USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 829 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 Single : A 1 MET CE :methyl 145:sc= -3.57 (180deg=-5.36!) USER MOD Single : A 1 MET N :NH3+ -159:sc=-0.00559 (180deg=-0.181) USER MOD Single : A 3 MET CE :methyl -133:sc= -1.97 (180deg=-4.25!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0399 USER MOD Single : A 6 SER OG : rot -16:sc= 0.212! USER MOD Single : A 9 ASN : amide:sc= -1.22 K(o=-1.2,f=-4.9!) USER MOD Single : A 14 GLN : amide:sc=-0.00713 X(o=-0.0071,f=-0.0071) USER MOD Single : A 19 TYR OH : rot -61:sc= 1.34 USER MOD Single : A 20 MET CE :methyl -164:sc= -4.4 (180deg=-5.53!) USER MOD Single : A 22 THR OG1 : rot -21:sc= 0.37 USER MOD Single : A 23 GLN : amide:sc= -1.17 K(o=-1.2,f=-2.5) USER MOD Single : A 28 THR OG1 : rot 70:sc= 0.231 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 GLN : amide:sc=-0.000243 X(o=-0.00024,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0.0478 USER MOD Single : A 44 GLN : amide:sc= -0.385 K(o=-0.39,f=-1.1) USER MOD Single : B 1 MET CE :methyl 148:sc= -3.95! (180deg=-5.81!) USER MOD Single : B 1 MET N :NH3+ -159:sc=-0.00969 (180deg=-0.16) USER MOD Single : B 3 MET CE :methyl -123:sc= -2.34 (180deg=-4.66!) USER MOD Single : B 5 THR OG1 : rot 180:sc= -0.0956 USER MOD Single : B 6 SER OG : rot -18:sc= 0.382! USER MOD Single : B 9 ASN : amide:sc= -1.22 K(o=-1.2,f=-5.8!) USER MOD Single : B 14 GLN : amide:sc= -0.188 X(o=-0.19,f=0) USER MOD Single : B 19 TYR OH : rot -60:sc= 1.31 USER MOD Single : B 20 MET CE :methyl -155:sc= -3.75! (180deg=-4.82!) USER MOD Single : B 22 THR OG1 : rot -20:sc= 0.464 USER MOD Single : B 23 GLN : amide:sc= -0.743 K(o=-0.74,f=-0.1) USER MOD Single : B 28 THR OG1 : rot 69:sc= 0.788 USER MOD Single : B 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 35 SER OG : rot 27:sc= 0.0764 USER MOD Single : B 43 SER OG : rot 180:sc= 0.0809 USER MOD Single : B 44 GLN : amide:sc= -0.239 X(o=-0.24,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.991 -10.883 -3.867 1.00 0.00 N ATOM 2 CA MET A 1 -1.316 -10.036 -4.844 1.00 0.00 C ATOM 3 C MET A 1 -1.431 -10.627 -6.246 1.00 0.00 C ATOM 4 O MET A 1 -1.008 -11.757 -6.491 1.00 0.00 O ATOM 5 CB MET A 1 0.157 -9.864 -4.470 1.00 0.00 C ATOM 6 CG MET A 1 0.368 -9.181 -3.129 1.00 0.00 C ATOM 7 SD MET A 1 1.375 -7.691 -3.259 1.00 0.00 S ATOM 8 CE MET A 1 0.451 -6.763 -4.481 1.00 0.00 C ATOM 0 H1 MET A 1 -2.215 -10.324 -3.019 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.871 -11.255 -4.279 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.369 -11.675 -3.606 1.00 0.00 H new ATOM 0 HA MET A 1 -1.801 -9.060 -4.839 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.635 -10.844 -4.449 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.655 -9.283 -5.246 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.601 -8.924 -2.700 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.846 -9.879 -2.441 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.510 -5.699 -4.251 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.872 -6.944 -5.470 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.592 -7.080 -4.467 1.00 0.00 H new ATOM 18 N LEU A 2 -2.006 -9.856 -7.162 1.00 0.00 N ATOM 19 CA LEU A 2 -2.177 -10.303 -8.540 1.00 0.00 C ATOM 20 C LEU A 2 -1.445 -9.377 -9.508 1.00 0.00 C ATOM 21 O LEU A 2 -1.696 -8.173 -9.539 1.00 0.00 O ATOM 22 CB LEU A 2 -3.663 -10.361 -8.898 1.00 0.00 C ATOM 23 CG LEU A 2 -3.990 -10.622 -10.369 1.00 0.00 C ATOM 24 CD1 LEU A 2 -3.429 -11.965 -10.810 1.00 0.00 C ATOM 25 CD2 LEU A 2 -5.493 -10.568 -10.599 1.00 0.00 C ATOM 0 H LEU A 2 -2.362 -8.918 -6.976 1.00 0.00 H new ATOM 0 HA LEU A 2 -1.749 -11.302 -8.627 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.130 -11.142 -8.299 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.123 -9.417 -8.606 1.00 0.00 H new ATOM 0 HG LEU A 2 -3.523 -9.841 -10.969 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -3.671 -12.134 -11.859 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -2.346 -11.967 -10.683 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -3.867 -12.759 -10.204 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -5.707 -10.756 -11.651 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -5.982 -11.327 -9.988 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -5.868 -9.583 -10.323 1.00 0.00 H new ATOM 37 N MET A 3 -0.542 -9.950 -10.297 1.00 0.00 N ATOM 38 CA MET A 3 0.223 -9.176 -11.268 1.00 0.00 C ATOM 39 C MET A 3 -0.705 -8.451 -12.238 1.00 0.00 C ATOM 40 O MET A 3 -1.553 -9.071 -12.880 1.00 0.00 O ATOM 41 CB MET A 3 1.176 -10.089 -12.042 1.00 0.00 C ATOM 42 CG MET A 3 2.555 -9.487 -12.255 1.00 0.00 C ATOM 43 SD MET A 3 3.484 -10.321 -13.556 1.00 0.00 S ATOM 44 CE MET A 3 3.867 -8.944 -14.636 1.00 0.00 C ATOM 0 H MET A 3 -0.322 -10.946 -10.283 1.00 0.00 H new ATOM 0 HA MET A 3 0.805 -8.432 -10.725 1.00 0.00 H new ATOM 0 HB2 MET A 3 1.279 -11.032 -11.505 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.736 -10.321 -13.012 1.00 0.00 H new ATOM 0 HG2 MET A 3 2.451 -8.432 -12.507 1.00 0.00 H new ATOM 0 HG3 MET A 3 3.117 -9.538 -11.323 1.00 0.00 H new ATOM 0 HE1 MET A 3 3.646 -9.218 -15.667 1.00 0.00 H new ATOM 0 HE2 MET A 3 3.265 -8.081 -14.353 1.00 0.00 H new ATOM 0 HE3 MET A 3 4.924 -8.694 -14.546 1.00 0.00 H new ATOM 54 N ILE A 4 -0.537 -7.137 -12.339 1.00 0.00 N ATOM 55 CA ILE A 4 -1.359 -6.329 -13.231 1.00 0.00 C ATOM 56 C ILE A 4 -0.796 -6.328 -14.648 1.00 0.00 C ATOM 57 O ILE A 4 -1.525 -6.531 -15.619 1.00 0.00 O ATOM 58 CB ILE A 4 -1.469 -4.875 -12.733 1.00 0.00 C ATOM 59 CG1 ILE A 4 -2.207 -4.826 -11.394 1.00 0.00 C ATOM 60 CG2 ILE A 4 -2.178 -4.014 -13.767 1.00 0.00 C ATOM 61 CD1 ILE A 4 -3.545 -5.533 -11.415 1.00 0.00 C ATOM 0 H ILE A 4 0.161 -6.609 -11.814 1.00 0.00 H new ATOM 0 HA ILE A 4 -2.352 -6.778 -13.238 1.00 0.00 H new ATOM 0 HB ILE A 4 -0.464 -4.479 -12.587 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -1.579 -5.277 -10.626 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -2.360 -3.785 -11.110 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -2.248 -2.990 -13.401 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -1.615 -4.028 -14.700 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.180 -4.406 -13.942 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.012 -5.458 -10.433 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.191 -5.068 -12.160 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.398 -6.583 -11.667 1.00 0.00 H new ATOM 73 N THR A 5 0.509 -6.100 -14.760 1.00 0.00 N ATOM 74 CA THR A 5 1.172 -6.074 -16.058 1.00 0.00 C ATOM 75 C THR A 5 2.683 -5.943 -15.901 1.00 0.00 C ATOM 76 O THR A 5 3.196 -5.862 -14.785 1.00 0.00 O ATOM 77 CB THR A 5 0.655 -4.913 -16.929 1.00 0.00 C ATOM 78 OG1 THR A 5 1.113 -5.070 -18.276 1.00 0.00 O ATOM 79 CG2 THR A 5 1.127 -3.574 -16.381 1.00 0.00 C ATOM 0 H THR A 5 1.128 -5.931 -13.967 1.00 0.00 H new ATOM 0 HA THR A 5 0.941 -7.019 -16.550 1.00 0.00 H new ATOM 0 HB THR A 5 -0.435 -4.932 -16.911 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.779 -4.329 -18.824 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.750 -2.769 -17.012 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.753 -3.444 -15.365 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.217 -3.548 -16.372 1.00 0.00 H new ATOM 87 N SER A 6 3.390 -5.923 -17.026 1.00 0.00 N ATOM 88 CA SER A 6 4.843 -5.805 -17.013 1.00 0.00 C ATOM 89 C SER A 6 5.309 -4.718 -17.978 1.00 0.00 C ATOM 90 O SER A 6 4.936 -4.712 -19.151 1.00 0.00 O ATOM 91 CB SER A 6 5.488 -7.142 -17.384 1.00 0.00 C ATOM 92 OG SER A 6 5.781 -7.200 -18.769 1.00 0.00 O ATOM 0 H SER A 6 2.980 -5.987 -17.958 1.00 0.00 H new ATOM 0 HA SER A 6 5.151 -5.528 -16.005 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.404 -7.279 -16.809 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.818 -7.959 -17.116 1.00 0.00 H new ATOM 0 HG SER A 6 5.285 -6.497 -19.238 1.00 0.00 H new ATOM 98 N PHE A 7 6.127 -3.800 -17.474 1.00 0.00 N ATOM 99 CA PHE A 7 6.644 -2.707 -18.289 1.00 0.00 C ATOM 100 C PHE A 7 8.166 -2.772 -18.384 1.00 0.00 C ATOM 101 O PHE A 7 8.804 -3.602 -17.738 1.00 0.00 O ATOM 102 CB PHE A 7 6.215 -1.359 -17.705 1.00 0.00 C ATOM 103 CG PHE A 7 4.758 -1.055 -17.906 1.00 0.00 C ATOM 104 CD1 PHE A 7 4.151 -1.287 -19.130 1.00 0.00 C ATOM 105 CD2 PHE A 7 3.995 -0.539 -16.872 1.00 0.00 C ATOM 106 CE1 PHE A 7 2.811 -1.007 -19.318 1.00 0.00 C ATOM 107 CE2 PHE A 7 2.654 -0.257 -17.054 1.00 0.00 C ATOM 108 CZ PHE A 7 2.061 -0.493 -18.278 1.00 0.00 C ATOM 0 H PHE A 7 6.446 -3.791 -16.505 1.00 0.00 H new ATOM 0 HA PHE A 7 6.230 -2.808 -19.292 1.00 0.00 H new ATOM 0 HB2 PHE A 7 6.436 -1.347 -16.638 1.00 0.00 H new ATOM 0 HB3 PHE A 7 6.809 -0.568 -18.163 1.00 0.00 H new ATOM 0 HD1 PHE A 7 4.732 -1.691 -19.946 1.00 0.00 H new ATOM 0 HD2 PHE A 7 4.453 -0.355 -15.912 1.00 0.00 H new ATOM 0 HE1 PHE A 7 2.350 -1.190 -20.278 1.00 0.00 H new ATOM 0 HE2 PHE A 7 2.071 0.147 -16.240 1.00 0.00 H new ATOM 0 HZ PHE A 7 1.013 -0.276 -18.422 1.00 0.00 H new ATOM 118 N ALA A 8 8.740 -1.890 -19.196 1.00 0.00 N ATOM 119 CA ALA A 8 10.186 -1.845 -19.375 1.00 0.00 C ATOM 120 C ALA A 8 10.710 -0.419 -19.249 1.00 0.00 C ATOM 121 O ALA A 8 11.487 0.043 -20.085 1.00 0.00 O ATOM 122 CB ALA A 8 10.569 -2.433 -20.725 1.00 0.00 C ATOM 0 H ALA A 8 8.226 -1.197 -19.740 1.00 0.00 H new ATOM 0 HA ALA A 8 10.644 -2.443 -18.587 1.00 0.00 H new ATOM 0 HB1 ALA A 8 11.652 -2.393 -20.845 1.00 0.00 H new ATOM 0 HB2 ALA A 8 10.236 -3.470 -20.778 1.00 0.00 H new ATOM 0 HB3 ALA A 8 10.094 -1.858 -21.520 1.00 0.00 H new ATOM 128 N ASN A 9 10.281 0.275 -18.200 1.00 0.00 N ATOM 129 CA ASN A 9 10.707 1.650 -17.966 1.00 0.00 C ATOM 130 C ASN A 9 10.149 2.175 -16.647 1.00 0.00 C ATOM 131 O ASN A 9 9.005 1.907 -16.277 1.00 0.00 O ATOM 132 CB ASN A 9 10.255 2.549 -19.118 1.00 0.00 C ATOM 133 CG ASN A 9 11.373 2.835 -20.101 1.00 0.00 C ATOM 134 OD1 ASN A 9 12.464 3.254 -19.713 1.00 0.00 O ATOM 135 ND2 ASN A 9 11.107 2.609 -21.383 1.00 0.00 N ATOM 0 H ASN A 9 9.638 -0.092 -17.498 1.00 0.00 H new ATOM 0 HA ASN A 9 11.795 1.662 -17.910 1.00 0.00 H new ATOM 0 HB2 ASN A 9 9.426 2.073 -19.643 1.00 0.00 H new ATOM 0 HB3 ASN A 9 9.879 3.490 -18.715 1.00 0.00 H new ATOM 0 HD21 ASN A 9 11.821 2.783 -22.090 1.00 0.00 H new ATOM 0 HD22 ASN A 9 10.189 2.262 -21.660 1.00 0.00 H new ATOM 142 N PRO A 10 10.974 2.942 -15.919 1.00 0.00 N ATOM 143 CA PRO A 10 10.584 3.523 -14.630 1.00 0.00 C ATOM 144 C PRO A 10 9.537 4.621 -14.782 1.00 0.00 C ATOM 145 O PRO A 10 8.601 4.713 -13.988 1.00 0.00 O ATOM 146 CB PRO A 10 11.894 4.103 -14.092 1.00 0.00 C ATOM 147 CG PRO A 10 12.716 4.371 -15.305 1.00 0.00 C ATOM 148 CD PRO A 10 12.350 3.303 -16.298 1.00 0.00 C ATOM 0 HA PRO A 10 10.127 2.785 -13.971 1.00 0.00 H new ATOM 0 HB2 PRO A 10 11.719 5.016 -13.523 1.00 0.00 H new ATOM 0 HB3 PRO A 10 12.392 3.401 -13.423 1.00 0.00 H new ATOM 0 HG2 PRO A 10 12.509 5.363 -15.705 1.00 0.00 H new ATOM 0 HG3 PRO A 10 13.780 4.338 -15.071 1.00 0.00 H new ATOM 0 HD2 PRO A 10 12.401 3.672 -17.322 1.00 0.00 H new ATOM 0 HD3 PRO A 10 13.022 2.447 -16.234 1.00 0.00 H new ATOM 156 N ARG A 11 9.702 5.452 -15.806 1.00 0.00 N ATOM 157 CA ARG A 11 8.772 6.545 -16.061 1.00 0.00 C ATOM 158 C ARG A 11 7.346 6.022 -16.210 1.00 0.00 C ATOM 159 O ARG A 11 6.418 6.529 -15.581 1.00 0.00 O ATOM 160 CB ARG A 11 9.181 7.308 -17.322 1.00 0.00 C ATOM 161 CG ARG A 11 10.669 7.609 -17.396 1.00 0.00 C ATOM 162 CD ARG A 11 11.214 8.056 -16.049 1.00 0.00 C ATOM 163 NE ARG A 11 12.276 9.048 -16.190 1.00 0.00 N ATOM 164 CZ ARG A 11 13.500 8.760 -16.618 1.00 0.00 C ATOM 165 NH1 ARG A 11 13.814 7.514 -16.946 1.00 0.00 N ATOM 166 NH2 ARG A 11 14.412 9.718 -16.720 1.00 0.00 N ATOM 0 H ARG A 11 10.471 5.389 -16.473 1.00 0.00 H new ATOM 0 HA ARG A 11 8.805 7.223 -15.208 1.00 0.00 H new ATOM 0 HB2 ARG A 11 8.893 6.727 -18.198 1.00 0.00 H new ATOM 0 HB3 ARG A 11 8.627 8.246 -17.365 1.00 0.00 H new ATOM 0 HG2 ARG A 11 11.205 6.721 -17.730 1.00 0.00 H new ATOM 0 HG3 ARG A 11 10.848 8.387 -18.138 1.00 0.00 H new ATOM 0 HD2 ARG A 11 10.404 8.474 -15.451 1.00 0.00 H new ATOM 0 HD3 ARG A 11 11.596 7.191 -15.507 1.00 0.00 H new ATOM 0 HE ARG A 11 12.066 10.016 -15.946 1.00 0.00 H new ATOM 0 HH11 ARG A 11 13.115 6.775 -16.870 1.00 0.00 H new ATOM 0 HH12 ARG A 11 14.754 7.295 -17.275 1.00 0.00 H new ATOM 0 HH21 ARG A 11 14.174 10.678 -16.470 1.00 0.00 H new ATOM 0 HH22 ARG A 11 15.351 9.495 -17.049 1.00 0.00 H new ATOM 180 N VAL A 12 7.180 5.003 -17.048 1.00 0.00 N ATOM 181 CA VAL A 12 5.868 4.410 -17.280 1.00 0.00 C ATOM 182 C VAL A 12 5.341 3.733 -16.020 1.00 0.00 C ATOM 183 O VAL A 12 4.227 4.009 -15.574 1.00 0.00 O ATOM 184 CB VAL A 12 5.912 3.379 -18.423 1.00 0.00 C ATOM 185 CG1 VAL A 12 4.504 2.983 -18.840 1.00 0.00 C ATOM 186 CG2 VAL A 12 6.692 3.931 -19.607 1.00 0.00 C ATOM 0 H VAL A 12 7.938 4.571 -17.577 1.00 0.00 H new ATOM 0 HA VAL A 12 5.198 5.223 -17.560 1.00 0.00 H new ATOM 0 HB VAL A 12 6.423 2.486 -18.064 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.556 2.254 -19.649 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.982 2.545 -17.989 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.964 3.866 -19.181 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.713 3.190 -20.406 1.00 0.00 H new ATOM 0 HG22 VAL A 12 6.211 4.840 -19.968 1.00 0.00 H new ATOM 0 HG23 VAL A 12 7.712 4.159 -19.296 1.00 0.00 H new ATOM 196 N ALA A 13 6.149 2.845 -15.449 1.00 0.00 N ATOM 197 CA ALA A 13 5.765 2.130 -14.239 1.00 0.00 C ATOM 198 C ALA A 13 5.241 3.091 -13.176 1.00 0.00 C ATOM 199 O ALA A 13 4.080 3.013 -12.775 1.00 0.00 O ATOM 200 CB ALA A 13 6.944 1.335 -13.699 1.00 0.00 C ATOM 0 H ALA A 13 7.074 2.604 -15.806 1.00 0.00 H new ATOM 0 HA ALA A 13 4.962 1.439 -14.495 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.643 0.806 -12.795 1.00 0.00 H new ATOM 0 HB2 ALA A 13 7.271 0.615 -14.449 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.764 2.014 -13.466 1.00 0.00 H new ATOM 206 N GLN A 14 6.104 3.995 -12.726 1.00 0.00 N ATOM 207 CA GLN A 14 5.728 4.970 -11.708 1.00 0.00 C ATOM 208 C GLN A 14 4.497 5.760 -12.141 1.00 0.00 C ATOM 209 O GLN A 14 3.541 5.905 -11.380 1.00 0.00 O ATOM 210 CB GLN A 14 6.890 5.924 -11.431 1.00 0.00 C ATOM 211 CG GLN A 14 6.535 7.057 -10.482 1.00 0.00 C ATOM 212 CD GLN A 14 6.211 6.567 -9.084 1.00 0.00 C ATOM 213 OE1 GLN A 14 7.037 5.929 -8.431 1.00 0.00 O ATOM 214 NE2 GLN A 14 5.003 6.863 -8.617 1.00 0.00 N ATOM 0 H GLN A 14 7.068 4.073 -13.050 1.00 0.00 H new ATOM 0 HA GLN A 14 5.487 4.429 -10.793 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.722 5.358 -11.012 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.235 6.346 -12.375 1.00 0.00 H new ATOM 0 HG2 GLN A 14 7.367 7.759 -10.433 1.00 0.00 H new ATOM 0 HG3 GLN A 14 5.680 7.604 -10.879 1.00 0.00 H new ATOM 0 HE21 GLN A 14 4.350 7.394 -9.193 1.00 0.00 H new ATOM 0 HE22 GLN A 14 4.729 6.559 -7.683 1.00 0.00 H new ATOM 223 N ALA A 15 4.529 6.270 -13.368 1.00 0.00 N ATOM 224 CA ALA A 15 3.416 7.045 -13.903 1.00 0.00 C ATOM 225 C ALA A 15 2.098 6.294 -13.744 1.00 0.00 C ATOM 226 O ALA A 15 1.162 6.788 -13.115 1.00 0.00 O ATOM 227 CB ALA A 15 3.661 7.381 -15.366 1.00 0.00 C ATOM 0 H ALA A 15 5.314 6.160 -14.010 1.00 0.00 H new ATOM 0 HA ALA A 15 3.346 7.973 -13.336 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.822 7.960 -15.752 1.00 0.00 H new ATOM 0 HB2 ALA A 15 4.577 7.965 -15.457 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.760 6.459 -15.939 1.00 0.00 H new ATOM 233 N PHE A 16 2.032 5.097 -14.318 1.00 0.00 N ATOM 234 CA PHE A 16 0.828 4.278 -14.242 1.00 0.00 C ATOM 235 C PHE A 16 0.349 4.148 -12.799 1.00 0.00 C ATOM 236 O PHE A 16 -0.821 4.383 -12.497 1.00 0.00 O ATOM 237 CB PHE A 16 1.090 2.891 -14.831 1.00 0.00 C ATOM 238 CG PHE A 16 0.747 2.785 -16.290 1.00 0.00 C ATOM 239 CD1 PHE A 16 1.545 3.387 -17.249 1.00 0.00 C ATOM 240 CD2 PHE A 16 -0.374 2.082 -16.702 1.00 0.00 C ATOM 241 CE1 PHE A 16 1.232 3.291 -18.592 1.00 0.00 C ATOM 242 CE2 PHE A 16 -0.692 1.982 -18.043 1.00 0.00 C ATOM 243 CZ PHE A 16 0.111 2.588 -18.989 1.00 0.00 C ATOM 0 H PHE A 16 2.798 4.673 -14.841 1.00 0.00 H new ATOM 0 HA PHE A 16 0.048 4.770 -14.823 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.142 2.639 -14.694 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.511 2.154 -14.275 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.422 3.938 -16.944 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -1.006 1.607 -15.967 1.00 0.00 H new ATOM 0 HE1 PHE A 16 1.863 3.765 -19.330 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -1.568 1.430 -18.351 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.137 2.512 -20.037 1.00 0.00 H new ATOM 253 N VAL A 17 1.263 3.771 -11.911 1.00 0.00 N ATOM 254 CA VAL A 17 0.936 3.609 -10.499 1.00 0.00 C ATOM 255 C VAL A 17 0.541 4.941 -9.870 1.00 0.00 C ATOM 256 O VAL A 17 -0.137 4.977 -8.843 1.00 0.00 O ATOM 257 CB VAL A 17 2.120 3.014 -9.713 1.00 0.00 C ATOM 258 CG1 VAL A 17 1.785 2.920 -8.232 1.00 0.00 C ATOM 259 CG2 VAL A 17 2.497 1.650 -10.271 1.00 0.00 C ATOM 0 H VAL A 17 2.236 3.572 -12.144 1.00 0.00 H new ATOM 0 HA VAL A 17 0.092 2.921 -10.447 1.00 0.00 H new ATOM 0 HB VAL A 17 2.978 3.677 -9.825 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.633 2.497 -7.693 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.568 3.915 -7.844 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.913 2.280 -8.096 1.00 0.00 H new ATOM 0 HG21 VAL A 17 3.335 1.244 -9.704 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.644 0.976 -10.191 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.782 1.751 -11.318 1.00 0.00 H new ATOM 269 N ASP A 18 0.969 6.033 -10.494 1.00 0.00 N ATOM 270 CA ASP A 18 0.659 7.368 -9.996 1.00 0.00 C ATOM 271 C ASP A 18 -0.817 7.694 -10.199 1.00 0.00 C ATOM 272 O ASP A 18 -1.543 7.957 -9.240 1.00 0.00 O ATOM 273 CB ASP A 18 1.526 8.413 -10.701 1.00 0.00 C ATOM 274 CG ASP A 18 1.565 9.732 -9.955 1.00 0.00 C ATOM 275 OD1 ASP A 18 2.156 9.774 -8.855 1.00 0.00 O ATOM 276 OD2 ASP A 18 1.007 10.722 -10.472 1.00 0.00 O ATOM 0 H ASP A 18 1.531 6.020 -11.345 1.00 0.00 H new ATOM 0 HA ASP A 18 0.874 7.389 -8.928 1.00 0.00 H new ATOM 0 HB2 ASP A 18 2.540 8.028 -10.806 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.143 8.580 -11.708 1.00 0.00 H new ATOM 281 N TYR A 19 -1.255 7.676 -11.454 1.00 0.00 N ATOM 282 CA TYR A 19 -2.644 7.974 -11.783 1.00 0.00 C ATOM 283 C TYR A 19 -3.585 6.961 -11.138 1.00 0.00 C ATOM 284 O TYR A 19 -4.717 7.287 -10.783 1.00 0.00 O ATOM 285 CB TYR A 19 -2.841 7.976 -13.300 1.00 0.00 C ATOM 286 CG TYR A 19 -3.168 6.615 -13.870 1.00 0.00 C ATOM 287 CD1 TYR A 19 -4.440 6.073 -13.741 1.00 0.00 C ATOM 288 CD2 TYR A 19 -2.204 5.871 -14.540 1.00 0.00 C ATOM 289 CE1 TYR A 19 -4.743 4.829 -14.260 1.00 0.00 C ATOM 290 CE2 TYR A 19 -2.498 4.627 -15.064 1.00 0.00 C ATOM 291 CZ TYR A 19 -3.768 4.110 -14.921 1.00 0.00 C ATOM 292 OH TYR A 19 -4.066 2.871 -15.441 1.00 0.00 O ATOM 0 H TYR A 19 -0.668 7.458 -12.259 1.00 0.00 H new ATOM 0 HA TYR A 19 -2.880 8.963 -11.391 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -3.644 8.669 -13.553 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.935 8.351 -13.775 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -5.206 6.634 -13.226 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -1.208 6.272 -14.653 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -5.737 4.422 -14.149 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -1.737 4.063 -15.583 1.00 0.00 H new ATOM 0 HH TYR A 19 -4.332 2.267 -14.716 1.00 0.00 H new ATOM 302 N MET A 20 -3.107 5.729 -10.990 1.00 0.00 N ATOM 303 CA MET A 20 -3.905 4.668 -10.387 1.00 0.00 C ATOM 304 C MET A 20 -4.037 4.876 -8.881 1.00 0.00 C ATOM 305 O MET A 20 -5.106 4.669 -8.308 1.00 0.00 O ATOM 306 CB MET A 20 -3.275 3.303 -10.671 1.00 0.00 C ATOM 307 CG MET A 20 -4.294 2.189 -10.852 1.00 0.00 C ATOM 308 SD MET A 20 -4.705 1.898 -12.583 1.00 0.00 S ATOM 309 CE MET A 20 -6.433 2.367 -12.604 1.00 0.00 C ATOM 0 H MET A 20 -2.172 5.442 -11.279 1.00 0.00 H new ATOM 0 HA MET A 20 -4.901 4.700 -10.829 1.00 0.00 H new ATOM 0 HB2 MET A 20 -2.663 3.374 -11.570 1.00 0.00 H new ATOM 0 HB3 MET A 20 -2.606 3.043 -9.850 1.00 0.00 H new ATOM 0 HG2 MET A 20 -3.903 1.270 -10.416 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.202 2.440 -10.304 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.903 1.984 -13.510 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.934 1.950 -11.731 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.515 3.454 -12.585 1.00 0.00 H new ATOM 319 N ALA A 21 -2.944 5.287 -8.247 1.00 0.00 N ATOM 320 CA ALA A 21 -2.939 5.525 -6.809 1.00 0.00 C ATOM 321 C ALA A 21 -3.862 6.682 -6.441 1.00 0.00 C ATOM 322 O ALA A 21 -4.591 6.617 -5.450 1.00 0.00 O ATOM 323 CB ALA A 21 -1.524 5.803 -6.325 1.00 0.00 C ATOM 0 H ALA A 21 -2.050 5.462 -8.707 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.310 4.627 -6.316 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.535 5.979 -5.249 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.889 4.945 -6.546 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.132 6.684 -6.833 1.00 0.00 H new ATOM 329 N THR A 22 -3.827 7.740 -7.244 1.00 0.00 N ATOM 330 CA THR A 22 -4.659 8.912 -7.002 1.00 0.00 C ATOM 331 C THR A 22 -6.122 8.622 -7.316 1.00 0.00 C ATOM 332 O THR A 22 -7.008 9.399 -6.961 1.00 0.00 O ATOM 333 CB THR A 22 -4.194 10.115 -7.843 1.00 0.00 C ATOM 334 OG1 THR A 22 -5.009 11.257 -7.557 1.00 0.00 O ATOM 335 CG2 THR A 22 -4.262 9.796 -9.329 1.00 0.00 C ATOM 0 H THR A 22 -3.231 7.810 -8.069 1.00 0.00 H new ATOM 0 HA THR A 22 -4.559 9.157 -5.945 1.00 0.00 H new ATOM 0 HB THR A 22 -3.159 10.334 -7.582 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.862 10.963 -7.175 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.929 10.661 -9.902 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.617 8.945 -9.548 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.289 9.553 -9.602 1.00 0.00 H new ATOM 343 N GLN A 23 -6.368 7.499 -7.983 1.00 0.00 N ATOM 344 CA GLN A 23 -7.725 7.107 -8.345 1.00 0.00 C ATOM 345 C GLN A 23 -8.340 6.218 -7.269 1.00 0.00 C ATOM 346 O GLN A 23 -9.489 5.792 -7.384 1.00 0.00 O ATOM 347 CB GLN A 23 -7.727 6.377 -9.689 1.00 0.00 C ATOM 348 CG GLN A 23 -7.652 7.309 -10.888 1.00 0.00 C ATOM 349 CD GLN A 23 -8.959 8.030 -11.149 1.00 0.00 C ATOM 350 OE1 GLN A 23 -9.757 7.609 -11.986 1.00 0.00 O ATOM 351 NE2 GLN A 23 -9.185 9.125 -10.432 1.00 0.00 N ATOM 0 H GLN A 23 -5.646 6.845 -8.284 1.00 0.00 H new ATOM 0 HA GLN A 23 -8.327 8.012 -8.431 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.882 5.689 -9.721 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -8.632 5.774 -9.764 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.863 8.043 -10.724 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -7.375 6.735 -11.772 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -8.496 9.438 -9.749 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -10.048 9.653 -10.565 1.00 0.00 H new ATOM 360 N GLY A 24 -7.567 5.940 -6.224 1.00 0.00 N ATOM 361 CA GLY A 24 -8.053 5.103 -5.143 1.00 0.00 C ATOM 362 C GLY A 24 -7.517 3.687 -5.221 1.00 0.00 C ATOM 363 O GLY A 24 -7.771 2.869 -4.337 1.00 0.00 O ATOM 0 H GLY A 24 -6.612 6.280 -6.107 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.767 5.545 -4.189 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -9.142 5.078 -5.168 1.00 0.00 H new ATOM 367 N VAL A 25 -6.774 3.394 -6.284 1.00 0.00 N ATOM 368 CA VAL A 25 -6.202 2.067 -6.475 1.00 0.00 C ATOM 369 C VAL A 25 -4.686 2.094 -6.316 1.00 0.00 C ATOM 370 O VAL A 25 -3.976 2.679 -7.135 1.00 0.00 O ATOM 371 CB VAL A 25 -6.551 1.500 -7.864 1.00 0.00 C ATOM 372 CG1 VAL A 25 -6.218 0.018 -7.935 1.00 0.00 C ATOM 373 CG2 VAL A 25 -8.019 1.741 -8.184 1.00 0.00 C ATOM 0 H VAL A 25 -6.554 4.058 -7.026 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.634 1.423 -5.709 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.950 2.019 -8.611 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -6.471 -0.365 -8.924 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -5.153 -0.125 -7.753 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.791 -0.520 -7.180 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.248 1.334 -9.169 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.640 1.250 -7.435 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.222 2.812 -8.178 1.00 0.00 H new ATOM 383 N ILE A 26 -4.197 1.458 -5.257 1.00 0.00 N ATOM 384 CA ILE A 26 -2.764 1.408 -4.991 1.00 0.00 C ATOM 385 C ILE A 26 -2.088 0.327 -5.826 1.00 0.00 C ATOM 386 O ILE A 26 -2.562 -0.808 -5.894 1.00 0.00 O ATOM 387 CB ILE A 26 -2.477 1.145 -3.501 1.00 0.00 C ATOM 388 CG1 ILE A 26 -3.109 2.239 -2.636 1.00 0.00 C ATOM 389 CG2 ILE A 26 -0.978 1.069 -3.256 1.00 0.00 C ATOM 390 CD1 ILE A 26 -2.571 3.623 -2.924 1.00 0.00 C ATOM 0 H ILE A 26 -4.771 0.970 -4.569 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.358 2.382 -5.264 1.00 0.00 H new ATOM 0 HB ILE A 26 -2.920 0.188 -3.224 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.188 2.237 -2.793 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -2.940 2.003 -1.585 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.791 0.883 -2.198 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.553 0.258 -3.848 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.514 2.012 -3.546 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -3.063 4.347 -2.275 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.497 3.642 -2.739 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.764 3.879 -3.966 1.00 0.00 H new ATOM 402 N LEU A 27 -0.976 0.685 -6.459 1.00 0.00 N ATOM 403 CA LEU A 27 -0.231 -0.255 -7.289 1.00 0.00 C ATOM 404 C LEU A 27 1.226 -0.337 -6.846 1.00 0.00 C ATOM 405 O LEU A 27 1.717 0.532 -6.125 1.00 0.00 O ATOM 406 CB LEU A 27 -0.307 0.161 -8.759 1.00 0.00 C ATOM 407 CG LEU A 27 -1.635 -0.113 -9.466 1.00 0.00 C ATOM 408 CD1 LEU A 27 -1.556 0.300 -10.928 1.00 0.00 C ATOM 409 CD2 LEU A 27 -2.012 -1.582 -9.345 1.00 0.00 C ATOM 0 H LEU A 27 -0.570 1.620 -6.413 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.682 -1.240 -7.173 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -0.097 1.228 -8.825 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.485 -0.354 -9.303 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.411 0.481 -8.983 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -2.510 0.098 -11.415 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.334 1.365 -10.994 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.768 -0.267 -11.424 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.960 -1.758 -9.854 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.236 -2.196 -9.802 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.111 -1.847 -8.292 1.00 0.00 H new ATOM 421 N THR A 28 1.915 -1.386 -7.285 1.00 0.00 N ATOM 422 CA THR A 28 3.316 -1.581 -6.935 1.00 0.00 C ATOM 423 C THR A 28 4.152 -1.897 -8.170 1.00 0.00 C ATOM 424 O THR A 28 3.653 -2.472 -9.138 1.00 0.00 O ATOM 425 CB THR A 28 3.486 -2.717 -5.909 1.00 0.00 C ATOM 426 OG1 THR A 28 2.216 -3.066 -5.349 1.00 0.00 O ATOM 427 CG2 THR A 28 4.440 -2.305 -4.798 1.00 0.00 C ATOM 0 H THR A 28 1.525 -2.114 -7.884 1.00 0.00 H new ATOM 0 HA THR A 28 3.664 -0.648 -6.493 1.00 0.00 H new ATOM 0 HB THR A 28 3.905 -3.581 -6.424 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.670 -3.513 -6.029 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.544 -3.123 -4.086 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.415 -2.069 -5.224 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.045 -1.427 -4.287 1.00 0.00 H new ATOM 435 N ILE A 29 5.425 -1.520 -8.129 1.00 0.00 N ATOM 436 CA ILE A 29 6.331 -1.765 -9.245 1.00 0.00 C ATOM 437 C ILE A 29 7.575 -2.519 -8.788 1.00 0.00 C ATOM 438 O ILE A 29 8.073 -2.302 -7.684 1.00 0.00 O ATOM 439 CB ILE A 29 6.761 -0.450 -9.921 1.00 0.00 C ATOM 440 CG1 ILE A 29 5.546 0.263 -10.519 1.00 0.00 C ATOM 441 CG2 ILE A 29 7.803 -0.723 -10.995 1.00 0.00 C ATOM 442 CD1 ILE A 29 4.855 -0.530 -11.606 1.00 0.00 C ATOM 0 H ILE A 29 5.853 -1.044 -7.335 1.00 0.00 H new ATOM 0 HA ILE A 29 5.785 -2.373 -9.966 1.00 0.00 H new ATOM 0 HB ILE A 29 7.206 0.200 -9.168 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.831 0.474 -9.724 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.862 1.223 -10.926 1.00 0.00 H new ATOM 0 HG21 ILE A 29 8.097 0.216 -11.464 1.00 0.00 H new ATOM 0 HG22 ILE A 29 8.677 -1.192 -10.543 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.383 -1.389 -11.749 1.00 0.00 H new ATOM 0 HD11 ILE A 29 4.003 0.036 -11.984 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.555 -0.719 -12.420 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.508 -1.480 -11.199 1.00 0.00 H new ATOM 454 N GLN A 30 8.072 -3.405 -9.645 1.00 0.00 N ATOM 455 CA GLN A 30 9.259 -4.190 -9.329 1.00 0.00 C ATOM 456 C GLN A 30 10.359 -3.952 -10.358 1.00 0.00 C ATOM 457 O GLN A 30 10.301 -4.469 -11.473 1.00 0.00 O ATOM 458 CB GLN A 30 8.911 -5.679 -9.273 1.00 0.00 C ATOM 459 CG GLN A 30 8.741 -6.211 -7.859 1.00 0.00 C ATOM 460 CD GLN A 30 9.739 -7.300 -7.521 1.00 0.00 C ATOM 461 OE1 GLN A 30 9.601 -8.443 -7.959 1.00 0.00 O ATOM 462 NE2 GLN A 30 10.753 -6.952 -6.738 1.00 0.00 N ATOM 0 H GLN A 30 7.671 -3.597 -10.563 1.00 0.00 H new ATOM 0 HA GLN A 30 9.625 -3.872 -8.353 1.00 0.00 H new ATOM 0 HB2 GLN A 30 7.990 -5.849 -9.830 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.696 -6.246 -9.774 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.851 -5.390 -7.150 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.730 -6.601 -7.741 1.00 0.00 H new ATOM 0 HE21 GLN A 30 10.829 -5.994 -6.397 1.00 0.00 H new ATOM 0 HE22 GLN A 30 11.456 -7.643 -6.477 1.00 0.00 H new ATOM 471 N GLN A 31 11.360 -3.166 -9.976 1.00 0.00 N ATOM 472 CA GLN A 31 12.473 -2.858 -10.866 1.00 0.00 C ATOM 473 C GLN A 31 13.528 -3.958 -10.819 1.00 0.00 C ATOM 474 O GLN A 31 14.143 -4.198 -9.780 1.00 0.00 O ATOM 475 CB GLN A 31 13.101 -1.516 -10.487 1.00 0.00 C ATOM 476 CG GLN A 31 12.928 -0.442 -11.549 1.00 0.00 C ATOM 477 CD GLN A 31 13.545 0.883 -11.145 1.00 0.00 C ATOM 478 OE1 GLN A 31 12.856 1.898 -11.045 1.00 0.00 O ATOM 479 NE2 GLN A 31 14.852 0.879 -10.910 1.00 0.00 N ATOM 0 H GLN A 31 11.423 -2.731 -9.056 1.00 0.00 H new ATOM 0 HA GLN A 31 12.085 -2.795 -11.883 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.658 -1.167 -9.554 1.00 0.00 H new ATOM 0 HB3 GLN A 31 14.165 -1.662 -10.300 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.382 -0.781 -12.480 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.866 -0.299 -11.746 1.00 0.00 H new ATOM 0 HE21 GLN A 31 15.385 0.014 -11.005 1.00 0.00 H new ATOM 0 HE22 GLN A 31 15.323 1.741 -10.634 1.00 0.00 H new ATOM 536 N SER A 35 23.565 -7.855 -14.493 1.00 0.00 N ATOM 537 CA SER A 35 24.807 -7.399 -15.106 1.00 0.00 C ATOM 538 C SER A 35 25.510 -8.545 -15.827 1.00 0.00 C ATOM 539 O SER A 35 26.178 -9.369 -15.203 1.00 0.00 O ATOM 540 CB SER A 35 25.735 -6.802 -14.047 1.00 0.00 C ATOM 541 OG SER A 35 25.249 -5.553 -13.588 1.00 0.00 O ATOM 0 HA SER A 35 24.560 -6.629 -15.837 1.00 0.00 H new ATOM 0 HB2 SER A 35 25.825 -7.491 -13.208 1.00 0.00 H new ATOM 0 HB3 SER A 35 26.734 -6.676 -14.464 1.00 0.00 H new ATOM 0 HG SER A 35 25.859 -5.193 -12.911 1.00 0.00 H new ATOM 547 N ASP A 36 25.353 -8.591 -17.146 1.00 0.00 N ATOM 548 CA ASP A 36 25.973 -9.635 -17.953 1.00 0.00 C ATOM 549 C ASP A 36 27.380 -9.229 -18.380 1.00 0.00 C ATOM 550 O ASP A 36 27.585 -8.146 -18.929 1.00 0.00 O ATOM 551 CB ASP A 36 25.118 -9.931 -19.186 1.00 0.00 C ATOM 552 CG ASP A 36 25.934 -10.482 -20.339 1.00 0.00 C ATOM 553 OD1 ASP A 36 26.797 -11.350 -20.092 1.00 0.00 O ATOM 554 OD2 ASP A 36 25.712 -10.043 -21.487 1.00 0.00 O ATOM 0 H ASP A 36 24.802 -7.918 -17.678 1.00 0.00 H new ATOM 0 HA ASP A 36 26.044 -10.536 -17.344 1.00 0.00 H new ATOM 0 HB2 ASP A 36 24.340 -10.647 -18.921 1.00 0.00 H new ATOM 0 HB3 ASP A 36 24.616 -9.017 -19.504 1.00 0.00 H new ATOM 559 N VAL A 37 28.347 -10.104 -18.124 1.00 0.00 N ATOM 560 CA VAL A 37 29.735 -9.837 -18.481 1.00 0.00 C ATOM 561 C VAL A 37 30.113 -10.542 -19.779 1.00 0.00 C ATOM 562 O VAL A 37 30.041 -11.767 -19.876 1.00 0.00 O ATOM 563 CB VAL A 37 30.698 -10.286 -17.366 1.00 0.00 C ATOM 564 CG1 VAL A 37 32.077 -9.679 -17.575 1.00 0.00 C ATOM 565 CG2 VAL A 37 30.143 -9.911 -16.001 1.00 0.00 C ATOM 0 H VAL A 37 28.194 -11.005 -17.670 1.00 0.00 H new ATOM 0 HA VAL A 37 29.826 -8.759 -18.616 1.00 0.00 H new ATOM 0 HB VAL A 37 30.795 -11.371 -17.408 1.00 0.00 H new ATOM 0 HG11 VAL A 37 32.744 -10.007 -16.778 1.00 0.00 H new ATOM 0 HG12 VAL A 37 32.475 -10.002 -18.537 1.00 0.00 H new ATOM 0 HG13 VAL A 37 32.002 -8.592 -17.560 1.00 0.00 H new ATOM 0 HG21 VAL A 37 30.836 -10.236 -15.225 1.00 0.00 H new ATOM 0 HG22 VAL A 37 30.015 -8.830 -15.945 1.00 0.00 H new ATOM 0 HG23 VAL A 37 29.179 -10.398 -15.854 1.00 0.00 H new ATOM 575 N TRP A 38 30.518 -9.760 -20.774 1.00 0.00 N ATOM 576 CA TRP A 38 30.909 -10.310 -22.067 1.00 0.00 C ATOM 577 C TRP A 38 32.284 -9.799 -22.482 1.00 0.00 C ATOM 578 O TRP A 38 32.627 -8.641 -22.238 1.00 0.00 O ATOM 579 CB TRP A 38 29.873 -9.947 -23.133 1.00 0.00 C ATOM 580 CG TRP A 38 29.082 -8.719 -22.798 1.00 0.00 C ATOM 581 CD1 TRP A 38 28.274 -8.535 -21.713 1.00 0.00 C ATOM 582 CD2 TRP A 38 29.022 -7.505 -23.556 1.00 0.00 C ATOM 583 NE1 TRP A 38 27.715 -7.280 -21.750 1.00 0.00 N ATOM 584 CE2 TRP A 38 28.159 -6.628 -22.870 1.00 0.00 C ATOM 585 CE3 TRP A 38 29.615 -7.073 -24.745 1.00 0.00 C ATOM 586 CZ2 TRP A 38 27.876 -5.347 -23.336 1.00 0.00 C ATOM 587 CZ3 TRP A 38 29.332 -5.802 -25.207 1.00 0.00 C ATOM 588 CH2 TRP A 38 28.470 -4.951 -24.503 1.00 0.00 C ATOM 0 H TRP A 38 30.584 -8.744 -20.710 1.00 0.00 H new ATOM 0 HA TRP A 38 30.958 -11.395 -21.973 1.00 0.00 H new ATOM 0 HB2 TRP A 38 30.380 -9.795 -24.086 1.00 0.00 H new ATOM 0 HB3 TRP A 38 29.190 -10.786 -23.266 1.00 0.00 H new ATOM 0 HD1 TRP A 38 28.100 -9.268 -20.939 1.00 0.00 H new ATOM 0 HE1 TRP A 38 27.074 -6.896 -21.056 1.00 0.00 H new ATOM 0 HE3 TRP A 38 30.283 -7.721 -25.293 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 27.211 -4.689 -22.796 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 29.783 -5.459 -26.126 1.00 0.00 H new ATOM 0 HH2 TRP A 38 28.270 -3.962 -24.889 1.00 0.00 H new ATOM 599 N LEU A 39 33.068 -10.668 -23.110 1.00 0.00 N ATOM 600 CA LEU A 39 34.408 -10.304 -23.560 1.00 0.00 C ATOM 601 C LEU A 39 34.500 -10.341 -25.082 1.00 0.00 C ATOM 602 O LEU A 39 33.768 -11.079 -25.740 1.00 0.00 O ATOM 603 CB LEU A 39 35.446 -11.248 -22.952 1.00 0.00 C ATOM 604 CG LEU A 39 36.855 -11.164 -23.539 1.00 0.00 C ATOM 605 CD1 LEU A 39 37.497 -9.828 -23.197 1.00 0.00 C ATOM 606 CD2 LEU A 39 37.713 -12.315 -23.033 1.00 0.00 C ATOM 0 H LEU A 39 32.800 -11.630 -23.319 1.00 0.00 H new ATOM 0 HA LEU A 39 34.612 -9.287 -23.227 1.00 0.00 H new ATOM 0 HB2 LEU A 39 35.507 -11.048 -21.882 1.00 0.00 H new ATOM 0 HB3 LEU A 39 35.087 -12.271 -23.065 1.00 0.00 H new ATOM 0 HG LEU A 39 36.781 -11.241 -24.624 1.00 0.00 H new ATOM 0 HD11 LEU A 39 38.499 -9.786 -23.623 1.00 0.00 H new ATOM 0 HD12 LEU A 39 36.894 -9.019 -23.608 1.00 0.00 H new ATOM 0 HD13 LEU A 39 37.558 -9.720 -22.114 1.00 0.00 H new ATOM 0 HD21 LEU A 39 38.713 -12.239 -23.461 1.00 0.00 H new ATOM 0 HD22 LEU A 39 37.779 -12.269 -21.946 1.00 0.00 H new ATOM 0 HD23 LEU A 39 37.262 -13.262 -23.329 1.00 0.00 H new ATOM 618 N ALA A 40 35.406 -9.540 -25.635 1.00 0.00 N ATOM 619 CA ALA A 40 35.597 -9.485 -27.078 1.00 0.00 C ATOM 620 C ALA A 40 36.816 -10.295 -27.502 1.00 0.00 C ATOM 621 O ALA A 40 36.866 -10.825 -28.613 1.00 0.00 O ATOM 622 CB ALA A 40 35.735 -8.041 -27.537 1.00 0.00 C ATOM 0 H ALA A 40 36.019 -8.921 -25.104 1.00 0.00 H new ATOM 0 HA ALA A 40 34.719 -9.924 -27.553 1.00 0.00 H new ATOM 0 HB1 ALA A 40 35.877 -8.015 -28.617 1.00 0.00 H new ATOM 0 HB2 ALA A 40 34.832 -7.488 -27.276 1.00 0.00 H new ATOM 0 HB3 ALA A 40 36.595 -7.584 -27.047 1.00 0.00 H new ATOM 628 N ASP A 41 37.798 -10.388 -26.612 1.00 0.00 N ATOM 629 CA ASP A 41 39.018 -11.135 -26.894 1.00 0.00 C ATOM 630 C ASP A 41 38.864 -12.599 -26.495 1.00 0.00 C ATOM 631 O ASP A 41 39.212 -12.988 -25.381 1.00 0.00 O ATOM 632 CB ASP A 41 40.204 -10.514 -26.155 1.00 0.00 C ATOM 633 CG ASP A 41 41.537 -11.014 -26.675 1.00 0.00 C ATOM 634 OD1 ASP A 41 41.692 -12.244 -26.827 1.00 0.00 O ATOM 635 OD2 ASP A 41 42.426 -10.175 -26.931 1.00 0.00 O ATOM 0 H ASP A 41 37.773 -9.955 -25.689 1.00 0.00 H new ATOM 0 HA ASP A 41 39.203 -11.088 -27.967 1.00 0.00 H new ATOM 0 HB2 ASP A 41 40.162 -9.429 -26.254 1.00 0.00 H new ATOM 0 HB3 ASP A 41 40.124 -10.740 -25.092 1.00 0.00 H new ATOM 640 N GLU A 42 38.339 -13.405 -27.413 1.00 0.00 N ATOM 641 CA GLU A 42 38.137 -14.826 -27.155 1.00 0.00 C ATOM 642 C GLU A 42 39.403 -15.461 -26.587 1.00 0.00 C ATOM 643 O GLU A 42 39.346 -16.246 -25.640 1.00 0.00 O ATOM 644 CB GLU A 42 37.723 -15.547 -28.439 1.00 0.00 C ATOM 645 CG GLU A 42 36.284 -15.284 -28.848 1.00 0.00 C ATOM 646 CD GLU A 42 35.920 -15.948 -30.162 1.00 0.00 C ATOM 647 OE1 GLU A 42 36.813 -16.557 -30.787 1.00 0.00 O ATOM 648 OE2 GLU A 42 34.741 -15.857 -30.566 1.00 0.00 O ATOM 0 H GLU A 42 38.046 -13.098 -28.341 1.00 0.00 H new ATOM 0 HA GLU A 42 37.340 -14.925 -26.419 1.00 0.00 H new ATOM 0 HB2 GLU A 42 38.384 -15.238 -29.249 1.00 0.00 H new ATOM 0 HB3 GLU A 42 37.863 -16.620 -28.305 1.00 0.00 H new ATOM 0 HG2 GLU A 42 35.616 -15.645 -28.066 1.00 0.00 H new ATOM 0 HG3 GLU A 42 36.125 -14.209 -28.932 1.00 0.00 H new ATOM 655 N SER A 43 40.545 -15.116 -27.173 1.00 0.00 N ATOM 656 CA SER A 43 41.825 -15.656 -26.730 1.00 0.00 C ATOM 657 C SER A 43 42.036 -15.401 -25.241 1.00 0.00 C ATOM 658 O SER A 43 42.629 -16.219 -24.538 1.00 0.00 O ATOM 659 CB SER A 43 42.970 -15.034 -27.532 1.00 0.00 C ATOM 660 OG SER A 43 42.549 -14.694 -28.842 1.00 0.00 O ATOM 0 H SER A 43 40.610 -14.465 -27.956 1.00 0.00 H new ATOM 0 HA SER A 43 41.815 -16.733 -26.899 1.00 0.00 H new ATOM 0 HB2 SER A 43 43.334 -14.143 -27.021 1.00 0.00 H new ATOM 0 HB3 SER A 43 43.804 -15.734 -27.585 1.00 0.00 H new ATOM 0 HG SER A 43 43.298 -14.297 -29.334 1.00 0.00 H new ATOM 666 N GLN A 44 41.545 -14.260 -24.767 1.00 0.00 N ATOM 667 CA GLN A 44 41.680 -13.896 -23.361 1.00 0.00 C ATOM 668 C GLN A 44 40.528 -14.465 -22.539 1.00 0.00 C ATOM 669 O GLN A 44 40.584 -14.491 -21.310 1.00 0.00 O ATOM 670 CB GLN A 44 41.728 -12.375 -23.209 1.00 0.00 C ATOM 671 CG GLN A 44 42.988 -11.872 -22.522 1.00 0.00 C ATOM 672 CD GLN A 44 44.254 -12.413 -23.156 1.00 0.00 C ATOM 673 OE1 GLN A 44 44.772 -13.452 -22.746 1.00 0.00 O ATOM 674 NE2 GLN A 44 44.760 -11.710 -24.163 1.00 0.00 N ATOM 0 H GLN A 44 41.051 -13.572 -25.335 1.00 0.00 H new ATOM 0 HA GLN A 44 42.612 -14.321 -22.989 1.00 0.00 H new ATOM 0 HB2 GLN A 44 41.654 -11.917 -24.195 1.00 0.00 H new ATOM 0 HB3 GLN A 44 40.858 -12.047 -22.640 1.00 0.00 H new ATOM 0 HG2 GLN A 44 43.006 -10.783 -22.556 1.00 0.00 H new ATOM 0 HG3 GLN A 44 42.962 -12.157 -21.470 1.00 0.00 H new ATOM 0 HE21 GLN A 44 44.298 -10.854 -24.470 1.00 0.00 H new ATOM 0 HE22 GLN A 44 45.611 -12.026 -24.629 1.00 0.00 H new ATOM 683 N ALA A 45 39.486 -14.920 -23.226 1.00 0.00 N ATOM 684 CA ALA A 45 38.322 -15.490 -22.559 1.00 0.00 C ATOM 685 C ALA A 45 38.733 -16.569 -21.563 1.00 0.00 C ATOM 686 O ALA A 45 38.133 -16.703 -20.497 1.00 0.00 O ATOM 687 CB ALA A 45 37.352 -16.058 -23.584 1.00 0.00 C ATOM 0 H ALA A 45 39.424 -14.905 -24.244 1.00 0.00 H new ATOM 0 HA ALA A 45 37.825 -14.693 -22.006 1.00 0.00 H new ATOM 0 HB1 ALA A 45 36.487 -16.480 -23.072 1.00 0.00 H new ATOM 0 HB2 ALA A 45 37.024 -15.263 -24.254 1.00 0.00 H new ATOM 0 HB3 ALA A 45 37.848 -16.838 -24.162 1.00 0.00 H new ATOM 693 N GLU A 46 39.760 -17.335 -21.918 1.00 0.00 N ATOM 694 CA GLU A 46 40.249 -18.403 -21.055 1.00 0.00 C ATOM 695 C GLU A 46 40.865 -17.833 -19.780 1.00 0.00 C ATOM 696 O GLU A 46 40.547 -18.272 -18.674 1.00 0.00 O ATOM 697 CB GLU A 46 41.281 -19.256 -21.796 1.00 0.00 C ATOM 698 CG GLU A 46 40.761 -19.851 -23.093 1.00 0.00 C ATOM 699 CD GLU A 46 41.861 -20.466 -23.936 1.00 0.00 C ATOM 700 OE1 GLU A 46 42.860 -19.768 -24.208 1.00 0.00 O ATOM 701 OE2 GLU A 46 41.723 -21.645 -24.324 1.00 0.00 O ATOM 0 H GLU A 46 40.269 -17.236 -22.796 1.00 0.00 H new ATOM 0 HA GLU A 46 39.401 -19.030 -20.780 1.00 0.00 H new ATOM 0 HB2 GLU A 46 42.157 -18.645 -22.012 1.00 0.00 H new ATOM 0 HB3 GLU A 46 41.609 -20.064 -21.142 1.00 0.00 H new ATOM 0 HG2 GLU A 46 40.015 -20.612 -22.865 1.00 0.00 H new ATOM 0 HG3 GLU A 46 40.259 -19.074 -23.669 1.00 0.00 H new ATOM 708 N ARG A 47 41.749 -16.854 -19.944 1.00 0.00 N ATOM 709 CA ARG A 47 42.411 -16.225 -18.808 1.00 0.00 C ATOM 710 C ARG A 47 41.389 -15.630 -17.843 1.00 0.00 C ATOM 711 O ARG A 47 41.406 -15.921 -16.647 1.00 0.00 O ATOM 712 CB ARG A 47 43.369 -15.133 -19.289 1.00 0.00 C ATOM 713 CG ARG A 47 43.893 -14.246 -18.171 1.00 0.00 C ATOM 714 CD ARG A 47 43.422 -12.810 -18.332 1.00 0.00 C ATOM 715 NE ARG A 47 44.459 -11.849 -17.967 1.00 0.00 N ATOM 716 CZ ARG A 47 44.913 -11.693 -16.728 1.00 0.00 C ATOM 717 NH1 ARG A 47 44.423 -12.430 -15.742 1.00 0.00 N ATOM 718 NH2 ARG A 47 45.859 -10.798 -16.475 1.00 0.00 N ATOM 0 H ARG A 47 42.023 -16.480 -20.852 1.00 0.00 H new ATOM 0 HA ARG A 47 42.979 -16.992 -18.281 1.00 0.00 H new ATOM 0 HB2 ARG A 47 44.213 -15.600 -19.797 1.00 0.00 H new ATOM 0 HB3 ARG A 47 42.858 -14.512 -20.025 1.00 0.00 H new ATOM 0 HG2 ARG A 47 43.557 -14.634 -17.209 1.00 0.00 H new ATOM 0 HG3 ARG A 47 44.983 -14.274 -18.163 1.00 0.00 H new ATOM 0 HD2 ARG A 47 43.120 -12.642 -19.366 1.00 0.00 H new ATOM 0 HD3 ARG A 47 42.541 -12.646 -17.711 1.00 0.00 H new ATOM 0 HE ARG A 47 44.857 -11.266 -18.703 1.00 0.00 H new ATOM 0 HH11 ARG A 47 43.696 -13.119 -15.933 1.00 0.00 H new ATOM 0 HH12 ARG A 47 44.773 -12.308 -14.792 1.00 0.00 H new ATOM 0 HH21 ARG A 47 46.238 -10.229 -17.232 1.00 0.00 H new ATOM 0 HH22 ARG A 47 46.207 -10.679 -15.524 1.00 0.00 H new ATOM 732 N VAL A 48 40.499 -14.796 -18.372 1.00 0.00 N ATOM 733 CA VAL A 48 39.469 -14.161 -17.559 1.00 0.00 C ATOM 734 C VAL A 48 38.590 -15.202 -16.875 1.00 0.00 C ATOM 735 O VAL A 48 38.189 -15.031 -15.723 1.00 0.00 O ATOM 736 CB VAL A 48 38.581 -13.230 -18.405 1.00 0.00 C ATOM 737 CG1 VAL A 48 39.393 -12.063 -18.946 1.00 0.00 C ATOM 738 CG2 VAL A 48 37.925 -14.005 -19.538 1.00 0.00 C ATOM 0 H VAL A 48 40.471 -14.545 -19.360 1.00 0.00 H new ATOM 0 HA VAL A 48 39.983 -13.570 -16.801 1.00 0.00 H new ATOM 0 HB VAL A 48 37.794 -12.828 -17.767 1.00 0.00 H new ATOM 0 HG11 VAL A 48 38.748 -11.416 -19.541 1.00 0.00 H new ATOM 0 HG12 VAL A 48 39.810 -11.494 -18.115 1.00 0.00 H new ATOM 0 HG13 VAL A 48 40.203 -12.441 -19.570 1.00 0.00 H new ATOM 0 HG21 VAL A 48 37.301 -13.332 -20.126 1.00 0.00 H new ATOM 0 HG22 VAL A 48 38.695 -14.437 -20.177 1.00 0.00 H new ATOM 0 HG23 VAL A 48 37.308 -14.803 -19.124 1.00 0.00 H new ATOM 748 N ARG A 49 38.293 -16.280 -17.592 1.00 0.00 N ATOM 749 CA ARG A 49 37.460 -17.350 -17.055 1.00 0.00 C ATOM 750 C ARG A 49 38.077 -17.936 -15.789 1.00 0.00 C ATOM 751 O ARG A 49 37.403 -18.090 -14.771 1.00 0.00 O ATOM 752 CB ARG A 49 37.269 -18.451 -18.100 1.00 0.00 C ATOM 753 CG ARG A 49 35.991 -18.307 -18.910 1.00 0.00 C ATOM 754 CD ARG A 49 36.142 -18.908 -20.298 1.00 0.00 C ATOM 755 NE ARG A 49 34.997 -19.739 -20.662 1.00 0.00 N ATOM 756 CZ ARG A 49 34.815 -20.977 -20.213 1.00 0.00 C ATOM 757 NH1 ARG A 49 35.698 -21.523 -19.389 1.00 0.00 N ATOM 758 NH2 ARG A 49 33.748 -21.670 -20.589 1.00 0.00 N ATOM 0 H ARG A 49 38.617 -16.436 -18.547 1.00 0.00 H new ATOM 0 HA ARG A 49 36.488 -16.927 -16.802 1.00 0.00 H new ATOM 0 HB2 ARG A 49 38.122 -18.448 -18.779 1.00 0.00 H new ATOM 0 HB3 ARG A 49 37.264 -19.419 -17.599 1.00 0.00 H new ATOM 0 HG2 ARG A 49 35.170 -18.798 -18.387 1.00 0.00 H new ATOM 0 HG3 ARG A 49 35.730 -17.252 -18.995 1.00 0.00 H new ATOM 0 HD2 ARG A 49 36.256 -18.108 -21.029 1.00 0.00 H new ATOM 0 HD3 ARG A 49 37.052 -19.507 -20.337 1.00 0.00 H new ATOM 0 HE ARG A 49 34.299 -19.348 -21.295 1.00 0.00 H new ATOM 0 HH11 ARG A 49 36.520 -20.993 -19.098 1.00 0.00 H new ATOM 0 HH12 ARG A 49 35.556 -22.473 -19.046 1.00 0.00 H new ATOM 0 HH21 ARG A 49 33.067 -21.253 -21.223 1.00 0.00 H new ATOM 0 HH22 ARG A 49 33.609 -22.620 -20.244 1.00 0.00 H new ATOM 772 N ALA A 50 39.364 -18.262 -15.861 1.00 0.00 N ATOM 773 CA ALA A 50 40.073 -18.830 -14.721 1.00 0.00 C ATOM 774 C ALA A 50 40.098 -17.855 -13.549 1.00 0.00 C ATOM 775 O ALA A 50 39.634 -18.174 -12.454 1.00 0.00 O ATOM 776 CB ALA A 50 41.489 -19.217 -15.119 1.00 0.00 C ATOM 0 H ALA A 50 39.936 -18.142 -16.697 1.00 0.00 H new ATOM 0 HA ALA A 50 39.540 -19.726 -14.403 1.00 0.00 H new ATOM 0 HB1 ALA A 50 42.006 -19.640 -14.258 1.00 0.00 H new ATOM 0 HB2 ALA A 50 41.453 -19.956 -15.919 1.00 0.00 H new ATOM 0 HB3 ALA A 50 42.024 -18.333 -15.466 1.00 0.00 H new ATOM 782 N GLU A 51 40.643 -16.666 -13.786 1.00 0.00 N ATOM 783 CA GLU A 51 40.730 -15.646 -12.748 1.00 0.00 C ATOM 784 C GLU A 51 39.355 -15.356 -12.153 1.00 0.00 C ATOM 785 O GLU A 51 39.189 -15.317 -10.933 1.00 0.00 O ATOM 786 CB GLU A 51 41.333 -14.359 -13.316 1.00 0.00 C ATOM 787 CG GLU A 51 42.697 -14.557 -13.955 1.00 0.00 C ATOM 788 CD GLU A 51 43.522 -15.618 -13.253 1.00 0.00 C ATOM 789 OE1 GLU A 51 43.681 -15.524 -12.018 1.00 0.00 O ATOM 790 OE2 GLU A 51 44.008 -16.542 -13.939 1.00 0.00 O ATOM 0 H GLU A 51 41.031 -16.386 -14.687 1.00 0.00 H new ATOM 0 HA GLU A 51 41.377 -16.024 -11.957 1.00 0.00 H new ATOM 0 HB2 GLU A 51 40.650 -13.944 -14.058 1.00 0.00 H new ATOM 0 HB3 GLU A 51 41.419 -13.624 -12.516 1.00 0.00 H new ATOM 0 HG2 GLU A 51 42.567 -14.836 -15.001 1.00 0.00 H new ATOM 0 HG3 GLU A 51 43.240 -13.612 -13.942 1.00 0.00 H new ATOM 797 N LEU A 52 38.371 -15.154 -13.022 1.00 0.00 N ATOM 798 CA LEU A 52 37.010 -14.868 -12.585 1.00 0.00 C ATOM 799 C LEU A 52 36.520 -15.926 -11.601 1.00 0.00 C ATOM 800 O LEU A 52 36.074 -15.606 -10.500 1.00 0.00 O ATOM 801 CB LEU A 52 36.069 -14.801 -13.789 1.00 0.00 C ATOM 802 CG LEU A 52 34.580 -14.659 -13.471 1.00 0.00 C ATOM 803 CD1 LEU A 52 34.032 -13.363 -14.049 1.00 0.00 C ATOM 804 CD2 LEU A 52 33.804 -15.854 -14.006 1.00 0.00 C ATOM 0 H LEU A 52 38.491 -15.183 -14.035 1.00 0.00 H new ATOM 0 HA LEU A 52 37.013 -13.902 -12.080 1.00 0.00 H new ATOM 0 HB2 LEU A 52 36.369 -13.959 -14.412 1.00 0.00 H new ATOM 0 HB3 LEU A 52 36.208 -15.703 -14.384 1.00 0.00 H new ATOM 0 HG LEU A 52 34.461 -14.629 -12.388 1.00 0.00 H new ATOM 0 HD11 LEU A 52 32.971 -13.279 -13.813 1.00 0.00 H new ATOM 0 HD12 LEU A 52 34.568 -12.517 -13.618 1.00 0.00 H new ATOM 0 HD13 LEU A 52 34.164 -13.363 -15.131 1.00 0.00 H new ATOM 0 HD21 LEU A 52 32.746 -15.736 -13.771 1.00 0.00 H new ATOM 0 HD22 LEU A 52 33.931 -15.916 -15.087 1.00 0.00 H new ATOM 0 HD23 LEU A 52 34.179 -16.767 -13.544 1.00 0.00 H new ATOM 816 N ALA A 53 36.609 -17.189 -12.006 1.00 0.00 N ATOM 817 CA ALA A 53 36.179 -18.295 -11.159 1.00 0.00 C ATOM 818 C ALA A 53 36.900 -18.270 -9.816 1.00 0.00 C ATOM 819 O ALA A 53 36.306 -18.559 -8.776 1.00 0.00 O ATOM 820 CB ALA A 53 36.418 -19.622 -11.863 1.00 0.00 C ATOM 0 H ALA A 53 36.975 -17.472 -12.915 1.00 0.00 H new ATOM 0 HA ALA A 53 35.111 -18.183 -10.971 1.00 0.00 H new ATOM 0 HB1 ALA A 53 36.092 -20.439 -11.219 1.00 0.00 H new ATOM 0 HB2 ALA A 53 35.853 -19.647 -12.795 1.00 0.00 H new ATOM 0 HB3 ALA A 53 37.480 -19.732 -12.080 1.00 0.00 H new ATOM 826 N ARG A 54 38.182 -17.923 -9.844 1.00 0.00 N ATOM 827 CA ARG A 54 38.984 -17.862 -8.628 1.00 0.00 C ATOM 828 C ARG A 54 38.588 -16.661 -7.775 1.00 0.00 C ATOM 829 O ARG A 54 38.796 -16.652 -6.561 1.00 0.00 O ATOM 830 CB ARG A 54 40.472 -17.786 -8.976 1.00 0.00 C ATOM 831 CG ARG A 54 41.036 -19.086 -9.527 1.00 0.00 C ATOM 832 CD ARG A 54 42.498 -18.937 -9.917 1.00 0.00 C ATOM 833 NE ARG A 54 43.394 -19.199 -8.793 1.00 0.00 N ATOM 834 CZ ARG A 54 44.707 -19.350 -8.921 1.00 0.00 C ATOM 835 NH1 ARG A 54 45.275 -19.266 -10.116 1.00 0.00 N ATOM 836 NH2 ARG A 54 45.456 -19.586 -7.851 1.00 0.00 N ATOM 0 H ARG A 54 38.688 -17.680 -10.696 1.00 0.00 H new ATOM 0 HA ARG A 54 38.798 -18.770 -8.054 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.625 -16.994 -9.709 1.00 0.00 H new ATOM 0 HB3 ARG A 54 41.031 -17.507 -8.083 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.936 -19.873 -8.780 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.456 -19.396 -10.396 1.00 0.00 H new ATOM 0 HD2 ARG A 54 42.728 -19.624 -10.731 1.00 0.00 H new ATOM 0 HD3 ARG A 54 42.672 -17.928 -10.292 1.00 0.00 H new ATOM 0 HE ARG A 54 42.989 -19.270 -7.860 1.00 0.00 H new ATOM 0 HH11 ARG A 54 44.703 -19.085 -10.941 1.00 0.00 H new ATOM 0 HH12 ARG A 54 46.284 -19.383 -10.210 1.00 0.00 H new ATOM 0 HH21 ARG A 54 45.023 -19.651 -6.930 1.00 0.00 H new ATOM 0 HH22 ARG A 54 46.465 -19.702 -7.950 1.00 0.00 H new ATOM 850 N PHE A 55 38.017 -15.648 -8.418 1.00 0.00 N ATOM 851 CA PHE A 55 37.593 -14.440 -7.719 1.00 0.00 C ATOM 852 C PHE A 55 36.196 -14.613 -7.132 1.00 0.00 C ATOM 853 O PHE A 55 35.891 -14.091 -6.059 1.00 0.00 O ATOM 854 CB PHE A 55 37.615 -13.241 -8.670 1.00 0.00 C ATOM 855 CG PHE A 55 37.682 -11.917 -7.963 1.00 0.00 C ATOM 856 CD1 PHE A 55 38.727 -11.630 -7.100 1.00 0.00 C ATOM 857 CD2 PHE A 55 36.700 -10.960 -8.163 1.00 0.00 C ATOM 858 CE1 PHE A 55 38.793 -10.413 -6.449 1.00 0.00 C ATOM 859 CE2 PHE A 55 36.761 -9.741 -7.514 1.00 0.00 C ATOM 860 CZ PHE A 55 37.807 -9.467 -6.656 1.00 0.00 C ATOM 0 H PHE A 55 37.837 -15.639 -9.422 1.00 0.00 H new ATOM 0 HA PHE A 55 38.291 -14.259 -6.901 1.00 0.00 H new ATOM 0 HB2 PHE A 55 38.473 -13.332 -9.337 1.00 0.00 H new ATOM 0 HB3 PHE A 55 36.722 -13.266 -9.294 1.00 0.00 H new ATOM 0 HD1 PHE A 55 39.499 -12.366 -6.934 1.00 0.00 H new ATOM 0 HD2 PHE A 55 35.879 -11.169 -8.833 1.00 0.00 H new ATOM 0 HE1 PHE A 55 39.614 -10.201 -5.780 1.00 0.00 H new ATOM 0 HE2 PHE A 55 35.990 -9.003 -7.678 1.00 0.00 H new ATOM 0 HZ PHE A 55 37.855 -8.515 -6.148 1.00 0.00 H new ATOM 989 N MET B 1 32.607 -11.981 -29.847 1.00 0.00 N ATOM 990 CA MET B 1 32.204 -11.677 -28.479 1.00 0.00 C ATOM 991 C MET B 1 31.760 -12.941 -27.749 1.00 0.00 C ATOM 992 O MET B 1 30.818 -13.614 -28.168 1.00 0.00 O ATOM 993 CB MET B 1 31.071 -10.648 -28.474 1.00 0.00 C ATOM 994 CG MET B 1 31.471 -9.303 -29.059 1.00 0.00 C ATOM 995 SD MET B 1 31.280 -7.951 -27.882 1.00 0.00 S ATOM 996 CE MET B 1 32.319 -8.520 -26.539 1.00 0.00 C ATOM 0 H1 MET B 1 33.221 -11.222 -30.205 1.00 0.00 H new ATOM 0 H2 MET B 1 33.125 -12.883 -29.864 1.00 0.00 H new ATOM 0 H3 MET B 1 31.762 -12.056 -30.449 1.00 0.00 H new ATOM 0 HA MET B 1 33.066 -11.261 -27.958 1.00 0.00 H new ATOM 0 HB2 MET B 1 30.228 -11.045 -29.039 1.00 0.00 H new ATOM 0 HB3 MET B 1 30.728 -10.502 -27.450 1.00 0.00 H new ATOM 0 HG2 MET B 1 32.509 -9.349 -29.389 1.00 0.00 H new ATOM 0 HG3 MET B 1 30.864 -9.100 -29.942 1.00 0.00 H new ATOM 0 HE1 MET B 1 32.765 -7.662 -26.036 1.00 0.00 H new ATOM 0 HE2 MET B 1 31.717 -9.085 -25.828 1.00 0.00 H new ATOM 0 HE3 MET B 1 33.108 -9.159 -26.935 1.00 0.00 H new ATOM 1006 N LEU B 2 32.446 -13.259 -26.656 1.00 0.00 N ATOM 1007 CA LEU B 2 32.122 -14.443 -25.867 1.00 0.00 C ATOM 1008 C LEU B 2 31.741 -14.060 -24.441 1.00 0.00 C ATOM 1009 O LEU B 2 32.536 -13.466 -23.714 1.00 0.00 O ATOM 1010 CB LEU B 2 33.310 -15.407 -25.848 1.00 0.00 C ATOM 1011 CG LEU B 2 32.966 -16.897 -25.858 1.00 0.00 C ATOM 1012 CD1 LEU B 2 34.206 -17.730 -26.141 1.00 0.00 C ATOM 1013 CD2 LEU B 2 32.336 -17.307 -24.534 1.00 0.00 C ATOM 0 H LEU B 2 33.229 -12.714 -26.296 1.00 0.00 H new ATOM 0 HA LEU B 2 31.268 -14.936 -26.331 1.00 0.00 H new ATOM 0 HB2 LEU B 2 33.939 -15.194 -26.712 1.00 0.00 H new ATOM 0 HB3 LEU B 2 33.907 -15.198 -24.960 1.00 0.00 H new ATOM 0 HG LEU B 2 32.243 -17.078 -26.654 1.00 0.00 H new ATOM 0 HD11 LEU B 2 33.941 -18.787 -26.144 1.00 0.00 H new ATOM 0 HD12 LEU B 2 34.615 -17.455 -27.114 1.00 0.00 H new ATOM 0 HD13 LEU B 2 34.953 -17.545 -25.369 1.00 0.00 H new ATOM 0 HD21 LEU B 2 32.097 -18.370 -24.558 1.00 0.00 H new ATOM 0 HD22 LEU B 2 33.036 -17.111 -23.722 1.00 0.00 H new ATOM 0 HD23 LEU B 2 31.423 -16.734 -24.373 1.00 0.00 H new ATOM 1025 N MET B 3 30.519 -14.406 -24.048 1.00 0.00 N ATOM 1026 CA MET B 3 30.034 -14.102 -22.707 1.00 0.00 C ATOM 1027 C MET B 3 30.947 -14.709 -21.647 1.00 0.00 C ATOM 1028 O MET B 3 31.123 -15.927 -21.590 1.00 0.00 O ATOM 1029 CB MET B 3 28.607 -14.623 -22.527 1.00 0.00 C ATOM 1030 CG MET B 3 27.701 -13.667 -21.769 1.00 0.00 C ATOM 1031 SD MET B 3 26.196 -14.461 -21.172 1.00 0.00 S ATOM 1032 CE MET B 3 26.306 -14.121 -19.417 1.00 0.00 C ATOM 0 H MET B 3 29.848 -14.897 -24.639 1.00 0.00 H new ATOM 0 HA MET B 3 30.036 -13.019 -22.585 1.00 0.00 H new ATOM 0 HB2 MET B 3 28.174 -14.819 -23.508 1.00 0.00 H new ATOM 0 HB3 MET B 3 28.641 -15.575 -21.997 1.00 0.00 H new ATOM 0 HG2 MET B 3 28.247 -13.249 -20.923 1.00 0.00 H new ATOM 0 HG3 MET B 3 27.434 -12.834 -22.419 1.00 0.00 H new ATOM 0 HE1 MET B 3 26.280 -15.059 -18.862 1.00 0.00 H new ATOM 0 HE2 MET B 3 27.240 -13.600 -19.205 1.00 0.00 H new ATOM 0 HE3 MET B 3 25.465 -13.497 -19.114 1.00 0.00 H new ATOM 1042 N ILE B 4 31.525 -13.855 -20.810 1.00 0.00 N ATOM 1043 CA ILE B 4 32.419 -14.309 -19.752 1.00 0.00 C ATOM 1044 C ILE B 4 31.635 -14.908 -18.589 1.00 0.00 C ATOM 1045 O ILE B 4 31.962 -15.988 -18.096 1.00 0.00 O ATOM 1046 CB ILE B 4 33.298 -13.159 -19.225 1.00 0.00 C ATOM 1047 CG1 ILE B 4 34.241 -12.665 -20.324 1.00 0.00 C ATOM 1048 CG2 ILE B 4 34.086 -13.611 -18.005 1.00 0.00 C ATOM 1049 CD1 ILE B 4 35.058 -13.768 -20.960 1.00 0.00 C ATOM 0 H ILE B 4 31.390 -12.844 -20.844 1.00 0.00 H new ATOM 0 HA ILE B 4 33.060 -15.075 -20.188 1.00 0.00 H new ATOM 0 HB ILE B 4 32.652 -12.333 -18.929 1.00 0.00 H new ATOM 0 HG12 ILE B 4 33.656 -12.166 -21.096 1.00 0.00 H new ATOM 0 HG13 ILE B 4 34.916 -11.920 -19.904 1.00 0.00 H new ATOM 0 HG21 ILE B 4 34.702 -12.787 -17.644 1.00 0.00 H new ATOM 0 HG22 ILE B 4 33.396 -13.919 -17.220 1.00 0.00 H new ATOM 0 HG23 ILE B 4 34.726 -14.451 -18.276 1.00 0.00 H new ATOM 0 HD11 ILE B 4 35.703 -13.345 -21.730 1.00 0.00 H new ATOM 0 HD12 ILE B 4 35.670 -14.252 -20.199 1.00 0.00 H new ATOM 0 HD13 ILE B 4 34.390 -14.502 -21.410 1.00 0.00 H new ATOM 1061 N THR B 5 30.596 -14.200 -18.156 1.00 0.00 N ATOM 1062 CA THR B 5 29.764 -14.662 -17.052 1.00 0.00 C ATOM 1063 C THR B 5 28.566 -13.743 -16.845 1.00 0.00 C ATOM 1064 O THR B 5 28.435 -12.717 -17.513 1.00 0.00 O ATOM 1065 CB THR B 5 30.567 -14.744 -15.740 1.00 0.00 C ATOM 1066 OG1 THR B 5 29.803 -15.427 -14.740 1.00 0.00 O ATOM 1067 CG2 THR B 5 30.934 -13.354 -15.242 1.00 0.00 C ATOM 0 H THR B 5 30.311 -13.305 -18.553 1.00 0.00 H new ATOM 0 HA THR B 5 29.412 -15.659 -17.317 1.00 0.00 H new ATOM 0 HB THR B 5 31.486 -15.297 -15.936 1.00 0.00 H new ATOM 0 HG1 THR B 5 30.321 -15.476 -13.910 1.00 0.00 H new ATOM 0 HG21 THR B 5 31.500 -13.438 -14.315 1.00 0.00 H new ATOM 0 HG22 THR B 5 31.540 -12.847 -15.993 1.00 0.00 H new ATOM 0 HG23 THR B 5 30.025 -12.780 -15.061 1.00 0.00 H new ATOM 1075 N SER B 6 27.693 -14.116 -15.915 1.00 0.00 N ATOM 1076 CA SER B 6 26.503 -13.327 -15.622 1.00 0.00 C ATOM 1077 C SER B 6 26.408 -13.018 -14.131 1.00 0.00 C ATOM 1078 O SER B 6 26.465 -13.920 -13.294 1.00 0.00 O ATOM 1079 CB SER B 6 25.246 -14.069 -16.081 1.00 0.00 C ATOM 1080 OG SER B 6 24.684 -14.824 -15.022 1.00 0.00 O ATOM 0 H SER B 6 27.788 -14.961 -15.351 1.00 0.00 H new ATOM 0 HA SER B 6 26.580 -12.386 -16.166 1.00 0.00 H new ATOM 0 HB2 SER B 6 24.512 -13.353 -16.451 1.00 0.00 H new ATOM 0 HB3 SER B 6 25.493 -14.730 -16.912 1.00 0.00 H new ATOM 0 HG SER B 6 25.355 -14.953 -14.320 1.00 0.00 H new ATOM 1086 N PHE B 7 26.265 -11.738 -13.805 1.00 0.00 N ATOM 1087 CA PHE B 7 26.163 -11.309 -12.415 1.00 0.00 C ATOM 1088 C PHE B 7 24.839 -10.594 -12.162 1.00 0.00 C ATOM 1089 O PHE B 7 24.092 -10.299 -13.094 1.00 0.00 O ATOM 1090 CB PHE B 7 27.331 -10.387 -12.058 1.00 0.00 C ATOM 1091 CG PHE B 7 28.654 -11.094 -11.989 1.00 0.00 C ATOM 1092 CD1 PHE B 7 28.769 -12.316 -11.346 1.00 0.00 C ATOM 1093 CD2 PHE B 7 29.783 -10.537 -12.568 1.00 0.00 C ATOM 1094 CE1 PHE B 7 29.986 -12.968 -11.280 1.00 0.00 C ATOM 1095 CE2 PHE B 7 31.002 -11.185 -12.506 1.00 0.00 C ATOM 1096 CZ PHE B 7 31.103 -12.403 -11.862 1.00 0.00 C ATOM 0 H PHE B 7 26.217 -10.979 -14.485 1.00 0.00 H new ATOM 0 HA PHE B 7 26.202 -12.196 -11.783 1.00 0.00 H new ATOM 0 HB2 PHE B 7 27.393 -9.589 -12.798 1.00 0.00 H new ATOM 0 HB3 PHE B 7 27.130 -9.915 -11.096 1.00 0.00 H new ATOM 0 HD1 PHE B 7 27.898 -12.764 -10.891 1.00 0.00 H new ATOM 0 HD2 PHE B 7 29.709 -9.585 -13.074 1.00 0.00 H new ATOM 0 HE1 PHE B 7 30.063 -13.919 -10.773 1.00 0.00 H new ATOM 0 HE2 PHE B 7 31.875 -10.740 -12.960 1.00 0.00 H new ATOM 0 HZ PHE B 7 32.054 -12.912 -11.814 1.00 0.00 H new ATOM 1106 N ALA B 8 24.556 -10.319 -10.893 1.00 0.00 N ATOM 1107 CA ALA B 8 23.324 -9.637 -10.516 1.00 0.00 C ATOM 1108 C ALA B 8 23.602 -8.502 -9.536 1.00 0.00 C ATOM 1109 O ALA B 8 22.933 -8.376 -8.511 1.00 0.00 O ATOM 1110 CB ALA B 8 22.337 -10.626 -9.914 1.00 0.00 C ATOM 0 H ALA B 8 25.163 -10.558 -10.109 1.00 0.00 H new ATOM 0 HA ALA B 8 22.887 -9.205 -11.416 1.00 0.00 H new ATOM 0 HB1 ALA B 8 21.421 -10.103 -9.637 1.00 0.00 H new ATOM 0 HB2 ALA B 8 22.106 -11.400 -10.646 1.00 0.00 H new ATOM 0 HB3 ALA B 8 22.776 -11.084 -9.028 1.00 0.00 H new ATOM 1116 N ASN B 9 24.595 -7.679 -9.857 1.00 0.00 N ATOM 1117 CA ASN B 9 24.962 -6.555 -9.004 1.00 0.00 C ATOM 1118 C ASN B 9 26.029 -5.692 -9.670 1.00 0.00 C ATOM 1119 O ASN B 9 26.938 -6.188 -10.335 1.00 0.00 O ATOM 1120 CB ASN B 9 25.470 -7.059 -7.651 1.00 0.00 C ATOM 1121 CG ASN B 9 24.446 -6.882 -6.547 1.00 0.00 C ATOM 1122 OD1 ASN B 9 23.964 -5.775 -6.303 1.00 0.00 O ATOM 1123 ND2 ASN B 9 24.108 -7.975 -5.872 1.00 0.00 N ATOM 0 H ASN B 9 25.160 -7.770 -10.702 1.00 0.00 H new ATOM 0 HA ASN B 9 24.072 -5.945 -8.847 1.00 0.00 H new ATOM 0 HB2 ASN B 9 25.732 -8.114 -7.734 1.00 0.00 H new ATOM 0 HB3 ASN B 9 26.382 -6.524 -7.386 1.00 0.00 H new ATOM 0 HD21 ASN B 9 23.424 -7.917 -5.118 1.00 0.00 H new ATOM 0 HD22 ASN B 9 24.533 -8.872 -6.108 1.00 0.00 H new ATOM 1130 N PRO B 10 25.917 -4.368 -9.488 1.00 0.00 N ATOM 1131 CA PRO B 10 26.864 -3.407 -10.062 1.00 0.00 C ATOM 1132 C PRO B 10 28.237 -3.481 -9.403 1.00 0.00 C ATOM 1133 O PRO B 10 29.263 -3.487 -10.083 1.00 0.00 O ATOM 1134 CB PRO B 10 26.208 -2.052 -9.783 1.00 0.00 C ATOM 1135 CG PRO B 10 25.345 -2.288 -8.592 1.00 0.00 C ATOM 1136 CD PRO B 10 24.859 -3.706 -8.707 1.00 0.00 C ATOM 0 HA PRO B 10 27.047 -3.597 -11.120 1.00 0.00 H new ATOM 0 HB2 PRO B 10 26.955 -1.284 -9.585 1.00 0.00 H new ATOM 0 HB3 PRO B 10 25.621 -1.713 -10.637 1.00 0.00 H new ATOM 0 HG2 PRO B 10 25.906 -2.141 -7.669 1.00 0.00 H new ATOM 0 HG3 PRO B 10 24.509 -1.589 -8.572 1.00 0.00 H new ATOM 0 HD2 PRO B 10 24.734 -4.168 -7.728 1.00 0.00 H new ATOM 0 HD3 PRO B 10 23.894 -3.760 -9.211 1.00 0.00 H new ATOM 1144 N ARG B 11 28.248 -3.537 -8.075 1.00 0.00 N ATOM 1145 CA ARG B 11 29.495 -3.609 -7.324 1.00 0.00 C ATOM 1146 C ARG B 11 30.372 -4.749 -7.835 1.00 0.00 C ATOM 1147 O ARG B 11 31.556 -4.559 -8.115 1.00 0.00 O ATOM 1148 CB ARG B 11 29.208 -3.801 -5.834 1.00 0.00 C ATOM 1149 CG ARG B 11 29.448 -2.552 -5.001 1.00 0.00 C ATOM 1150 CD ARG B 11 30.889 -2.079 -5.110 1.00 0.00 C ATOM 1151 NE ARG B 11 31.327 -1.376 -3.907 1.00 0.00 N ATOM 1152 CZ ARG B 11 31.035 -0.106 -3.650 1.00 0.00 C ATOM 1153 NH1 ARG B 11 30.308 0.597 -4.508 1.00 0.00 N ATOM 1154 NH2 ARG B 11 31.469 0.463 -2.533 1.00 0.00 N ATOM 0 H ARG B 11 27.407 -3.534 -7.497 1.00 0.00 H new ATOM 0 HA ARG B 11 30.030 -2.670 -7.466 1.00 0.00 H new ATOM 0 HB2 ARG B 11 28.172 -4.117 -5.710 1.00 0.00 H new ATOM 0 HB3 ARG B 11 29.835 -4.607 -5.453 1.00 0.00 H new ATOM 0 HG2 ARG B 11 28.777 -1.759 -5.331 1.00 0.00 H new ATOM 0 HG3 ARG B 11 29.209 -2.758 -3.958 1.00 0.00 H new ATOM 0 HD2 ARG B 11 31.539 -2.936 -5.286 1.00 0.00 H new ATOM 0 HD3 ARG B 11 30.990 -1.420 -5.972 1.00 0.00 H new ATOM 0 HE ARG B 11 31.888 -1.889 -3.227 1.00 0.00 H new ATOM 0 HH11 ARG B 11 29.972 0.163 -5.367 1.00 0.00 H new ATOM 0 HH12 ARG B 11 30.085 1.572 -4.308 1.00 0.00 H new ATOM 0 HH21 ARG B 11 32.028 -0.075 -1.870 1.00 0.00 H new ATOM 0 HH22 ARG B 11 31.244 1.438 -2.337 1.00 0.00 H new ATOM 1168 N VAL B 12 29.783 -5.935 -7.953 1.00 0.00 N ATOM 1169 CA VAL B 12 30.509 -7.105 -8.430 1.00 0.00 C ATOM 1170 C VAL B 12 30.892 -6.954 -9.898 1.00 0.00 C ATOM 1171 O VAL B 12 32.067 -7.027 -10.255 1.00 0.00 O ATOM 1172 CB VAL B 12 29.678 -8.390 -8.258 1.00 0.00 C ATOM 1173 CG1 VAL B 12 30.452 -9.599 -8.762 1.00 0.00 C ATOM 1174 CG2 VAL B 12 29.277 -8.574 -6.802 1.00 0.00 C ATOM 0 H VAL B 12 28.805 -6.110 -7.725 1.00 0.00 H new ATOM 0 HA VAL B 12 31.414 -7.183 -7.827 1.00 0.00 H new ATOM 0 HB VAL B 12 28.770 -8.296 -8.853 1.00 0.00 H new ATOM 0 HG11 VAL B 12 29.849 -10.497 -8.632 1.00 0.00 H new ATOM 0 HG12 VAL B 12 30.684 -9.468 -9.819 1.00 0.00 H new ATOM 0 HG13 VAL B 12 31.378 -9.699 -8.197 1.00 0.00 H new ATOM 0 HG21 VAL B 12 28.690 -9.487 -6.699 1.00 0.00 H new ATOM 0 HG22 VAL B 12 30.172 -8.646 -6.184 1.00 0.00 H new ATOM 0 HG23 VAL B 12 28.681 -7.721 -6.478 1.00 0.00 H new ATOM 1184 N ALA B 13 29.890 -6.742 -10.746 1.00 0.00 N ATOM 1185 CA ALA B 13 30.122 -6.577 -12.176 1.00 0.00 C ATOM 1186 C ALA B 13 31.256 -5.592 -12.438 1.00 0.00 C ATOM 1187 O ALA B 13 32.248 -5.932 -13.082 1.00 0.00 O ATOM 1188 CB ALA B 13 28.848 -6.115 -12.867 1.00 0.00 C ATOM 0 H ALA B 13 28.911 -6.681 -10.467 1.00 0.00 H new ATOM 0 HA ALA B 13 30.414 -7.544 -12.586 1.00 0.00 H new ATOM 0 HB1 ALA B 13 29.036 -5.996 -13.934 1.00 0.00 H new ATOM 0 HB2 ALA B 13 28.063 -6.857 -12.717 1.00 0.00 H new ATOM 0 HB3 ALA B 13 28.531 -5.161 -12.446 1.00 0.00 H new ATOM 1194 N GLN B 14 31.100 -4.371 -11.937 1.00 0.00 N ATOM 1195 CA GLN B 14 32.112 -3.336 -12.120 1.00 0.00 C ATOM 1196 C GLN B 14 33.453 -3.778 -11.544 1.00 0.00 C ATOM 1197 O GLN B 14 34.496 -3.609 -12.174 1.00 0.00 O ATOM 1198 CB GLN B 14 31.663 -2.033 -11.457 1.00 0.00 C ATOM 1199 CG GLN B 14 32.730 -0.950 -11.460 1.00 0.00 C ATOM 1200 CD GLN B 14 33.069 -0.468 -12.857 1.00 0.00 C ATOM 1201 OE1 GLN B 14 32.203 0.018 -13.586 1.00 0.00 O ATOM 1202 NE2 GLN B 14 34.334 -0.601 -13.239 1.00 0.00 N ATOM 0 H GLN B 14 30.284 -4.074 -11.402 1.00 0.00 H new ATOM 0 HA GLN B 14 32.235 -3.168 -13.190 1.00 0.00 H new ATOM 0 HB2 GLN B 14 30.777 -1.660 -11.971 1.00 0.00 H new ATOM 0 HB3 GLN B 14 31.371 -2.241 -10.428 1.00 0.00 H new ATOM 0 HG2 GLN B 14 32.387 -0.106 -10.862 1.00 0.00 H new ATOM 0 HG3 GLN B 14 33.632 -1.333 -10.983 1.00 0.00 H new ATOM 0 HE21 GLN B 14 35.019 -1.009 -12.603 1.00 0.00 H new ATOM 0 HE22 GLN B 14 34.621 -0.295 -14.169 1.00 0.00 H new ATOM 1211 N ALA B 15 33.417 -4.345 -10.342 1.00 0.00 N ATOM 1212 CA ALA B 15 34.630 -4.813 -9.682 1.00 0.00 C ATOM 1213 C ALA B 15 35.376 -5.818 -10.552 1.00 0.00 C ATOM 1214 O ALA B 15 36.594 -5.735 -10.709 1.00 0.00 O ATOM 1215 CB ALA B 15 34.292 -5.428 -8.332 1.00 0.00 C ATOM 0 H ALA B 15 32.562 -4.491 -9.806 1.00 0.00 H new ATOM 0 HA ALA B 15 35.283 -3.954 -9.525 1.00 0.00 H new ATOM 0 HB1 ALA B 15 35.207 -5.773 -7.850 1.00 0.00 H new ATOM 0 HB2 ALA B 15 33.810 -4.680 -7.702 1.00 0.00 H new ATOM 0 HB3 ALA B 15 33.617 -6.272 -8.475 1.00 0.00 H new ATOM 1221 N PHE B 16 34.637 -6.769 -11.115 1.00 0.00 N ATOM 1222 CA PHE B 16 35.229 -7.792 -11.968 1.00 0.00 C ATOM 1223 C PHE B 16 35.925 -7.162 -13.171 1.00 0.00 C ATOM 1224 O PHE B 16 37.122 -7.356 -13.382 1.00 0.00 O ATOM 1225 CB PHE B 16 34.156 -8.775 -12.443 1.00 0.00 C ATOM 1226 CG PHE B 16 34.064 -10.015 -11.600 1.00 0.00 C ATOM 1227 CD1 PHE B 16 33.230 -10.057 -10.495 1.00 0.00 C ATOM 1228 CD2 PHE B 16 34.813 -11.138 -11.913 1.00 0.00 C ATOM 1229 CE1 PHE B 16 33.142 -11.197 -9.718 1.00 0.00 C ATOM 1230 CE2 PHE B 16 34.729 -12.281 -11.140 1.00 0.00 C ATOM 1231 CZ PHE B 16 33.894 -12.310 -10.040 1.00 0.00 C ATOM 0 H PHE B 16 33.627 -6.852 -10.995 1.00 0.00 H new ATOM 0 HA PHE B 16 35.973 -8.332 -11.382 1.00 0.00 H new ATOM 0 HB2 PHE B 16 33.189 -8.273 -12.443 1.00 0.00 H new ATOM 0 HB3 PHE B 16 34.367 -9.061 -13.474 1.00 0.00 H new ATOM 0 HD1 PHE B 16 32.641 -9.189 -10.237 1.00 0.00 H new ATOM 0 HD2 PHE B 16 35.470 -11.120 -12.770 1.00 0.00 H new ATOM 0 HE1 PHE B 16 32.486 -11.217 -8.860 1.00 0.00 H new ATOM 0 HE2 PHE B 16 35.316 -13.151 -11.396 1.00 0.00 H new ATOM 0 HZ PHE B 16 33.829 -13.201 -9.433 1.00 0.00 H new ATOM 1241 N VAL B 17 35.166 -6.406 -13.957 1.00 0.00 N ATOM 1242 CA VAL B 17 35.708 -5.746 -15.139 1.00 0.00 C ATOM 1243 C VAL B 17 36.784 -4.735 -14.759 1.00 0.00 C ATOM 1244 O VAL B 17 37.625 -4.370 -15.580 1.00 0.00 O ATOM 1245 CB VAL B 17 34.603 -5.028 -15.937 1.00 0.00 C ATOM 1246 CG1 VAL B 17 33.628 -6.036 -16.526 1.00 0.00 C ATOM 1247 CG2 VAL B 17 33.877 -4.023 -15.056 1.00 0.00 C ATOM 0 H VAL B 17 34.173 -6.235 -13.797 1.00 0.00 H new ATOM 0 HA VAL B 17 36.149 -6.524 -15.762 1.00 0.00 H new ATOM 0 HB VAL B 17 35.068 -4.485 -16.760 1.00 0.00 H new ATOM 0 HG11 VAL B 17 32.855 -5.510 -17.086 1.00 0.00 H new ATOM 0 HG12 VAL B 17 34.163 -6.712 -17.193 1.00 0.00 H new ATOM 0 HG13 VAL B 17 33.167 -6.609 -15.722 1.00 0.00 H new ATOM 0 HG21 VAL B 17 33.100 -3.525 -15.636 1.00 0.00 H new ATOM 0 HG22 VAL B 17 33.423 -4.541 -14.211 1.00 0.00 H new ATOM 0 HG23 VAL B 17 34.587 -3.282 -14.689 1.00 0.00 H new ATOM 1257 N ASP B 18 36.750 -4.286 -13.508 1.00 0.00 N ATOM 1258 CA ASP B 18 37.724 -3.318 -13.018 1.00 0.00 C ATOM 1259 C ASP B 18 39.107 -3.951 -12.897 1.00 0.00 C ATOM 1260 O ASP B 18 40.063 -3.504 -13.531 1.00 0.00 O ATOM 1261 CB ASP B 18 37.284 -2.762 -11.662 1.00 0.00 C ATOM 1262 CG ASP B 18 38.244 -1.720 -11.124 1.00 0.00 C ATOM 1263 OD1 ASP B 18 38.302 -0.613 -11.699 1.00 0.00 O ATOM 1264 OD2 ASP B 18 38.938 -2.012 -10.128 1.00 0.00 O ATOM 0 H ASP B 18 36.059 -4.577 -12.816 1.00 0.00 H new ATOM 0 HA ASP B 18 37.780 -2.501 -13.737 1.00 0.00 H new ATOM 0 HB2 ASP B 18 36.291 -2.322 -11.758 1.00 0.00 H new ATOM 0 HB3 ASP B 18 37.202 -3.580 -10.946 1.00 0.00 H new ATOM 1269 N TYR B 19 39.205 -4.992 -12.078 1.00 0.00 N ATOM 1270 CA TYR B 19 40.472 -5.684 -11.871 1.00 0.00 C ATOM 1271 C TYR B 19 40.967 -6.314 -13.169 1.00 0.00 C ATOM 1272 O TYR B 19 42.171 -6.421 -13.400 1.00 0.00 O ATOM 1273 CB TYR B 19 40.319 -6.761 -10.795 1.00 0.00 C ATOM 1274 CG TYR B 19 39.850 -8.093 -11.334 1.00 0.00 C ATOM 1275 CD1 TYR B 19 40.719 -8.933 -12.019 1.00 0.00 C ATOM 1276 CD2 TYR B 19 38.537 -8.513 -11.156 1.00 0.00 C ATOM 1277 CE1 TYR B 19 40.294 -10.151 -12.514 1.00 0.00 C ATOM 1278 CE2 TYR B 19 38.104 -9.730 -11.646 1.00 0.00 C ATOM 1279 CZ TYR B 19 38.986 -10.545 -12.324 1.00 0.00 C ATOM 1280 OH TYR B 19 38.559 -11.758 -12.814 1.00 0.00 O ATOM 0 H TYR B 19 38.423 -5.375 -11.547 1.00 0.00 H new ATOM 0 HA TYR B 19 41.207 -4.951 -11.540 1.00 0.00 H new ATOM 0 HB2 TYR B 19 41.276 -6.899 -10.292 1.00 0.00 H new ATOM 0 HB3 TYR B 19 39.611 -6.413 -10.043 1.00 0.00 H new ATOM 0 HD1 TYR B 19 41.745 -8.629 -12.167 1.00 0.00 H new ATOM 0 HD2 TYR B 19 37.844 -7.877 -10.626 1.00 0.00 H new ATOM 0 HE1 TYR B 19 40.982 -10.791 -13.047 1.00 0.00 H new ATOM 0 HE2 TYR B 19 37.080 -10.041 -11.499 1.00 0.00 H new ATOM 0 HH TYR B 19 38.681 -11.779 -13.786 1.00 0.00 H new ATOM 1290 N MET B 20 40.028 -6.729 -14.014 1.00 0.00 N ATOM 1291 CA MET B 20 40.368 -7.347 -15.290 1.00 0.00 C ATOM 1292 C MET B 20 40.859 -6.301 -16.286 1.00 0.00 C ATOM 1293 O MET B 20 41.775 -6.557 -17.068 1.00 0.00 O ATOM 1294 CB MET B 20 39.156 -8.084 -15.863 1.00 0.00 C ATOM 1295 CG MET B 20 39.520 -9.338 -16.641 1.00 0.00 C ATOM 1296 SD MET B 20 39.315 -10.843 -15.669 1.00 0.00 S ATOM 1297 CE MET B 20 40.989 -11.481 -15.677 1.00 0.00 C ATOM 0 H MET B 20 39.027 -6.648 -13.838 1.00 0.00 H new ATOM 0 HA MET B 20 41.171 -8.063 -15.116 1.00 0.00 H new ATOM 0 HB2 MET B 20 38.486 -8.354 -15.047 1.00 0.00 H new ATOM 0 HB3 MET B 20 38.605 -7.408 -16.517 1.00 0.00 H new ATOM 0 HG2 MET B 20 38.899 -9.400 -17.534 1.00 0.00 H new ATOM 0 HG3 MET B 20 40.554 -9.265 -16.977 1.00 0.00 H new ATOM 0 HE1 MET B 20 40.968 -12.561 -15.530 1.00 0.00 H new ATOM 0 HE2 MET B 20 41.460 -11.255 -16.634 1.00 0.00 H new ATOM 0 HE3 MET B 20 41.559 -11.016 -14.873 1.00 0.00 H new ATOM 1307 N ALA B 21 40.244 -5.123 -16.253 1.00 0.00 N ATOM 1308 CA ALA B 21 40.620 -4.039 -17.152 1.00 0.00 C ATOM 1309 C ALA B 21 42.032 -3.545 -16.855 1.00 0.00 C ATOM 1310 O ALA B 21 42.811 -3.273 -17.769 1.00 0.00 O ATOM 1311 CB ALA B 21 39.625 -2.894 -17.042 1.00 0.00 C ATOM 0 H ALA B 21 39.483 -4.895 -15.613 1.00 0.00 H new ATOM 0 HA ALA B 21 40.604 -4.423 -18.172 1.00 0.00 H new ATOM 0 HB1 ALA B 21 39.918 -2.091 -17.719 1.00 0.00 H new ATOM 0 HB2 ALA B 21 38.630 -3.250 -17.310 1.00 0.00 H new ATOM 0 HB3 ALA B 21 39.613 -2.519 -16.018 1.00 0.00 H new ATOM 1317 N THR B 22 42.357 -3.431 -15.571 1.00 0.00 N ATOM 1318 CA THR B 22 43.675 -2.968 -15.154 1.00 0.00 C ATOM 1319 C THR B 22 44.732 -4.043 -15.378 1.00 0.00 C ATOM 1320 O THR B 22 45.930 -3.771 -15.310 1.00 0.00 O ATOM 1321 CB THR B 22 43.682 -2.558 -13.670 1.00 0.00 C ATOM 1322 OG1 THR B 22 44.983 -2.088 -13.298 1.00 0.00 O ATOM 1323 CG2 THR B 22 43.287 -3.729 -12.782 1.00 0.00 C ATOM 0 H THR B 22 41.725 -3.653 -14.802 1.00 0.00 H new ATOM 0 HA THR B 22 43.912 -2.097 -15.765 1.00 0.00 H new ATOM 0 HB THR B 22 42.954 -1.758 -13.534 1.00 0.00 H new ATOM 0 HG1 THR B 22 45.646 -2.417 -13.941 1.00 0.00 H new ATOM 0 HG21 THR B 22 43.299 -3.415 -11.738 1.00 0.00 H new ATOM 0 HG22 THR B 22 42.285 -4.065 -13.048 1.00 0.00 H new ATOM 0 HG23 THR B 22 43.994 -4.547 -12.923 1.00 0.00 H new ATOM 1331 N GLN B 23 44.279 -5.264 -15.644 1.00 0.00 N ATOM 1332 CA GLN B 23 45.188 -6.381 -15.878 1.00 0.00 C ATOM 1333 C GLN B 23 45.530 -6.503 -17.359 1.00 0.00 C ATOM 1334 O GLN B 23 46.301 -7.375 -17.758 1.00 0.00 O ATOM 1335 CB GLN B 23 44.566 -7.685 -15.377 1.00 0.00 C ATOM 1336 CG GLN B 23 44.709 -7.891 -13.877 1.00 0.00 C ATOM 1337 CD GLN B 23 46.111 -8.307 -13.476 1.00 0.00 C ATOM 1338 OE1 GLN B 23 46.397 -9.494 -13.318 1.00 0.00 O ATOM 1339 NE2 GLN B 23 46.994 -7.329 -13.310 1.00 0.00 N ATOM 0 H GLN B 23 43.290 -5.505 -15.703 1.00 0.00 H new ATOM 0 HA GLN B 23 46.108 -6.190 -15.326 1.00 0.00 H new ATOM 0 HB2 GLN B 23 43.508 -7.697 -15.638 1.00 0.00 H new ATOM 0 HB3 GLN B 23 45.031 -8.523 -15.896 1.00 0.00 H new ATOM 0 HG2 GLN B 23 44.446 -6.968 -13.361 1.00 0.00 H new ATOM 0 HG3 GLN B 23 44.001 -8.652 -13.549 1.00 0.00 H new ATOM 0 HE21 GLN B 23 46.713 -6.359 -13.452 1.00 0.00 H new ATOM 0 HE22 GLN B 23 47.953 -7.548 -13.041 1.00 0.00 H new ATOM 1348 N GLY B 24 44.951 -5.623 -18.170 1.00 0.00 N ATOM 1349 CA GLY B 24 45.207 -5.650 -19.599 1.00 0.00 C ATOM 1350 C GLY B 24 44.078 -6.295 -20.378 1.00 0.00 C ATOM 1351 O GLY B 24 44.103 -6.328 -21.608 1.00 0.00 O ATOM 0 H GLY B 24 44.309 -4.892 -17.863 1.00 0.00 H new ATOM 0 HA2 GLY B 24 45.356 -4.632 -19.958 1.00 0.00 H new ATOM 0 HA3 GLY B 24 46.132 -6.194 -19.789 1.00 0.00 H new ATOM 1355 N VAL B 25 43.086 -6.812 -19.660 1.00 0.00 N ATOM 1356 CA VAL B 25 41.942 -7.460 -20.292 1.00 0.00 C ATOM 1357 C VAL B 25 40.688 -6.603 -20.169 1.00 0.00 C ATOM 1358 O VAL B 25 40.161 -6.409 -19.073 1.00 0.00 O ATOM 1359 CB VAL B 25 41.668 -8.843 -19.672 1.00 0.00 C ATOM 1360 CG1 VAL B 25 40.640 -9.603 -20.496 1.00 0.00 C ATOM 1361 CG2 VAL B 25 42.960 -9.638 -19.552 1.00 0.00 C ATOM 0 H VAL B 25 43.051 -6.795 -18.641 1.00 0.00 H new ATOM 0 HA VAL B 25 42.191 -7.585 -21.346 1.00 0.00 H new ATOM 0 HB VAL B 25 41.262 -8.699 -18.671 1.00 0.00 H new ATOM 0 HG11 VAL B 25 40.459 -10.578 -20.043 1.00 0.00 H new ATOM 0 HG12 VAL B 25 39.708 -9.038 -20.526 1.00 0.00 H new ATOM 0 HG13 VAL B 25 41.015 -9.738 -21.510 1.00 0.00 H new ATOM 0 HG21 VAL B 25 42.748 -10.612 -19.112 1.00 0.00 H new ATOM 0 HG22 VAL B 25 43.397 -9.774 -20.541 1.00 0.00 H new ATOM 0 HG23 VAL B 25 43.662 -9.098 -18.917 1.00 0.00 H new ATOM 1371 N ILE B 26 40.214 -6.092 -21.301 1.00 0.00 N ATOM 1372 CA ILE B 26 39.019 -5.257 -21.320 1.00 0.00 C ATOM 1373 C ILE B 26 37.754 -6.107 -21.297 1.00 0.00 C ATOM 1374 O ILE B 26 37.632 -7.080 -22.041 1.00 0.00 O ATOM 1375 CB ILE B 26 38.990 -4.346 -22.561 1.00 0.00 C ATOM 1376 CG1 ILE B 26 40.223 -3.440 -22.586 1.00 0.00 C ATOM 1377 CG2 ILE B 26 37.715 -3.515 -22.578 1.00 0.00 C ATOM 1378 CD1 ILE B 26 40.333 -2.536 -21.378 1.00 0.00 C ATOM 0 H ILE B 26 40.639 -6.242 -22.216 1.00 0.00 H new ATOM 0 HA ILE B 26 39.053 -4.637 -20.424 1.00 0.00 H new ATOM 0 HB ILE B 26 39.005 -4.972 -23.453 1.00 0.00 H new ATOM 0 HG12 ILE B 26 41.118 -4.059 -22.649 1.00 0.00 H new ATOM 0 HG13 ILE B 26 40.195 -2.827 -23.487 1.00 0.00 H new ATOM 0 HG21 ILE B 26 37.709 -2.876 -23.461 1.00 0.00 H new ATOM 0 HG22 ILE B 26 36.849 -4.177 -22.603 1.00 0.00 H new ATOM 0 HG23 ILE B 26 37.672 -2.896 -21.682 1.00 0.00 H new ATOM 0 HD11 ILE B 26 41.230 -1.923 -21.463 1.00 0.00 H new ATOM 0 HD12 ILE B 26 39.456 -1.891 -21.325 1.00 0.00 H new ATOM 0 HD13 ILE B 26 40.393 -3.142 -20.474 1.00 0.00 H new ATOM 1390 N LEU B 27 36.812 -5.732 -20.438 1.00 0.00 N ATOM 1391 CA LEU B 27 35.552 -6.458 -20.318 1.00 0.00 C ATOM 1392 C LEU B 27 34.363 -5.515 -20.470 1.00 0.00 C ATOM 1393 O LEU B 27 34.502 -4.298 -20.350 1.00 0.00 O ATOM 1394 CB LEU B 27 35.481 -7.175 -18.969 1.00 0.00 C ATOM 1395 CG LEU B 27 36.346 -8.427 -18.827 1.00 0.00 C ATOM 1396 CD1 LEU B 27 36.166 -9.048 -17.450 1.00 0.00 C ATOM 1397 CD2 LEU B 27 36.009 -9.435 -19.917 1.00 0.00 C ATOM 0 H LEU B 27 36.897 -4.929 -19.814 1.00 0.00 H new ATOM 0 HA LEU B 27 35.509 -7.197 -21.118 1.00 0.00 H new ATOM 0 HB2 LEU B 27 35.768 -6.469 -18.190 1.00 0.00 H new ATOM 0 HB3 LEU B 27 34.443 -7.452 -18.782 1.00 0.00 H new ATOM 0 HG LEU B 27 37.391 -8.137 -18.938 1.00 0.00 H new ATOM 0 HD11 LEU B 27 36.790 -9.938 -17.368 1.00 0.00 H new ATOM 0 HD12 LEU B 27 36.458 -8.328 -16.685 1.00 0.00 H new ATOM 0 HD13 LEU B 27 35.121 -9.323 -17.309 1.00 0.00 H new ATOM 0 HD21 LEU B 27 36.635 -10.320 -19.800 1.00 0.00 H new ATOM 0 HD22 LEU B 27 34.960 -9.719 -19.838 1.00 0.00 H new ATOM 0 HD23 LEU B 27 36.191 -8.988 -20.894 1.00 0.00 H new ATOM 1409 N THR B 28 33.192 -6.086 -20.734 1.00 0.00 N ATOM 1410 CA THR B 28 31.978 -5.297 -20.901 1.00 0.00 C ATOM 1411 C THR B 28 30.863 -5.804 -19.993 1.00 0.00 C ATOM 1412 O THR B 28 30.780 -6.998 -19.704 1.00 0.00 O ATOM 1413 CB THR B 28 31.487 -5.324 -22.360 1.00 0.00 C ATOM 1414 OG1 THR B 28 32.475 -5.934 -23.199 1.00 0.00 O ATOM 1415 CG2 THR B 28 31.191 -3.917 -22.858 1.00 0.00 C ATOM 0 H THR B 28 33.059 -7.092 -20.837 1.00 0.00 H new ATOM 0 HA THR B 28 32.228 -4.272 -20.628 1.00 0.00 H new ATOM 0 HB THR B 28 30.567 -5.908 -22.399 1.00 0.00 H new ATOM 0 HG1 THR B 28 32.536 -6.890 -22.990 1.00 0.00 H new ATOM 0 HG21 THR B 28 30.846 -3.962 -23.891 1.00 0.00 H new ATOM 0 HG22 THR B 28 30.418 -3.466 -22.236 1.00 0.00 H new ATOM 0 HG23 THR B 28 32.097 -3.314 -22.804 1.00 0.00 H new ATOM 1423 N ILE B 29 30.009 -4.890 -19.545 1.00 0.00 N ATOM 1424 CA ILE B 29 28.899 -5.246 -18.671 1.00 0.00 C ATOM 1425 C ILE B 29 27.571 -4.762 -19.244 1.00 0.00 C ATOM 1426 O ILE B 29 27.500 -3.699 -19.859 1.00 0.00 O ATOM 1427 CB ILE B 29 29.081 -4.656 -17.260 1.00 0.00 C ATOM 1428 CG1 ILE B 29 30.323 -5.249 -16.592 1.00 0.00 C ATOM 1429 CG2 ILE B 29 27.844 -4.914 -16.413 1.00 0.00 C ATOM 1430 CD1 ILE B 29 30.255 -6.750 -16.415 1.00 0.00 C ATOM 0 H ILE B 29 30.065 -3.897 -19.773 1.00 0.00 H new ATOM 0 HA ILE B 29 28.888 -6.334 -18.603 1.00 0.00 H new ATOM 0 HB ILE B 29 29.218 -3.578 -17.349 1.00 0.00 H new ATOM 0 HG12 ILE B 29 31.200 -5.001 -17.189 1.00 0.00 H new ATOM 0 HG13 ILE B 29 30.459 -4.782 -15.617 1.00 0.00 H new ATOM 0 HG21 ILE B 29 27.989 -4.491 -15.419 1.00 0.00 H new ATOM 0 HG22 ILE B 29 26.978 -4.448 -16.883 1.00 0.00 H new ATOM 0 HG23 ILE B 29 27.678 -5.988 -16.329 1.00 0.00 H new ATOM 0 HD11 ILE B 29 31.169 -7.102 -15.935 1.00 0.00 H new ATOM 0 HD12 ILE B 29 29.397 -7.004 -15.792 1.00 0.00 H new ATOM 0 HD13 ILE B 29 30.150 -7.227 -17.390 1.00 0.00 H new ATOM 1442 N GLN B 30 26.521 -5.550 -19.036 1.00 0.00 N ATOM 1443 CA GLN B 30 25.194 -5.201 -19.531 1.00 0.00 C ATOM 1444 C GLN B 30 24.178 -5.177 -18.395 1.00 0.00 C ATOM 1445 O GLN B 30 23.739 -6.225 -17.920 1.00 0.00 O ATOM 1446 CB GLN B 30 24.751 -6.194 -20.607 1.00 0.00 C ATOM 1447 CG GLN B 30 24.951 -5.685 -22.025 1.00 0.00 C ATOM 1448 CD GLN B 30 23.648 -5.567 -22.792 1.00 0.00 C ATOM 1449 OE1 GLN B 30 23.081 -6.568 -23.231 1.00 0.00 O ATOM 1450 NE2 GLN B 30 23.166 -4.341 -22.956 1.00 0.00 N ATOM 0 H GLN B 30 26.563 -6.434 -18.528 1.00 0.00 H new ATOM 0 HA GLN B 30 25.247 -4.203 -19.967 1.00 0.00 H new ATOM 0 HB2 GLN B 30 25.306 -7.124 -20.482 1.00 0.00 H new ATOM 0 HB3 GLN B 30 23.697 -6.430 -20.460 1.00 0.00 H new ATOM 0 HG2 GLN B 30 25.438 -4.711 -21.992 1.00 0.00 H new ATOM 0 HG3 GLN B 30 25.622 -6.359 -22.558 1.00 0.00 H new ATOM 0 HE21 GLN B 30 23.669 -3.540 -22.575 1.00 0.00 H new ATOM 0 HE22 GLN B 30 22.292 -4.200 -23.463 1.00 0.00 H new ATOM 1459 N GLN B 31 23.808 -3.976 -17.963 1.00 0.00 N ATOM 1460 CA GLN B 31 22.844 -3.816 -16.881 1.00 0.00 C ATOM 1461 C GLN B 31 21.415 -3.880 -17.412 1.00 0.00 C ATOM 1462 O GLN B 31 21.004 -3.046 -18.219 1.00 0.00 O ATOM 1463 CB GLN B 31 23.073 -2.489 -16.157 1.00 0.00 C ATOM 1464 CG GLN B 31 23.519 -2.653 -14.713 1.00 0.00 C ATOM 1465 CD GLN B 31 23.764 -1.325 -14.023 1.00 0.00 C ATOM 1466 OE1 GLN B 31 24.867 -1.052 -13.550 1.00 0.00 O ATOM 1467 NE2 GLN B 31 22.733 -0.490 -13.962 1.00 0.00 N ATOM 0 H GLN B 31 24.161 -3.099 -18.346 1.00 0.00 H new ATOM 0 HA GLN B 31 22.988 -4.635 -16.176 1.00 0.00 H new ATOM 0 HB2 GLN B 31 23.825 -1.915 -16.698 1.00 0.00 H new ATOM 0 HB3 GLN B 31 22.151 -1.908 -16.180 1.00 0.00 H new ATOM 0 HG2 GLN B 31 22.760 -3.209 -14.163 1.00 0.00 H new ATOM 0 HG3 GLN B 31 24.432 -3.247 -14.684 1.00 0.00 H new ATOM 0 HE21 GLN B 31 21.836 -0.757 -14.367 1.00 0.00 H new ATOM 0 HE22 GLN B 31 22.838 0.418 -13.510 1.00 0.00 H new ATOM 1524 N SER B 35 10.275 -3.314 -15.109 1.00 0.00 N ATOM 1525 CA SER B 35 9.350 -2.828 -14.092 1.00 0.00 C ATOM 1526 C SER B 35 8.043 -3.615 -14.127 1.00 0.00 C ATOM 1527 O SER B 35 7.188 -3.382 -14.982 1.00 0.00 O ATOM 1528 CB SER B 35 9.068 -1.339 -14.299 1.00 0.00 C ATOM 1529 OG SER B 35 10.265 -0.582 -14.258 1.00 0.00 O ATOM 0 HA SER B 35 9.814 -2.970 -13.116 1.00 0.00 H new ATOM 0 HB2 SER B 35 8.572 -1.190 -15.258 1.00 0.00 H new ATOM 0 HB3 SER B 35 8.384 -0.985 -13.528 1.00 0.00 H new ATOM 0 HG SER B 35 11.018 -1.145 -14.536 1.00 0.00 H new ATOM 1535 N ASP B 36 7.896 -4.546 -13.191 1.00 0.00 N ATOM 1536 CA ASP B 36 6.694 -5.368 -13.113 1.00 0.00 C ATOM 1537 C ASP B 36 5.636 -4.700 -12.239 1.00 0.00 C ATOM 1538 O ASP B 36 5.915 -4.289 -11.113 1.00 0.00 O ATOM 1539 CB ASP B 36 7.031 -6.752 -12.558 1.00 0.00 C ATOM 1540 CG ASP B 36 5.848 -7.406 -11.872 1.00 0.00 C ATOM 1541 OD1 ASP B 36 4.727 -7.322 -12.416 1.00 0.00 O ATOM 1542 OD2 ASP B 36 6.042 -8.001 -10.791 1.00 0.00 O ATOM 0 H ASP B 36 8.594 -4.750 -12.476 1.00 0.00 H new ATOM 0 HA ASP B 36 6.293 -5.478 -14.120 1.00 0.00 H new ATOM 0 HB2 ASP B 36 7.375 -7.392 -13.371 1.00 0.00 H new ATOM 0 HB3 ASP B 36 7.855 -6.665 -11.850 1.00 0.00 H new ATOM 1547 N VAL B 37 4.420 -4.596 -12.767 1.00 0.00 N ATOM 1548 CA VAL B 37 3.320 -3.978 -12.035 1.00 0.00 C ATOM 1549 C VAL B 37 2.428 -5.033 -11.391 1.00 0.00 C ATOM 1550 O VAL B 37 1.887 -5.903 -12.074 1.00 0.00 O ATOM 1551 CB VAL B 37 2.463 -3.089 -12.956 1.00 0.00 C ATOM 1552 CG1 VAL B 37 1.530 -2.213 -12.134 1.00 0.00 C ATOM 1553 CG2 VAL B 37 3.351 -2.241 -13.854 1.00 0.00 C ATOM 0 H VAL B 37 4.172 -4.931 -13.698 1.00 0.00 H new ATOM 0 HA VAL B 37 3.765 -3.359 -11.256 1.00 0.00 H new ATOM 0 HB VAL B 37 1.853 -3.733 -13.590 1.00 0.00 H new ATOM 0 HG11 VAL B 37 0.932 -1.592 -12.801 1.00 0.00 H new ATOM 0 HG12 VAL B 37 0.871 -2.843 -11.537 1.00 0.00 H new ATOM 0 HG13 VAL B 37 2.118 -1.575 -11.474 1.00 0.00 H new ATOM 0 HG21 VAL B 37 2.729 -1.619 -14.498 1.00 0.00 H new ATOM 0 HG22 VAL B 37 3.988 -1.604 -13.240 1.00 0.00 H new ATOM 0 HG23 VAL B 37 3.973 -2.891 -14.469 1.00 0.00 H new ATOM 1563 N TRP B 38 2.278 -4.949 -10.074 1.00 0.00 N ATOM 1564 CA TRP B 38 1.450 -5.897 -9.338 1.00 0.00 C ATOM 1565 C TRP B 38 0.463 -5.169 -8.432 1.00 0.00 C ATOM 1566 O TRP B 38 0.782 -4.124 -7.863 1.00 0.00 O ATOM 1567 CB TRP B 38 2.328 -6.834 -8.506 1.00 0.00 C ATOM 1568 CG TRP B 38 3.676 -6.261 -8.192 1.00 0.00 C ATOM 1569 CD1 TRP B 38 4.626 -5.861 -9.087 1.00 0.00 C ATOM 1570 CD2 TRP B 38 4.225 -6.027 -6.890 1.00 0.00 C ATOM 1571 NE1 TRP B 38 5.733 -5.392 -8.421 1.00 0.00 N ATOM 1572 CE2 TRP B 38 5.511 -5.482 -7.072 1.00 0.00 C ATOM 1573 CE3 TRP B 38 3.755 -6.222 -5.589 1.00 0.00 C ATOM 1574 CZ2 TRP B 38 6.330 -5.132 -6.002 1.00 0.00 C ATOM 1575 CZ3 TRP B 38 4.568 -5.875 -4.527 1.00 0.00 C ATOM 1576 CH2 TRP B 38 5.844 -5.335 -4.739 1.00 0.00 C ATOM 0 H TRP B 38 2.719 -4.235 -9.494 1.00 0.00 H new ATOM 0 HA TRP B 38 0.885 -6.485 -10.061 1.00 0.00 H new ATOM 0 HB2 TRP B 38 1.815 -7.069 -7.574 1.00 0.00 H new ATOM 0 HB3 TRP B 38 2.457 -7.773 -9.044 1.00 0.00 H new ATOM 0 HD1 TRP B 38 4.523 -5.906 -10.161 1.00 0.00 H new ATOM 0 HE1 TRP B 38 6.582 -5.035 -8.860 1.00 0.00 H new ATOM 0 HE3 TRP B 38 2.773 -6.637 -5.416 1.00 0.00 H new ATOM 0 HZ2 TRP B 38 7.313 -4.715 -6.163 1.00 0.00 H new ATOM 0 HZ3 TRP B 38 4.215 -6.022 -3.517 1.00 0.00 H new ATOM 0 HH2 TRP B 38 6.456 -5.074 -3.888 1.00 0.00 H new ATOM 1587 N LEU B 39 -0.736 -5.726 -8.303 1.00 0.00 N ATOM 1588 CA LEU B 39 -1.771 -5.128 -7.465 1.00 0.00 C ATOM 1589 C LEU B 39 -2.122 -6.045 -6.298 1.00 0.00 C ATOM 1590 O LEU B 39 -1.968 -7.262 -6.383 1.00 0.00 O ATOM 1591 CB LEU B 39 -3.022 -4.838 -8.296 1.00 0.00 C ATOM 1592 CG LEU B 39 -4.266 -4.420 -7.511 1.00 0.00 C ATOM 1593 CD1 LEU B 39 -4.040 -3.080 -6.827 1.00 0.00 C ATOM 1594 CD2 LEU B 39 -5.479 -4.354 -8.428 1.00 0.00 C ATOM 0 H LEU B 39 -1.016 -6.590 -8.767 1.00 0.00 H new ATOM 0 HA LEU B 39 -1.384 -4.191 -7.063 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -2.785 -4.049 -9.010 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -3.264 -5.729 -8.875 1.00 0.00 H new ATOM 0 HG LEU B 39 -4.456 -5.170 -6.743 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -4.936 -2.799 -6.273 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -3.198 -3.160 -6.139 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -3.824 -2.320 -7.578 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -6.355 -4.055 -7.852 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -5.298 -3.625 -9.218 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -5.654 -5.334 -8.871 1.00 0.00 H new ATOM 1606 N ALA B 40 -2.598 -5.450 -5.209 1.00 0.00 N ATOM 1607 CA ALA B 40 -2.976 -6.213 -4.026 1.00 0.00 C ATOM 1608 C ALA B 40 -4.487 -6.411 -3.959 1.00 0.00 C ATOM 1609 O ALA B 40 -4.968 -7.419 -3.440 1.00 0.00 O ATOM 1610 CB ALA B 40 -2.478 -5.518 -2.767 1.00 0.00 C ATOM 0 H ALA B 40 -2.731 -4.442 -5.122 1.00 0.00 H new ATOM 0 HA ALA B 40 -2.509 -7.196 -4.095 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -2.768 -6.099 -1.892 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.392 -5.434 -2.803 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -2.917 -4.522 -2.703 1.00 0.00 H new ATOM 1616 N ASP B 41 -5.229 -5.445 -4.488 1.00 0.00 N ATOM 1617 CA ASP B 41 -6.686 -5.513 -4.489 1.00 0.00 C ATOM 1618 C ASP B 41 -7.197 -6.194 -5.755 1.00 0.00 C ATOM 1619 O ASP B 41 -7.462 -5.535 -6.760 1.00 0.00 O ATOM 1620 CB ASP B 41 -7.284 -4.110 -4.372 1.00 0.00 C ATOM 1621 CG ASP B 41 -8.765 -4.137 -4.051 1.00 0.00 C ATOM 1622 OD1 ASP B 41 -9.506 -4.883 -4.726 1.00 0.00 O ATOM 1623 OD2 ASP B 41 -9.184 -3.414 -3.123 1.00 0.00 O ATOM 0 H ASP B 41 -4.846 -4.605 -4.922 1.00 0.00 H new ATOM 0 HA ASP B 41 -6.998 -6.105 -3.628 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.757 -3.557 -3.595 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -7.128 -3.572 -5.307 1.00 0.00 H new ATOM 1628 N GLU B 42 -7.330 -7.515 -5.698 1.00 0.00 N ATOM 1629 CA GLU B 42 -7.807 -8.284 -6.841 1.00 0.00 C ATOM 1630 C GLU B 42 -9.079 -7.669 -7.418 1.00 0.00 C ATOM 1631 O GLU B 42 -9.237 -7.569 -8.635 1.00 0.00 O ATOM 1632 CB GLU B 42 -8.069 -9.736 -6.435 1.00 0.00 C ATOM 1633 CG GLU B 42 -6.805 -10.513 -6.109 1.00 0.00 C ATOM 1634 CD GLU B 42 -7.095 -11.918 -5.616 1.00 0.00 C ATOM 1635 OE1 GLU B 42 -8.287 -12.269 -5.492 1.00 0.00 O ATOM 1636 OE2 GLU B 42 -6.129 -12.665 -5.354 1.00 0.00 O ATOM 0 H GLU B 42 -7.114 -8.075 -4.873 1.00 0.00 H new ATOM 0 HA GLU B 42 -7.033 -8.263 -7.608 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -8.728 -9.749 -5.567 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -8.598 -10.241 -7.243 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -6.176 -10.566 -6.998 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -6.238 -9.975 -5.349 1.00 0.00 H new ATOM 1643 N SER B 43 -9.984 -7.258 -6.535 1.00 0.00 N ATOM 1644 CA SER B 43 -11.244 -6.657 -6.955 1.00 0.00 C ATOM 1645 C SER B 43 -10.997 -5.461 -7.870 1.00 0.00 C ATOM 1646 O SER B 43 -11.776 -5.196 -8.785 1.00 0.00 O ATOM 1647 CB SER B 43 -12.057 -6.220 -5.735 1.00 0.00 C ATOM 1648 OG SER B 43 -11.775 -7.040 -4.614 1.00 0.00 O ATOM 0 H SER B 43 -9.868 -7.330 -5.524 1.00 0.00 H new ATOM 0 HA SER B 43 -11.808 -7.407 -7.509 1.00 0.00 H new ATOM 0 HB2 SER B 43 -11.830 -5.181 -5.496 1.00 0.00 H new ATOM 0 HB3 SER B 43 -13.121 -6.269 -5.967 1.00 0.00 H new ATOM 0 HG SER B 43 -12.306 -6.739 -3.847 1.00 0.00 H new ATOM 1654 N GLN B 44 -9.908 -4.744 -7.616 1.00 0.00 N ATOM 1655 CA GLN B 44 -9.558 -3.577 -8.416 1.00 0.00 C ATOM 1656 C GLN B 44 -8.711 -3.975 -9.620 1.00 0.00 C ATOM 1657 O GLN B 44 -8.526 -3.189 -10.548 1.00 0.00 O ATOM 1658 CB GLN B 44 -8.804 -2.555 -7.563 1.00 0.00 C ATOM 1659 CG GLN B 44 -9.533 -1.230 -7.414 1.00 0.00 C ATOM 1660 CD GLN B 44 -10.946 -1.397 -6.890 1.00 0.00 C ATOM 1661 OE1 GLN B 44 -11.904 -1.456 -7.663 1.00 0.00 O ATOM 1662 NE2 GLN B 44 -11.084 -1.475 -5.572 1.00 0.00 N ATOM 0 H GLN B 44 -9.253 -4.951 -6.862 1.00 0.00 H new ATOM 0 HA GLN B 44 -10.482 -3.127 -8.778 1.00 0.00 H new ATOM 0 HB2 GLN B 44 -8.630 -2.978 -6.573 1.00 0.00 H new ATOM 0 HB3 GLN B 44 -7.826 -2.374 -8.008 1.00 0.00 H new ATOM 0 HG2 GLN B 44 -8.972 -0.585 -6.737 1.00 0.00 H new ATOM 0 HG3 GLN B 44 -9.565 -0.727 -8.380 1.00 0.00 H new ATOM 0 HE21 GLN B 44 -10.263 -1.422 -4.969 1.00 0.00 H new ATOM 0 HE22 GLN B 44 -12.011 -1.588 -5.162 1.00 0.00 H new ATOM 1671 N ALA B 45 -8.198 -5.201 -9.596 1.00 0.00 N ATOM 1672 CA ALA B 45 -7.373 -5.705 -10.687 1.00 0.00 C ATOM 1673 C ALA B 45 -8.048 -5.481 -12.036 1.00 0.00 C ATOM 1674 O ALA B 45 -7.390 -5.152 -13.022 1.00 0.00 O ATOM 1675 CB ALA B 45 -7.073 -7.183 -10.483 1.00 0.00 C ATOM 0 H ALA B 45 -8.339 -5.863 -8.833 1.00 0.00 H new ATOM 0 HA ALA B 45 -6.434 -5.151 -10.685 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.456 -7.546 -11.305 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -6.540 -7.320 -9.542 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -8.007 -7.744 -10.456 1.00 0.00 H new ATOM 1681 N GLU B 46 -9.365 -5.663 -12.070 1.00 0.00 N ATOM 1682 CA GLU B 46 -10.128 -5.483 -13.300 1.00 0.00 C ATOM 1683 C GLU B 46 -10.107 -4.023 -13.743 1.00 0.00 C ATOM 1684 O GLU B 46 -9.895 -3.723 -14.918 1.00 0.00 O ATOM 1685 CB GLU B 46 -11.572 -5.947 -13.102 1.00 0.00 C ATOM 1686 CG GLU B 46 -11.690 -7.388 -12.636 1.00 0.00 C ATOM 1687 CD GLU B 46 -13.102 -7.753 -12.221 1.00 0.00 C ATOM 1688 OE1 GLU B 46 -13.675 -7.036 -11.374 1.00 0.00 O ATOM 1689 OE2 GLU B 46 -13.634 -8.756 -12.742 1.00 0.00 O ATOM 0 H GLU B 46 -9.925 -5.934 -11.262 1.00 0.00 H new ATOM 0 HA GLU B 46 -9.663 -6.088 -14.079 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -12.057 -5.298 -12.373 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -12.114 -5.832 -14.041 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -11.368 -8.053 -13.437 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -11.015 -7.551 -11.796 1.00 0.00 H new ATOM 1696 N ARG B 47 -10.330 -3.119 -12.795 1.00 0.00 N ATOM 1697 CA ARG B 47 -10.339 -1.691 -13.087 1.00 0.00 C ATOM 1698 C ARG B 47 -8.987 -1.239 -13.633 1.00 0.00 C ATOM 1699 O ARG B 47 -8.909 -0.634 -14.702 1.00 0.00 O ATOM 1700 CB ARG B 47 -10.685 -0.893 -11.829 1.00 0.00 C ATOM 1701 CG ARG B 47 -10.732 0.609 -12.054 1.00 0.00 C ATOM 1702 CD ARG B 47 -9.410 1.269 -11.696 1.00 0.00 C ATOM 1703 NE ARG B 47 -9.422 2.704 -11.967 1.00 0.00 N ATOM 1704 CZ ARG B 47 -10.130 3.579 -11.262 1.00 0.00 C ATOM 1705 NH1 ARG B 47 -10.878 3.167 -10.247 1.00 0.00 N ATOM 1706 NH2 ARG B 47 -10.089 4.869 -11.570 1.00 0.00 N ATOM 0 H ARG B 47 -10.507 -3.350 -11.818 1.00 0.00 H new ATOM 0 HA ARG B 47 -11.099 -1.506 -13.846 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -11.652 -1.226 -11.453 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -9.949 -1.113 -11.056 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -10.971 0.814 -13.097 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -11.531 1.043 -11.453 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -9.196 1.102 -10.640 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -8.606 0.800 -12.263 1.00 0.00 H new ATOM 0 HE ARG B 47 -8.856 3.053 -12.740 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -10.910 2.176 -10.006 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -11.421 3.841 -9.707 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -9.513 5.189 -12.349 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -10.633 5.540 -11.028 1.00 0.00 H new ATOM 1720 N VAL B 48 -7.925 -1.538 -12.891 1.00 0.00 N ATOM 1721 CA VAL B 48 -6.577 -1.163 -13.301 1.00 0.00 C ATOM 1722 C VAL B 48 -6.235 -1.748 -14.666 1.00 0.00 C ATOM 1723 O VAL B 48 -5.582 -1.101 -15.485 1.00 0.00 O ATOM 1724 CB VAL B 48 -5.528 -1.634 -12.276 1.00 0.00 C ATOM 1725 CG1 VAL B 48 -5.702 -0.896 -10.957 1.00 0.00 C ATOM 1726 CG2 VAL B 48 -5.621 -3.138 -12.071 1.00 0.00 C ATOM 0 H VAL B 48 -7.972 -2.038 -12.003 1.00 0.00 H new ATOM 0 HA VAL B 48 -6.555 -0.075 -13.360 1.00 0.00 H new ATOM 0 HB VAL B 48 -4.536 -1.405 -12.665 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -4.952 -1.242 -10.245 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -5.581 0.175 -11.120 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -6.698 -1.092 -10.559 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -4.873 -3.453 -11.344 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -6.615 -3.394 -11.703 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -5.442 -3.646 -13.019 1.00 0.00 H new ATOM 1736 N ARG B 49 -6.682 -2.977 -14.907 1.00 0.00 N ATOM 1737 CA ARG B 49 -6.423 -3.650 -16.174 1.00 0.00 C ATOM 1738 C ARG B 49 -6.999 -2.853 -17.340 1.00 0.00 C ATOM 1739 O ARG B 49 -6.299 -2.556 -18.308 1.00 0.00 O ATOM 1740 CB ARG B 49 -7.020 -5.058 -16.159 1.00 0.00 C ATOM 1741 CG ARG B 49 -6.024 -6.138 -15.768 1.00 0.00 C ATOM 1742 CD ARG B 49 -6.718 -7.328 -15.124 1.00 0.00 C ATOM 1743 NE ARG B 49 -6.272 -8.596 -15.695 1.00 0.00 N ATOM 1744 CZ ARG B 49 -6.696 -9.066 -16.863 1.00 0.00 C ATOM 1745 NH1 ARG B 49 -7.573 -8.377 -17.580 1.00 0.00 N ATOM 1746 NH2 ARG B 49 -6.244 -10.229 -17.316 1.00 0.00 N ATOM 0 H ARG B 49 -7.225 -3.526 -14.241 1.00 0.00 H new ATOM 0 HA ARG B 49 -5.343 -3.723 -16.305 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -7.859 -5.080 -15.463 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -7.419 -5.285 -17.148 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -5.478 -6.468 -16.652 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -5.290 -5.725 -15.076 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -6.523 -7.325 -14.052 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -7.796 -7.232 -15.252 1.00 0.00 H new ATOM 0 HE ARG B 49 -5.598 -9.151 -15.168 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -7.924 -7.484 -17.235 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -7.897 -8.740 -18.476 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -5.570 -10.763 -16.767 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -6.570 -10.589 -18.213 1.00 0.00 H new ATOM 1760 N ALA B 50 -8.280 -2.511 -17.241 1.00 0.00 N ATOM 1761 CA ALA B 50 -8.950 -1.749 -18.287 1.00 0.00 C ATOM 1762 C ALA B 50 -8.266 -0.404 -18.509 1.00 0.00 C ATOM 1763 O ALA B 50 -7.837 -0.092 -19.620 1.00 0.00 O ATOM 1764 CB ALA B 50 -10.416 -1.545 -17.935 1.00 0.00 C ATOM 0 H ALA B 50 -8.874 -2.750 -16.447 1.00 0.00 H new ATOM 0 HA ALA B 50 -8.886 -2.318 -19.214 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -10.904 -0.974 -18.725 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.904 -2.514 -17.833 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.492 -1.000 -16.994 1.00 0.00 H new ATOM 1770 N GLU B 51 -8.168 0.388 -17.446 1.00 0.00 N ATOM 1771 CA GLU B 51 -7.538 1.701 -17.527 1.00 0.00 C ATOM 1772 C GLU B 51 -6.116 1.588 -18.070 1.00 0.00 C ATOM 1773 O GLU B 51 -5.703 2.368 -18.929 1.00 0.00 O ATOM 1774 CB GLU B 51 -7.519 2.368 -16.151 1.00 0.00 C ATOM 1775 CG GLU B 51 -8.898 2.530 -15.534 1.00 0.00 C ATOM 1776 CD GLU B 51 -9.969 2.821 -16.567 1.00 0.00 C ATOM 1777 OE1 GLU B 51 -9.784 3.766 -17.362 1.00 0.00 O ATOM 1778 OE2 GLU B 51 -10.991 2.104 -16.580 1.00 0.00 O ATOM 0 H GLU B 51 -8.517 0.144 -16.519 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.123 2.315 -18.212 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -6.897 1.777 -15.479 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.052 3.349 -16.238 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -9.159 1.621 -14.992 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -8.873 3.339 -14.804 1.00 0.00 H new ATOM 1785 N LEU B 52 -5.371 0.613 -17.561 1.00 0.00 N ATOM 1786 CA LEU B 52 -3.994 0.398 -17.994 1.00 0.00 C ATOM 1787 C LEU B 52 -3.916 0.246 -19.509 1.00 0.00 C ATOM 1788 O LEU B 52 -3.122 0.914 -20.170 1.00 0.00 O ATOM 1789 CB LEU B 52 -3.414 -0.845 -17.315 1.00 0.00 C ATOM 1790 CG LEU B 52 -1.974 -1.202 -17.686 1.00 0.00 C ATOM 1791 CD1 LEU B 52 -1.055 -1.025 -16.487 1.00 0.00 C ATOM 1792 CD2 LEU B 52 -1.897 -2.627 -18.214 1.00 0.00 C ATOM 0 H LEU B 52 -5.696 -0.041 -16.849 1.00 0.00 H new ATOM 0 HA LEU B 52 -3.408 1.270 -17.705 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -3.465 -0.702 -16.236 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -4.051 -1.696 -17.554 1.00 0.00 H new ATOM 0 HG LEU B 52 -1.643 -0.526 -18.474 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -0.034 -1.284 -16.769 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -1.088 0.012 -16.154 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -1.384 -1.677 -15.677 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -0.865 -2.864 -18.473 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -2.247 -3.318 -17.447 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -2.524 -2.721 -19.100 1.00 0.00 H new ATOM 1804 N ALA B 53 -4.749 -0.636 -20.054 1.00 0.00 N ATOM 1805 CA ALA B 53 -4.777 -0.872 -21.492 1.00 0.00 C ATOM 1806 C ALA B 53 -5.102 0.409 -22.252 1.00 0.00 C ATOM 1807 O ALA B 53 -4.481 0.712 -23.271 1.00 0.00 O ATOM 1808 CB ALA B 53 -5.788 -1.958 -21.828 1.00 0.00 C ATOM 0 H ALA B 53 -5.413 -1.198 -19.521 1.00 0.00 H new ATOM 0 HA ALA B 53 -3.786 -1.205 -21.800 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -5.799 -2.124 -22.905 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -5.511 -2.882 -21.321 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -6.779 -1.647 -21.499 1.00 0.00 H new ATOM 1814 N ARG B 54 -6.079 1.158 -21.751 1.00 0.00 N ATOM 1815 CA ARG B 54 -6.487 2.406 -22.385 1.00 0.00 C ATOM 1816 C ARG B 54 -5.414 3.478 -22.217 1.00 0.00 C ATOM 1817 O ARG B 54 -5.375 4.455 -22.964 1.00 0.00 O ATOM 1818 CB ARG B 54 -7.809 2.896 -21.791 1.00 0.00 C ATOM 1819 CG ARG B 54 -9.008 2.053 -22.196 1.00 0.00 C ATOM 1820 CD ARG B 54 -10.283 2.540 -21.527 1.00 0.00 C ATOM 1821 NE ARG B 54 -10.942 3.589 -22.302 1.00 0.00 N ATOM 1822 CZ ARG B 54 -12.168 4.030 -22.048 1.00 0.00 C ATOM 1823 NH1 ARG B 54 -12.866 3.517 -21.044 1.00 0.00 N ATOM 1824 NH2 ARG B 54 -12.699 4.987 -22.798 1.00 0.00 N ATOM 0 H ARG B 54 -6.603 0.922 -20.908 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.623 2.216 -23.450 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -7.730 2.901 -20.704 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -7.978 3.927 -22.103 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.128 2.086 -23.279 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.830 1.012 -21.927 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.967 1.701 -21.397 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.049 2.918 -20.532 1.00 0.00 H new ATOM 0 HE ARG B 54 -10.432 4.005 -23.081 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -12.461 2.782 -20.465 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.808 3.858 -20.851 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -12.165 5.385 -23.571 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -13.641 5.325 -22.602 1.00 0.00 H new ATOM 1838 N PHE B 55 -4.545 3.287 -21.229 1.00 0.00 N ATOM 1839 CA PHE B 55 -3.472 4.238 -20.962 1.00 0.00 C ATOM 1840 C PHE B 55 -2.236 3.912 -21.795 1.00 0.00 C ATOM 1841 O PHE B 55 -1.533 4.809 -22.261 1.00 0.00 O ATOM 1842 CB PHE B 55 -3.115 4.231 -19.474 1.00 0.00 C ATOM 1843 CG PHE B 55 -2.295 5.415 -19.049 1.00 0.00 C ATOM 1844 CD1 PHE B 55 -0.996 5.575 -19.506 1.00 0.00 C ATOM 1845 CD2 PHE B 55 -2.821 6.368 -18.192 1.00 0.00 C ATOM 1846 CE1 PHE B 55 -0.239 6.663 -19.115 1.00 0.00 C ATOM 1847 CE2 PHE B 55 -2.069 7.458 -17.798 1.00 0.00 C ATOM 1848 CZ PHE B 55 -0.777 7.607 -18.261 1.00 0.00 C ATOM 0 H PHE B 55 -4.563 2.483 -20.601 1.00 0.00 H new ATOM 0 HA PHE B 55 -3.823 5.232 -21.240 1.00 0.00 H new ATOM 0 HB2 PHE B 55 -4.034 4.206 -18.888 1.00 0.00 H new ATOM 0 HB3 PHE B 55 -2.566 3.318 -19.244 1.00 0.00 H new ATOM 0 HD1 PHE B 55 -0.571 4.841 -20.175 1.00 0.00 H new ATOM 0 HD2 PHE B 55 -3.832 6.257 -17.827 1.00 0.00 H new ATOM 0 HE1 PHE B 55 0.772 6.776 -19.477 1.00 0.00 H new ATOM 0 HE2 PHE B 55 -2.491 8.193 -17.129 1.00 0.00 H new ATOM 0 HZ PHE B 55 -0.188 8.459 -17.956 1.00 0.00 H new ATOM 1858 N LEU B 56 -1.976 2.622 -21.977 1.00 0.00 N ATOM 1859 CA LEU B 56 -0.825 2.175 -22.753 1.00 0.00 C ATOM 1860 C LEU B 56 -0.881 2.723 -24.175 1.00 0.00 C ATOM 1861 O LEU B 56 0.149 3.045 -24.767 1.00 0.00 O ATOM 1862 CB LEU B 56 -0.768 0.647 -22.785 1.00 0.00 C ATOM 1863 CG LEU B 56 0.227 -0.008 -21.828 1.00 0.00 C ATOM 1864 CD1 LEU B 56 0.172 -1.523 -21.953 1.00 0.00 C ATOM 1865 CD2 LEU B 56 1.637 0.499 -22.095 1.00 0.00 C ATOM 0 H LEU B 56 -2.547 1.867 -21.597 1.00 0.00 H new ATOM 0 HA LEU B 56 0.076 2.556 -22.272 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -1.763 0.262 -22.562 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.525 0.334 -23.800 1.00 0.00 H new ATOM 0 HG LEU B 56 -0.049 0.262 -20.809 1.00 0.00 H new ATOM 0 HD11 LEU B 56 0.888 -1.971 -21.264 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -0.832 -1.872 -21.711 1.00 0.00 H new ATOM 0 HD13 LEU B 56 0.421 -1.813 -22.974 1.00 0.00 H new ATOM 0 HD21 LEU B 56 2.332 0.022 -21.404 1.00 0.00 H new ATOM 0 HD22 LEU B 56 1.922 0.260 -23.120 1.00 0.00 H new ATOM 0 HD23 LEU B 56 1.668 1.579 -21.953 1.00 0.00 H new