 -19.616 1.00 0.00 C ATOM 0 H THR A 21 9.201 2.566 -17.938 1.00 0.00 H new ATOM 0 HA THR A 21 10.535 5.071 -18.594 1.00 0.00 H new ATOM 0 HB THR A 21 7.625 4.214 -18.569 1.00 0.00 H new ATOM 0 HG1 THR A 21 8.047 3.800 -20.854 1.00 0.00 H new ATOM 0 HG21 THR A 21 7.313 5.951 -20.303 1.00 0.00 H new ATOM 0 HG22 THR A 21 7.900 6.641 -18.771 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.022 6.416 -20.134 1.00 0.00 H new ATOM 335 N ILE A 22 9.433 6.702 -16.936 1.00 0.00 N ATOM 336 CA ILE A 22 9.040 7.610 -15.865 1.00 0.00 C ATOM 337 C ILE A 22 8.014 8.592 -16.427 1.00 0.00 C ATOM 338 O ILE A 22 8.362 9.550 -17.112 1.00 0.00 O ATOM 339 CB ILE A 22 10.271 8.288 -15.238 1.00 0.00 C ATOM 340 CG1 ILE A 22 9.885 9.437 -14.301 1.00 0.00 C ATOM 341 CG2 ILE A 22 11.241 8.833 -16.288 1.00 0.00 C ATOM 342 CD1 ILE A 22 9.039 8.943 -13.131 1.00 0.00 C ATOM 0 H ILE A 22 9.798 7.184 -17.758 1.00 0.00 H new ATOM 0 HA ILE A 22 8.571 7.066 -15.045 1.00 0.00 H new ATOM 0 HB ILE A 22 10.765 7.501 -14.668 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.787 9.918 -13.922 1.00 0.00 H new ATOM 0 HG13 ILE A 22 9.331 10.192 -14.859 1.00 0.00 H new ATOM 0 HG21 ILE A 22 12.091 9.301 -15.790 1.00 0.00 H new ATOM 0 HG22 ILE A 22 11.594 8.015 -16.917 1.00 0.00 H new ATOM 0 HG23 ILE A 22 10.731 9.572 -16.906 1.00 0.00 H new ATOM 0 HD11 ILE A 22 8.783 9.784 -12.486 1.00 0.00 H new ATOM 0 HD12 ILE A 22 8.125 8.485 -13.510 1.00 0.00 H new ATOM 0 HD13 ILE A 22 9.603 8.206 -12.559 1.00 0.00 H new ATOM 354 N LEU A 23 6.734 8.346 -16.133 1.00 0.00 N ATOM 355 CA LEU A 23 5.644 9.128 -16.696 1.00 0.00 C ATOM 356 C LEU A 23 5.557 10.494 -16.027 1.00 0.00 C ATOM 357 O LEU A 23 5.061 11.442 -16.638 1.00 0.00 O ATOM 358 CB LEU A 23 4.319 8.377 -16.537 1.00 0.00 C ATOM 359 CG LEU A 23 4.363 6.971 -17.143 1.00 0.00 C ATOM 360 CD1 LEU A 23 2.963 6.365 -17.120 1.00 0.00 C ATOM 361 CD2 LEU A 23 4.833 7.011 -18.594 1.00 0.00 C ATOM 0 H LEU A 23 6.432 7.604 -15.502 1.00 0.00 H new ATOM 0 HA LEU A 23 5.842 9.278 -17.757 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.071 8.305 -15.478 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.522 8.949 -17.012 1.00 0.00 H new ATOM 0 HG LEU A 23 5.059 6.374 -16.554 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.993 5.364 -17.551 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.609 6.307 -16.091 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.286 6.991 -17.702 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.854 5.999 -18.998 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.148 7.622 -19.182 1.00 0.00 H new ATOM 0 HD23 LEU A 23 5.833 7.441 -18.641 1.00 0.00 H new ATOM 373 N GLY A 24 6.034 10.606 -14.783 1.00 0.00 N ATOM 374 CA GLY A 24 6.156 11.909 -14.150 1.00 0.00 C ATOM 375 C GLY A 24 6.017 11.871 -12.637 1.00 0.00 C ATOM 376 O GLY A 24 5.656 10.852 -12.050 1.00 0.00 O ATOM 0 H GLY A 24 6.336 9.820 -14.208 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.125 12.338 -14.406 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.395 12.574 -14.559 1.00 0.00 H new ATOM 380 N VAL A 25 6.314 13.013 -12.012 1.00 0.00 N ATOM 381 CA VAL A 25 6.204 13.185 -10.572 1.00 0.00 C ATOM 382 C VAL A 25 4.737 13.329 -10.172 1.00 0.00 C ATOM 383 O VAL A 25 3.872 13.575 -11.011 1.00 0.00 O ATOM 384 CB VAL A 25 7.004 14.416 -10.126 1.00 0.00 C ATOM 385 CG1 VAL A 25 8.483 14.243 -10.478 1.00 0.00 C ATOM 386 CG2 VAL A 25 6.488 15.694 -10.790 1.00 0.00 C ATOM 0 H VAL A 25 6.640 13.847 -12.500 1.00 0.00 H new ATOM 0 HA VAL A 25 6.615 12.305 -10.077 1.00 0.00 H new ATOM 0 HB VAL A 25 6.882 14.506 -9.047 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.039 15.124 -10.156 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.876 13.361 -9.973 1.00 0.00 H new ATOM 0 HG13 VAL A 25 8.589 14.121 -11.556 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.079 16.545 -10.450 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.574 15.602 -11.873 1.00 0.00 H new ATOM 0 HG23 VAL A 25 5.443 15.847 -10.521 1.00 0.00 H new ATOM 396 N SER A 26 4.470 13.174 -8.875 1.00 0.00 N ATOM 397 CA SER A 26 3.149 13.304 -8.278 1.00 0.00 C ATOM 398 C SER A 26 3.316 13.792 -6.840 1.00 0.00 C ATOM 399 O SER A 26 2.608 13.348 -5.936 1.00 0.00 O ATOM 400 CB SER A 26 2.423 11.960 -8.334 1.00 0.00 C ATOM 401 OG SER A 26 2.078 11.645 -9.666 1.00 0.00 O ATOM 0 H SER A 26 5.193 12.947 -8.193 1.00 0.00 H new ATOM 0 HA SER A 26 2.546 14.026 -8.828 1.00 0.00 H new ATOM 0 HB2 SER A 26 3.060 11.177 -7.921 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.525 11.998 -7.718 1.00 0.00 H new ATOM 0 HG SER A 26 1.615 10.781 -9.689 1.00 0.00 H new ATOM 407 N GLY A 27 4.260 14.715 -6.632 1.00 0.00 N ATOM 408 CA GLY A 27 4.579 15.256 -5.323 1.00 0.00 C ATOM 409 C GLY A 27 5.388 14.244 -4.526 1.00 0.00 C ATOM 410 O GLY A 27 6.511 13.912 -4.900 1.00 0.00 O ATOM 0 H GLY A 27 4.827 15.108 -7.383 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.144 16.182 -5.431 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.662 15.503 -4.789 1.00 0.00 H new ATOM 414 N GLN A 28 4.817 13.751 -3.426 1.00 0.00 N ATOM 415 CA GLN A 28 5.445 12.714 -2.625 1.00 0.00 C ATOM 416 C GLN A 28 5.412 11.376 -3.373 1.00 0.00 C ATOM 417 O GLN A 28 6.032 10.405 -2.940 1.00 0.00 O ATOM 418 CB GLN A 28 4.693 12.615 -1.294 1.00 0.00 C ATOM 419 CG GLN A 28 5.477 11.851 -0.222 1.00 0.00 C ATOM 420 CD GLN A 28 6.751 12.587 0.180 1.00 0.00 C ATOM 421 OE1 GLN A 28 7.851 12.058 0.054 1.00 0.00 O ATOM 422 NE2 GLN A 28 6.613 13.817 0.668 1.00 0.00 N ATOM 0 H GLN A 28 3.912 14.061 -3.072 1.00 0.00 H new ATOM 0 HA GLN A 28 6.490 12.961 -2.437 1.00 0.00 H new ATOM 0 HB2 GLN A 28 4.474 13.619 -0.931 1.00 0.00 H new ATOM 0 HB3 GLN A 28 3.736 12.120 -1.459 1.00 0.00 H new ATOM 0 HG2 GLN A 28 4.847 11.708 0.656 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.733 10.860 -0.596 1.00 0.00 H new ATOM 0 HE21 GLN A 28 5.684 14.228 0.760 1.00 0.00 H new ATOM 0 HE22 GLN A 28 7.436 14.349 0.950 1.00 0.00 H new ATOM 431 N GLN A 29 4.689 11.321 -4.498 1.00 0.00 N ATOM 432 CA GLN A 29 4.556 10.109 -5.289 1.00 0.00 C ATOM 433 C GLN A 29 5.210 10.275 -6.658 1.00 0.00 C ATOM 434 O GLN A 29 5.586 11.382 -7.043 1.00 0.00 O ATOM 435 CB GLN A 29 3.078 9.736 -5.433 1.00 0.00 C ATOM 436 CG GLN A 29 2.349 9.731 -4.090 1.00 0.00 C ATOM 437 CD GLN A 29 0.929 9.219 -4.251 1.00 0.00 C ATOM 438 OE1 GLN A 29 0.553 8.204 -3.674 1.00 0.00 O ATOM 439 NE2 GLN A 29 0.123 9.919 -5.039 1.00 0.00 N ATOM 0 H GLN A 29 4.183 12.120 -4.879 1.00 0.00 H new ATOM 0 HA GLN A 29 5.071 9.300 -4.772 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.591 10.442 -6.106 1.00 0.00 H new ATOM 0 HB3 GLN A 29 2.997 8.751 -5.892 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.889 9.104 -3.380 1.00 0.00 H new ATOM 0 HG3 GLN A 29 2.332 10.739 -3.676 1.00 0.00 H new ATOM 0 HE21 GLN A 29 0.468 10.759 -5.504 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -0.841 9.617 -5.180 1.00 0.00 H new ATOM 448 N VAL A 30 5.344 9.168 -7.392 1.00 0.00 N ATOM 449 CA VAL A 30 5.941 9.141 -8.719 1.00 0.00 C ATOM 450 C VAL A 30 5.261 8.067 -9.564 1.00 0.00 C ATOM 451 O VAL A 30 5.128 6.926 -9.123 1.00 0.00 O ATOM 452 CB VAL A 30 7.439 8.831 -8.608 1.00 0.00 C ATOM 453 CG1 VAL A 30 8.068 8.812 -9.999 1.00 0.00 C ATOM 454 CG2 VAL A 30 8.171 9.886 -7.778 1.00 0.00 C ATOM 0 H VAL A 30 5.033 8.251 -7.070 1.00 0.00 H new ATOM 0 HA VAL A 30 5.808 10.114 -9.191 1.00 0.00 H new ATOM 0 HB VAL A 30 7.534 7.860 -8.122 1.00 0.00 H new ATOM 0 HG11 VAL A 30 9.132 8.591 -9.914 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.586 8.046 -10.606 1.00 0.00 H new ATOM 0 HG13 VAL A 30 7.936 9.785 -10.471 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.230 9.634 -7.721 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.056 10.863 -8.248 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.750 9.915 -6.773 1.00 0.00 H new ATOM 464 N ARG A 31 4.830 8.432 -10.776 1.00 0.00 N ATOM 465 CA ARG A 31 4.221 7.490 -11.701 1.00 0.00 C ATOM 466 C ARG A 31 5.287 6.910 -12.624 1.00 0.00 C ATOM 467 O ARG A 31 5.804 7.602 -13.502 1.00 0.00 O ATOM 468 CB ARG A 31 3.090 8.151 -12.489 1.00 0.00 C ATOM 469 CG ARG A 31 2.417 7.104 -13.379 1.00 0.00 C ATOM 470 CD ARG A 31 1.063 7.606 -13.881 1.00 0.00 C ATOM 471 NE ARG A 31 0.102 7.634 -12.774 1.00 0.00 N ATOM 472 CZ ARG A 31 -1.228 7.700 -12.880 1.00 0.00 C ATOM 473 NH1 ARG A 31 -1.834 7.760 -14.064 1.00 0.00 N ATOM 474 NH2 ARG A 31 -1.960 7.707 -11.770 1.00 0.00 N ATOM 0 H ARG A 31 4.896 9.384 -11.135 1.00 0.00 H new ATOM 0 HA ARG A 31 3.778 6.671 -11.134 1.00 0.00 H new ATOM 0 HB2 ARG A 31 2.361 8.587 -11.806 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.483 8.965 -13.098 1.00 0.00 H new ATOM 0 HG2 ARG A 31 3.061 6.873 -14.227 1.00 0.00 H new ATOM 0 HG3 ARG A 31 2.282 6.178 -12.820 1.00 0.00 H new ATOM 0 HD2 ARG A 31 1.170 8.604 -14.307 1.00 0.00 H new ATOM 0 HD3 ARG A 31 0.696 6.957 -14.677 1.00 0.00 H new ATOM 0 HE ARG A 31 0.487 7.600 -11.830 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -1.281 7.756 -14.921 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -2.852 7.810 -14.114 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.505 7.662 -10.858 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.977 7.757 -11.830 1.00 0.00 H new ATOM 488 N ILE A 32 5.601 5.630 -12.403 1.00 0.00 N ATOM 489 CA ILE A 32 6.599 4.877 -13.147 1.00 0.00 C ATOM 490 C ILE A 32 5.875 3.880 -14.056 1.00 0.00 C ATOM 491 O ILE A 32 4.723 3.533 -13.801 1.00 0.00 O ATOM 492 CB ILE A 32 7.533 4.171 -12.145 1.00 0.00 C ATOM 493 CG1 ILE A 32 8.133 5.207 -11.184 1.00 0.00 C ATOM 494 CG2 ILE A 32 8.658 3.421 -12.865 1.00 0.00 C ATOM 495 CD1 ILE A 32 9.000 4.562 -10.100 1.00 0.00 C ATOM 0 H ILE A 32 5.149 5.076 -11.675 1.00 0.00 H new ATOM 0 HA ILE A 32 7.208 5.529 -13.773 1.00 0.00 H new ATOM 0 HB ILE A 32 6.945 3.443 -11.586 1.00 0.00 H new ATOM 0 HG12 ILE A 32 8.733 5.919 -11.750 1.00 0.00 H new ATOM 0 HG13 ILE A 32 7.328 5.772 -10.714 1.00 0.00 H new ATOM 0 HG21 ILE A 32 9.299 2.934 -12.130 1.00 0.00 H new ATOM 0 HG22 ILE A 32 8.228 2.669 -13.527 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.248 4.126 -13.451 1.00 0.00 H new ATOM 0 HD11 ILE A 32 9.401 5.336 -9.446 1.00 0.00 H new ATOM 0 HD12 ILE A 32 8.395 3.870 -9.514 1.00 0.00 H new ATOM 0 HD13 ILE A 32 9.822 4.020 -10.567 1.00 0.00 H new ATOM 507 N GLY A 33 6.545 3.418 -15.116 1.00 0.00 N ATOM 508 CA GLY A 33 5.969 2.488 -16.074 1.00 0.00 C ATOM 509 C GLY A 33 6.909 1.314 -16.317 1.00 0.00 C ATOM 510 O GLY A 33 7.883 1.442 -17.056 1.00 0.00 O ATOM 0 H GLY A 33 7.506 3.684 -15.329 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.011 2.123 -15.703 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.771 3.003 -17.014 1.00 0.00 H new ATOM 514 N ILE A 34 6.620 0.168 -15.695 1.00 0.00 N ATOM 515 CA ILE A 34 7.449 -1.018 -15.824 1.00 0.00 C ATOM 516 C ILE A 34 6.949 -1.808 -17.027 1.00 0.00 C ATOM 517 O ILE A 34 5.823 -2.304 -17.015 1.00 0.00 O ATOM 518 CB ILE A 34 7.389 -1.874 -14.550 1.00 0.00 C ATOM 519 CG1 ILE A 34 7.972 -1.156 -13.324 1.00 0.00 C ATOM 520 CG2 ILE A 34 8.217 -3.142 -14.779 1.00 0.00 C ATOM 521 CD1 ILE A 34 6.997 -0.160 -12.691 1.00 0.00 C ATOM 0 H ILE A 34 5.807 0.043 -15.092 1.00 0.00 H new ATOM 0 HA ILE A 34 8.490 -0.730 -15.967 1.00 0.00 H new ATOM 0 HB ILE A 34 6.339 -2.090 -14.352 1.00 0.00 H new ATOM 0 HG12 ILE A 34 8.259 -1.898 -12.579 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.881 -0.630 -13.617 1.00 0.00 H new ATOM 0 HG21 ILE A 34 8.186 -3.763 -13.884 1.00 0.00 H new ATOM 0 HG22 ILE A 34 7.805 -3.698 -15.621 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.250 -2.868 -14.995 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.469 0.314 -11.830 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.729 0.602 -13.423 1.00 0.00 H new ATOM 0 HD13 ILE A 34 6.098 -0.686 -12.369 1.00 0.00 H new ATOM 533 N ASN A 35 7.774 -1.930 -18.067 1.00 0.00 N ATOM 534 CA ASN A 35 7.385 -2.614 -19.288 1.00 0.00 C ATOM 535 C ASN A 35 8.227 -3.863 -19.504 1.00 0.00 C ATOM 536 O ASN A 35 9.428 -3.785 -19.754 1.00 0.00 O ATOM 537 CB ASN A 35 7.493 -1.658 -20.472 1.00 0.00 C ATOM 538 CG ASN A 35 6.876 -2.266 -21.723 1.00 0.00 C ATOM 539 OD1 ASN A 35 5.692 -2.588 -21.741 1.00 0.00 O ATOM 540 ND2 ASN A 35 7.674 -2.429 -22.777 1.00 0.00 N ATOM 0 H ASN A 35 8.724 -1.558 -18.082 1.00 0.00 H new ATOM 0 HA ASN A 35 6.348 -2.936 -19.198 1.00 0.00 H new ATOM 0 HB2 ASN A 35 6.991 -0.720 -20.234 1.00 0.00 H new ATOM 0 HB3 ASN A 35 8.540 -1.420 -20.658 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.306 -2.834 -23.638 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.653 -2.149 -22.723 1.00 0.00 H new ATOM 547 N ALA A 36 7.570 -5.016 -19.405 1.00 0.00 N ATOM 548 CA ALA A 36 8.170 -6.325 -19.595 1.00 0.00 C ATOM 549 C ALA A 36 7.137 -7.239 -20.255 1.00 0.00 C ATOM 550 O ALA A 36 5.935 -6.987 -20.140 1.00 0.00 O ATOM 551 CB ALA A 36 8.591 -6.868 -18.229 1.00 0.00 C ATOM 0 H ALA A 36 6.575 -5.062 -19.183 1.00 0.00 H new ATOM 0 HA ALA A 36 9.050 -6.269 -20.236 1.00 0.00 H new ATOM 0 HB1 ALA A 36 9.044 -7.852 -18.352 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.314 -6.190 -17.775 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.716 -6.950 -17.585 1.00 0.00 H new ATOM 557 N PRO A 37 7.574 -8.299 -20.948 1.00 0.00 N ATOM 558 CA PRO A 37 6.666 -9.238 -21.577 1.00 0.00 C ATOM 559 C PRO A 37 5.928 -10.017 -20.494 1.00 0.00 C ATOM 560 O PRO A 37 6.415 -10.138 -19.372 1.00 0.00 O ATOM 561 CB PRO A 37 7.554 -10.142 -22.433 1.00 0.00 C ATOM 562 CG PRO A 37 8.898 -10.102 -21.709 1.00 0.00 C ATOM 563 CD PRO A 37 8.958 -8.674 -21.172 1.00 0.00 C ATOM 0 HA PRO A 37 5.904 -8.759 -22.193 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.158 -11.156 -22.491 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.637 -9.773 -23.455 1.00 0.00 H new ATOM 0 HG2 PRO A 37 8.946 -10.837 -20.906 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.727 -10.314 -22.385 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.535 -8.623 -20.249 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.438 -8.004 -21.885 1.00 0.00 H new ATOM 571 N LYS A 38 4.749 -10.553 -20.816 1.00 0.00 N ATOM 572 CA LYS A 38 3.961 -11.285 -19.834 1.00 0.00 C ATOM 573 C LYS A 38 4.618 -12.622 -19.477 1.00 0.00 C ATOM 574 O LYS A 38 4.105 -13.370 -18.648 1.00 0.00 O ATOM 575 CB LYS A 38 2.523 -11.428 -20.339 1.00 0.00 C ATOM 576 CG LYS A 38 1.562 -11.570 -19.155 1.00 0.00 C ATOM 577 CD LYS A 38 0.124 -11.346 -19.618 1.00 0.00 C ATOM 578 CE LYS A 38 -0.829 -11.487 -18.432 1.00 0.00 C ATOM 579 NZ LYS A 38 -2.222 -11.214 -18.831 1.00 0.00 N ATOM 0 H LYS A 38 4.325 -10.493 -21.742 1.00 0.00 H new ATOM 0 HA LYS A 38 3.924 -10.724 -18.900 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.251 -10.558 -20.936 1.00 0.00 H new ATOM 0 HB3 LYS A 38 2.442 -12.299 -20.989 1.00 0.00 H new ATOM 0 HG2 LYS A 38 1.660 -12.562 -18.714 1.00 0.00 H new ATOM 0 HG3 LYS A 38 1.819 -10.849 -18.379 1.00 0.00 H new ATOM 0 HD2 LYS A 38 0.025 -10.355 -20.060 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.135 -12.068 -20.392 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.756 -12.494 -18.022 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -0.533 -10.798 -17.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -2.846 -11.317 -18.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -2.294 -10.244 -19.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -2.510 -11.888 -19.569 1.00 0.00 H new ATOM 593 N ASP A 39 5.759 -12.918 -20.110 1.00 0.00 N ATOM 594 CA ASP A 39 6.576 -14.083 -19.813 1.00 0.00 C ATOM 595 C ASP A 39 7.230 -13.963 -18.434 1.00 0.00 C ATOM 596 O ASP A 39 7.725 -14.953 -17.898 1.00 0.00 O ATOM 597 CB ASP A 39 7.672 -14.185 -20.875 1.00 0.00 C ATOM 598 CG ASP A 39 8.430 -15.508 -20.782 1.00 0.00 C ATOM 599 OD1 ASP A 39 7.777 -16.561 -20.955 1.00 0.00 O ATOM 600 OD2 ASP A 39 9.656 -15.455 -20.542 1.00 0.00 O ATOM 0 H ASP A 39 6.141 -12.338 -20.857 1.00 0.00 H new ATOM 0 HA ASP A 39 5.942 -14.970 -19.815 1.00 0.00 H new ATOM 0 HB2 ASP A 39 7.228 -14.089 -21.866 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.371 -13.357 -20.757 1.00 0.00 H new ATOM 605 N VAL A 40 7.230 -12.754 -17.863 1.00 0.00 N ATOM 606 CA VAL A 40 7.842 -12.485 -16.570 1.00 0.00 C ATOM 607 C VAL A 40 6.857 -11.734 -15.679 1.00 0.00 C ATOM 608 O VAL A 40 5.842 -11.227 -16.157 1.00 0.00 O ATOM 609 CB VAL A 40 9.152 -11.703 -16.748 1.00 0.00 C ATOM 610 CG1 VAL A 40 10.075 -12.403 -17.745 1.00 0.00 C ATOM 611 CG2 VAL A 40 8.906 -10.288 -17.268 1.00 0.00 C ATOM 0 H VAL A 40 6.801 -11.934 -18.292 1.00 0.00 H new ATOM 0 HA VAL A 40 8.088 -13.429 -16.084 1.00 0.00 H new ATOM 0 HB VAL A 40 9.613 -11.657 -15.761 1.00 0.00 H new ATOM 0 HG11 VAL A 40 10.996 -11.829 -17.853 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.311 -13.403 -17.382 1.00 0.00 H new ATOM 0 HG13 VAL A 40 9.577 -12.476 -18.712 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.859 -9.770 -17.379 1.00 0.00 H new ATOM 0 HG22 VAL A 40 8.405 -10.338 -18.235 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.278 -9.745 -16.562 1.00 0.00 H new ATOM 621 N ALA A 41 7.151 -11.658 -14.379 1.00 0.00 N ATOM 622 CA ALA A 41 6.256 -11.019 -13.427 1.00 0.00 C ATOM 623 C ALA A 41 6.758 -9.630 -13.040 1.00 0.00 C ATOM 624 O ALA A 41 7.933 -9.311 -13.215 1.00 0.00 O ATOM 625 CB ALA A 41 6.135 -11.911 -12.192 1.00 0.00 C ATOM 0 H ALA A 41 8.005 -12.033 -13.966 1.00 0.00 H new ATOM 0 HA ALA A 41 5.277 -10.891 -13.888 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.466 -11.443 -11.469 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.734 -12.882 -12.482 1.00 0.00 H new ATOM 0 HB3 ALA A 41 7.119 -12.045 -11.742 1.00 0.00 H new ATOM 631 N VAL A 42 5.850 -8.806 -12.511 1.00 0.00 N ATOM 632 CA VAL A 42 6.153 -7.482 -11.986 1.00 0.00 C ATOM 633 C VAL A 42 5.114 -7.127 -10.923 1.00 0.00 C ATOM 634 O VAL A 42 3.923 -7.034 -11.212 1.00 0.00 O ATOM 635 CB VAL A 42 6.216 -6.431 -13.108 1.00 0.00 C ATOM 636 CG1 VAL A 42 5.203 -6.699 -14.216 1.00 0.00 C ATOM 637 CG2 VAL A 42 5.981 -5.017 -12.572 1.00 0.00 C ATOM 0 H VAL A 42 4.863 -9.051 -12.436 1.00 0.00 H new ATOM 0 HA VAL A 42 7.141 -7.489 -11.526 1.00 0.00 H new ATOM 0 HB VAL A 42 7.222 -6.507 -13.521 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.289 -5.929 -14.982 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.399 -7.675 -14.659 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.196 -6.685 -13.799 1.00 0.00 H new ATOM 0 HG21 VAL A 42 6.033 -4.303 -13.394 1.00 0.00 H new ATOM 0 HG22 VAL A 42 4.997 -4.963 -12.107 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.745 -4.776 -11.833 1.00 0.00 H new ATOM 647 N HIS A 43 5.576 -6.929 -9.686 1.00 0.00 N ATOM 648 CA HIS A 43 4.726 -6.553 -8.566 1.00 0.00 C ATOM 649 C HIS A 43 5.462 -5.573 -7.657 1.00 0.00 C ATOM 650 O HIS A 43 6.690 -5.512 -7.672 1.00 0.00 O ATOM 651 CB HIS A 43 4.337 -7.801 -7.764 1.00 0.00 C ATOM 652 CG HIS A 43 3.475 -8.776 -8.523 1.00 0.00 C ATOM 653 ND1 HIS A 43 2.119 -8.956 -8.357 1.00 0.00 N ATOM 654 CD2 HIS A 43 3.894 -9.641 -9.496 1.00 0.00 C ATOM 655 CE1 HIS A 43 1.730 -9.900 -9.234 1.00 0.00 C ATOM 656 NE2 HIS A 43 2.777 -10.350 -9.947 1.00 0.00 N ATOM 0 H HIS A 43 6.560 -7.027 -9.437 1.00 0.00 H new ATOM 0 HA HIS A 43 3.825 -6.077 -8.953 1.00 0.00 H new ATOM 0 HB2 HIS A 43 5.245 -8.310 -7.441 1.00 0.00 H new ATOM 0 HB3 HIS A 43 3.808 -7.490 -6.863 1.00 0.00 H new ATOM 0 HD2 HIS A 43 4.907 -9.756 -9.852 1.00 0.00 H new ATOM 0 HE1 HIS A 43 0.714 -10.249 -9.349 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.760 -11.066 -10.673 1.00 0.00 H new ATOM 664 N ARG A 44 4.713 -4.802 -6.863 1.00 0.00 N ATOM 665 CA ARG A 44 5.303 -3.887 -5.894 1.00 0.00 C ATOM 666 C ARG A 44 5.764 -4.667 -4.663 1.00 0.00 C ATOM 667 O ARG A 44 5.365 -5.813 -4.468 1.00 0.00 O ATOM 668 CB ARG A 44 4.296 -2.786 -5.542 1.00 0.00 C ATOM 669 CG ARG A 44 3.052 -3.389 -4.893 1.00 0.00 C ATOM 670 CD ARG A 44 1.993 -2.336 -4.595 1.00 0.00 C ATOM 671 NE ARG A 44 1.259 -1.941 -5.798 1.00 0.00 N ATOM 672 CZ ARG A 44 0.303 -1.010 -5.806 1.00 0.00 C ATOM 673 NH1 ARG A 44 -0.018 -0.342 -4.700 1.00 0.00 N ATOM 674 NH2 ARG A 44 -0.339 -0.749 -6.940 1.00 0.00 N ATOM 0 H ARG A 44 3.693 -4.797 -6.876 1.00 0.00 H new ATOM 0 HA ARG A 44 6.181 -3.402 -6.321 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.756 -2.067 -4.863 1.00 0.00 H new ATOM 0 HB3 ARG A 44 4.015 -2.240 -6.443 1.00 0.00 H new ATOM 0 HG2 ARG A 44 2.632 -4.148 -5.552 1.00 0.00 H new ATOM 0 HG3 ARG A 44 3.334 -3.891 -3.967 1.00 0.00 H new ATOM 0 HD2 ARG A 44 1.294 -2.725 -3.855 1.00 0.00 H new ATOM 0 HD3 ARG A 44 2.468 -1.459 -4.155 1.00 0.00 H new ATOM 0 HE ARG A 44 1.491 -2.402 -6.678 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.470 -0.538 -3.826 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -0.752 0.366 -4.727 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.099 -1.258 -7.791 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.072 -0.040 -6.960 1.00 0.00 H new ATOM 688 N GLU A 45 6.604 -4.055 -3.827 1.00 0.00 N ATOM 689 CA GLU A 45 7.199 -4.747 -2.688 1.00 0.00 C ATOM 690 C GLU A 45 6.162 -5.140 -1.631 1.00 0.00 C ATOM 691 O GLU A 45 6.332 -6.141 -0.938 1.00 0.00 O ATOM 692 CB GLU A 45 8.275 -3.841 -2.083 1.00 0.00 C ATOM 693 CG GLU A 45 9.137 -4.580 -1.058 1.00 0.00 C ATOM 694 CD GLU A 45 9.934 -5.710 -1.710 1.00 0.00 C ATOM 695 OE1 GLU A 45 10.993 -5.405 -2.301 1.00 0.00 O ATOM 696 OE2 GLU A 45 9.480 -6.873 -1.613 1.00 0.00 O ATOM 0 H GLU A 45 6.887 -3.079 -3.920 1.00 0.00 H new ATOM 0 HA GLU A 45 7.639 -5.680 -3.039 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.911 -3.452 -2.878 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.801 -2.983 -1.606 1.00 0.00 H new ATOM 0 HG2 GLU A 45 9.821 -3.878 -0.582 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.501 -4.988 -0.272 1.00 0.00 H new ATOM 703 N GLU A 46 5.084 -4.360 -1.500 1.00 0.00 N ATOM 704 CA GLU A 46 4.037 -4.625 -0.518 1.00 0.00 C ATOM 705 C GLU A 46 2.975 -5.593 -1.049 1.00 0.00 C ATOM 706 O GLU A 46 1.977 -5.844 -0.377 1.00 0.00 O ATOM 707 CB GLU A 46 3.412 -3.303 -0.061 1.00 0.00 C ATOM 708 CG GLU A 46 2.719 -2.566 -1.206 1.00 0.00 C ATOM 709 CD GLU A 46 2.135 -1.236 -0.732 1.00 0.00 C ATOM 710 OE1 GLU A 46 1.203 -1.275 0.101 1.00 0.00 O ATOM 711 OE2 GLU A 46 2.631 -0.191 -1.207 1.00 0.00 O ATOM 0 H GLU A 46 4.916 -3.531 -2.071 1.00 0.00 H new ATOM 0 HA GLU A 46 4.494 -5.116 0.341 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.690 -3.499 0.732 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.187 -2.665 0.364 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.432 -2.387 -2.011 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.925 -3.190 -1.616 1.00 0.00 H new ATOM 718 N ILE A 47 3.186 -6.135 -2.254 1.00 0.00 N ATOM 719 CA ILE A 47 2.253 -7.043 -2.914 1.00 0.00 C ATOM 720 C ILE A 47 2.967 -8.328 -3.319 1.00 0.00 C ATOM 721 O ILE A 47 2.344 -9.386 -3.359 1.00 0.00 O ATOM 722 CB ILE A 47 1.670 -6.318 -4.129 1.00 0.00 C ATOM 723 CG1 ILE A 47 0.644 -5.264 -3.695 1.00 0.00 C ATOM 724 CG2 ILE A 47 1.033 -7.234 -5.166 1.00 0.00 C ATOM 725 CD1 ILE A 47 -0.679 -5.867 -3.223 1.00 0.00 C ATOM 0 H ILE A 47 4.025 -5.949 -2.803 1.00 0.00 H new ATOM 0 HA ILE A 47 1.445 -7.324 -2.239 1.00 0.00 H new ATOM 0 HB ILE A 47 2.527 -5.847 -4.610 1.00 0.00 H new ATOM 0 HG12 ILE A 47 1.069 -4.663 -2.891 1.00 0.00 H new ATOM 0 HG13 ILE A 47 0.451 -4.590 -4.529 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.647 -6.636 -5.991 1.00 0.00 H new ATOM 0 HG22 ILE A 47 1.780 -7.932 -5.543 1.00 0.00 H new ATOM 0 HG23 ILE A 47 0.216 -7.790 -4.707 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -1.360 -5.067 -2.931 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.125 -6.445 -4.033 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.497 -6.519 -2.369 1.00 0.00 H new ATOM 737 N TYR A 48 4.266 -8.252 -3.619 1.00 0.00 N ATOM 738 CA TYR A 48 5.047 -9.436 -3.932 1.00 0.00 C ATOM 739 C TYR A 48 5.097 -10.361 -2.717 1.00 0.00 C ATOM 740 O TYR A 48 4.969 -11.575 -2.851 1.00 0.00 O ATOM 741 CB TYR A 48 6.458 -9.018 -4.344 1.00 0.00 C ATOM 742 CG TYR A 48 7.400 -10.191 -4.483 1.00 0.00 C ATOM 743 CD1 TYR A 48 7.124 -11.209 -5.408 1.00 0.00 C ATOM 744 CD2 TYR A 48 8.548 -10.262 -3.681 1.00 0.00 C ATOM 745 CE1 TYR A 48 7.986 -12.310 -5.522 1.00 0.00 C ATOM 746 CE2 TYR A 48 9.417 -11.357 -3.789 1.00 0.00 C ATOM 747 CZ TYR A 48 9.138 -12.386 -4.712 1.00 0.00 C ATOM 748 OH TYR A 48 9.982 -13.452 -4.819 1.00 0.00 O ATOM 0 H TYR A 48 4.793 -7.379 -3.650 1.00 0.00 H new ATOM 0 HA TYR A 48 4.581 -9.974 -4.757 1.00 0.00 H new ATOM 0 HB2 TYR A 48 6.411 -8.482 -5.292 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.857 -8.324 -3.604 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.246 -11.145 -6.034 1.00 0.00 H new ATOM 0 HD2 TYR A 48 8.763 -9.471 -2.978 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.768 -13.097 -6.228 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.298 -11.412 -3.167 1.00 0.00 H new ATOM 0 HH TYR A 48 10.726 -13.345 -4.190 1.00 0.00 H new ATOM 846 N MET B 1 2.539 -2.368 -20.812 1.00 0.00 N ATOM 847 CA MET B 1 3.247 -1.743 -19.679 1.00 0.00 C ATOM 848 C MET B 1 2.393 -1.800 -18.419 1.00 0.00 C ATOM 849 O MET B 1 1.172 -1.702 -18.503 1.00 0.00 O ATOM 850 CB MET B 1 3.620 -0.298 -20.023 1.00 0.00 C ATOM 851 CG MET B 1 4.454 0.354 -18.922 1.00 0.00 C ATOM 852 SD MET B 1 5.409 1.791 -19.475 1.00 0.00 S ATOM 853 CE MET B 1 4.074 2.883 -20.032 1.00 0.00 C ATOM 0 H1 MET B 1 2.588 -1.741 -21.640 1.00 0.00 H new ATOM 0 H2 MET B 1 2.986 -3.279 -21.040 1.00 0.00 H new ATOM 0 H3 MET B 1 1.544 -2.525 -20.555 1.00 0.00 H new ATOM 0 HA MET B 1 4.165 -2.299 -19.488 1.00 0.00 H new ATOM 0 HB2 MET B 1 4.178 -0.280 -20.959 1.00 0.00 H new ATOM 0 HB3 MET B 1 2.712 0.283 -20.182 1.00 0.00 H new ATOM 0 HG2 MET B 1 3.792 0.660 -18.112 1.00 0.00 H new ATOM 0 HG3 MET B 1 5.138 -0.388 -18.511 1.00 0.00 H new ATOM 0 HE1 MET B 1 4.501 3.761 -20.517 1.00 0.00 H new ATOM 0 HE2 MET B 1 3.439 2.350 -20.740 1.00 0.00 H new ATOM 0 HE3 MET B 1 3.478 3.196 -19.175 1.00 0.00 H new ATOM 865 N LEU B 2 3.034 -1.959 -17.257 1.00 0.00 N ATOM 866 CA LEU B 2 2.351 -1.970 -15.973 1.00 0.00 C ATOM 867 C LEU B 2 2.705 -0.689 -15.220 1.00 0.00 C ATOM 868 O LEU B 2 3.731 -0.613 -14.544 1.00 0.00 O ATOM 869 CB LEU B 2 2.751 -3.216 -15.170 1.00 0.00 C ATOM 870 CG LEU B 2 1.659 -3.702 -14.204 1.00 0.00 C ATOM 871 CD1 LEU B 2 2.268 -4.445 -13.028 1.00 0.00 C ATOM 872 CD2 LEU B 2 0.766 -2.608 -13.640 1.00 0.00 C ATOM 0 H LEU B 2 4.044 -2.084 -17.187 1.00 0.00 H new ATOM 0 HA LEU B 2 1.272 -2.009 -16.122 1.00 0.00 H new ATOM 0 HB2 LEU B 2 2.996 -4.021 -15.863 1.00 0.00 H new ATOM 0 HB3 LEU B 2 3.655 -2.997 -14.602 1.00 0.00 H new ATOM 0 HG LEU B 2 1.036 -4.352 -14.818 1.00 0.00 H new ATOM 0 HD11 LEU B 2 1.475 -4.779 -12.359 1.00 0.00 H new ATOM 0 HD12 LEU B 2 2.824 -5.309 -13.392 1.00 0.00 H new ATOM 0 HD13 LEU B 2 2.943 -3.781 -12.488 1.00 0.00 H new ATOM 0 HD21 LEU B 2 0.028 -3.050 -12.970 1.00 0.00 H new ATOM 0 HD22 LEU B 2 1.374 -1.891 -13.088 1.00 0.00 H new ATOM 0 HD23 LEU B 2 0.255 -2.098 -14.457 1.00 0.00 H new ATOM 884 N ILE B 3 1.848 0.324 -15.340 1.00 0.00 N ATOM 885 CA ILE B 3 2.059 1.605 -14.692 1.00 0.00 C ATOM 886 C ILE B 3 1.691 1.489 -13.215 1.00 0.00 C ATOM 887 O ILE B 3 0.771 0.758 -12.854 1.00 0.00 O ATOM 888 CB ILE B 3 1.209 2.679 -15.389 1.00 0.00 C ATOM 889 CG1 ILE B 3 1.684 2.929 -16.827 1.00 0.00 C ATOM 890 CG2 ILE B 3 1.326 4.008 -14.640 1.00 0.00 C ATOM 891 CD1 ILE B 3 1.154 1.916 -17.839 1.00 0.00 C ATOM 0 H ILE B 3 0.990 0.274 -15.890 1.00 0.00 H new ATOM 0 HA ILE B 3 3.107 1.895 -14.767 1.00 0.00 H new ATOM 0 HB ILE B 3 0.182 2.315 -15.396 1.00 0.00 H new ATOM 0 HG12 ILE B 3 1.375 3.929 -17.133 1.00 0.00 H new ATOM 0 HG13 ILE B 3 2.774 2.912 -16.847 1.00 0.00 H new ATOM 0 HG21 ILE B 3 0.720 4.763 -15.141 1.00 0.00 H new ATOM 0 HG22 ILE B 3 0.973 3.881 -13.616 1.00 0.00 H new ATOM 0 HG23 ILE B 3 2.368 4.328 -14.628 1.00 0.00 H new ATOM 0 HD11 ILE B 3 1.534 2.160 -18.831 1.00 0.00 H new ATOM 0 HD12 ILE B 3 1.485 0.916 -17.560 1.00 0.00 H new ATOM 0 HD13 ILE B 3 0.065 1.948 -17.850 1.00 0.00 H new ATOM 903 N LEU B 4 2.416 2.217 -12.362 1.00 0.00 N ATOM 904 CA LEU B 4 2.148 2.308 -10.936 1.00 0.00 C ATOM 905 C LEU B 4 2.445 3.741 -10.496 1.00 0.00 C ATOM 906 O LEU B 4 3.146 4.466 -11.198 1.00 0.00 O ATOM 907 CB LEU B 4 3.059 1.342 -10.166 1.00 0.00 C ATOM 908 CG LEU B 4 2.800 -0.138 -10.474 1.00 0.00 C ATOM 909 CD1 LEU B 4 3.875 -0.981 -9.792 1.00 0.00 C ATOM 910 CD2 LEU B 4 1.451 -0.594 -9.926 1.00 0.00 C ATOM 0 H LEU B 4 3.222 2.769 -12.656 1.00 0.00 H new ATOM 0 HA LEU B 4 1.110 2.046 -10.732 1.00 0.00 H new ATOM 0 HB2 LEU B 4 4.098 1.575 -10.399 1.00 0.00 H new ATOM 0 HB3 LEU B 4 2.927 1.509 -9.097 1.00 0.00 H new ATOM 0 HG LEU B 4 2.812 -0.261 -11.557 1.00 0.00 H new ATOM 0 HD11 LEU B 4 3.700 -2.036 -10.005 1.00 0.00 H new ATOM 0 HD12 LEU B 4 4.857 -0.693 -10.168 1.00 0.00 H new ATOM 0 HD13 LEU B 4 3.837 -0.817 -8.715 1.00 0.00 H new ATOM 0 HD21 LEU B 4 1.300 -1.647 -10.162 1.00 0.00 H new ATOM 0 HD22 LEU B 4 1.433 -0.458 -8.845 1.00 0.00 H new ATOM 0 HD23 LEU B 4 0.655 -0.003 -10.379 1.00 0.00 H new ATOM 922 N THR B 5 1.922 4.156 -9.339 1.00 0.00 N ATOM 923 CA THR B 5 2.210 5.475 -8.786 1.00 0.00 C ATOM 924 C THR B 5 2.724 5.299 -7.364 1.00 0.00 C ATOM 925 O THR B 5 1.993 5.500 -6.395 1.00 0.00 O ATOM 926 CB THR B 5 0.979 6.384 -8.851 1.00 0.00 C ATOM 927 OG1 THR B 5 0.495 6.442 -10.174 1.00 0.00 O ATOM 928 CG2 THR B 5 1.327 7.808 -8.423 1.00 0.00 C ATOM 0 H THR B 5 1.294 3.591 -8.767 1.00 0.00 H new ATOM 0 HA THR B 5 2.979 5.969 -9.380 1.00 0.00 H new ATOM 0 HB THR B 5 0.228 5.969 -8.179 1.00 0.00 H new ATOM 0 HG1 THR B 5 -0.426 6.109 -10.200 1.00 0.00 H new ATOM 0 HG21 THR B 5 0.435 8.433 -8.478 1.00 0.00 H new ATOM 0 HG22 THR B 5 1.701 7.799 -7.399 1.00 0.00 H new ATOM 0 HG23 THR B 5 2.093 8.210 -9.086 1.00 0.00 H new ATOM 936 N ARG B 6 3.997 4.916 -7.238 1.00 0.00 N ATOM 937 CA ARG B 6 4.591 4.601 -5.947 1.00 0.00 C ATOM 938 C ARG B 6 4.943 5.881 -5.208 1.00 0.00 C ATOM 939 O ARG B 6 4.851 6.972 -5.768 1.00 0.00 O ATOM 940 CB ARG B 6 5.853 3.755 -6.146 1.00 0.00 C ATOM 941 CG ARG B 6 5.549 2.426 -6.841 1.00 0.00 C ATOM 942 CD ARG B 6 4.576 1.567 -6.029 1.00 0.00 C ATOM 943 NE ARG B 6 5.164 1.114 -4.761 1.00 0.00 N ATOM 944 CZ ARG B 6 4.453 0.848 -3.661 1.00 0.00 C ATOM 945 NH1 ARG B 6 3.132 1.007 -3.640 1.00 0.00 N ATOM 946 NH2 ARG B 6 5.054 0.414 -2.559 1.00 0.00 N ATOM 0 H ARG B 6 4.637 4.818 -8.026 1.00 0.00 H new ATOM 0 HA ARG B 6 3.870 4.036 -5.356 1.00 0.00 H new ATOM 0 HB2 ARG B 6 6.576 4.316 -6.738 1.00 0.00 H new ATOM 0 HB3 ARG B 6 6.315 3.561 -5.178 1.00 0.00 H new ATOM 0 HG2 ARG B 6 5.126 2.620 -7.827 1.00 0.00 H new ATOM 0 HG3 ARG B 6 6.477 1.876 -6.995 1.00 0.00 H new ATOM 0 HD2 ARG B 6 3.671 2.140 -5.824 1.00 0.00 H new ATOM 0 HD3 ARG B 6 4.278 0.701 -6.620 1.00 0.00 H new ATOM 0 HE ARG B 6 6.176 0.995 -4.718 1.00 0.00 H new ATOM 0 HH11 ARG B 6 2.645 1.337 -4.473 1.00 0.00 H new ATOM 0 HH12 ARG B 6 2.607 0.799 -2.791 1.00 0.00 H new ATOM 0 HH21 ARG B 6 6.065 0.281 -2.548 1.00 0.00 H new ATOM 0 HH22 ARG B 6 4.504 0.213 -1.724 1.00 0.00 H new ATOM 960 N LYS B 7 5.352 5.748 -3.944 1.00 0.00 N ATOM 961 CA LYS B 7 5.831 6.884 -3.175 1.00 0.00 C ATOM 962 C LYS B 7 7.348 6.777 -3.086 1.00 0.00 C ATOM 963 O LYS B 7 7.891 5.677 -3.171 1.00 0.00 O ATOM 964 CB LYS B 7 5.150 6.928 -1.803 1.00 0.00 C ATOM 965 CG LYS B 7 3.644 6.678 -1.945 1.00 0.00 C ATOM 966 CD LYS B 7 2.852 7.321 -0.806 1.00 0.00 C ATOM 967 CE LYS B 7 1.392 6.869 -0.882 1.00 0.00 C ATOM 968 NZ LYS B 7 0.559 7.558 0.123 1.00 0.00 N ATOM 0 H LYS B 7 5.359 4.863 -3.437 1.00 0.00 H new ATOM 0 HA LYS B 7 5.577 7.826 -3.661 1.00 0.00 H new ATOM 0 HB2 LYS B 7 5.590 6.176 -1.148 1.00 0.00 H new ATOM 0 HB3 LYS B 7 5.322 7.898 -1.336 1.00 0.00 H new ATOM 0 HG2 LYS B 7 3.298 7.076 -2.899 1.00 0.00 H new ATOM 0 HG3 LYS B 7 3.453 5.605 -1.960 1.00 0.00 H new ATOM 0 HD2 LYS B 7 3.282 7.038 0.155 1.00 0.00 H new ATOM 0 HD3 LYS B 7 2.912 8.407 -0.875 1.00 0.00 H new ATOM 0 HE2 LYS B 7 1.000 7.068 -1.879 1.00 0.00 H new ATOM 0 HE3 LYS B 7 1.335 5.792 -0.726 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -0.424 7.228 0.044 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 0.919 7.348 1.076 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 0.594 8.584 -0.041 1.00 0.00 H new ATOM 982 N VAL B 8 8.047 7.899 -2.918 1.00 0.00 N ATOM 983 CA VAL B 8 9.502 7.849 -2.891 1.00 0.00 C ATOM 984 C VAL B 8 9.978 7.079 -1.668 1.00 0.00 C ATOM 985 O VAL B 8 9.446 7.218 -0.568 1.00 0.00 O ATOM 986 CB VAL B 8 10.103 9.251 -2.984 1.00 0.00 C ATOM 987 CG1 VAL B 8 9.701 9.816 -4.341 1.00 0.00 C ATOM 988 CG2 VAL B 8 9.646 10.211 -1.890 1.00 0.00 C ATOM 0 H VAL B 8 7.641 8.827 -2.802 1.00 0.00 H new ATOM 0 HA VAL B 8 9.857 7.309 -3.769 1.00 0.00 H new ATOM 0 HB VAL B 8 11.182 9.158 -2.857 1.00 0.00 H new ATOM 0 HG11 VAL B 8 10.110 10.820 -4.452 1.00 0.00 H new ATOM 0 HG12 VAL B 8 10.091 9.176 -5.132 1.00 0.00 H new ATOM 0 HG13 VAL B 8 8.614 9.857 -4.411 1.00 0.00 H new ATOM 0 HG21 VAL B 8 10.122 11.181 -2.035 1.00 0.00 H new ATOM 0 HG22 VAL B 8 8.563 10.328 -1.937 1.00 0.00 H new ATOM 0 HG23 VAL B 8 9.926 9.811 -0.915 1.00 0.00 H new ATOM 998 N GLY B 9 11.001 6.260 -1.900 1.00 0.00 N ATOM 999 CA GLY B 9 11.577 5.357 -0.915 1.00 0.00 C ATOM 1000 C GLY B 9 11.000 3.943 -1.022 1.00 0.00 C ATOM 1001 O GLY B 9 11.513 3.027 -0.380 1.00 0.00 O ATOM 0 H GLY B 9 11.464 6.207 -2.807 1.00 0.00 H new ATOM 0 HA2 GLY B 9 12.658 5.318 -1.048 1.00 0.00 H new ATOM 0 HA3 GLY B 9 11.393 5.748 0.086 1.00 0.00 H new ATOM 1005 N GLU B 10 9.943 3.749 -1.821 1.00 0.00 N ATOM 1006 CA GLU B 10 9.357 2.429 -2.033 1.00 0.00 C ATOM 1007 C GLU B 10 10.145 1.639 -3.078 1.00 0.00 C ATOM 1008 O GLU B 10 11.116 2.138 -3.648 1.00 0.00 O ATOM 1009 CB GLU B 10 7.891 2.561 -2.466 1.00 0.00 C ATOM 1010 CG GLU B 10 7.041 3.200 -1.366 1.00 0.00 C ATOM 1011 CD GLU B 10 7.051 2.361 -0.087 1.00 0.00 C ATOM 1012 OE1 GLU B 10 6.925 1.122 -0.206 1.00 0.00 O ATOM 1013 OE2 GLU B 10 7.184 2.965 1.000 1.00 0.00 O ATOM 0 H GLU B 10 9.477 4.498 -2.332 1.00 0.00 H new ATOM 0 HA GLU B 10 9.401 1.885 -1.090 1.00 0.00 H new ATOM 0 HB2 GLU B 10 7.830 3.164 -3.372 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.492 1.577 -2.711 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.418 4.200 -1.149 1.00 0.00 H new ATOM 0 HG3 GLU B 10 6.016 3.315 -1.718 1.00 0.00 H new ATOM 1020 N SER B 11 9.722 0.395 -3.330 1.00 0.00 N ATOM 1021 CA SER B 11 10.379 -0.487 -4.283 1.00 0.00 C ATOM 1022 C SER B 11 9.363 -1.269 -5.111 1.00 0.00 C ATOM 1023 O SER B 11 8.173 -1.294 -4.799 1.00 0.00 O ATOM 1024 CB SER B 11 11.291 -1.460 -3.533 1.00 0.00 C ATOM 1025 OG SER B 11 12.278 -0.760 -2.804 1.00 0.00 O ATOM 0 H SER B 11 8.911 -0.023 -2.874 1.00 0.00 H new ATOM 0 HA SER B 11 10.968 0.126 -4.965 1.00 0.00 H new ATOM 0 HB2 SER B 11 10.697 -2.073 -2.855 1.00 0.00 H new ATOM 0 HB3 SER B 11 11.768 -2.138 -4.241 1.00 0.00 H new ATOM 0 HG SER B 11 12.850 -1.400 -2.330 1.00 0.00 H new ATOM 1031 N ILE B 12 9.860 -1.909 -6.172 1.00 0.00 N ATOM 1032 CA ILE B 12 9.118 -2.757 -7.094 1.00 0.00 C ATOM 1033 C ILE B 12 9.984 -3.992 -7.358 1.00 0.00 C ATOM 1034 O ILE B 12 11.173 -3.990 -7.040 1.00 0.00 O ATOM 1035 CB ILE B 12 8.833 -1.975 -8.391 1.00 0.00 C ATOM 1036 CG1 ILE B 12 7.957 -0.732 -8.167 1.00 0.00 C ATOM 1037 CG2 ILE B 12 8.183 -2.849 -9.467 1.00 0.00 C ATOM 1038 CD1 ILE B 12 6.545 -1.064 -7.688 1.00 0.00 C ATOM 0 H ILE B 12 10.847 -1.842 -6.420 1.00 0.00 H new ATOM 0 HA ILE B 12 8.156 -3.063 -6.683 1.00 0.00 H new ATOM 0 HB ILE B 12 9.814 -1.648 -8.736 1.00 0.00 H new ATOM 0 HG12 ILE B 12 8.438 -0.084 -7.434 1.00 0.00 H new ATOM 0 HG13 ILE B 12 7.894 -0.168 -9.098 1.00 0.00 H new ATOM 0 HG21 ILE B 12 8.002 -2.252 -10.361 1.00 0.00 H new ATOM 0 HG22 ILE B 12 8.847 -3.678 -9.712 1.00 0.00 H new ATOM 0 HG23 ILE B 12 7.236 -3.240 -9.095 1.00 0.00 H new ATOM 0 HD11 ILE B 12 5.981 -0.141 -7.550 1.00 0.00 H new ATOM 0 HD12 ILE B 12 6.046 -1.687 -8.431 1.00 0.00 H new ATOM 0 HD13 ILE B 12 6.599 -1.601 -6.741 1.00 0.00 H new ATOM 1050 N ASN B 13 9.414 -5.051 -7.937 1.00 0.00 N ATOM 1051 CA ASN B 13 10.165 -6.259 -8.233 1.00 0.00 C ATOM 1052 C ASN B 13 9.818 -6.767 -9.632 1.00 0.00 C ATOM 1053 O ASN B 13 8.721 -6.512 -10.126 1.00 0.00 O ATOM 1054 CB ASN B 13 9.847 -7.299 -7.158 1.00 0.00 C ATOM 1055 CG ASN B 13 10.890 -8.404 -7.142 1.00 0.00 C ATOM 1056 OD1 ASN B 13 10.743 -9.424 -7.808 1.00 0.00 O ATOM 1057 ND2 ASN B 13 11.954 -8.195 -6.372 1.00 0.00 N ATOM 0 H ASN B 13 8.432 -5.090 -8.208 1.00 0.00 H new ATOM 0 HA ASN B 13 11.236 -6.055 -8.223 1.00 0.00 H new ATOM 0 HB2 ASN B 13 9.808 -6.817 -6.181 1.00 0.00 H new ATOM 0 HB3 ASN B 13 8.862 -7.727 -7.342 1.00 0.00 H new ATOM 0 HD21 ASN B 13 12.691 -8.899 -6.318 1.00 0.00 H new ATOM 0 HD22 ASN B 13 12.034 -7.331 -5.836 1.00 0.00 H new ATOM 1064 N ILE B 14 10.749 -7.486 -10.269 1.00 0.00 N ATOM 1065 CA ILE B 14 10.558 -8.017 -11.613 1.00 0.00 C ATOM 1066 C ILE B 14 11.182 -9.410 -11.703 1.00 0.00 C ATOM 1067 O ILE B 14 12.203 -9.687 -11.071 1.00 0.00 O ATOM 1068 CB ILE B 14 11.184 -7.071 -12.653 1.00 0.00 C ATOM 1069 CG1 ILE B 14 10.566 -5.669 -12.551 1.00 0.00 C ATOM 1070 CG2 ILE B 14 10.977 -7.632 -14.064 1.00 0.00 C ATOM 1071 CD1 ILE B 14 11.207 -4.685 -13.533 1.00 0.00 C ATOM 0 H ILE B 14 11.656 -7.714 -9.862 1.00 0.00 H new ATOM 0 HA ILE B 14 9.491 -8.094 -11.824 1.00 0.00 H new ATOM 0 HB ILE B 14 12.252 -6.994 -12.451 1.00 0.00 H new ATOM 0 HG12 ILE B 14 9.495 -5.730 -12.746 1.00 0.00 H new ATOM 0 HG13 ILE B 14 10.684 -5.294 -11.534 1.00 0.00 H new ATOM 0 HG21 ILE B 14 11.423 -6.956 -14.793 1.00 0.00 H new ATOM 0 HG22 ILE B 14 11.450 -8.611 -14.139 1.00 0.00 H new ATOM 0 HG23 ILE B 14 9.910 -7.729 -14.264 1.00 0.00 H new ATOM 0 HD11 ILE B 14 10.739 -3.707 -13.426 1.00 0.00 H new ATOM 0 HD12 ILE B 14 12.273 -4.602 -13.321 1.00 0.00 H new ATOM 0 HD13 ILE B 14 11.066 -5.045 -14.552 1.00 0.00 H new ATOM 1083 N GLY B 15 10.560 -10.289 -12.495 1.00 0.00 N ATOM 1084 CA GLY B 15 11.028 -11.653 -12.682 1.00 0.00 C ATOM 1085 C GLY B 15 11.160 -12.365 -11.341 1.00 0.00 C ATOM 1086 O GLY B 15 10.203 -12.428 -10.571 1.00 0.00 O ATOM 0 H GLY B 15 9.716 -10.067 -13.023 1.00 0.00 H new ATOM 0 HA2 GLY B 15 10.333 -12.197 -13.321 1.00 0.00 H new ATOM 0 HA3 GLY B 15 11.991 -11.646 -13.192 1.00 0.00 H new ATOM 1090 N ASP B 16 12.351 -12.903 -11.067 1.00 0.00 N ATOM 1091 CA ASP B 16 12.654 -13.575 -9.810 1.00 0.00 C ATOM 1092 C ASP B 16 14.058 -13.207 -9.318 1.00 0.00 C ATOM 1093 O ASP B 16 14.510 -13.715 -8.293 1.00 0.00 O ATOM 1094 CB ASP B 16 12.507 -15.085 -10.012 1.00 0.00 C ATOM 1095 CG ASP B 16 12.618 -15.858 -8.699 1.00 0.00 C ATOM 1096 OD1 ASP B 16 11.842 -15.538 -7.773 1.00 0.00 O ATOM 1097 OD2 ASP B 16 13.480 -16.764 -8.631 1.00 0.00 O ATOM 0 H ASP B 16 13.135 -12.882 -11.719 1.00 0.00 H new ATOM 0 HA ASP B 16 11.954 -13.249 -9.040 1.00 0.00 H new ATOM 0 HB2 ASP B 16 11.543 -15.295 -10.475 1.00 0.00 H new ATOM 0 HB3 ASP B 16 13.275 -15.434 -10.703 1.00 0.00 H new ATOM 1102 N ASP B 17 14.753 -12.325 -10.045 1.00 0.00 N ATOM 1103 CA ASP B 17 16.123 -11.941 -9.734 1.00 0.00 C ATOM 1104 C ASP B 17 16.351 -10.437 -9.891 1.00 0.00 C ATOM 1105 O ASP B 17 17.479 -9.975 -9.730 1.00 0.00 O ATOM 1106 CB ASP B 17 17.086 -12.704 -10.649 1.00 0.00 C ATOM 1107 CG ASP B 17 16.974 -14.215 -10.467 1.00 0.00 C ATOM 1108 OD1 ASP B 17 17.577 -14.725 -9.498 1.00 0.00 O ATOM 1109 OD2 ASP B 17 16.285 -14.848 -11.299 1.00 0.00 O ATOM 0 H ASP B 17 14.373 -11.858 -10.869 1.00 0.00 H new ATOM 0 HA ASP B 17 16.309 -12.194 -8.690 1.00 0.00 H new ATOM 0 HB2 ASP B 17 16.878 -12.448 -11.688 1.00 0.00 H new ATOM 0 HB3 ASP B 17 18.109 -12.389 -10.442 1.00 0.00 H new ATOM 1114 N ILE B 18 15.304 -9.661 -10.201 1.00 0.00 N ATOM 1115 CA ILE B 18 15.450 -8.232 -10.446 1.00 0.00 C ATOM 1116 C ILE B 18 14.601 -7.445 -9.449 1.00 0.00 C ATOM 1117 O ILE B 18 13.488 -7.848 -9.115 1.00 0.00 O ATOM 1118 CB ILE B 18 15.046 -7.920 -11.894 1.00 0.00 C ATOM 1119 CG1 ILE B 18 15.935 -8.701 -12.872 1.00 0.00 C ATOM 1120 CG2 ILE B 18 15.162 -6.415 -12.162 1.00 0.00 C ATOM 1121 CD1 ILE B 18 15.423 -8.587 -14.308 1.00 0.00 C ATOM 0 H ILE B 18 14.348 -10.006 -10.287 1.00 0.00 H new ATOM 0 HA ILE B 18 16.490 -7.935 -10.308 1.00 0.00 H new ATOM 0 HB ILE B 18 14.010 -8.224 -12.042 1.00 0.00 H new ATOM 0 HG12 ILE B 18 16.956 -8.324 -12.818 1.00 0.00 H new ATOM 0 HG13 ILE B 18 15.967 -9.750 -12.578 1.00 0.00 H new ATOM 0 HG21 ILE B 18 14.873 -6.205 -13.192 1.00 0.00 H new ATOM 0 HG22 ILE B 18 14.504 -5.873 -11.483 1.00 0.00 H new ATOM 0 HG23 ILE B 18 16.192 -6.095 -12.002 1.00 0.00 H new ATOM 0 HD11 ILE B 18 16.076 -9.152 -14.973 1.00 0.00 H new ATOM 0 HD12 ILE B 18 14.411 -8.988 -14.366 1.00 0.00 H new ATOM 0 HD13 ILE B 18 15.416 -7.540 -14.610 1.00 0.00 H new ATOM 1133 N THR B 19 15.131 -6.316 -8.973 1.00 0.00 N ATOM 1134 CA THR B 19 14.427 -5.448 -8.044 1.00 0.00 C ATOM 1135 C THR B 19 14.647 -4.002 -8.459 1.00 0.00 C ATOM 1136 O THR B 19 15.737 -3.645 -8.899 1.00 0.00 O ATOM 1137 CB THR B 19 14.942 -5.688 -6.621 1.00 0.00 C ATOM 1138 OG1 THR B 19 14.885 -7.064 -6.314 1.00 0.00 O ATOM 1139 CG2 THR B 19 14.102 -4.926 -5.597 1.00 0.00 C ATOM 0 H THR B 19 16.062 -5.983 -9.225 1.00 0.00 H new ATOM 0 HA THR B 19 13.359 -5.666 -8.062 1.00 0.00 H new ATOM 0 HB THR B 19 15.971 -5.332 -6.575 1.00 0.00 H new ATOM 0 HG1 THR B 19 15.217 -7.210 -5.404 1.00 0.00 H new ATOM 0 HG21 THR B 19 14.490 -5.114 -4.596 1.00 0.00 H new ATOM 0 HG22 THR B 19 14.150 -3.858 -5.810 1.00 0.00 H new ATOM 0 HG23 THR B 19 13.066 -5.261 -5.654 1.00 0.00 H new ATOM 1147 N ILE B 20 13.613 -3.174 -8.318 1.00 0.00 N ATOM 1148 CA ILE B 20 13.663 -1.778 -8.728 1.00 0.00 C ATOM 1149 C ILE B 20 13.303 -0.906 -7.530 1.00 0.00 C ATOM 1150 O ILE B 20 12.603 -1.355 -6.624 1.00 0.00 O ATOM 1151 CB ILE B 20 12.696 -1.546 -9.902 1.00 0.00 C ATOM 1152 CG1 ILE B 20 12.840 -2.599 -11.012 1.00 0.00 C ATOM 1153 CG2 ILE B 20 12.881 -0.148 -10.498 1.00 0.00 C ATOM 1154 CD1 ILE B 20 14.214 -2.589 -11.681 1.00 0.00 C ATOM 0 H ILE B 20 12.719 -3.455 -7.916 1.00 0.00 H new ATOM 0 HA ILE B 20 14.665 -1.515 -9.067 1.00 0.00 H new ATOM 0 HB ILE B 20 11.692 -1.638 -9.487 1.00 0.00 H new ATOM 0 HG12 ILE B 20 12.656 -3.588 -10.591 1.00 0.00 H new ATOM 0 HG13 ILE B 20 12.074 -2.427 -11.768 1.00 0.00 H new ATOM 0 HG21 ILE B 20 12.185 -0.010 -11.326 1.00 0.00 H new ATOM 0 HG22 ILE B 20 12.687 0.603 -9.732 1.00 0.00 H new ATOM 0 HG23 ILE B 20 13.903 -0.040 -10.861 1.00 0.00 H new ATOM 0 HD11 ILE B 20 14.248 -3.356 -12.455 1.00 0.00 H new ATOM 0 HD12 ILE B 20 14.393 -1.612 -12.131 1.00 0.00 H new ATOM 0 HD13 ILE B 20 14.983 -2.791 -10.936 1.00 0.00 H new ATOM 1166 N THR B 21 13.775 0.341 -7.515 1.00 0.00 N ATOM 1167 CA THR B 21 13.534 1.246 -6.401 1.00 0.00 C ATOM 1168 C THR B 21 13.321 2.667 -6.916 1.00 0.00 C ATOM 1169 O THR B 21 13.696 2.989 -8.042 1.00 0.00 O ATOM 1170 CB THR B 21 14.732 1.182 -5.444 1.00 0.00 C ATOM 1171 OG1 THR B 21 15.031 -0.163 -5.140 1.00 0.00 O ATOM 1172 CG2 THR B 21 14.454 1.896 -4.122 1.00 0.00 C ATOM 0 H THR B 21 14.330 0.745 -8.269 1.00 0.00 H new ATOM 0 HA THR B 21 12.633 0.947 -5.866 1.00 0.00 H new ATOM 0 HB THR B 21 15.563 1.674 -5.950 1.00 0.00 H new ATOM 0 HG1 THR B 21 15.797 -0.198 -4.530 1.00 0.00 H new ATOM 0 HG21 THR B 21 15.330 1.824 -3.478 1.00 0.00 H new ATOM 0 HG22 THR B 21 14.231 2.945 -4.315 1.00 0.00 H new ATOM 0 HG23 THR B 21 13.602 1.429 -3.628 1.00 0.00 H new ATOM 1180 N ILE B 22 12.715 3.514 -6.080 1.00 0.00 N ATOM 1181 CA ILE B 22 12.503 4.923 -6.360 1.00 0.00 C ATOM 1182 C ILE B 22 13.103 5.717 -5.201 1.00 0.00 C ATOM 1183 O ILE B 22 12.455 5.929 -4.181 1.00 0.00 O ATOM 1184 CB ILE B 22 11.009 5.195 -6.609 1.00 0.00 C ATOM 1185 CG1 ILE B 22 10.696 6.693 -6.640 1.00 0.00 C ATOM 1186 CG2 ILE B 22 10.103 4.533 -5.567 1.00 0.00 C ATOM 1187 CD1 ILE B 22 11.474 7.407 -7.740 1.00 0.00 C ATOM 0 H ILE B 22 12.353 3.226 -5.171 1.00 0.00 H new ATOM 0 HA ILE B 22 13.004 5.240 -7.275 1.00 0.00 H new ATOM 0 HB ILE B 22 10.802 4.756 -7.585 1.00 0.00 H new ATOM 0 HG12 ILE B 22 9.627 6.839 -6.796 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.940 7.136 -5.675 1.00 0.00 H new ATOM 0 HG21 ILE B 22 9.061 4.760 -5.794 1.00 0.00 H new ATOM 0 HG22 ILE B 22 10.252 3.453 -5.588 1.00 0.00 H new ATOM 0 HG23 ILE B 22 10.350 4.914 -4.576 1.00 0.00 H new ATOM 0 HD11 ILE B 22 11.226 8.468 -7.731 1.00 0.00 H new ATOM 0 HD12 ILE B 22 12.543 7.283 -7.569 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.210 6.981 -8.708 1.00 0.00 H new ATOM 1199 N LEU B 23 14.353 6.159 -5.356 1.00 0.00 N ATOM 1200 CA LEU B 23 15.071 6.824 -4.280 1.00 0.00 C ATOM 1201 C LEU B 23 14.460 8.196 -4.026 1.00 0.00 C ATOM 1202 O LEU B 23 14.496 8.688 -2.900 1.00 0.00 O ATOM 1203 CB LEU B 23 16.563 6.943 -4.610 1.00 0.00 C ATOM 1204 CG LEU B 23 17.204 5.588 -4.932 1.00 0.00 C ATOM 1205 CD1 LEU B 23 18.722 5.751 -4.960 1.00 0.00 C ATOM 1206 CD2 LEU B 23 16.867 4.536 -3.880 1.00 0.00 C ATOM 0 H LEU B 23 14.885 6.065 -6.221 1.00 0.00 H new ATOM 0 HA LEU B 23 14.981 6.225 -3.374 1.00 0.00 H new ATOM 0 HB2 LEU B 23 16.691 7.613 -5.460 1.00 0.00 H new ATOM 0 HB3 LEU B 23 17.083 7.396 -3.766 1.00 0.00 H new ATOM 0 HG LEU B 23 16.816 5.259 -5.896 1.00 0.00 H new ATOM 0 HD11 LEU B 23 19.187 4.792 -5.188 1.00 0.00 H new ATOM 0 HD12 LEU B 23 18.996 6.478 -5.724 1.00 0.00 H new ATOM 0 HD13 LEU B 23 19.069 6.100 -3.987 1.00 0.00 H new ATOM 0 HD21 LEU B 23 17.341 3.591 -4.146 1.00 0.00 H new ATOM 0 HD22 LEU B 23 17.233 4.864 -2.907 1.00 0.00 H new ATOM 0 HD23 LEU B 23 15.786 4.400 -3.834 1.00 0.00 H new ATOM 1218 N GLY B 24 13.898 8.811 -5.072 1.00 0.00 N ATOM 1219 CA GLY B 24 13.066 9.986 -4.879 1.00 0.00 C ATOM 1220 C GLY B 24 13.139 11.001 -6.010 1.00 0.00 C ATOM 1221 O GLY B 24 13.982 10.919 -6.901 1.00 0.00 O ATOM 0 H GLY B 24 14.006 8.515 -6.042 1.00 0.00 H new ATOM 0 HA2 GLY B 24 12.031 9.667 -4.760 1.00 0.00 H new ATOM 0 HA3 GLY B 24 13.358 10.474 -3.949 1.00 0.00 H new ATOM 1225 N VAL B 25 12.221 11.968 -5.945 1.00 0.00 N ATOM 1226 CA VAL B 25 12.117 13.070 -6.884 1.00 0.00 C ATOM 1227 C VAL B 25 13.238 14.077 -6.628 1.00 0.00 C ATOM 1228 O VAL B 25 13.626 14.305 -5.483 1.00 0.00 O ATOM 1229 CB VAL B 25 10.725 13.705 -6.747 1.00 0.00 C ATOM 1230 CG1 VAL B 25 10.388 14.077 -5.297 1.00 0.00 C ATOM 1231 CG2 VAL B 25 10.608 14.949 -7.627 1.00 0.00 C ATOM 0 H VAL B 25 11.512 12.000 -5.213 1.00 0.00 H new ATOM 0 HA VAL B 25 12.232 12.715 -7.908 1.00 0.00 H new ATOM 0 HB VAL B 25 10.010 12.951 -7.075 1.00 0.00 H new ATOM 0 HG11 VAL B 25 9.394 14.522 -5.257 1.00 0.00 H new ATOM 0 HG12 VAL B 25 10.410 13.181 -4.677 1.00 0.00 H new ATOM 0 HG13 VAL B 25 11.121 14.793 -4.925 1.00 0.00 H new ATOM 0 HG21 VAL B 25 9.614 15.382 -7.514 1.00 0.00 H new ATOM 0 HG22 VAL B 25 11.359 15.680 -7.326 1.00 0.00 H new ATOM 0 HG23 VAL B 25 10.768 14.674 -8.669 1.00 0.00 H new ATOM 1241 N SER B 26 13.751 14.678 -7.706 1.00 0.00 N ATOM 1242 CA SER B 26 14.822 15.664 -7.656 1.00 0.00 C ATOM 1243 C SER B 26 14.601 16.684 -8.768 1.00 0.00 C ATOM 1244 O SER B 26 15.201 16.580 -9.838 1.00 0.00 O ATOM 1245 CB SER B 26 16.179 14.975 -7.825 1.00 0.00 C ATOM 1246 OG SER B 26 16.414 14.074 -6.764 1.00 0.00 O ATOM 0 H SER B 26 13.424 14.486 -8.653 1.00 0.00 H new ATOM 0 HA SER B 26 14.815 16.170 -6.691 1.00 0.00 H new ATOM 0 HB2 SER B 26 16.206 14.442 -8.775 1.00 0.00 H new ATOM 0 HB3 SER B 26 16.971 15.723 -7.856 1.00 0.00 H new ATOM 0 HG SER B 26 17.285 13.642 -6.889 1.00 0.00 H new ATOM 1252 N GLY B 27 13.738 17.672 -8.523 1.00 0.00 N ATOM 1253 CA GLY B 27 13.381 18.633 -9.552 1.00 0.00 C ATOM 1254 C GLY B 27 12.596 17.929 -10.654 1.00 0.00 C ATOM 1255 O GLY B 27 11.806 17.028 -10.376 1.00 0.00 O ATOM 0 H GLY B 27 13.279 17.822 -7.624 1.00 0.00 H new ATOM 0 HA2 GLY B 27 12.784 19.437 -9.122 1.00 0.00 H new ATOM 0 HA3 GLY B 27 14.280 19.090 -9.966 1.00 0.00 H new ATOM 1259 N GLN B 28 12.811 18.338 -11.906 1.00 0.00 N ATOM 1260 CA GLN B 28 12.186 17.701 -13.058 1.00 0.00 C ATOM 1261 C GLN B 28 12.729 16.283 -13.274 1.00 0.00 C ATOM 1262 O GLN B 28 12.245 15.561 -14.147 1.00 0.00 O ATOM 1263 CB GLN B 28 12.419 18.587 -14.287 1.00 0.00 C ATOM 1264 CG GLN B 28 11.582 18.176 -15.502 1.00 0.00 C ATOM 1265 CD GLN B 28 10.090 18.252 -15.206 1.00 0.00 C ATOM 1266 OE1 GLN B 28 9.472 19.304 -15.349 1.00 0.00 O ATOM 1267 NE2 GLN B 28 9.497 17.136 -14.789 1.00 0.00 N ATOM 0 H GLN B 28 13.422 19.119 -12.145 1.00 0.00 H new ATOM 0 HA GLN B 28 11.115 17.597 -12.884 1.00 0.00 H new ATOM 0 HB2 GLN B 28 12.188 19.621 -14.029 1.00 0.00 H new ATOM 0 HB3 GLN B 28 13.475 18.553 -14.555 1.00 0.00 H new ATOM 0 HG2 GLN B 28 11.820 18.825 -16.345 1.00 0.00 H new ATOM 0 HG3 GLN B 28 11.844 17.160 -15.798 1.00 0.00 H new ATOM 0 HE21 GLN B 28 10.040 16.279 -14.681 1.00 0.00 H new ATOM 0 HE22 GLN B 28 8.499 17.137 -14.577 1.00 0.00 H new ATOM 1276 N GLN B 29 13.731 15.872 -12.490 1.00 0.00 N ATOM 1277 CA GLN B 29 14.307 14.540 -12.594 1.00 0.00 C ATOM 1278 C GLN B 29 13.827 13.646 -11.456 1.00 0.00 C ATOM 1279 O GLN B 29 13.166 14.101 -10.523 1.00 0.00 O ATOM 1280 CB GLN B 29 15.836 14.600 -12.561 1.00 0.00 C ATOM 1281 CG GLN B 29 16.400 15.635 -13.530 1.00 0.00 C ATOM 1282 CD GLN B 29 17.917 15.628 -13.476 1.00 0.00 C ATOM 1283 OE1 GLN B 29 18.580 15.169 -14.401 1.00 0.00 O ATOM 1284 NE2 GLN B 29 18.483 16.137 -12.390 1.00 0.00 N ATOM 0 H GLN B 29 14.159 16.455 -11.771 1.00 0.00 H new ATOM 0 HA GLN B 29 13.980 14.122 -13.546 1.00 0.00 H new ATOM 0 HB2 GLN B 29 16.166 14.836 -11.549 1.00 0.00 H new ATOM 0 HB3 GLN B 29 16.241 13.618 -12.807 1.00 0.00 H new ATOM 0 HG2 GLN B 29 16.063 15.417 -14.544 1.00 0.00 H new ATOM 0 HG3 GLN B 29 16.024 16.626 -13.275 1.00 0.00 H new ATOM 0 HE21 GLN B 29 17.902 16.510 -11.639 1.00 0.00 H new ATOM 0 HE22 GLN B 29 19.499 16.155 -12.305 1.00 0.00 H new ATOM 1293 N VAL B 30 14.170 12.360 -11.547 1.00 0.00 N ATOM 1294 CA VAL B 30 13.834 11.366 -10.542 1.00 0.00 C ATOM 1295 C VAL B 30 14.992 10.382 -10.418 1.00 0.00 C ATOM 1296 O VAL B 30 15.452 9.843 -11.425 1.00 0.00 O ATOM 1297 CB VAL B 30 12.556 10.635 -10.964 1.00 0.00 C ATOM 1298 CG1 VAL B 30 12.170 9.633 -9.885 1.00 0.00 C ATOM 1299 CG2 VAL B 30 11.383 11.600 -11.156 1.00 0.00 C ATOM 0 H VAL B 30 14.696 11.981 -12.334 1.00 0.00 H new ATOM 0 HA VAL B 30 13.664 11.844 -9.577 1.00 0.00 H new ATOM 0 HB VAL B 30 12.761 10.139 -11.913 1.00 0.00 H new ATOM 0 HG11 VAL B 30 11.261 9.111 -10.182 1.00 0.00 H new ATOM 0 HG12 VAL B 30 12.976 8.911 -9.753 1.00 0.00 H new ATOM 0 HG13 VAL B 30 11.996 10.158 -8.946 1.00 0.00 H new ATOM 0 HG21 VAL B 30 10.497 11.040 -11.455 1.00 0.00 H new ATOM 0 HG22 VAL B 30 11.184 12.122 -10.220 1.00 0.00 H new ATOM 0 HG23 VAL B 30 11.632 12.326 -11.930 1.00 0.00 H new ATOM 1309 N ARG B 31 15.468 10.139 -9.193 1.00 0.00 N ATOM 1310 CA ARG B 31 16.528 9.169 -8.958 1.00 0.00 C ATOM 1311 C ARG B 31 15.921 7.783 -8.773 1.00 0.00 C ATOM 1312 O ARG B 31 15.352 7.477 -7.723 1.00 0.00 O ATOM 1313 CB ARG B 31 17.387 9.579 -7.762 1.00 0.00 C ATOM 1314 CG ARG B 31 18.559 8.604 -7.621 1.00 0.00 C ATOM 1315 CD ARG B 31 19.621 9.162 -6.671 1.00 0.00 C ATOM 1316 NE ARG B 31 20.310 10.301 -7.293 1.00 0.00 N ATOM 1317 CZ ARG B 31 21.530 10.746 -6.982 1.00 0.00 C ATOM 1318 NH1 ARG B 31 22.256 10.192 -6.013 1.00 0.00 N ATOM 1319 NH2 ARG B 31 22.036 11.771 -7.661 1.00 0.00 N ATOM 0 H ARG B 31 15.131 10.605 -8.350 1.00 0.00 H new ATOM 0 HA ARG B 31 17.187 9.140 -9.825 1.00 0.00 H new ATOM 0 HB2 ARG B 31 17.759 10.595 -7.898 1.00 0.00 H new ATOM 0 HB3 ARG B 31 16.787 9.578 -6.852 1.00 0.00 H new ATOM 0 HG2 ARG B 31 18.198 7.646 -7.247 1.00 0.00 H new ATOM 0 HG3 ARG B 31 19.002 8.417 -8.599 1.00 0.00 H new ATOM 0 HD2 ARG B 31 19.155 9.476 -5.737 1.00 0.00 H new ATOM 0 HD3 ARG B 31 20.342 8.383 -6.422 1.00 0.00 H new ATOM 0 HE ARG B 31 19.810 10.798 -8.031 1.00 0.00 H new ATOM 0 HH11 ARG B 31 21.883 9.404 -5.484 1.00 0.00 H new ATOM 0 HH12 ARG B 31 23.185 10.556 -5.800 1.00 0.00 H new ATOM 0 HH21 ARG B 31 21.494 12.206 -8.407 1.00 0.00 H new ATOM 0 HH22 ARG B 31 22.967 12.123 -7.435 1.00 0.00 H new ATOM 1333 N ILE B 32 16.057 6.957 -9.814 1.00 0.00 N ATOM 1334 CA ILE B 32 15.598 5.576 -9.848 1.00 0.00 C ATOM 1335 C ILE B 32 16.732 4.658 -9.389 1.00 0.00 C ATOM 1336 O ILE B 32 17.895 5.058 -9.369 1.00 0.00 O ATOM 1337 CB ILE B 32 15.191 5.220 -11.289 1.00 0.00 C ATOM 1338 CG1 ILE B 32 14.316 6.304 -11.935 1.00 0.00 C ATOM 1339 CG2 ILE B 32 14.449 3.879 -11.351 1.00 0.00 C ATOM 1340 CD1 ILE B 32 13.020 6.563 -11.170 1.00 0.00 C ATOM 0 H ILE B 32 16.506 7.246 -10.683 1.00 0.00 H new ATOM 0 HA ILE B 32 14.742 5.449 -9.186 1.00 0.00 H new ATOM 0 HB ILE B 32 16.123 5.146 -11.850 1.00 0.00 H new ATOM 0 HG12 ILE B 32 14.885 7.232 -11.998 1.00 0.00 H new ATOM 0 HG13 ILE B 32 14.075 6.007 -12.956 1.00 0.00 H new ATOM 0 HG21 ILE B 32 14.177 3.661 -12.384 1.00 0.00 H new ATOM 0 HG22 ILE B 32 15.095 3.088 -10.971 1.00 0.00 H new ATOM 0 HG23 ILE B 32 13.546 3.934 -10.742 1.00 0.00 H new ATOM 0 HD11 ILE B 32 12.447 7.339 -11.677 1.00 0.00 H new ATOM 0 HD12 ILE B 32 12.432 5.646 -11.129 1.00 0.00 H new ATOM 0 HD13 ILE B 32 13.255 6.889 -10.157 1.00 0.00 H new ATOM 1352 N GLY B 33 16.396 3.420 -9.020 1.00 0.00 N ATOM 1353 CA GLY B 33 17.372 2.400 -8.679 1.00 0.00 C ATOM 1354 C GLY B 33 17.017 1.108 -9.402 1.00 0.00 C ATOM 1355 O GLY B 33 15.857 0.701 -9.403 1.00 0.00 O ATOM 0 H GLY B 33 15.429 3.101 -8.951 1.00 0.00 H new ATOM 0 HA2 GLY B 33 18.372 2.727 -8.963 1.00 0.00 H new ATOM 0 HA3 GLY B 33 17.384 2.237 -7.601 1.00 0.00 H new ATOM 1359 N ILE B 34 18.011 0.462 -10.016 1.00 0.00 N ATOM 1360 CA ILE B 34 17.811 -0.773 -10.758 1.00 0.00 C ATOM 1361 C ILE B 34 18.791 -1.820 -10.242 1.00 0.00 C ATOM 1362 O ILE B 34 20.001 -1.618 -10.307 1.00 0.00 O ATOM 1363 CB ILE B 34 18.009 -0.537 -12.263 1.00 0.00 C ATOM 1364 CG1 ILE B 34 17.038 0.507 -12.834 1.00 0.00 C ATOM 1365 CG2 ILE B 34 17.780 -1.861 -12.993 1.00 0.00 C ATOM 1366 CD1 ILE B 34 17.600 1.928 -12.752 1.00 0.00 C ATOM 0 H ILE B 34 18.978 0.786 -10.009 1.00 0.00 H new ATOM 0 HA ILE B 34 16.791 -1.127 -10.611 1.00 0.00 H new ATOM 0 HB ILE B 34 19.021 -0.160 -12.408 1.00 0.00 H new ATOM 0 HG12 ILE B 34 16.818 0.265 -13.874 1.00 0.00 H new ATOM 0 HG13 ILE B 34 16.095 0.459 -12.289 1.00 0.00 H new ATOM 0 HG21 ILE B 34 17.916 -1.714 -14.064 1.00 0.00 H new ATOM 0 HG22 ILE B 34 18.494 -2.602 -12.635 1.00 0.00 H new ATOM 0 HG23 ILE B 34 16.766 -2.212 -12.801 1.00 0.00 H new ATOM 0 HD11 ILE B 34 16.877 2.630 -13.168 1.00 0.00 H new ATOM 0 HD12 ILE B 34 17.795 2.183 -11.710 1.00 0.00 H new ATOM 0 HD13 ILE B 34 18.529 1.985 -13.319 1.00 0.00 H new ATOM 1378 N ASN B 35 18.279 -2.940 -9.729 1.00 0.00 N ATOM 1379 CA ASN B 35 19.111 -3.982 -9.152 1.00 0.00 C ATOM 1380 C ASN B 35 18.879 -5.314 -9.851 1.00 0.00 C ATOM 1381 O ASN B 35 17.802 -5.897 -9.764 1.00 0.00 O ATOM 1382 CB ASN B 35 18.831 -4.087 -7.655 1.00 0.00 C ATOM 1383 CG ASN B 35 19.833 -5.008 -6.977 1.00 0.00 C ATOM 1384 OD1 ASN B 35 21.016 -4.690 -6.898 1.00 0.00 O ATOM 1385 ND2 ASN B 35 19.370 -6.152 -6.485 1.00 0.00 N ATOM 0 H ASN B 35 17.280 -3.144 -9.705 1.00 0.00 H new ATOM 0 HA ASN B 35 20.159 -3.720 -9.295 1.00 0.00 H new ATOM 0 HB2 ASN B 35 18.878 -3.097 -7.202 1.00 0.00 H new ATOM 0 HB3 ASN B 35 17.820 -4.463 -7.496 1.00 0.00 H new ATOM 0 HD21 ASN B 35 20.005 -6.802 -6.022 1.00 0.00 H new ATOM 0 HD22 ASN B 35 18.380 -6.380 -6.571 1.00 0.00 H new ATOM 1392 N ALA B 36 19.913 -5.785 -10.544 1.00 0.00 N ATOM 1393 CA ALA B 36 19.904 -7.046 -11.265 1.00 0.00 C ATOM 1394 C ALA B 36 21.310 -7.644 -11.226 1.00 0.00 C ATOM 1395 O ALA B 36 22.279 -6.913 -11.016 1.00 0.00 O ATOM 1396 CB ALA B 36 19.466 -6.770 -12.703 1.00 0.00 C ATOM 0 H ALA B 36 20.799 -5.285 -10.619 1.00 0.00 H new ATOM 0 HA ALA B 36 19.213 -7.757 -10.812 1.00 0.00 H new ATOM 0 HB1 ALA B 36 19.452 -7.704 -13.265 1.00 0.00 H new ATOM 0 HB2 ALA B 36 18.468 -6.332 -12.702 1.00 0.00 H new ATOM 0 HB3 ALA B 36 20.166 -6.077 -13.170 1.00 0.00 H new ATOM 1402 N PRO B 37 21.448 -8.961 -11.423 1.00 0.00 N ATOM 1403 CA PRO B 37 22.743 -9.615 -11.457 1.00 0.00 C ATOM 1404 C PRO B 37 23.474 -9.263 -12.751 1.00 0.00 C ATOM 1405 O PRO B 37 22.865 -8.791 -13.708 1.00 0.00 O ATOM 1406 CB PRO B 37 22.428 -11.110 -11.384 1.00 0.00 C ATOM 1407 CG PRO B 37 21.062 -11.206 -12.061 1.00 0.00 C ATOM 1408 CD PRO B 37 20.373 -9.915 -11.623 1.00 0.00 C ATOM 0 HA PRO B 37 23.395 -9.303 -10.641 1.00 0.00 H new ATOM 0 HB2 PRO B 37 23.178 -11.707 -11.903 1.00 0.00 H new ATOM 0 HB3 PRO B 37 22.394 -11.466 -10.354 1.00 0.00 H new ATOM 0 HG2 PRO B 37 21.152 -11.268 -13.146 1.00 0.00 H new ATOM 0 HG3 PRO B 37 20.511 -12.088 -11.736 1.00 0.00 H new ATOM 0 HD2 PRO B 37 19.672 -9.566 -12.381 1.00 0.00 H new ATOM 0 HD3 PRO B 37 19.803 -10.064 -10.706 1.00 0.00 H new ATOM 1416 N LYS B 38 24.790 -9.495 -12.780 1.00 0.00 N ATOM 1417 CA LYS B 38 25.614 -9.246 -13.958 1.00 0.00 C ATOM 1418 C LYS B 38 25.249 -10.186 -15.109 1.00 0.00 C ATOM 1419 O LYS B 38 25.831 -10.095 -16.189 1.00 0.00 O ATOM 1420 CB LYS B 38 27.087 -9.391 -13.571 1.00 0.00 C ATOM 1421 CG LYS B 38 27.563 -8.181 -12.761 1.00 0.00 C ATOM 1422 CD LYS B 38 27.850 -6.997 -13.687 1.00 0.00 C ATOM 1423 CE LYS B 38 28.413 -5.850 -12.853 1.00 0.00 C ATOM 1424 NZ LYS B 38 28.791 -4.705 -13.701 1.00 0.00 N ATOM 0 H LYS B 38 25.311 -9.862 -11.984 1.00 0.00 H new ATOM 0 HA LYS B 38 25.430 -8.232 -14.313 1.00 0.00 H new ATOM 0 HB2 LYS B 38 27.226 -10.301 -12.987 1.00 0.00 H new ATOM 0 HB3 LYS B 38 27.695 -9.493 -14.470 1.00 0.00 H new ATOM 0 HG2 LYS B 38 26.803 -7.903 -12.030 1.00 0.00 H new ATOM 0 HG3 LYS B 38 28.463 -8.440 -12.203 1.00 0.00 H new ATOM 0 HD2 LYS B 38 28.561 -7.286 -14.461 1.00 0.00 H new ATOM 0 HD3 LYS B 38 26.937 -6.683 -14.194 1.00 0.00 H new ATOM 0 HE2 LYS B 38 27.671 -5.533 -12.120 1.00 0.00 H new ATOM 0 HE3 LYS B 38 29.284 -6.196 -12.296 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 29.170 -3.942 -13.105 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 29.516 -5.003 -14.384 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 27.954 -4.361 -14.213 1.00 0.00 H new ATOM 1438 N ASP B 39 24.289 -11.088 -14.883 1.00 0.00 N ATOM 1439 CA ASP B 39 23.777 -11.986 -15.910 1.00 0.00 C ATOM 1440 C ASP B 39 22.969 -11.207 -16.949 1.00 0.00 C ATOM 1441 O ASP B 39 22.683 -11.723 -18.029 1.00 0.00 O ATOM 1442 CB ASP B 39 22.879 -13.031 -15.248 1.00 0.00 C ATOM 1443 CG ASP B 39 22.470 -14.128 -16.230 1.00 0.00 C ATOM 1444 OD1 ASP B 39 23.385 -14.804 -16.753 1.00 0.00 O ATOM 1445 OD2 ASP B 39 21.249 -14.281 -16.451 1.00 0.00 O ATOM 0 H ASP B 39 23.845 -11.213 -13.973 1.00 0.00 H new ATOM 0 HA ASP B 39 24.614 -12.470 -16.412 1.00 0.00 H new ATOM 0 HB2 ASP B 39 23.402 -13.477 -14.402 1.00 0.00 H new ATOM 0 HB3 ASP B 39 21.987 -12.546 -14.852 1.00 0.00 H new ATOM 1450 N VAL B 40 22.603 -9.963 -16.619 1.00 0.00 N ATOM 1451 CA VAL B 40 21.818 -9.097 -17.485 1.00 0.00 C ATOM 1452 C VAL B 40 22.419 -7.695 -17.488 1.00 0.00 C ATOM 1453 O VAL B 40 23.337 -7.403 -16.723 1.00 0.00 O ATOM 1454 CB VAL B 40 20.352 -9.074 -17.027 1.00 0.00 C ATOM 1455 CG1 VAL B 40 19.801 -10.494 -16.877 1.00 0.00 C ATOM 1456 CG2 VAL B 40 20.188 -8.366 -15.684 1.00 0.00 C ATOM 0 H VAL B 40 22.851 -9.530 -15.729 1.00 0.00 H new ATOM 0 HA VAL B 40 21.842 -9.484 -18.504 1.00 0.00 H new ATOM 0 HB VAL B 40 19.801 -8.532 -17.796 1.00 0.00 H new ATOM 0 HG11 VAL B 40 18.762 -10.449 -16.552 1.00 0.00 H new ATOM 0 HG12 VAL B 40 19.859 -11.010 -17.835 1.00 0.00 H new ATOM 0 HG13 VAL B 40 20.389 -11.036 -16.137 1.00 0.00 H new ATOM 0 HG21 VAL B 40 19.137 -8.371 -15.396 1.00 0.00 H new ATOM 0 HG22 VAL B 40 20.775 -8.884 -14.926 1.00 0.00 H new ATOM 0 HG23 VAL B 40 20.535 -7.336 -15.771 1.00 0.00 H new ATOM 1466 N ALA B 41 21.902 -6.819 -18.353 1.00 0.00 N ATOM 1467 CA ALA B 41 22.410 -5.465 -18.478 1.00 0.00 C ATOM 1468 C ALA B 41 21.356 -4.448 -18.049 1.00 0.00 C ATOM 1469 O ALA B 41 20.179 -4.781 -17.914 1.00 0.00 O ATOM 1470 CB ALA B 41 22.851 -5.233 -19.922 1.00 0.00 C ATOM 0 H ALA B 41 21.125 -7.033 -18.979 1.00 0.00 H new ATOM 0 HA ALA B 41 23.268 -5.334 -17.818 1.00 0.00 H new ATOM 0 HB1 ALA B 41 23.234 -4.218 -20.027 1.00 0.00 H new ATOM 0 HB2 ALA B 41 23.634 -5.945 -20.182 1.00 0.00 H new ATOM 0 HB3 ALA B 41 22.000 -5.370 -20.589 1.00 0.00 H new ATOM 1476 N VAL B 42 21.788 -3.203 -17.837 1.00 0.00 N ATOM 1477 CA VAL B 42 20.909 -2.093 -17.490 1.00 0.00 C ATOM 1478 C VAL B 42 21.551 -0.794 -17.967 1.00 0.00 C ATOM 1479 O VAL B 42 22.694 -0.500 -17.624 1.00 0.00 O ATOM 1480 CB VAL B 42 20.619 -2.083 -15.977 1.00 0.00 C ATOM 1481 CG1 VAL B 42 21.807 -2.583 -15.158 1.00 0.00 C ATOM 1482 CG2 VAL B 42 20.249 -0.690 -15.474 1.00 0.00 C ATOM 0 H VAL B 42 22.771 -2.938 -17.903 1.00 0.00 H new ATOM 0 HA VAL B 42 19.946 -2.204 -17.987 1.00 0.00 H new ATOM 0 HB VAL B 42 19.774 -2.758 -15.841 1.00 0.00 H new ATOM 0 HG11 VAL B 42 21.555 -2.557 -14.098 1.00 0.00 H new ATOM 0 HG12 VAL B 42 22.045 -3.606 -15.450 1.00 0.00 H new ATOM 0 HG13 VAL B 42 22.670 -1.943 -15.341 1.00 0.00 H new ATOM 0 HG21 VAL B 42 20.053 -0.730 -14.403 1.00 0.00 H new ATOM 0 HG22 VAL B 42 21.073 -0.003 -15.667 1.00 0.00 H new ATOM 0 HG23 VAL B 42 19.357 -0.341 -15.993 1.00 0.00 H new ATOM 1492 N HIS B 43 20.810 -0.015 -18.761 1.00 0.00 N ATOM 1493 CA HIS B 43 21.313 1.235 -19.323 1.00 0.00 C ATOM 1494 C HIS B 43 20.232 2.311 -19.409 1.00 0.00 C ATOM 1495 O HIS B 43 19.039 2.017 -19.438 1.00 0.00 O ATOM 1496 CB HIS B 43 21.925 0.960 -20.700 1.00 0.00 C ATOM 1497 CG HIS B 43 23.094 0.016 -20.618 1.00 0.00 C ATOM 1498 ND1 HIS B 43 24.404 0.367 -20.377 1.00 0.00 N ATOM 1499 CD2 HIS B 43 23.046 -1.345 -20.759 1.00 0.00 C ATOM 1500 CE1 HIS B 43 25.120 -0.772 -20.326 1.00 0.00 C ATOM 1501 NE2 HIS B 43 24.342 -1.838 -20.571 1.00 0.00 N ATOM 0 H HIS B 43 19.851 -0.234 -19.029 1.00 0.00 H new ATOM 0 HA HIS B 43 22.080 1.624 -18.653 1.00 0.00 H new ATOM 0 HB2 HIS B 43 21.164 0.539 -21.357 1.00 0.00 H new ATOM 0 HB3 HIS B 43 22.248 1.900 -21.147 1.00 0.00 H new ATOM 0 HD1 HIS B 43 24.765 1.314 -20.259 1.00 0.00 H new ATOM 0 HD2 HIS B 43 22.166 -1.932 -20.976 1.00 0.00 H new ATOM 0 HE1 HIS B 43 26.178 -0.821 -20.116 1.00 0.00 H new ATOM 1509 N ARG B 44 20.679 3.571 -19.448 1.00 0.00 N ATOM 1510 CA ARG B 44 19.872 4.790 -19.463 1.00 0.00 C ATOM 1511 C ARG B 44 19.154 5.057 -20.790 1.00 0.00 C ATOM 1512 O ARG B 44 18.641 6.157 -20.985 1.00 0.00 O ATOM 1513 CB ARG B 44 20.780 5.964 -19.074 1.00 0.00 C ATOM 1514 CG ARG B 44 21.955 6.125 -20.045 1.00 0.00 C ATOM 1515 CD ARG B 44 23.184 6.687 -19.322 1.00 0.00 C ATOM 1516 NE ARG B 44 23.151 8.146 -19.179 1.00 0.00 N ATOM 1517 CZ ARG B 44 23.346 9.028 -20.165 1.00 0.00 C ATOM 1518 NH1 ARG B 44 23.563 8.627 -21.415 1.00 0.00 N ATOM 1519 NH2 ARG B 44 23.324 10.331 -19.899 1.00 0.00 N ATOM 0 H ARG B 44 21.678 3.777 -19.471 1.00 0.00 H new ATOM 0 HA ARG B 44 19.064 4.664 -18.742 1.00 0.00 H new ATOM 0 HB2 ARG B 44 20.196 6.884 -19.056 1.00 0.00 H new ATOM 0 HB3 ARG B 44 21.162 5.809 -18.065 1.00 0.00 H new ATOM 0 HG2 ARG B 44 22.199 5.161 -20.491 1.00 0.00 H new ATOM 0 HG3 ARG B 44 21.671 6.791 -20.860 1.00 0.00 H new ATOM 0 HD2 ARG B 44 23.256 6.233 -18.334 1.00 0.00 H new ATOM 0 HD3 ARG B 44 24.082 6.402 -19.870 1.00 0.00 H new ATOM 0 HE ARG B 44 22.963 8.520 -18.249 1.00 0.00 H new ATOM 0 HH11 ARG B 44 23.583 7.631 -21.635 1.00 0.00 H new ATOM 0 HH12 ARG B 44 23.710 9.315 -22.153 1.00 0.00 H new ATOM 0 HH21 ARG B 44 23.159 10.654 -18.946 1.00 0.00 H new ATOM 0 HH22 ARG B 44 23.472 11.007 -20.648 1.00 0.00 H new