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 Set 1.1: B 19 TYR OH : rot 180:sc= -0.809 USER MOD Set 1.2: B 20 MET CE :methyl 141:sc= -0.83 (180deg=-2.37) USER MOD Set 2.1: A 19 TYR OH : rot 180:sc= -0.734 USER MOD Set 2.2: A 20 MET CE :methyl 135:sc= -1.4 (180deg=-2.73) USER MOD Single : A 1 MET CE :methyl 144:sc= -3.88! (180deg=-5.61!) USER MOD Single : A 1 MET N :NH3+ -161:sc= 0 (180deg=-0.14) USER MOD Single : A 3 MET CE :methyl -116:sc= -1.68 (180deg=-5.62!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.218 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.724 K(o=-0.72,f=-4.9!) USER MOD Single : A 14 GLN : amide:sc= -0.147 X(o=-0.15,f=0) USER MOD Single : A 22 THR OG1 : rot -27:sc= 0.293 USER MOD Single : A 23 GLN : amide:sc= -0.481 X(o=-0.48,f=-0.016) USER MOD Single : A 28 THR OG1 : rot 68:sc= 0.563 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 14:sc= 0.79 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.17 K(o=-0.17,f=-0.72) USER MOD Single : B 1 MET CE :methyl 149:sc= -3.22 (180deg=-5.08!) USER MOD Single : B 1 MET N :NH3+ -157:sc= 0 (180deg=-0.209) USER MOD Single : B 3 MET CE :methyl -113:sc= -3.08 (180deg=-7.92!) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.149 USER MOD Single : B 6 SER OG : rot 8:sc= 0.275! USER MOD Single : B 9 ASN : amide:sc= -0.917 K(o=-0.92,f=-5.6!) USER MOD Single : B 14 GLN : amide:sc= -0.103 X(o=-0.1,f=0) USER MOD Single : B 22 THR OG1 : rot -26:sc= 0.322 USER MOD Single : B 23 GLN : amide:sc= -0.45 X(o=-0.45,f=-0.01) USER MOD Single : B 28 THR OG1 : rot 69:sc= 0.521 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 15:sc= 0.589 USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 44 GLN : amide:sc= -0.376 X(o=-0.38,f=-0.23) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.171 -11.331 -4.161 1.00 0.00 N ATOM 2 CA MET A 1 -1.471 -10.447 -5.086 1.00 0.00 C ATOM 3 C MET A 1 -1.599 -10.949 -6.521 1.00 0.00 C ATOM 4 O MET A 1 -1.217 -12.078 -6.830 1.00 0.00 O ATOM 5 CB MET A 1 0.006 -10.337 -4.701 1.00 0.00 C ATOM 6 CG MET A 1 0.233 -9.711 -3.335 1.00 0.00 C ATOM 7 SD MET A 1 1.272 -8.239 -3.410 1.00 0.00 S ATOM 8 CE MET A 1 0.333 -7.219 -4.544 1.00 0.00 C ATOM 0 H1 MET A 1 -2.351 -10.828 -3.269 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.076 -11.626 -4.580 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.586 -12.170 -3.973 1.00 0.00 H new ATOM 0 HA MET A 1 -1.930 -9.460 -5.023 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.451 -11.332 -4.714 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.526 -9.745 -5.454 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.729 -9.450 -2.895 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.696 -10.445 -2.676 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.411 -6.174 -4.243 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.729 -7.337 -5.553 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.713 -7.525 -4.527 1.00 0.00 H new ATOM 18 N LEU A 2 -2.139 -10.104 -7.392 1.00 0.00 N ATOM 19 CA LEU A 2 -2.317 -10.463 -8.795 1.00 0.00 C ATOM 20 C LEU A 2 -1.549 -9.509 -9.703 1.00 0.00 C ATOM 21 O LEU A 2 -1.772 -8.299 -9.679 1.00 0.00 O ATOM 22 CB LEU A 2 -3.803 -10.448 -9.161 1.00 0.00 C ATOM 23 CG LEU A 2 -4.134 -10.687 -10.634 1.00 0.00 C ATOM 24 CD1 LEU A 2 -3.522 -11.995 -11.113 1.00 0.00 C ATOM 25 CD2 LEU A 2 -5.640 -10.692 -10.848 1.00 0.00 C ATOM 0 H LEU A 2 -2.461 -9.166 -7.152 1.00 0.00 H new ATOM 0 HA LEU A 2 -1.923 -11.469 -8.940 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.310 -11.208 -8.567 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.219 -9.484 -8.868 1.00 0.00 H new ATOM 0 HG LEU A 2 -3.706 -9.873 -11.219 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -3.768 -12.149 -12.164 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -2.439 -11.954 -10.996 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -3.920 -12.821 -10.523 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -5.857 -10.863 -11.902 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -6.090 -11.486 -10.251 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -6.054 -9.731 -10.544 1.00 0.00 H new ATOM 37 N MET A 3 -0.644 -10.062 -10.505 1.00 0.00 N ATOM 38 CA MET A 3 0.155 -9.260 -11.424 1.00 0.00 C ATOM 39 C MET A 3 -0.739 -8.469 -12.373 1.00 0.00 C ATOM 40 O MET A 3 -1.610 -9.033 -13.035 1.00 0.00 O ATOM 41 CB MET A 3 1.102 -10.155 -12.224 1.00 0.00 C ATOM 42 CG MET A 3 2.455 -9.518 -12.498 1.00 0.00 C ATOM 43 SD MET A 3 3.175 -10.059 -14.059 1.00 0.00 S ATOM 44 CE MET A 3 4.122 -8.609 -14.517 1.00 0.00 C ATOM 0 H MET A 3 -0.446 -11.062 -10.537 1.00 0.00 H new ATOM 0 HA MET A 3 0.743 -8.556 -10.836 1.00 0.00 H new ATOM 0 HB2 MET A 3 1.252 -11.088 -11.681 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.631 -10.411 -13.173 1.00 0.00 H new ATOM 0 HG2 MET A 3 2.346 -8.434 -12.509 1.00 0.00 H new ATOM 0 HG3 MET A 3 3.138 -9.761 -11.684 1.00 0.00 H new ATOM 0 HE1 MET A 3 3.720 -8.188 -15.439 1.00 0.00 H new ATOM 0 HE2 MET A 3 4.059 -7.867 -13.721 1.00 0.00 H new ATOM 0 HE3 MET A 3 5.164 -8.889 -14.670 1.00 0.00 H new ATOM 54 N ILE A 4 -0.518 -7.160 -12.434 1.00 0.00 N ATOM 55 CA ILE A 4 -1.303 -6.292 -13.303 1.00 0.00 C ATOM 56 C ILE A 4 -0.718 -6.249 -14.710 1.00 0.00 C ATOM 57 O ILE A 4 -1.436 -6.406 -15.699 1.00 0.00 O ATOM 58 CB ILE A 4 -1.380 -4.858 -12.746 1.00 0.00 C ATOM 59 CG1 ILE A 4 -2.134 -4.844 -11.415 1.00 0.00 C ATOM 60 CG2 ILE A 4 -2.052 -3.935 -13.751 1.00 0.00 C ATOM 61 CD1 ILE A 4 -3.514 -5.459 -11.495 1.00 0.00 C ATOM 0 H ILE A 4 0.198 -6.677 -11.892 1.00 0.00 H new ATOM 0 HA ILE A 4 -2.308 -6.711 -13.343 1.00 0.00 H new ATOM 0 HB ILE A 4 -0.366 -4.497 -12.572 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -1.548 -5.382 -10.669 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -2.224 -3.814 -11.068 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -2.099 -2.925 -13.343 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -1.477 -3.926 -14.677 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.062 -4.292 -13.954 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -3.990 -5.414 -10.515 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.117 -4.907 -12.216 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.431 -6.499 -11.811 1.00 0.00 H new ATOM 73 N THR A 5 0.591 -6.036 -14.794 1.00 0.00 N ATOM 74 CA THR A 5 1.274 -5.972 -16.080 1.00 0.00 C ATOM 75 C THR A 5 2.778 -5.806 -15.897 1.00 0.00 C ATOM 76 O THR A 5 3.284 -5.845 -14.775 1.00 0.00 O ATOM 77 CB THR A 5 0.742 -4.812 -16.942 1.00 0.00 C ATOM 78 OG1 THR A 5 1.176 -4.969 -18.298 1.00 0.00 O ATOM 79 CG2 THR A 5 1.221 -3.473 -16.403 1.00 0.00 C ATOM 0 H THR A 5 1.200 -5.905 -13.986 1.00 0.00 H new ATOM 0 HA THR A 5 1.075 -6.915 -16.590 1.00 0.00 H new ATOM 0 HB THR A 5 -0.347 -4.832 -16.905 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.832 -4.228 -18.839 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.833 -2.669 -17.028 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.864 -3.343 -15.381 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.311 -3.446 -16.412 1.00 0.00 H new ATOM 87 N SER A 6 3.488 -5.618 -17.005 1.00 0.00 N ATOM 88 CA SER A 6 4.936 -5.448 -16.966 1.00 0.00 C ATOM 89 C SER A 6 5.373 -4.302 -17.873 1.00 0.00 C ATOM 90 O SER A 6 4.741 -4.027 -18.894 1.00 0.00 O ATOM 91 CB SER A 6 5.634 -6.743 -17.388 1.00 0.00 C ATOM 92 OG SER A 6 5.605 -6.901 -18.796 1.00 0.00 O ATOM 0 H SER A 6 3.084 -5.580 -17.941 1.00 0.00 H new ATOM 0 HA SER A 6 5.222 -5.207 -15.942 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.667 -6.733 -17.041 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.146 -7.594 -16.913 1.00 0.00 H new ATOM 0 HG SER A 6 6.058 -7.734 -19.041 1.00 0.00 H new ATOM 98 N PHE A 7 6.458 -3.636 -17.493 1.00 0.00 N ATOM 99 CA PHE A 7 6.980 -2.518 -18.270 1.00 0.00 C ATOM 100 C PHE A 7 8.499 -2.604 -18.394 1.00 0.00 C ATOM 101 O PHE A 7 9.141 -3.418 -17.731 1.00 0.00 O ATOM 102 CB PHE A 7 6.584 -1.190 -17.622 1.00 0.00 C ATOM 103 CG PHE A 7 5.130 -0.853 -17.786 1.00 0.00 C ATOM 104 CD1 PHE A 7 4.671 -0.249 -18.945 1.00 0.00 C ATOM 105 CD2 PHE A 7 4.222 -1.140 -16.779 1.00 0.00 C ATOM 106 CE1 PHE A 7 3.333 0.062 -19.099 1.00 0.00 C ATOM 107 CE2 PHE A 7 2.883 -0.831 -16.927 1.00 0.00 C ATOM 108 CZ PHE A 7 2.438 -0.229 -18.088 1.00 0.00 C ATOM 0 H PHE A 7 6.993 -3.851 -16.652 1.00 0.00 H new ATOM 0 HA PHE A 7 6.548 -2.569 -19.269 1.00 0.00 H new ATOM 0 HB2 PHE A 7 6.822 -1.228 -16.559 1.00 0.00 H new ATOM 0 HB3 PHE A 7 7.185 -0.390 -18.055 1.00 0.00 H new ATOM 0 HD1 PHE A 7 5.367 -0.018 -19.738 1.00 0.00 H new ATOM 0 HD2 PHE A 7 4.564 -1.610 -15.869 1.00 0.00 H new ATOM 0 HE1 PHE A 7 2.988 0.532 -20.008 1.00 0.00 H new ATOM 0 HE2 PHE A 7 2.185 -1.060 -16.135 1.00 0.00 H new ATOM 0 HZ PHE A 7 1.392 0.014 -18.205 1.00 0.00 H new ATOM 118 N ALA A 8 9.066 -1.759 -19.248 1.00 0.00 N ATOM 119 CA ALA A 8 10.508 -1.737 -19.458 1.00 0.00 C ATOM 120 C ALA A 8 11.075 -0.340 -19.231 1.00 0.00 C ATOM 121 O ALA A 8 12.188 -0.035 -19.658 1.00 0.00 O ATOM 122 CB ALA A 8 10.844 -2.224 -20.860 1.00 0.00 C ATOM 0 H ALA A 8 8.548 -1.080 -19.806 1.00 0.00 H new ATOM 0 HA ALA A 8 10.966 -2.408 -18.732 1.00 0.00 H new ATOM 0 HB1 ALA A 8 11.924 -2.202 -21.003 1.00 0.00 H new ATOM 0 HB2 ALA A 8 10.481 -3.244 -20.988 1.00 0.00 H new ATOM 0 HB3 ALA A 8 10.367 -1.575 -21.595 1.00 0.00 H new ATOM 128 N ASN A 9 10.302 0.505 -18.557 1.00 0.00 N ATOM 129 CA ASN A 9 10.728 1.871 -18.274 1.00 0.00 C ATOM 130 C ASN A 9 10.190 2.340 -16.926 1.00 0.00 C ATOM 131 O ASN A 9 9.056 2.049 -16.546 1.00 0.00 O ATOM 132 CB ASN A 9 10.254 2.814 -19.382 1.00 0.00 C ATOM 133 CG ASN A 9 11.379 3.226 -20.311 1.00 0.00 C ATOM 134 OD1 ASN A 9 12.482 3.543 -19.866 1.00 0.00 O ATOM 135 ND2 ASN A 9 11.104 3.224 -21.610 1.00 0.00 N ATOM 0 H ASN A 9 9.378 0.268 -18.197 1.00 0.00 H new ATOM 0 HA ASN A 9 11.817 1.886 -18.235 1.00 0.00 H new ATOM 0 HB2 ASN A 9 9.470 2.326 -19.960 1.00 0.00 H new ATOM 0 HB3 ASN A 9 9.812 3.704 -18.934 1.00 0.00 H new ATOM 0 HD21 ASN A 9 11.821 3.493 -22.284 1.00 0.00 H new ATOM 0 HD22 ASN A 9 10.175 2.954 -21.934 1.00 0.00 H new ATOM 142 N PRO A 10 11.023 3.086 -16.184 1.00 0.00 N ATOM 143 CA PRO A 10 10.653 3.613 -14.867 1.00 0.00 C ATOM 144 C PRO A 10 9.595 4.708 -14.957 1.00 0.00 C ATOM 145 O PRO A 10 8.616 4.700 -14.212 1.00 0.00 O ATOM 146 CB PRO A 10 11.968 4.183 -14.331 1.00 0.00 C ATOM 147 CG PRO A 10 12.766 4.505 -15.548 1.00 0.00 C ATOM 148 CD PRO A 10 12.389 3.472 -16.574 1.00 0.00 C ATOM 0 HA PRO A 10 10.214 2.846 -14.230 1.00 0.00 H new ATOM 0 HB2 PRO A 10 11.796 5.072 -13.724 1.00 0.00 H new ATOM 0 HB3 PRO A 10 12.484 3.460 -13.699 1.00 0.00 H new ATOM 0 HG2 PRO A 10 12.544 5.510 -15.906 1.00 0.00 H new ATOM 0 HG3 PRO A 10 13.834 4.472 -15.335 1.00 0.00 H new ATOM 0 HD2 PRO A 10 12.418 3.880 -17.584 1.00 0.00 H new ATOM 0 HD3 PRO A 10 13.068 2.620 -16.555 1.00 0.00 H new ATOM 156 N ARG A 11 9.800 5.648 -15.875 1.00 0.00 N ATOM 157 CA ARG A 11 8.864 6.750 -16.061 1.00 0.00 C ATOM 158 C ARG A 11 7.439 6.230 -16.229 1.00 0.00 C ATOM 159 O ARG A 11 6.505 6.736 -15.607 1.00 0.00 O ATOM 160 CB ARG A 11 9.261 7.584 -17.281 1.00 0.00 C ATOM 161 CG ARG A 11 9.424 6.766 -18.551 1.00 0.00 C ATOM 162 CD ARG A 11 10.568 7.287 -19.407 1.00 0.00 C ATOM 163 NE ARG A 11 10.093 7.879 -20.654 1.00 0.00 N ATOM 164 CZ ARG A 11 10.887 8.486 -21.529 1.00 0.00 C ATOM 165 NH1 ARG A 11 12.188 8.580 -21.294 1.00 0.00 N ATOM 166 NH2 ARG A 11 10.380 9.000 -22.642 1.00 0.00 N ATOM 0 H ARG A 11 10.605 5.668 -16.501 1.00 0.00 H new ATOM 0 HA ARG A 11 8.901 7.379 -15.172 1.00 0.00 H new ATOM 0 HB2 ARG A 11 8.505 8.351 -17.448 1.00 0.00 H new ATOM 0 HB3 ARG A 11 10.197 8.100 -17.069 1.00 0.00 H new ATOM 0 HG2 ARG A 11 9.608 5.723 -18.292 1.00 0.00 H new ATOM 0 HG3 ARG A 11 8.497 6.794 -19.124 1.00 0.00 H new ATOM 0 HD2 ARG A 11 11.132 8.031 -18.844 1.00 0.00 H new ATOM 0 HD3 ARG A 11 11.254 6.470 -19.632 1.00 0.00 H new ATOM 0 HE ARG A 11 9.097 7.823 -20.865 1.00 0.00 H new ATOM 0 HH11 ARG A 11 12.582 8.186 -20.440 1.00 0.00 H new ATOM 0 HH12 ARG A 11 12.796 9.047 -21.968 1.00 0.00 H new ATOM 0 HH21 ARG A 11 9.379 8.929 -22.827 1.00 0.00 H new ATOM 0 HH22 ARG A 11 10.991 9.466 -23.313 1.00 0.00 H new ATOM 180 N VAL A 12 7.280 5.217 -17.076 1.00 0.00 N ATOM 181 CA VAL A 12 5.969 4.629 -17.326 1.00 0.00 C ATOM 182 C VAL A 12 5.433 3.933 -16.080 1.00 0.00 C ATOM 183 O VAL A 12 4.336 4.237 -15.611 1.00 0.00 O ATOM 184 CB VAL A 12 6.021 3.615 -18.484 1.00 0.00 C ATOM 185 CG1 VAL A 12 4.673 2.934 -18.658 1.00 0.00 C ATOM 186 CG2 VAL A 12 6.452 4.300 -19.772 1.00 0.00 C ATOM 0 H VAL A 12 8.042 4.787 -17.600 1.00 0.00 H new ATOM 0 HA VAL A 12 5.301 5.447 -17.598 1.00 0.00 H new ATOM 0 HB VAL A 12 6.759 2.850 -18.242 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.729 2.221 -19.481 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.410 2.409 -17.740 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.913 3.683 -18.878 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.483 3.569 -20.580 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.740 5.086 -20.022 1.00 0.00 H new ATOM 0 HG23 VAL A 12 7.442 4.736 -19.639 1.00 0.00 H new ATOM 196 N ALA A 13 6.213 2.999 -15.548 1.00 0.00 N ATOM 197 CA ALA A 13 5.818 2.261 -14.354 1.00 0.00 C ATOM 198 C ALA A 13 5.314 3.205 -13.268 1.00 0.00 C ATOM 199 O ALA A 13 4.162 3.118 -12.844 1.00 0.00 O ATOM 200 CB ALA A 13 6.983 1.431 -13.836 1.00 0.00 C ATOM 0 H ALA A 13 7.123 2.735 -15.925 1.00 0.00 H new ATOM 0 HA ALA A 13 5.002 1.591 -14.624 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.673 0.886 -12.945 1.00 0.00 H new ATOM 0 HB2 ALA A 13 7.295 0.723 -14.604 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.816 2.088 -13.588 1.00 0.00 H new ATOM 206 N GLN A 14 6.184 4.105 -12.822 1.00 0.00 N ATOM 207 CA GLN A 14 5.826 5.064 -11.783 1.00 0.00 C ATOM 208 C GLN A 14 4.595 5.869 -12.187 1.00 0.00 C ATOM 209 O GLN A 14 3.645 5.998 -11.416 1.00 0.00 O ATOM 210 CB GLN A 14 6.998 6.006 -11.504 1.00 0.00 C ATOM 211 CG GLN A 14 6.724 7.004 -10.390 1.00 0.00 C ATOM 212 CD GLN A 14 7.130 6.482 -9.026 1.00 0.00 C ATOM 213 OE1 GLN A 14 8.143 6.900 -8.465 1.00 0.00 O ATOM 214 NE2 GLN A 14 6.338 5.564 -8.484 1.00 0.00 N ATOM 0 H GLN A 14 7.141 4.190 -13.163 1.00 0.00 H new ATOM 0 HA GLN A 14 5.592 4.508 -10.875 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.875 5.414 -11.243 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.241 6.550 -12.417 1.00 0.00 H new ATOM 0 HG2 GLN A 14 7.262 7.929 -10.596 1.00 0.00 H new ATOM 0 HG3 GLN A 14 5.662 7.249 -10.380 1.00 0.00 H new ATOM 0 HE21 GLN A 14 5.508 5.246 -8.985 1.00 0.00 H new ATOM 0 HE22 GLN A 14 6.560 5.177 -7.567 1.00 0.00 H new ATOM 223 N ALA A 15 4.620 6.411 -13.401 1.00 0.00 N ATOM 224 CA ALA A 15 3.506 7.202 -13.907 1.00 0.00 C ATOM 225 C ALA A 15 2.190 6.442 -13.780 1.00 0.00 C ATOM 226 O ALA A 15 1.183 6.995 -13.336 1.00 0.00 O ATOM 227 CB ALA A 15 3.753 7.594 -15.357 1.00 0.00 C ATOM 0 H ALA A 15 5.400 6.316 -14.052 1.00 0.00 H new ATOM 0 HA ALA A 15 3.432 8.107 -13.304 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.913 8.185 -15.722 1.00 0.00 H new ATOM 0 HB2 ALA A 15 4.667 8.184 -15.424 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.856 6.695 -15.965 1.00 0.00 H new ATOM 233 N PHE A 16 2.205 5.173 -14.173 1.00 0.00 N ATOM 234 CA PHE A 16 1.011 4.338 -14.104 1.00 0.00 C ATOM 235 C PHE A 16 0.502 4.234 -12.669 1.00 0.00 C ATOM 236 O PHE A 16 -0.611 4.660 -12.361 1.00 0.00 O ATOM 237 CB PHE A 16 1.308 2.941 -14.655 1.00 0.00 C ATOM 238 CG PHE A 16 0.885 2.758 -16.084 1.00 0.00 C ATOM 239 CD1 PHE A 16 -0.426 2.436 -16.396 1.00 0.00 C ATOM 240 CD2 PHE A 16 1.798 2.908 -17.115 1.00 0.00 C ATOM 241 CE1 PHE A 16 -0.818 2.266 -17.711 1.00 0.00 C ATOM 242 CE2 PHE A 16 1.412 2.740 -18.432 1.00 0.00 C ATOM 243 CZ PHE A 16 0.102 2.419 -18.730 1.00 0.00 C ATOM 0 H PHE A 16 3.030 4.700 -14.542 1.00 0.00 H new ATOM 0 HA PHE A 16 0.236 4.804 -14.712 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.377 2.747 -14.573 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.801 2.200 -14.037 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -1.150 2.316 -15.603 1.00 0.00 H new ATOM 0 HD2 PHE A 16 2.823 3.159 -16.887 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -1.843 2.014 -17.941 1.00 0.00 H new ATOM 0 HE2 PHE A 16 2.134 2.860 -19.227 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.202 2.288 -19.758 1.00 0.00 H new ATOM 253 N VAL A 17 1.325 3.663 -11.796 1.00 0.00 N ATOM 254 CA VAL A 17 0.960 3.502 -10.393 1.00 0.00 C ATOM 255 C VAL A 17 0.622 4.845 -9.756 1.00 0.00 C ATOM 256 O VAL A 17 -0.092 4.907 -8.755 1.00 0.00 O ATOM 257 CB VAL A 17 2.094 2.836 -9.591 1.00 0.00 C ATOM 258 CG1 VAL A 17 2.342 1.421 -10.091 1.00 0.00 C ATOM 259 CG2 VAL A 17 3.364 3.670 -9.671 1.00 0.00 C ATOM 0 H VAL A 17 2.249 3.304 -12.035 1.00 0.00 H new ATOM 0 HA VAL A 17 0.080 2.859 -10.366 1.00 0.00 H new ATOM 0 HB VAL A 17 1.791 2.778 -8.546 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.146 0.966 -9.513 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.433 0.830 -9.976 1.00 0.00 H new ATOM 0 HG13 VAL A 17 2.624 1.451 -11.143 1.00 0.00 H new ATOM 0 HG21 VAL A 17 4.155 3.185 -9.099 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.674 3.762 -10.712 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.175 4.661 -9.260 1.00 0.00 H new ATOM 269 N ASP A 18 1.139 5.919 -10.343 1.00 0.00 N ATOM 270 CA ASP A 18 0.891 7.263 -9.834 1.00 0.00 C ATOM 271 C ASP A 18 -0.556 7.678 -10.078 1.00 0.00 C ATOM 272 O ASP A 18 -1.295 7.972 -9.138 1.00 0.00 O ATOM 273 CB ASP A 18 1.840 8.264 -10.495 1.00 0.00 C ATOM 274 CG ASP A 18 1.771 9.637 -9.854 1.00 0.00 C ATOM 275 OD1 ASP A 18 0.710 10.287 -9.959 1.00 0.00 O ATOM 276 OD2 ASP A 18 2.777 10.061 -9.248 1.00 0.00 O ATOM 0 H ASP A 18 1.733 5.885 -11.172 1.00 0.00 H new ATOM 0 HA ASP A 18 1.072 7.257 -8.759 1.00 0.00 H new ATOM 0 HB2 ASP A 18 2.861 7.888 -10.433 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.595 8.348 -11.554 1.00 0.00 H new ATOM 281 N TYR A 19 -0.954 7.700 -11.345 1.00 0.00 N ATOM 282 CA TYR A 19 -2.312 8.082 -11.713 1.00 0.00 C ATOM 283 C TYR A 19 -3.332 7.123 -11.106 1.00 0.00 C ATOM 284 O TYR A 19 -4.486 7.486 -10.883 1.00 0.00 O ATOM 285 CB TYR A 19 -2.463 8.108 -13.235 1.00 0.00 C ATOM 286 CG TYR A 19 -3.151 6.884 -13.796 1.00 0.00 C ATOM 287 CD1 TYR A 19 -4.537 6.796 -13.829 1.00 0.00 C ATOM 288 CD2 TYR A 19 -2.415 5.817 -14.296 1.00 0.00 C ATOM 289 CE1 TYR A 19 -5.170 5.679 -14.340 1.00 0.00 C ATOM 290 CE2 TYR A 19 -3.039 4.697 -14.810 1.00 0.00 C ATOM 291 CZ TYR A 19 -4.417 4.633 -14.830 1.00 0.00 C ATOM 292 OH TYR A 19 -5.043 3.520 -15.341 1.00 0.00 O ATOM 0 H TYR A 19 -0.355 7.458 -12.135 1.00 0.00 H new ATOM 0 HA TYR A 19 -2.500 9.081 -11.319 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -3.028 8.995 -13.521 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.476 8.199 -13.688 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -5.130 7.615 -13.449 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -1.336 5.864 -14.283 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.249 5.626 -14.355 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -2.452 3.876 -15.194 1.00 0.00 H new ATOM 0 HH TYR A 19 -4.369 2.877 -15.645 1.00 0.00 H new ATOM 302 N MET A 20 -2.895 5.896 -10.841 1.00 0.00 N ATOM 303 CA MET A 20 -3.768 4.884 -10.258 1.00 0.00 C ATOM 304 C MET A 20 -3.975 5.138 -8.768 1.00 0.00 C ATOM 305 O MET A 20 -5.098 5.075 -8.269 1.00 0.00 O ATOM 306 CB MET A 20 -3.180 3.488 -10.472 1.00 0.00 C ATOM 307 CG MET A 20 -3.488 2.903 -11.841 1.00 0.00 C ATOM 308 SD MET A 20 -4.897 1.778 -11.816 1.00 0.00 S ATOM 309 CE MET A 20 -6.258 2.938 -11.914 1.00 0.00 C ATOM 0 H MET A 20 -1.942 5.579 -11.021 1.00 0.00 H new ATOM 0 HA MET A 20 -4.735 4.943 -10.757 1.00 0.00 H new ATOM 0 HB2 MET A 20 -2.099 3.534 -10.340 1.00 0.00 H new ATOM 0 HB3 MET A 20 -3.567 2.818 -9.704 1.00 0.00 H new ATOM 0 HG2 MET A 20 -3.688 3.714 -12.541 1.00 0.00 H new ATOM 0 HG3 MET A 20 -2.611 2.372 -12.210 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.988 2.582 -12.641 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.733 3.025 -10.937 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.883 3.913 -12.224 1.00 0.00 H new ATOM 319 N ALA A 21 -2.885 5.424 -8.064 1.00 0.00 N ATOM 320 CA ALA A 21 -2.949 5.688 -6.632 1.00 0.00 C ATOM 321 C ALA A 21 -3.798 6.920 -6.338 1.00 0.00 C ATOM 322 O ALA A 21 -4.597 6.928 -5.401 1.00 0.00 O ATOM 323 CB ALA A 21 -1.548 5.864 -6.065 1.00 0.00 C ATOM 0 H ALA A 21 -1.947 5.479 -8.462 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.420 4.831 -6.151 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.611 6.061 -4.995 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.970 4.955 -6.234 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.058 6.703 -6.560 1.00 0.00 H new ATOM 329 N THR A 22 -3.621 7.962 -7.145 1.00 0.00 N ATOM 330 CA THR A 22 -4.370 9.200 -6.970 1.00 0.00 C ATOM 331 C THR A 22 -5.832 9.018 -7.362 1.00 0.00 C ATOM 332 O THR A 22 -6.672 9.869 -7.070 1.00 0.00 O ATOM 333 CB THR A 22 -3.765 10.345 -7.805 1.00 0.00 C ATOM 334 OG1 THR A 22 -4.444 11.572 -7.517 1.00 0.00 O ATOM 335 CG2 THR A 22 -3.865 10.041 -9.292 1.00 0.00 C ATOM 0 H THR A 22 -2.965 7.973 -7.926 1.00 0.00 H new ATOM 0 HA THR A 22 -4.310 9.460 -5.913 1.00 0.00 H new ATOM 0 HB THR A 22 -2.712 10.442 -7.540 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.359 11.379 -7.224 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.432 10.863 -9.861 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.323 9.121 -9.513 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.912 9.920 -9.569 1.00 0.00 H new ATOM 343 N GLN A 23 -6.128 7.904 -8.024 1.00 0.00 N ATOM 344 CA GLN A 23 -7.490 7.612 -8.455 1.00 0.00 C ATOM 345 C GLN A 23 -8.192 6.696 -7.458 1.00 0.00 C ATOM 346 O GLN A 23 -9.372 6.384 -7.611 1.00 0.00 O ATOM 347 CB GLN A 23 -7.481 6.965 -9.841 1.00 0.00 C ATOM 348 CG GLN A 23 -7.509 7.970 -10.982 1.00 0.00 C ATOM 349 CD GLN A 23 -8.890 8.552 -11.212 1.00 0.00 C ATOM 350 OE1 GLN A 23 -9.656 8.055 -12.038 1.00 0.00 O ATOM 351 NE2 GLN A 23 -9.215 9.612 -10.481 1.00 0.00 N ATOM 0 H GLN A 23 -5.444 7.190 -8.273 1.00 0.00 H new ATOM 0 HA GLN A 23 -8.038 8.553 -8.504 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.591 6.344 -9.937 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -8.343 6.303 -9.930 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.809 8.778 -10.767 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -7.166 7.486 -11.896 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -8.549 9.991 -9.808 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -10.131 10.047 -10.593 1.00 0.00 H new ATOM 360 N GLY A 24 -7.457 6.267 -6.436 1.00 0.00 N ATOM 361 CA GLY A 24 -8.026 5.390 -5.429 1.00 0.00 C ATOM 362 C GLY A 24 -7.619 3.943 -5.624 1.00 0.00 C ATOM 363 O GLY A 24 -8.240 3.036 -5.070 1.00 0.00 O ATOM 0 H GLY A 24 -6.478 6.511 -6.288 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.710 5.723 -4.441 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -9.113 5.466 -5.458 1.00 0.00 H new ATOM 367 N VAL A 25 -6.573 3.725 -6.415 1.00 0.00 N ATOM 368 CA VAL A 25 -6.084 2.378 -6.682 1.00 0.00 C ATOM 369 C VAL A 25 -4.588 2.272 -6.408 1.00 0.00 C ATOM 370 O VAL A 25 -3.774 2.863 -7.117 1.00 0.00 O ATOM 371 CB VAL A 25 -6.359 1.959 -8.138 1.00 0.00 C ATOM 372 CG1 VAL A 25 -5.831 0.557 -8.400 1.00 0.00 C ATOM 373 CG2 VAL A 25 -7.847 2.044 -8.444 1.00 0.00 C ATOM 0 H VAL A 25 -6.048 4.464 -6.882 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.622 1.708 -6.011 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.835 2.647 -8.801 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -6.035 0.279 -9.434 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -4.756 0.534 -8.223 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.324 -0.148 -7.731 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.024 1.745 -9.477 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.395 1.380 -7.775 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.190 3.068 -8.299 1.00 0.00 H new ATOM 383 N ILE A 26 -4.233 1.514 -5.376 1.00 0.00 N ATOM 384 CA ILE A 26 -2.835 1.329 -5.009 1.00 0.00 C ATOM 385 C ILE A 26 -2.183 0.244 -5.859 1.00 0.00 C ATOM 386 O ILE A 26 -2.746 -0.836 -6.045 1.00 0.00 O ATOM 387 CB ILE A 26 -2.687 0.959 -3.521 1.00 0.00 C ATOM 388 CG1 ILE A 26 -3.253 2.073 -2.638 1.00 0.00 C ATOM 389 CG2 ILE A 26 -1.227 0.698 -3.183 1.00 0.00 C ATOM 390 CD1 ILE A 26 -2.590 3.415 -2.858 1.00 0.00 C ATOM 0 H ILE A 26 -4.895 1.018 -4.779 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.333 2.279 -5.189 1.00 0.00 H new ATOM 0 HB ILE A 26 -3.252 0.047 -3.330 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.322 2.169 -2.829 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.141 1.789 -1.592 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -1.139 0.438 -2.128 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.854 -0.125 -3.792 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.641 1.594 -3.386 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -3.042 4.156 -2.199 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.525 3.335 -2.639 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.725 3.722 -3.895 1.00 0.00 H new ATOM 402 N LEU A 27 -0.992 0.536 -6.371 1.00 0.00 N ATOM 403 CA LEU A 27 -0.261 -0.416 -7.200 1.00 0.00 C ATOM 404 C LEU A 27 1.188 -0.537 -6.741 1.00 0.00 C ATOM 405 O LEU A 27 1.701 0.329 -6.030 1.00 0.00 O ATOM 406 CB LEU A 27 -0.309 0.013 -8.667 1.00 0.00 C ATOM 407 CG LEU A 27 -1.632 -0.230 -9.395 1.00 0.00 C ATOM 408 CD1 LEU A 27 -1.520 0.177 -10.856 1.00 0.00 C ATOM 409 CD2 LEU A 27 -2.046 -1.689 -9.276 1.00 0.00 C ATOM 0 H LEU A 27 -0.512 1.424 -6.227 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.738 -1.391 -7.097 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -0.078 1.077 -8.721 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.480 -0.513 -9.204 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.401 0.384 -8.926 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -2.471 -0.003 -11.358 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.270 1.236 -10.921 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.738 -0.410 -11.338 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.989 -1.843 -9.800 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.277 -2.323 -9.718 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.168 -1.948 -8.224 1.00 0.00 H new ATOM 421 N THR A 28 1.846 -1.616 -7.153 1.00 0.00 N ATOM 422 CA THR A 28 3.237 -1.850 -6.785 1.00 0.00 C ATOM 423 C THR A 28 4.096 -2.108 -8.018 1.00 0.00 C ATOM 424 O THR A 28 3.628 -2.682 -9.002 1.00 0.00 O ATOM 425 CB THR A 28 3.370 -3.044 -5.822 1.00 0.00 C ATOM 426 OG1 THR A 28 2.076 -3.448 -5.361 1.00 0.00 O ATOM 427 CG2 THR A 28 4.248 -2.685 -4.633 1.00 0.00 C ATOM 0 H THR A 28 1.438 -2.342 -7.742 1.00 0.00 H new ATOM 0 HA THR A 28 3.587 -0.948 -6.284 1.00 0.00 H new ATOM 0 HB THR A 28 3.836 -3.868 -6.362 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.568 -3.831 -6.106 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.327 -3.544 -3.967 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.241 -2.406 -4.985 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.806 -1.847 -4.094 1.00 0.00 H new ATOM 435 N ILE A 29 5.353 -1.682 -7.958 1.00 0.00 N ATOM 436 CA ILE A 29 6.276 -1.870 -9.069 1.00 0.00 C ATOM 437 C ILE A 29 7.539 -2.597 -8.619 1.00 0.00 C ATOM 438 O ILE A 29 8.015 -2.399 -7.501 1.00 0.00 O ATOM 439 CB ILE A 29 6.672 -0.524 -9.705 1.00 0.00 C ATOM 440 CG1 ILE A 29 5.443 0.165 -10.302 1.00 0.00 C ATOM 441 CG2 ILE A 29 7.737 -0.735 -10.771 1.00 0.00 C ATOM 442 CD1 ILE A 29 4.844 -0.579 -11.475 1.00 0.00 C ATOM 0 H ILE A 29 5.755 -1.204 -7.151 1.00 0.00 H new ATOM 0 HA ILE A 29 5.756 -2.476 -9.811 1.00 0.00 H new ATOM 0 HB ILE A 29 7.085 0.120 -8.928 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.685 0.275 -9.526 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.719 1.170 -10.622 1.00 0.00 H new ATOM 0 HG21 ILE A 29 8.006 0.225 -11.211 1.00 0.00 H new ATOM 0 HG22 ILE A 29 8.620 -1.187 -10.319 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.349 -1.394 -11.548 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.977 -0.033 -11.848 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.586 -0.666 -12.268 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.536 -1.575 -11.156 1.00 0.00 H new ATOM 454 N GLN A 30 8.076 -3.438 -9.497 1.00 0.00 N ATOM 455 CA GLN A 30 9.284 -4.194 -9.189 1.00 0.00 C ATOM 456 C GLN A 30 10.371 -3.930 -10.226 1.00 0.00 C ATOM 457 O GLN A 30 10.315 -4.447 -11.341 1.00 0.00 O ATOM 458 CB GLN A 30 8.973 -5.690 -9.128 1.00 0.00 C ATOM 459 CG GLN A 30 8.798 -6.219 -7.714 1.00 0.00 C ATOM 460 CD GLN A 30 9.815 -7.286 -7.360 1.00 0.00 C ATOM 461 OE1 GLN A 30 9.724 -8.424 -7.821 1.00 0.00 O ATOM 462 NE2 GLN A 30 10.792 -6.924 -6.536 1.00 0.00 N ATOM 0 H GLN A 30 7.694 -3.613 -10.426 1.00 0.00 H new ATOM 0 HA GLN A 30 9.649 -3.866 -8.216 1.00 0.00 H new ATOM 0 HB2 GLN A 30 8.063 -5.887 -9.695 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.778 -6.240 -9.615 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.883 -5.393 -7.008 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.794 -6.629 -7.605 1.00 0.00 H new ATOM 0 HE21 GLN A 30 10.829 -5.970 -6.177 1.00 0.00 H new ATOM 0 HE22 GLN A 30 11.505 -7.600 -6.262 1.00 0.00 H new ATOM 471 N GLN A 31 11.357 -3.122 -9.850 1.00 0.00 N ATOM 472 CA GLN A 31 12.455 -2.789 -10.749 1.00 0.00 C ATOM 473 C GLN A 31 13.546 -3.854 -10.693 1.00 0.00 C ATOM 474 O GLN A 31 14.377 -3.859 -9.784 1.00 0.00 O ATOM 475 CB GLN A 31 13.041 -1.423 -10.389 1.00 0.00 C ATOM 476 CG GLN A 31 12.883 -0.384 -11.488 1.00 0.00 C ATOM 477 CD GLN A 31 13.618 0.906 -11.182 1.00 0.00 C ATOM 478 OE1 GLN A 31 13.051 1.835 -10.606 1.00 0.00 O ATOM 479 NE2 GLN A 31 14.887 0.969 -11.566 1.00 0.00 N ATOM 0 H GLN A 31 11.418 -2.686 -8.930 1.00 0.00 H new ATOM 0 HA GLN A 31 12.061 -2.751 -11.765 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.558 -1.057 -9.483 1.00 0.00 H new ATOM 0 HB3 GLN A 31 14.100 -1.540 -10.161 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.254 -0.795 -12.427 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.824 -0.169 -11.630 1.00 0.00 H new ATOM 0 HE21 GLN A 31 15.316 0.175 -12.041 1.00 0.00 H new ATOM 0 HE22 GLN A 31 15.433 1.812 -11.387 1.00 0.00 H new ATOM 536 N SER A 35 22.074 -8.673 -13.309 1.00 0.00 N ATOM 537 CA SER A 35 23.256 -8.297 -14.076 1.00 0.00 C ATOM 538 C SER A 35 23.747 -9.467 -14.924 1.00 0.00 C ATOM 539 O SER A 35 24.408 -10.377 -14.423 1.00 0.00 O ATOM 540 CB SER A 35 24.371 -7.829 -13.139 1.00 0.00 C ATOM 541 OG SER A 35 23.883 -7.635 -11.823 1.00 0.00 O ATOM 0 HA SER A 35 22.982 -7.478 -14.741 1.00 0.00 H new ATOM 0 HB2 SER A 35 25.174 -8.566 -13.128 1.00 0.00 H new ATOM 0 HB3 SER A 35 24.798 -6.898 -13.513 1.00 0.00 H new ATOM 0 HG SER A 35 22.995 -8.042 -11.740 1.00 0.00 H new ATOM 547 N ASP A 36 23.419 -9.435 -16.211 1.00 0.00 N ATOM 548 CA ASP A 36 23.827 -10.491 -17.131 1.00 0.00 C ATOM 549 C ASP A 36 25.257 -10.268 -17.614 1.00 0.00 C ATOM 550 O ASP A 36 25.602 -9.186 -18.088 1.00 0.00 O ATOM 551 CB ASP A 36 22.875 -10.551 -18.326 1.00 0.00 C ATOM 552 CG ASP A 36 21.486 -11.017 -17.937 1.00 0.00 C ATOM 553 OD1 ASP A 36 21.186 -11.039 -16.726 1.00 0.00 O ATOM 554 OD2 ASP A 36 20.699 -11.359 -18.845 1.00 0.00 O ATOM 0 H ASP A 36 22.872 -8.689 -16.641 1.00 0.00 H new ATOM 0 HA ASP A 36 23.787 -11.440 -16.597 1.00 0.00 H new ATOM 0 HB2 ASP A 36 22.809 -9.564 -18.784 1.00 0.00 H new ATOM 0 HB3 ASP A 36 23.284 -11.225 -19.079 1.00 0.00 H new ATOM 559 N VAL A 37 26.085 -11.300 -17.489 1.00 0.00 N ATOM 560 CA VAL A 37 27.478 -11.218 -17.913 1.00 0.00 C ATOM 561 C VAL A 37 27.673 -11.851 -19.286 1.00 0.00 C ATOM 562 O VAL A 37 27.353 -13.022 -19.492 1.00 0.00 O ATOM 563 CB VAL A 37 28.413 -11.910 -16.903 1.00 0.00 C ATOM 564 CG1 VAL A 37 29.867 -11.583 -17.211 1.00 0.00 C ATOM 565 CG2 VAL A 37 28.056 -11.504 -15.482 1.00 0.00 C ATOM 0 H VAL A 37 25.816 -12.203 -17.098 1.00 0.00 H new ATOM 0 HA VAL A 37 27.731 -10.159 -17.966 1.00 0.00 H new ATOM 0 HB VAL A 37 28.281 -12.988 -16.992 1.00 0.00 H new ATOM 0 HG11 VAL A 37 30.513 -12.080 -16.487 1.00 0.00 H new ATOM 0 HG12 VAL A 37 30.113 -11.929 -18.215 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.018 -10.505 -17.152 1.00 0.00 H new ATOM 0 HG21 VAL A 37 28.727 -12.002 -14.782 1.00 0.00 H new ATOM 0 HG22 VAL A 37 28.158 -10.424 -15.376 1.00 0.00 H new ATOM 0 HG23 VAL A 37 27.027 -11.794 -15.268 1.00 0.00 H new ATOM 575 N TRP A 38 28.200 -11.069 -20.221 1.00 0.00 N ATOM 576 CA TRP A 38 28.438 -11.554 -21.576 1.00 0.00 C ATOM 577 C TRP A 38 29.857 -11.228 -22.029 1.00 0.00 C ATOM 578 O TRP A 38 30.414 -10.192 -21.662 1.00 0.00 O ATOM 579 CB TRP A 38 27.427 -10.939 -22.545 1.00 0.00 C ATOM 580 CG TRP A 38 26.856 -9.640 -22.063 1.00 0.00 C ATOM 581 CD1 TRP A 38 26.162 -9.429 -20.905 1.00 0.00 C ATOM 582 CD2 TRP A 38 26.928 -8.373 -22.726 1.00 0.00 C ATOM 583 NE1 TRP A 38 25.799 -8.107 -20.809 1.00 0.00 N ATOM 584 CE2 TRP A 38 26.258 -7.438 -21.913 1.00 0.00 C ATOM 585 CE3 TRP A 38 27.495 -7.937 -23.926 1.00 0.00 C ATOM 586 CZ2 TRP A 38 26.140 -6.096 -22.264 1.00 0.00 C ATOM 587 CZ3 TRP A 38 27.377 -6.605 -24.274 1.00 0.00 C ATOM 588 CH2 TRP A 38 26.704 -5.697 -23.445 1.00 0.00 C ATOM 0 H TRP A 38 28.470 -10.098 -20.066 1.00 0.00 H new ATOM 0 HA TRP A 38 28.316 -12.637 -21.574 1.00 0.00 H new ATOM 0 HB2 TRP A 38 27.909 -10.780 -23.509 1.00 0.00 H new ATOM 0 HB3 TRP A 38 26.614 -11.647 -22.708 1.00 0.00 H new ATOM 0 HD1 TRP A 38 25.933 -10.189 -20.173 1.00 0.00 H new ATOM 0 HE1 TRP A 38 25.273 -7.691 -20.040 1.00 0.00 H new ATOM 0 HE3 TRP A 38 28.017 -8.629 -24.571 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 25.622 -5.395 -21.627 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 27.811 -6.258 -25.200 1.00 0.00 H new ATOM 0 HH2 TRP A 38 26.629 -4.662 -23.744 1.00 0.00 H new ATOM 599 N LEU A 39 30.437 -12.117 -22.828 1.00 0.00 N ATOM 600 CA LEU A 39 31.793 -11.923 -23.332 1.00 0.00 C ATOM 601 C LEU A 39 31.796 -11.796 -24.852 1.00 0.00 C ATOM 602 O LEU A 39 30.896 -12.294 -25.528 1.00 0.00 O ATOM 603 CB LEU A 39 32.688 -13.086 -22.903 1.00 0.00 C ATOM 604 CG LEU A 39 34.101 -13.097 -23.488 1.00 0.00 C ATOM 605 CD1 LEU A 39 34.893 -11.897 -22.993 1.00 0.00 C ATOM 606 CD2 LEU A 39 34.816 -14.393 -23.134 1.00 0.00 C ATOM 0 H LEU A 39 29.990 -12.979 -23.141 1.00 0.00 H new ATOM 0 HA LEU A 39 32.183 -10.997 -22.909 1.00 0.00 H new ATOM 0 HB2 LEU A 39 32.767 -13.076 -21.816 1.00 0.00 H new ATOM 0 HB3 LEU A 39 32.195 -14.018 -23.178 1.00 0.00 H new ATOM 0 HG LEU A 39 34.024 -13.033 -24.573 1.00 0.00 H new ATOM 0 HD11 LEU A 39 35.896 -11.922 -23.420 1.00 0.00 H new ATOM 0 HD12 LEU A 39 34.391 -10.979 -23.298 1.00 0.00 H new ATOM 0 HD13 LEU A 39 34.961 -11.929 -21.906 1.00 0.00 H new ATOM 0 HD21 LEU A 39 35.820 -14.383 -23.559 1.00 0.00 H new ATOM 0 HD22 LEU A 39 34.882 -14.488 -22.050 1.00 0.00 H new ATOM 0 HD23 LEU A 39 34.259 -15.238 -23.539 1.00 0.00 H new ATOM 618 N ALA A 40 32.815 -11.128 -25.383 1.00 0.00 N ATOM 619 CA ALA A 40 32.938 -10.940 -26.823 1.00 0.00 C ATOM 620 C ALA A 40 33.994 -11.870 -27.410 1.00 0.00 C ATOM 621 O ALA A 40 33.892 -12.293 -28.561 1.00 0.00 O ATOM 622 CB ALA A 40 33.274 -9.491 -27.139 1.00 0.00 C ATOM 0 H ALA A 40 33.567 -10.708 -24.837 1.00 0.00 H new ATOM 0 HA ALA A 40 31.980 -11.187 -27.280 1.00 0.00 H new ATOM 0 HB1 ALA A 40 33.363 -9.365 -28.218 1.00 0.00 H new ATOM 0 HB2 ALA A 40 32.482 -8.843 -26.762 1.00 0.00 H new ATOM 0 HB3 ALA A 40 34.218 -9.224 -26.664 1.00 0.00 H new ATOM 628 N ASP A 41 35.009 -12.184 -26.611 1.00 0.00 N ATOM 629 CA ASP A 41 36.084 -13.065 -27.052 1.00 0.00 C ATOM 630 C ASP A 41 35.770 -14.518 -26.712 1.00 0.00 C ATOM 631 O ASP A 41 36.095 -14.995 -25.625 1.00 0.00 O ATOM 632 CB ASP A 41 37.408 -12.651 -26.406 1.00 0.00 C ATOM 633 CG ASP A 41 38.435 -12.202 -27.427 1.00 0.00 C ATOM 634 OD1 ASP A 41 38.646 -12.934 -28.418 1.00 0.00 O ATOM 635 OD2 ASP A 41 39.026 -11.120 -27.236 1.00 0.00 O ATOM 0 H ASP A 41 35.109 -11.842 -25.655 1.00 0.00 H new ATOM 0 HA ASP A 41 36.173 -12.976 -28.135 1.00 0.00 H new ATOM 0 HB2 ASP A 41 37.226 -11.842 -25.698 1.00 0.00 H new ATOM 0 HB3 ASP A 41 37.809 -13.489 -25.836 1.00 0.00 H new ATOM 640 N GLU A 42 35.136 -15.217 -27.649 1.00 0.00 N ATOM 641 CA GLU A 42 34.777 -16.615 -27.446 1.00 0.00 C ATOM 642 C GLU A 42 35.970 -17.414 -26.931 1.00 0.00 C ATOM 643 O GLU A 42 35.831 -18.257 -26.045 1.00 0.00 O ATOM 644 CB GLU A 42 34.264 -17.227 -28.752 1.00 0.00 C ATOM 645 CG GLU A 42 32.870 -16.762 -29.136 1.00 0.00 C ATOM 646 CD GLU A 42 32.426 -17.300 -30.482 1.00 0.00 C ATOM 647 OE1 GLU A 42 31.948 -18.453 -30.531 1.00 0.00 O ATOM 648 OE2 GLU A 42 32.556 -16.569 -31.487 1.00 0.00 O ATOM 0 H GLU A 42 34.861 -14.838 -28.555 1.00 0.00 H new ATOM 0 HA GLU A 42 33.985 -16.656 -26.698 1.00 0.00 H new ATOM 0 HB2 GLU A 42 34.956 -16.977 -29.557 1.00 0.00 H new ATOM 0 HB3 GLU A 42 34.263 -18.313 -28.659 1.00 0.00 H new ATOM 0 HG2 GLU A 42 32.162 -17.079 -28.371 1.00 0.00 H new ATOM 0 HG3 GLU A 42 32.848 -15.672 -29.159 1.00 0.00 H new ATOM 655 N SER A 43 37.144 -17.143 -27.493 1.00 0.00 N ATOM 656 CA SER A 43 38.361 -17.839 -27.095 1.00 0.00 C ATOM 657 C SER A 43 38.571 -17.747 -25.587 1.00 0.00 C ATOM 658 O SER A 43 39.037 -18.695 -24.955 1.00 0.00 O ATOM 659 CB SER A 43 39.571 -17.255 -27.827 1.00 0.00 C ATOM 660 OG SER A 43 40.620 -18.203 -27.917 1.00 0.00 O ATOM 0 H SER A 43 37.277 -16.446 -28.226 1.00 0.00 H new ATOM 0 HA SER A 43 38.254 -18.889 -27.366 1.00 0.00 H new ATOM 0 HB2 SER A 43 39.276 -16.938 -28.827 1.00 0.00 H new ATOM 0 HB3 SER A 43 39.923 -16.367 -27.302 1.00 0.00 H new ATOM 0 HG SER A 43 41.380 -17.805 -28.390 1.00 0.00 H new ATOM 666 N GLN A 44 38.225 -16.597 -25.017 1.00 0.00 N ATOM 667 CA GLN A 44 38.376 -16.379 -23.583 1.00 0.00 C ATOM 668 C GLN A 44 37.151 -16.881 -22.824 1.00 0.00 C ATOM 669 O GLN A 44 37.183 -17.028 -21.603 1.00 0.00 O ATOM 670 CB GLN A 44 38.598 -14.894 -23.292 1.00 0.00 C ATOM 671 CG GLN A 44 40.063 -14.515 -23.147 1.00 0.00 C ATOM 672 CD GLN A 44 40.947 -15.203 -24.168 1.00 0.00 C ATOM 673 OE1 GLN A 44 40.768 -15.037 -25.375 1.00 0.00 O ATOM 674 NE2 GLN A 44 41.910 -15.983 -23.689 1.00 0.00 N ATOM 0 H GLN A 44 37.838 -15.802 -25.526 1.00 0.00 H new ATOM 0 HA GLN A 44 39.246 -16.942 -23.245 1.00 0.00 H new ATOM 0 HB2 GLN A 44 38.157 -14.305 -24.096 1.00 0.00 H new ATOM 0 HB3 GLN A 44 38.070 -14.629 -22.376 1.00 0.00 H new ATOM 0 HG2 GLN A 44 40.167 -13.435 -23.251 1.00 0.00 H new ATOM 0 HG3 GLN A 44 40.404 -14.773 -22.144 1.00 0.00 H new ATOM 0 HE21 GLN A 44 42.023 -16.093 -22.681 1.00 0.00 H new ATOM 0 HE22 GLN A 44 42.536 -16.472 -24.329 1.00 0.00 H new ATOM 683 N ALA A 45 36.073 -17.141 -23.557 1.00 0.00 N ATOM 684 CA ALA A 45 34.839 -17.627 -22.953 1.00 0.00 C ATOM 685 C ALA A 45 35.097 -18.858 -22.091 1.00 0.00 C ATOM 686 O ALA A 45 34.365 -19.124 -21.138 1.00 0.00 O ATOM 687 CB ALA A 45 33.812 -17.942 -24.031 1.00 0.00 C ATOM 0 H ALA A 45 36.030 -17.023 -24.569 1.00 0.00 H new ATOM 0 HA ALA A 45 34.445 -16.841 -22.309 1.00 0.00 H new ATOM 0 HB1 ALA A 45 32.895 -18.304 -23.566 1.00 0.00 H new ATOM 0 HB2 ALA A 45 33.597 -17.040 -24.603 1.00 0.00 H new ATOM 0 HB3 ALA A 45 34.208 -18.708 -24.698 1.00 0.00 H new ATOM 693 N GLU A 46 36.143 -19.605 -22.432 1.00 0.00 N ATOM 694 CA GLU A 46 36.495 -20.809 -21.688 1.00 0.00 C ATOM 695 C GLU A 46 37.228 -20.456 -20.397 1.00 0.00 C ATOM 696 O GLU A 46 36.845 -20.897 -19.313 1.00 0.00 O ATOM 697 CB GLU A 46 37.367 -21.728 -22.547 1.00 0.00 C ATOM 698 CG GLU A 46 36.719 -22.127 -23.862 1.00 0.00 C ATOM 699 CD GLU A 46 37.731 -22.584 -24.896 1.00 0.00 C ATOM 700 OE1 GLU A 46 38.908 -22.181 -24.791 1.00 0.00 O ATOM 701 OE2 GLU A 46 37.345 -23.343 -25.809 1.00 0.00 O ATOM 0 H GLU A 46 36.760 -19.398 -23.217 1.00 0.00 H new ATOM 0 HA GLU A 46 35.573 -21.330 -21.431 1.00 0.00 H new ATOM 0 HB2 GLU A 46 38.313 -21.228 -22.755 1.00 0.00 H new ATOM 0 HB3 GLU A 46 37.601 -22.628 -21.979 1.00 0.00 H new ATOM 0 HG2 GLU A 46 36.003 -22.928 -23.681 1.00 0.00 H new ATOM 0 HG3 GLU A 46 36.158 -21.281 -24.258 1.00 0.00 H new ATOM 708 N ARG A 47 38.284 -19.658 -20.522 1.00 0.00 N ATOM 709 CA ARG A 47 39.071 -19.247 -19.366 1.00 0.00 C ATOM 710 C ARG A 47 38.203 -18.507 -18.352 1.00 0.00 C ATOM 711 O ARG A 47 38.400 -18.631 -17.143 1.00 0.00 O ATOM 712 CB ARG A 47 40.234 -18.355 -19.805 1.00 0.00 C ATOM 713 CG ARG A 47 39.869 -16.882 -19.900 1.00 0.00 C ATOM 714 CD ARG A 47 40.136 -16.157 -18.591 1.00 0.00 C ATOM 715 NE ARG A 47 41.513 -15.679 -18.500 1.00 0.00 N ATOM 716 CZ ARG A 47 42.112 -15.375 -17.354 1.00 0.00 C ATOM 717 NH1 ARG A 47 41.458 -15.500 -16.207 1.00 0.00 N ATOM 718 NH2 ARG A 47 43.367 -14.946 -17.353 1.00 0.00 N ATOM 0 H ARG A 47 38.614 -19.284 -21.412 1.00 0.00 H new ATOM 0 HA ARG A 47 39.469 -20.144 -18.892 1.00 0.00 H new ATOM 0 HB2 ARG A 47 41.057 -18.472 -19.100 1.00 0.00 H new ATOM 0 HB3 ARG A 47 40.595 -18.695 -20.776 1.00 0.00 H new ATOM 0 HG2 ARG A 47 40.443 -16.415 -20.700 1.00 0.00 H new ATOM 0 HG3 ARG A 47 38.816 -16.783 -20.164 1.00 0.00 H new ATOM 0 HD2 ARG A 47 39.453 -15.313 -18.498 1.00 0.00 H new ATOM 0 HD3 ARG A 47 39.929 -16.827 -17.757 1.00 0.00 H new ATOM 0 HE ARG A 47 42.044 -15.573 -19.364 1.00 0.00 H new ATOM 0 HH11 ARG A 47 40.493 -15.830 -16.204 1.00 0.00 H new ATOM 0 HH12 ARG A 47 41.920 -15.266 -15.328 1.00 0.00 H new ATOM 0 HH21 ARG A 47 43.874 -14.849 -18.233 1.00 0.00 H new ATOM 0 HH22 ARG A 47 43.826 -14.713 -16.472 1.00 0.00 H new ATOM 732 N VAL A 48 37.243 -17.736 -18.853 1.00 0.00 N ATOM 733 CA VAL A 48 36.345 -16.977 -17.992 1.00 0.00 C ATOM 734 C VAL A 48 35.326 -17.890 -17.319 1.00 0.00 C ATOM 735 O VAL A 48 35.014 -17.726 -16.139 1.00 0.00 O ATOM 736 CB VAL A 48 35.597 -15.887 -18.783 1.00 0.00 C ATOM 737 CG1 VAL A 48 36.582 -14.921 -19.423 1.00 0.00 C ATOM 738 CG2 VAL A 48 34.695 -16.516 -19.834 1.00 0.00 C ATOM 0 H VAL A 48 37.068 -17.621 -19.851 1.00 0.00 H new ATOM 0 HA VAL A 48 36.963 -16.503 -17.230 1.00 0.00 H new ATOM 0 HB VAL A 48 34.971 -15.324 -18.090 1.00 0.00 H new ATOM 0 HG11 VAL A 48 36.035 -14.158 -19.977 1.00 0.00 H new ATOM 0 HG12 VAL A 48 37.182 -14.446 -18.647 1.00 0.00 H new ATOM 0 HG13 VAL A 48 37.236 -15.466 -20.104 1.00 0.00 H new ATOM 0 HG21 VAL A 48 34.174 -15.732 -20.383 1.00 0.00 H new ATOM 0 HG22 VAL A 48 35.298 -17.104 -20.526 1.00 0.00 H new ATOM 0 HG23 VAL A 48 33.966 -17.163 -19.347 1.00 0.00 H new ATOM 748 N ARG A 49 34.812 -18.853 -18.076 1.00 0.00 N ATOM 749 CA ARG A 49 33.827 -19.793 -17.553 1.00 0.00 C ATOM 750 C ARG A 49 34.394 -20.571 -16.369 1.00 0.00 C ATOM 751 O ARG A 49 33.717 -20.766 -15.360 1.00 0.00 O ATOM 752 CB ARG A 49 33.384 -20.763 -18.650 1.00 0.00 C ATOM 753 CG ARG A 49 32.024 -20.431 -19.243 1.00 0.00 C ATOM 754 CD ARG A 49 31.870 -21.009 -20.641 1.00 0.00 C ATOM 755 NE ARG A 49 30.584 -21.679 -20.817 1.00 0.00 N ATOM 756 CZ ARG A 49 30.288 -22.437 -21.867 1.00 0.00 C ATOM 757 NH1 ARG A 49 31.182 -22.621 -22.829 1.00 0.00 N ATOM 758 NH2 ARG A 49 29.096 -23.013 -21.956 1.00 0.00 N ATOM 0 H ARG A 49 35.061 -19.003 -19.054 1.00 0.00 H new ATOM 0 HA ARG A 49 32.963 -19.223 -17.211 1.00 0.00 H new ATOM 0 HB2 ARG A 49 34.128 -20.762 -19.446 1.00 0.00 H new ATOM 0 HB3 ARG A 49 33.356 -21.773 -18.241 1.00 0.00 H new ATOM 0 HG2 ARG A 49 31.239 -20.824 -18.597 1.00 0.00 H new ATOM 0 HG3 ARG A 49 31.896 -19.349 -19.279 1.00 0.00 H new ATOM 0 HD2 ARG A 49 31.966 -20.210 -21.376 1.00 0.00 H new ATOM 0 HD3 ARG A 49 32.677 -21.717 -20.832 1.00 0.00 H new ATOM 0 HE ARG A 49 29.875 -21.558 -20.094 1.00 0.00 H new ATOM 0 HH11 ARG A 49 32.099 -22.180 -22.764 1.00 0.00 H new ATOM 0 HH12 ARG A 49 30.952 -23.204 -23.634 1.00 0.00 H new ATOM 0 HH21 ARG A 49 28.406 -22.874 -21.218 1.00 0.00 H new ATOM 0 HH22 ARG A 49 28.870 -23.595 -22.763 1.00 0.00 H new ATOM 772 N ALA A 50 35.640 -21.014 -16.501 1.00 0.00 N ATOM 773 CA ALA A 50 36.299 -21.770 -15.443 1.00 0.00 C ATOM 774 C ALA A 50 36.573 -20.889 -14.229 1.00 0.00 C ATOM 775 O ALA A 50 36.129 -21.189 -13.121 1.00 0.00 O ATOM 776 CB ALA A 50 37.594 -22.380 -15.958 1.00 0.00 C ATOM 0 H ALA A 50 36.214 -20.862 -17.331 1.00 0.00 H new ATOM 0 HA ALA A 50 35.630 -22.573 -15.133 1.00 0.00 H new ATOM 0 HB1 ALA A 50 38.075 -22.942 -15.157 1.00 0.00 H new ATOM 0 HB2 ALA A 50 37.375 -23.049 -16.790 1.00 0.00 H new ATOM 0 HB3 ALA A 50 38.261 -21.587 -16.296 1.00 0.00 H new ATOM 782 N GLU A 51 37.307 -19.802 -14.445 1.00 0.00 N ATOM 783 CA GLU A 51 37.640 -18.879 -13.366 1.00 0.00 C ATOM 784 C GLU A 51 36.378 -18.370 -12.676 1.00 0.00 C ATOM 785 O GLU A 51 36.340 -18.226 -11.454 1.00 0.00 O ATOM 786 CB GLU A 51 38.451 -17.699 -13.907 1.00 0.00 C ATOM 787 CG GLU A 51 39.846 -18.082 -14.371 1.00 0.00 C ATOM 788 CD GLU A 51 40.523 -19.066 -13.436 1.00 0.00 C ATOM 789 OE1 GLU A 51 40.956 -18.643 -12.343 1.00 0.00 O ATOM 790 OE2 GLU A 51 40.620 -20.257 -13.797 1.00 0.00 O ATOM 0 H GLU A 51 37.682 -19.539 -15.356 1.00 0.00 H new ATOM 0 HA GLU A 51 38.241 -19.418 -12.633 1.00 0.00 H new ATOM 0 HB2 GLU A 51 37.911 -17.249 -14.740 1.00 0.00 H new ATOM 0 HB3 GLU A 51 38.531 -16.938 -13.131 1.00 0.00 H new ATOM 0 HG2 GLU A 51 39.786 -18.517 -15.369 1.00 0.00 H new ATOM 0 HG3 GLU A 51 40.458 -17.183 -14.451 1.00 0.00 H new ATOM 797 N LEU A 52 35.347 -18.097 -13.469 1.00 0.00 N ATOM 798 CA LEU A 52 34.082 -17.602 -12.936 1.00 0.00 C ATOM 799 C LEU A 52 33.449 -18.626 -11.999 1.00 0.00 C ATOM 800 O LEU A 52 33.087 -18.306 -10.867 1.00 0.00 O ATOM 801 CB LEU A 52 33.119 -17.274 -14.077 1.00 0.00 C ATOM 802 CG LEU A 52 31.782 -16.654 -13.670 1.00 0.00 C ATOM 803 CD1 LEU A 52 31.228 -15.793 -14.795 1.00 0.00 C ATOM 804 CD2 LEU A 52 30.786 -17.738 -13.286 1.00 0.00 C ATOM 0 H LEU A 52 35.362 -18.210 -14.483 1.00 0.00 H new ATOM 0 HA LEU A 52 34.285 -16.694 -12.368 1.00 0.00 H new ATOM 0 HB2 LEU A 52 33.620 -16.591 -14.763 1.00 0.00 H new ATOM 0 HB3 LEU A 52 32.918 -18.191 -14.631 1.00 0.00 H new ATOM 0 HG LEU A 52 31.949 -16.017 -12.801 1.00 0.00 H new ATOM 0 HD11 LEU A 52 30.276 -15.360 -14.487 1.00 0.00 H new ATOM 0 HD12 LEU A 52 31.933 -14.994 -15.023 1.00 0.00 H new ATOM 0 HD13 LEU A 52 31.077 -16.407 -15.683 1.00 0.00 H new ATOM 0 HD21 LEU A 52 29.840 -17.278 -12.999 1.00 0.00 H new ATOM 0 HD22 LEU A 52 30.624 -18.401 -14.136 1.00 0.00 H new ATOM 0 HD23 LEU A 52 31.179 -18.313 -12.447 1.00 0.00 H new ATOM 816 N ALA A 53 33.319 -19.859 -12.479 1.00 0.00 N ATOM 817 CA ALA A 53 32.734 -20.930 -11.683 1.00 0.00 C ATOM 818 C ALA A 53 33.520 -21.151 -10.395 1.00 0.00 C ATOM 819 O ALA A 53 32.959 -21.547 -9.374 1.00 0.00 O ATOM 820 CB ALA A 53 32.673 -22.217 -12.493 1.00 0.00 C ATOM 0 H ALA A 53 33.611 -20.140 -13.415 1.00 0.00 H new ATOM 0 HA ALA A 53 31.720 -20.635 -11.413 1.00 0.00 H new ATOM 0 HB1 ALA A 53 32.234 -23.009 -11.886 1.00 0.00 H new ATOM 0 HB2 ALA A 53 32.061 -22.059 -13.381 1.00 0.00 H new ATOM 0 HB3 ALA A 53 33.680 -22.506 -12.793 1.00 0.00 H new ATOM 826 N ARG A 54 34.823 -20.893 -10.452 1.00 0.00 N ATOM 827 CA ARG A 54 35.686 -21.065 -9.290 1.00 0.00 C ATOM 828 C ARG A 54 35.538 -19.894 -8.323 1.00 0.00 C ATOM 829 O ARG A 54 35.716 -20.046 -7.114 1.00 0.00 O ATOM 830 CB ARG A 54 37.146 -21.196 -9.728 1.00 0.00 C ATOM 831 CG ARG A 54 37.530 -22.603 -10.156 1.00 0.00 C ATOM 832 CD ARG A 54 38.939 -22.648 -10.726 1.00 0.00 C ATOM 833 NE ARG A 54 39.955 -22.500 -9.687 1.00 0.00 N ATOM 834 CZ ARG A 54 41.255 -22.401 -9.940 1.00 0.00 C ATOM 835 NH1 ARG A 54 41.695 -22.433 -11.190 1.00 0.00 N ATOM 836 NH2 ARG A 54 42.118 -22.269 -8.941 1.00 0.00 N ATOM 0 H ARG A 54 35.303 -20.564 -11.290 1.00 0.00 H new ATOM 0 HA ARG A 54 35.383 -21.978 -8.777 1.00 0.00 H new ATOM 0 HB2 ARG A 54 37.331 -20.511 -10.555 1.00 0.00 H new ATOM 0 HB3 ARG A 54 37.792 -20.886 -8.907 1.00 0.00 H new ATOM 0 HG2 ARG A 54 37.461 -23.276 -9.301 1.00 0.00 H new ATOM 0 HG3 ARG A 54 36.823 -22.963 -10.903 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.089 -23.593 -11.248 1.00 0.00 H new ATOM 0 HD3 ARG A 54 39.057 -21.855 -11.464 1.00 0.00 H new ATOM 0 HE ARG A 54 39.649 -22.471 -8.714 1.00 0.00 H new ATOM 0 HH11 ARG A 54 41.035 -22.534 -11.961 1.00 0.00 H new ATOM 0 HH12 ARG A 54 42.694 -22.357 -11.381 1.00 0.00 H new ATOM 0 HH21 ARG A 54 41.783 -22.244 -7.978 1.00 0.00 H new ATOM 0 HH22 ARG A 54 43.116 -22.193 -9.136 1.00 0.00 H new ATOM 850 N PHE A 55 35.210 -18.725 -8.864 1.00 0.00 N ATOM 851 CA PHE A 55 35.039 -17.527 -8.050 1.00 0.00 C ATOM 852 C PHE A 55 33.647 -17.488 -7.426 1.00 0.00 C ATOM 853 O PHE A 55 33.482 -17.093 -6.271 1.00 0.00 O ATOM 854 CB PHE A 55 35.267 -16.273 -8.896 1.00 0.00 C ATOM 855 CG PHE A 55 35.664 -15.070 -8.089 1.00 0.00 C ATOM 856 CD1 PHE A 55 36.777 -15.108 -7.265 1.00 0.00 C ATOM 857 CD2 PHE A 55 34.925 -13.900 -8.156 1.00 0.00 C ATOM 858 CE1 PHE A 55 37.144 -14.003 -6.521 1.00 0.00 C ATOM 859 CE2 PHE A 55 35.287 -12.791 -7.414 1.00 0.00 C ATOM 860 CZ PHE A 55 36.399 -12.842 -6.597 1.00 0.00 C ATOM 0 H PHE A 55 35.057 -18.582 -9.862 1.00 0.00 H new ATOM 0 HA PHE A 55 35.777 -17.554 -7.248 1.00 0.00 H new ATOM 0 HB2 PHE A 55 36.043 -16.478 -9.634 1.00 0.00 H new ATOM 0 HB3 PHE A 55 34.355 -16.046 -9.448 1.00 0.00 H new ATOM 0 HD1 PHE A 55 37.365 -16.012 -7.203 1.00 0.00 H new ATOM 0 HD2 PHE A 55 34.056 -13.854 -8.795 1.00 0.00 H new ATOM 0 HE1 PHE A 55 38.013 -14.047 -5.881 1.00 0.00 H new ATOM 0 HE2 PHE A 55 34.701 -11.886 -7.473 1.00 0.00 H new ATOM 0 HZ PHE A 55 36.686 -11.976 -6.019 1.00 0.00 H new ATOM 989 N MET B 1 29.487 -12.642 -29.624 1.00 0.00 N ATOM 990 CA MET B 1 29.197 -12.446 -28.209 1.00 0.00 C ATOM 991 C MET B 1 28.619 -13.716 -27.591 1.00 0.00 C ATOM 992 O MET B 1 27.591 -14.224 -28.040 1.00 0.00 O ATOM 993 CB MET B 1 28.219 -11.284 -28.022 1.00 0.00 C ATOM 994 CG MET B 1 28.758 -9.952 -28.518 1.00 0.00 C ATOM 995 SD MET B 1 28.776 -8.688 -27.231 1.00 0.00 S ATOM 996 CE MET B 1 29.861 -9.449 -26.026 1.00 0.00 C ATOM 0 H1 MET B 1 30.207 -11.956 -29.929 1.00 0.00 H new ATOM 0 H2 MET B 1 29.842 -13.608 -29.775 1.00 0.00 H new ATOM 0 H3 MET B 1 28.619 -12.502 -30.179 1.00 0.00 H new ATOM 0 HA MET B 1 30.133 -12.209 -27.702 1.00 0.00 H new ATOM 0 HB2 MET B 1 27.292 -11.511 -28.549 1.00 0.00 H new ATOM 0 HB3 MET B 1 27.970 -11.195 -26.964 1.00 0.00 H new ATOM 0 HG2 MET B 1 29.770 -10.093 -28.898 1.00 0.00 H new ATOM 0 HG3 MET B 1 28.149 -9.606 -29.353 1.00 0.00 H new ATOM 0 HE1 MET B 1 30.405 -8.674 -25.486 1.00 0.00 H new ATOM 0 HE2 MET B 1 29.269 -10.034 -25.322 1.00 0.00 H new ATOM 0 HE3 MET B 1 30.569 -10.102 -26.536 1.00 0.00 H new ATOM 1006 N LEU B 2 29.286 -14.223 -26.560 1.00 0.00 N ATOM 1007 CA LEU B 2 28.839 -15.434 -25.881 1.00 0.00 C ATOM 1008 C LEU B 2 28.549 -15.158 -24.409 1.00 0.00 C ATOM 1009 O LEU B 2 29.431 -14.732 -23.663 1.00 0.00 O ATOM 1010 CB LEU B 2 29.895 -16.533 -26.007 1.00 0.00 C ATOM 1011 CG LEU B 2 29.366 -17.963 -26.121 1.00 0.00 C ATOM 1012 CD1 LEU B 2 30.488 -18.920 -26.492 1.00 0.00 C ATOM 1013 CD2 LEU B 2 28.705 -18.392 -24.819 1.00 0.00 C ATOM 0 H LEU B 2 30.138 -13.814 -26.176 1.00 0.00 H new ATOM 0 HA LEU B 2 27.917 -15.768 -26.357 1.00 0.00 H new ATOM 0 HB2 LEU B 2 30.507 -16.322 -26.884 1.00 0.00 H new ATOM 0 HB3 LEU B 2 30.553 -16.478 -25.139 1.00 0.00 H new ATOM 0 HG LEU B 2 28.617 -17.991 -26.912 1.00 0.00 H new ATOM 0 HD11 LEU B 2 30.092 -19.933 -26.568 1.00 0.00 H new ATOM 0 HD12 LEU B 2 30.916 -18.625 -27.450 1.00 0.00 H new ATOM 0 HD13 LEU B 2 31.261 -18.890 -25.724 1.00 0.00 H new ATOM 0 HD21 LEU B 2 28.334 -19.412 -24.918 1.00 0.00 H new ATOM 0 HD22 LEU B 2 29.433 -18.348 -24.009 1.00 0.00 H new ATOM 0 HD23 LEU B 2 27.873 -17.724 -24.596 1.00 0.00 H new ATOM 1025 N MET B 3 27.310 -15.404 -23.998 1.00 0.00 N ATOM 1026 CA MET B 3 26.906 -15.185 -22.614 1.00 0.00 C ATOM 1027 C MET B 3 27.778 -15.994 -21.659 1.00 0.00 C ATOM 1028 O MET B 3 27.867 -17.217 -21.770 1.00 0.00 O ATOM 1029 CB MET B 3 25.435 -15.562 -22.424 1.00 0.00 C ATOM 1030 CG MET B 3 24.708 -14.684 -21.418 1.00 0.00 C ATOM 1031 SD MET B 3 23.440 -15.581 -20.503 1.00 0.00 S ATOM 1032 CE MET B 3 23.407 -14.652 -18.971 1.00 0.00 C ATOM 0 H MET B 3 26.568 -15.755 -24.603 1.00 0.00 H new ATOM 0 HA MET B 3 27.034 -14.127 -22.387 1.00 0.00 H new ATOM 0 HB2 MET B 3 24.925 -15.498 -23.385 1.00 0.00 H new ATOM 0 HB3 MET B 3 25.374 -16.601 -22.099 1.00 0.00 H new ATOM 0 HG2 MET B 3 25.431 -14.267 -20.716 1.00 0.00 H new ATOM 0 HG3 MET B 3 24.249 -13.844 -21.939 1.00 0.00 H new ATOM 0 HE1 MET B 3 23.777 -15.277 -18.158 1.00 0.00 H new ATOM 0 HE2 MET B 3 24.039 -13.769 -19.067 1.00 0.00 H new ATOM 0 HE3 MET B 3 22.384 -14.344 -18.754 1.00 0.00 H new ATOM 1042 N ILE B 4 28.419 -15.303 -20.722 1.00 0.00 N ATOM 1043 CA ILE B 4 29.282 -15.958 -19.748 1.00 0.00 C ATOM 1044 C ILE B 4 28.474 -16.499 -18.573 1.00 0.00 C ATOM 1045 O ILE B 4 28.662 -17.639 -18.147 1.00 0.00 O ATOM 1046 CB ILE B 4 30.361 -14.997 -19.215 1.00 0.00 C ATOM 1047 CG1 ILE B 4 31.286 -14.554 -20.351 1.00 0.00 C ATOM 1048 CG2 ILE B 4 31.160 -15.660 -18.103 1.00 0.00 C ATOM 1049 CD1 ILE B 4 31.858 -15.705 -21.148 1.00 0.00 C ATOM 0 H ILE B 4 28.357 -14.290 -20.617 1.00 0.00 H new ATOM 0 HA ILE B 4 29.768 -16.786 -20.264 1.00 0.00 H new ATOM 0 HB ILE B 4 29.870 -14.114 -18.806 1.00 0.00 H new ATOM 0 HG12 ILE B 4 30.734 -13.896 -21.023 1.00 0.00 H new ATOM 0 HG13 ILE B 4 32.106 -13.969 -19.934 1.00 0.00 H new ATOM 0 HG21 ILE B 4 31.918 -14.968 -17.737 1.00 0.00 H new ATOM 0 HG22 ILE B 4 30.491 -15.930 -17.286 1.00 0.00 H new ATOM 0 HG23 ILE B 4 31.644 -16.558 -18.488 1.00 0.00 H new ATOM 0 HD11 ILE B 4 32.504 -15.317 -21.936 1.00 0.00 H new ATOM 0 HD12 ILE B 4 32.438 -16.351 -20.489 1.00 0.00 H new ATOM 0 HD13 ILE B 4 31.045 -16.278 -21.594 1.00 0.00 H new ATOM 1061 N THR B 5 27.573 -15.672 -18.051 1.00 0.00 N ATOM 1062 CA THR B 5 26.735 -16.067 -16.926 1.00 0.00 C ATOM 1063 C THR B 5 25.714 -14.984 -16.594 1.00 0.00 C ATOM 1064 O THR B 5 25.638 -13.960 -17.274 1.00 0.00 O ATOM 1065 CB THR B 5 27.580 -16.361 -15.672 1.00 0.00 C ATOM 1066 OG1 THR B 5 26.786 -17.042 -14.695 1.00 0.00 O ATOM 1067 CG2 THR B 5 28.132 -15.074 -15.077 1.00 0.00 C ATOM 0 H THR B 5 27.405 -14.725 -18.390 1.00 0.00 H new ATOM 0 HA THR B 5 26.213 -16.976 -17.225 1.00 0.00 H new ATOM 0 HB THR B 5 28.417 -16.995 -15.965 1.00 0.00 H new ATOM 0 HG1 THR B 5 27.331 -17.227 -13.902 1.00 0.00 H new ATOM 0 HG21 THR B 5 28.725 -15.307 -14.193 1.00 0.00 H new ATOM 0 HG22 THR B 5 28.760 -14.573 -15.813 1.00 0.00 H new ATOM 0 HG23 THR B 5 27.307 -14.419 -14.798 1.00 0.00 H new ATOM 1075 N SER B 6 24.932 -15.216 -15.545 1.00 0.00 N ATOM 1076 CA SER B 6 23.913 -14.261 -15.125 1.00 0.00 C ATOM 1077 C SER B 6 23.949 -14.059 -13.613 1.00 0.00 C ATOM 1078 O SER B 6 23.913 -15.021 -12.846 1.00 0.00 O ATOM 1079 CB SER B 6 22.525 -14.741 -15.555 1.00 0.00 C ATOM 1080 OG SER B 6 22.019 -15.708 -14.651 1.00 0.00 O ATOM 0 H SER B 6 24.984 -16.057 -14.970 1.00 0.00 H new ATOM 0 HA SER B 6 24.124 -13.306 -15.607 1.00 0.00 H new ATOM 0 HB2 SER B 6 21.842 -13.893 -15.605 1.00 0.00 H new ATOM 0 HB3 SER B 6 22.578 -15.167 -16.557 1.00 0.00 H new ATOM 0 HG SER B 6 22.615 -15.775 -13.876 1.00 0.00 H new ATOM 1086 N PHE B 7 24.019 -12.800 -13.193 1.00 0.00 N ATOM 1087 CA PHE B 7 24.061 -12.470 -11.773 1.00 0.00 C ATOM 1088 C PHE B 7 22.846 -11.638 -11.373 1.00 0.00 C ATOM 1089 O PHE B 7 22.084 -11.183 -12.225 1.00 0.00 O ATOM 1090 CB PHE B 7 25.346 -11.708 -11.442 1.00 0.00 C ATOM 1091 CG PHE B 7 26.592 -12.529 -11.620 1.00 0.00 C ATOM 1092 CD1 PHE B 7 26.628 -13.854 -11.215 1.00 0.00 C ATOM 1093 CD2 PHE B 7 27.726 -11.976 -12.192 1.00 0.00 C ATOM 1094 CE1 PHE B 7 27.773 -14.610 -11.377 1.00 0.00 C ATOM 1095 CE2 PHE B 7 28.874 -12.728 -12.357 1.00 0.00 C ATOM 1096 CZ PHE B 7 28.897 -14.047 -11.950 1.00 0.00 C ATOM 0 H PHE B 7 24.048 -11.992 -13.815 1.00 0.00 H new ATOM 0 HA PHE B 7 24.044 -13.402 -11.208 1.00 0.00 H new ATOM 0 HB2 PHE B 7 25.409 -10.824 -12.077 1.00 0.00 H new ATOM 0 HB3 PHE B 7 25.296 -11.357 -10.411 1.00 0.00 H new ATOM 0 HD1 PHE B 7 25.752 -14.300 -10.768 1.00 0.00 H new ATOM 0 HD2 PHE B 7 27.713 -10.945 -12.513 1.00 0.00 H new ATOM 0 HE1 PHE B 7 27.789 -15.641 -11.056 1.00 0.00 H new ATOM 0 HE2 PHE B 7 29.752 -12.284 -12.804 1.00 0.00 H new ATOM 0 HZ PHE B 7 29.792 -14.638 -12.079 1.00 0.00 H new ATOM 1106 N ALA B 8 22.673 -11.443 -10.069 1.00 0.00 N ATOM 1107 CA ALA B 8 21.553 -10.665 -9.555 1.00 0.00 C ATOM 1108 C ALA B 8 22.025 -9.623 -8.548 1.00 0.00 C ATOM 1109 O ALA B 8 21.327 -9.318 -7.582 1.00 0.00 O ATOM 1110 CB ALA B 8 20.519 -11.584 -8.921 1.00 0.00 C ATOM 0 H ALA B 8 23.295 -11.813 -9.350 1.00 0.00 H new ATOM 0 HA ALA B 8 21.092 -10.141 -10.392 1.00 0.00 H new ATOM 0 HB1 ALA B 8 19.688 -10.990 -8.541 1.00 0.00 H new ATOM 0 HB2 ALA B 8 20.151 -12.287 -9.668 1.00 0.00 H new ATOM 0 HB3 ALA B 8 20.977 -12.134 -8.099 1.00 0.00 H new ATOM 1116 N ASN B 9 23.215 -9.079 -8.780 1.00 0.00 N ATOM 1117 CA ASN B 9 23.781 -8.071 -7.891 1.00 0.00 C ATOM 1118 C ASN B 9 24.883 -7.283 -8.594 1.00 0.00 C ATOM 1119 O ASN B 9 25.680 -7.828 -9.358 1.00 0.00 O ATOM 1120 CB ASN B 9 24.338 -8.729 -6.627 1.00 0.00 C ATOM 1121 CG ASN B 9 23.456 -8.494 -5.416 1.00 0.00 C ATOM 1122 OD1 ASN B 9 22.977 -7.382 -5.190 1.00 0.00 O ATOM 1123 ND2 ASN B 9 23.237 -9.542 -4.631 1.00 0.00 N ATOM 0 H ASN B 9 23.806 -9.319 -9.576 1.00 0.00 H new ATOM 0 HA ASN B 9 22.985 -7.381 -7.613 1.00 0.00 H new ATOM 0 HB2 ASN B 9 24.442 -9.801 -6.795 1.00 0.00 H new ATOM 0 HB3 ASN B 9 25.336 -8.339 -6.427 1.00 0.00 H new ATOM 0 HD21 ASN B 9 22.651 -9.444 -3.802 1.00 0.00 H new ATOM 0 HD22 ASN B 9 23.655 -10.445 -4.857 1.00 0.00 H new ATOM 1130 N PRO B 10 24.930 -5.969 -8.330 1.00 0.00 N ATOM 1131 CA PRO B 10 25.930 -5.077 -8.926 1.00 0.00 C ATOM 1132 C PRO B 10 27.333 -5.336 -8.387 1.00 0.00 C ATOM 1133 O PRO B 10 28.291 -5.447 -9.151 1.00 0.00 O ATOM 1134 CB PRO B 10 25.449 -3.682 -8.519 1.00 0.00 C ATOM 1135 CG PRO B 10 24.658 -3.902 -7.276 1.00 0.00 C ATOM 1136 CD PRO B 10 24.012 -5.252 -7.429 1.00 0.00 C ATOM 0 HA PRO B 10 26.010 -5.217 -10.004 1.00 0.00 H new ATOM 0 HB2 PRO B 10 26.289 -3.010 -8.340 1.00 0.00 H new ATOM 0 HB3 PRO B 10 24.840 -3.229 -9.301 1.00 0.00 H new ATOM 0 HG2 PRO B 10 25.300 -3.874 -6.395 1.00 0.00 H new ATOM 0 HG3 PRO B 10 23.907 -3.122 -7.148 1.00 0.00 H new ATOM 0 HD2 PRO B 10 23.911 -5.760 -6.470 1.00 0.00 H new ATOM 0 HD3 PRO B 10 23.012 -5.173 -7.854 1.00 0.00 H new ATOM 1144 N ARG B 11 27.445 -5.432 -7.066 1.00 0.00 N ATOM 1145 CA ARG B 11 28.731 -5.677 -6.424 1.00 0.00 C ATOM 1146 C ARG B 11 29.422 -6.892 -7.037 1.00 0.00 C ATOM 1147 O ARG B 11 30.614 -6.854 -7.342 1.00 0.00 O ATOM 1148 CB ARG B 11 28.543 -5.888 -4.921 1.00 0.00 C ATOM 1149 CG ARG B 11 27.539 -6.977 -4.580 1.00 0.00 C ATOM 1150 CD ARG B 11 26.725 -6.617 -3.347 1.00 0.00 C ATOM 1151 NE ARG B 11 26.958 -7.549 -2.246 1.00 0.00 N ATOM 1152 CZ ARG B 11 26.455 -7.387 -1.027 1.00 0.00 C ATOM 1153 NH1 ARG B 11 25.695 -6.336 -0.755 1.00 0.00 N ATOM 1154 NH2 ARG B 11 26.712 -8.278 -0.079 1.00 0.00 N ATOM 0 H ARG B 11 26.661 -5.344 -6.420 1.00 0.00 H new ATOM 0 HA ARG B 11 29.361 -4.802 -6.585 1.00 0.00 H new ATOM 0 HB2 ARG B 11 29.505 -6.140 -4.475 1.00 0.00 H new ATOM 0 HB3 ARG B 11 28.218 -4.951 -4.469 1.00 0.00 H new ATOM 0 HG2 ARG B 11 26.870 -7.135 -5.426 1.00 0.00 H new ATOM 0 HG3 ARG B 11 28.064 -7.917 -4.409 1.00 0.00 H new ATOM 0 HD2 ARG B 11 26.980 -5.607 -3.027 1.00 0.00 H new ATOM 0 HD3 ARG B 11 25.665 -6.613 -3.601 1.00 0.00 H new ATOM 0 HE ARG B 11 27.539 -8.369 -2.423 1.00 0.00 H new ATOM 0 HH11 ARG B 11 25.495 -5.649 -1.482 1.00 0.00 H new ATOM 0 HH12 ARG B 11 25.310 -6.214 0.182 1.00 0.00 H new ATOM 0 HH21 ARG B 11 27.296 -9.088 -0.285 1.00 0.00 H new ATOM 0 HH22 ARG B 11 26.326 -8.153 0.857 1.00 0.00 H new ATOM 1168 N VAL B 12 28.664 -7.970 -7.215 1.00 0.00 N ATOM 1169 CA VAL B 12 29.202 -9.196 -7.792 1.00 0.00 C ATOM 1170 C VAL B 12 29.552 -9.004 -9.263 1.00 0.00 C ATOM 1171 O VAL B 12 30.683 -9.250 -9.680 1.00 0.00 O ATOM 1172 CB VAL B 12 28.205 -10.362 -7.660 1.00 0.00 C ATOM 1173 CG1 VAL B 12 28.757 -11.614 -8.325 1.00 0.00 C ATOM 1174 CG2 VAL B 12 27.881 -10.624 -6.197 1.00 0.00 C ATOM 0 H VAL B 12 27.676 -8.019 -6.968 1.00 0.00 H new ATOM 0 HA VAL B 12 30.108 -9.437 -7.235 1.00 0.00 H new ATOM 0 HB VAL B 12 27.281 -10.086 -8.169 1.00 0.00 H new ATOM 0 HG11 VAL B 12 28.039 -12.428 -8.222 1.00 0.00 H new ATOM 0 HG12 VAL B 12 28.933 -11.417 -9.383 1.00 0.00 H new ATOM 0 HG13 VAL B 12 29.696 -11.896 -7.848 1.00 0.00 H new ATOM 0 HG21 VAL B 12 27.175 -11.451 -6.123 1.00 0.00 H new ATOM 0 HG22 VAL B 12 28.796 -10.879 -5.662 1.00 0.00 H new ATOM 0 HG23 VAL B 12 27.440 -9.730 -5.756 1.00 0.00 H new ATOM 1184 N ALA B 13 28.573 -8.562 -10.045 1.00 0.00 N ATOM 1185 CA ALA B 13 28.778 -8.334 -11.470 1.00 0.00 C ATOM 1186 C ALA B 13 30.026 -7.494 -11.718 1.00 0.00 C ATOM 1187 O ALA B 13 30.948 -7.926 -12.409 1.00 0.00 O ATOM 1188 CB ALA B 13 27.557 -7.660 -12.078 1.00 0.00 C ATOM 0 H ALA B 13 27.630 -8.355 -9.716 1.00 0.00 H new ATOM 0 HA ALA B 13 28.922 -9.302 -11.950 1.00 0.00 H new ATOM 0 HB1 ALA B 13 27.724 -7.496 -13.143 1.00 0.00 H new ATOM 0 HB2 ALA B 13 26.684 -8.298 -11.942 1.00 0.00 H new ATOM 0 HB3 ALA B 13 27.387 -6.703 -11.586 1.00 0.00 H new ATOM 1194 N GLN B 14 30.047 -6.292 -11.150 1.00 0.00 N ATOM 1195 CA GLN B 14 31.183 -5.392 -11.312 1.00 0.00 C ATOM 1196 C GLN B 14 32.473 -6.051 -10.835 1.00 0.00 C ATOM 1197 O GLN B 14 33.490 -6.018 -11.527 1.00 0.00 O ATOM 1198 CB GLN B 14 30.945 -4.093 -10.539 1.00 0.00 C ATOM 1199 CG GLN B 14 32.068 -3.080 -10.690 1.00 0.00 C ATOM 1200 CD GLN B 14 31.881 -2.177 -11.893 1.00 0.00 C ATOM 1201 OE1 GLN B 14 31.488 -1.018 -11.759 1.00 0.00 O ATOM 1202 NE2 GLN B 14 32.162 -2.704 -13.079 1.00 0.00 N ATOM 0 H GLN B 14 29.292 -5.920 -10.575 1.00 0.00 H new ATOM 0 HA GLN B 14 31.284 -5.163 -12.373 1.00 0.00 H new ATOM 0 HB2 GLN B 14 30.013 -3.643 -10.880 1.00 0.00 H new ATOM 0 HB3 GLN B 14 30.818 -4.327 -9.482 1.00 0.00 H new ATOM 0 HG2 GLN B 14 32.126 -2.470 -9.788 1.00 0.00 H new ATOM 0 HG3 GLN B 14 33.018 -3.607 -10.780 1.00 0.00 H new ATOM 0 HE21 GLN B 14 32.485 -3.669 -13.145 1.00 0.00 H new ATOM 0 HE22 GLN B 14 32.055 -2.144 -13.924 1.00 0.00 H new ATOM 1211 N ALA B 15 32.423 -6.649 -9.650 1.00 0.00 N ATOM 1212 CA ALA B 15 33.587 -7.318 -9.082 1.00 0.00 C ATOM 1213 C ALA B 15 34.155 -8.349 -10.051 1.00 0.00 C ATOM 1214 O ALA B 15 35.365 -8.408 -10.272 1.00 0.00 O ATOM 1215 CB ALA B 15 33.224 -7.978 -7.760 1.00 0.00 C ATOM 0 H ALA B 15 31.589 -6.684 -9.064 1.00 0.00 H new ATOM 0 HA ALA B 15 34.355 -6.566 -8.901 1.00 0.00 H new ATOM 0 HB1 ALA B 15 34.103 -8.474 -7.347 1.00 0.00 H new ATOM 0 HB2 ALA B 15 32.872 -7.220 -7.060 1.00 0.00 H new ATOM 0 HB3 ALA B 15 32.436 -8.713 -7.925 1.00 0.00 H new ATOM 1221 N PHE B 16 33.274 -9.161 -10.627 1.00 0.00 N ATOM 1222 CA PHE B 16 33.688 -10.192 -11.572 1.00 0.00 C ATOM 1223 C PHE B 16 34.419 -9.577 -12.762 1.00 0.00 C ATOM 1224 O PHE B 16 35.582 -9.890 -13.020 1.00 0.00 O ATOM 1225 CB PHE B 16 32.474 -10.985 -12.059 1.00 0.00 C ATOM 1226 CG PHE B 16 32.256 -12.268 -11.310 1.00 0.00 C ATOM 1227 CD1 PHE B 16 33.013 -13.392 -11.600 1.00 0.00 C ATOM 1228 CD2 PHE B 16 31.295 -12.351 -10.315 1.00 0.00 C ATOM 1229 CE1 PHE B 16 32.813 -14.575 -10.913 1.00 0.00 C ATOM 1230 CE2 PHE B 16 31.091 -13.530 -9.624 1.00 0.00 C ATOM 1231 CZ PHE B 16 31.852 -14.643 -9.923 1.00 0.00 C ATOM 0 H PHE B 16 32.269 -9.125 -10.456 1.00 0.00 H new ATOM 0 HA PHE B 16 34.372 -10.868 -11.058 1.00 0.00 H new ATOM 0 HB2 PHE B 16 31.583 -10.364 -11.966 1.00 0.00 H new ATOM 0 HB3 PHE B 16 32.598 -11.209 -13.119 1.00 0.00 H new ATOM 0 HD1 PHE B 16 33.768 -13.343 -12.371 1.00 0.00 H new ATOM 0 HD2 PHE B 16 30.698 -11.483 -10.077 1.00 0.00 H new ATOM 0 HE1 PHE B 16 33.407 -15.445 -11.150 1.00 0.00 H new ATOM 0 HE2 PHE B 16 30.338 -13.581 -8.852 1.00 0.00 H new ATOM 0 HZ PHE B 16 31.696 -15.565 -9.383 1.00 0.00 H new ATOM 1241 N VAL B 17 33.729 -8.700 -13.484 1.00 0.00 N ATOM 1242 CA VAL B 17 34.311 -8.040 -14.646 1.00 0.00 C ATOM 1243 C VAL B 17 35.554 -7.245 -14.261 1.00 0.00 C ATOM 1244 O VAL B 17 36.420 -6.984 -15.097 1.00 0.00 O ATOM 1245 CB VAL B 17 33.299 -7.095 -15.320 1.00 0.00 C ATOM 1246 CG1 VAL B 17 32.106 -7.878 -15.847 1.00 0.00 C ATOM 1247 CG2 VAL B 17 32.851 -6.014 -14.348 1.00 0.00 C ATOM 0 H VAL B 17 32.766 -8.430 -13.284 1.00 0.00 H new ATOM 0 HA VAL B 17 34.589 -8.825 -15.350 1.00 0.00 H new ATOM 0 HB VAL B 17 33.787 -6.611 -16.166 1.00 0.00 H new ATOM 0 HG11 VAL B 17 31.402 -7.194 -16.320 1.00 0.00 H new ATOM 0 HG12 VAL B 17 32.446 -8.611 -16.578 1.00 0.00 H new ATOM 0 HG13 VAL B 17 31.614 -8.391 -15.021 1.00 0.00 H new ATOM 0 HG21 VAL B 17 32.136 -5.355 -14.841 1.00 0.00 H new ATOM 0 HG22 VAL B 17 32.380 -6.477 -13.481 1.00 0.00 H new ATOM 0 HG23 VAL B 17 33.716 -5.434 -14.025 1.00 0.00 H new ATOM 1257 N ASP B 18 35.635 -6.862 -12.992 1.00 0.00 N ATOM 1258 CA ASP B 18 36.773 -6.098 -12.495 1.00 0.00 C ATOM 1259 C ASP B 18 38.033 -6.957 -12.463 1.00 0.00 C ATOM 1260 O ASP B 18 39.031 -6.639 -13.110 1.00 0.00 O ATOM 1261 CB ASP B 18 36.477 -5.552 -11.097 1.00 0.00 C ATOM 1262 CG ASP B 18 37.540 -4.583 -10.617 1.00 0.00 C ATOM 1263 OD1 ASP B 18 38.693 -5.019 -10.419 1.00 0.00 O ATOM 1264 OD2 ASP B 18 37.218 -3.390 -10.438 1.00 0.00 O ATOM 0 H ASP B 18 34.926 -7.068 -12.288 1.00 0.00 H new ATOM 0 HA ASP B 18 36.942 -5.263 -13.174 1.00 0.00 H new ATOM 0 HB2 ASP B 18 35.509 -5.051 -11.103 1.00 0.00 H new ATOM 0 HB3 ASP B 18 36.402 -6.382 -10.394 1.00 0.00 H new ATOM 1269 N TYR B 19 37.980 -8.047 -11.705 1.00 0.00 N ATOM 1270 CA TYR B 19 39.118 -8.951 -11.586 1.00 0.00 C ATOM 1271 C TYR B 19 39.455 -9.584 -12.933 1.00 0.00 C ATOM 1272 O TYR B 19 40.598 -9.964 -13.184 1.00 0.00 O ATOM 1273 CB TYR B 19 38.823 -10.043 -10.557 1.00 0.00 C ATOM 1274 CG TYR B 19 38.435 -11.368 -11.173 1.00 0.00 C ATOM 1275 CD1 TYR B 19 39.403 -12.272 -11.592 1.00 0.00 C ATOM 1276 CD2 TYR B 19 37.100 -11.716 -11.336 1.00 0.00 C ATOM 1277 CE1 TYR B 19 39.053 -13.483 -12.157 1.00 0.00 C ATOM 1278 CE2 TYR B 19 36.740 -12.925 -11.899 1.00 0.00 C ATOM 1279 CZ TYR B 19 37.720 -13.805 -12.308 1.00 0.00 C ATOM 1280 OH TYR B 19 37.367 -15.011 -12.869 1.00 0.00 O ATOM 0 H TYR B 19 37.161 -8.326 -11.164 1.00 0.00 H new ATOM 0 HA TYR B 19 39.978 -8.369 -11.253 1.00 0.00 H new ATOM 0 HB2 TYR B 19 39.703 -10.187 -9.931 1.00 0.00 H new ATOM 0 HB3 TYR B 19 38.018 -9.706 -9.903 1.00 0.00 H new ATOM 0 HD1 TYR B 19 40.447 -12.024 -11.474 1.00 0.00 H new ATOM 0 HD2 TYR B 19 36.330 -11.029 -11.017 1.00 0.00 H new ATOM 0 HE1 TYR B 19 39.818 -14.174 -12.479 1.00 0.00 H new ATOM 0 HE2 TYR B 19 35.697 -13.180 -12.018 1.00 0.00 H new ATOM 0 HH TYR B 19 36.390 -15.083 -12.902 1.00 0.00 H new ATOM 1290 N MET B 20 38.450 -9.692 -13.796 1.00 0.00 N ATOM 1291 CA MET B 20 38.639 -10.277 -15.118 1.00 0.00 C ATOM 1292 C MET B 20 39.380 -9.313 -16.038 1.00 0.00 C ATOM 1293 O MET B 20 40.308 -9.705 -16.746 1.00 0.00 O ATOM 1294 CB MET B 20 37.288 -10.650 -15.733 1.00 0.00 C ATOM 1295 CG MET B 20 36.769 -12.005 -15.282 1.00 0.00 C ATOM 1296 SD MET B 20 37.099 -13.309 -16.483 1.00 0.00 S ATOM 1297 CE MET B 20 38.780 -13.750 -16.050 1.00 0.00 C ATOM 0 H MET B 20 37.497 -9.382 -13.604 1.00 0.00 H new ATOM 0 HA MET B 20 39.240 -11.179 -15.006 1.00 0.00 H new ATOM 0 HB2 MET B 20 36.556 -9.885 -15.473 1.00 0.00 H new ATOM 0 HB3 MET B 20 37.379 -10.648 -16.819 1.00 0.00 H new ATOM 0 HG2 MET B 20 37.230 -12.268 -14.330 1.00 0.00 H new ATOM 0 HG3 MET B 20 35.695 -11.939 -15.109 1.00 0.00 H new ATOM 0 HE1 MET B 20 38.903 -14.831 -16.123 1.00 0.00 H new ATOM 0 HE2 MET B 20 39.473 -13.259 -16.733 1.00 0.00 H new ATOM 0 HE3 MET B 20 38.989 -13.430 -15.029 1.00 0.00 H new ATOM 1307 N ALA B 21 38.965 -8.050 -16.023 1.00 0.00 N ATOM 1308 CA ALA B 21 39.591 -7.030 -16.855 1.00 0.00 C ATOM 1309 C ALA B 21 41.050 -6.821 -16.462 1.00 0.00 C ATOM 1310 O ALA B 21 41.925 -6.702 -17.321 1.00 0.00 O ATOM 1311 CB ALA B 21 38.822 -5.721 -16.753 1.00 0.00 C ATOM 0 H ALA B 21 38.198 -7.709 -15.444 1.00 0.00 H new ATOM 0 HA ALA B 21 39.566 -7.374 -17.889 1.00 0.00 H new ATOM 0 HB1 ALA B 21 39.301 -4.968 -17.379 1.00 0.00 H new ATOM 0 HB2 ALA B 21 37.797 -5.874 -17.089 1.00 0.00 H new ATOM 0 HB3 ALA B 21 38.817 -5.382 -15.717 1.00 0.00 H new ATOM 1317 N THR B 22 41.307 -6.776 -15.158 1.00 0.00 N ATOM 1318 CA THR B 22 42.659 -6.579 -14.652 1.00 0.00 C ATOM 1319 C THR B 22 43.533 -7.797 -14.929 1.00 0.00 C ATOM 1320 O THR B 22 44.754 -7.740 -14.789 1.00 0.00 O ATOM 1321 CB THR B 22 42.656 -6.298 -13.138 1.00 0.00 C ATOM 1322 OG1 THR B 22 43.978 -5.966 -12.698 1.00 0.00 O ATOM 1323 CG2 THR B 22 42.147 -7.504 -12.364 1.00 0.00 C ATOM 0 H THR B 22 40.596 -6.873 -14.433 1.00 0.00 H new ATOM 0 HA THR B 22 43.069 -5.715 -15.174 1.00 0.00 H new ATOM 0 HB THR B 22 41.989 -5.457 -12.949 1.00 0.00 H new ATOM 0 HG1 THR B 22 44.635 -6.368 -13.304 1.00 0.00 H new ATOM 0 HG21 THR B 22 42.154 -7.281 -11.297 1.00 0.00 H new ATOM 0 HG22 THR B 22 41.130 -7.736 -12.679 1.00 0.00 H new ATOM 0 HG23 THR B 22 42.792 -8.361 -12.560 1.00 0.00 H new ATOM 1331 N GLN B 23 42.899 -8.897 -15.323 1.00 0.00 N ATOM 1332 CA GLN B 23 43.620 -10.129 -15.620 1.00 0.00 C ATOM 1333 C GLN B 23 43.853 -10.276 -17.120 1.00 0.00 C ATOM 1334 O GLN B 23 44.503 -11.219 -17.568 1.00 0.00 O ATOM 1335 CB GLN B 23 42.846 -11.338 -15.091 1.00 0.00 C ATOM 1336 CG GLN B 23 43.157 -11.672 -13.641 1.00 0.00 C ATOM 1337 CD GLN B 23 44.479 -12.398 -13.480 1.00 0.00 C ATOM 1338 OE1 GLN B 23 44.526 -13.628 -13.450 1.00 0.00 O ATOM 1339 NE2 GLN B 23 45.562 -11.637 -13.375 1.00 0.00 N ATOM 0 H GLN B 23 41.888 -8.960 -15.444 1.00 0.00 H new ATOM 0 HA GLN B 23 44.589 -10.081 -15.124 1.00 0.00 H new ATOM 0 HB2 GLN B 23 41.778 -11.147 -15.190 1.00 0.00 H new ATOM 0 HB3 GLN B 23 43.073 -12.205 -15.712 1.00 0.00 H new ATOM 0 HG2 GLN B 23 43.178 -10.752 -13.057 1.00 0.00 H new ATOM 0 HG3 GLN B 23 42.356 -12.289 -13.234 1.00 0.00 H new ATOM 0 HE21 GLN B 23 45.476 -10.621 -13.405 1.00 0.00 H new ATOM 0 HE22 GLN B 23 46.480 -12.068 -13.264 1.00 0.00 H new ATOM 1348 N GLY B 24 43.315 -9.336 -17.892 1.00 0.00 N ATOM 1349 CA GLY B 24 43.475 -9.380 -19.334 1.00 0.00 C ATOM 1350 C GLY B 24 42.239 -9.902 -20.038 1.00 0.00 C ATOM 1351 O GLY B 24 42.300 -10.301 -21.201 1.00 0.00 O ATOM 0 H GLY B 24 42.772 -8.546 -17.545 1.00 0.00 H new ATOM 0 HA2 GLY B 24 43.704 -8.380 -19.702 1.00 0.00 H new ATOM 0 HA3 GLY B 24 44.326 -10.014 -19.583 1.00 0.00 H new ATOM 1355 N VAL B 25 41.112 -9.901 -19.333 1.00 0.00 N ATOM 1356 CA VAL B 25 39.856 -10.378 -19.898 1.00 0.00 C ATOM 1357 C VAL B 25 38.750 -9.341 -19.733 1.00 0.00 C ATOM 1358 O VAL B 25 38.308 -9.063 -18.617 1.00 0.00 O ATOM 1359 CB VAL B 25 39.410 -11.697 -19.240 1.00 0.00 C ATOM 1360 CG1 VAL B 25 38.097 -12.177 -19.840 1.00 0.00 C ATOM 1361 CG2 VAL B 25 40.491 -12.757 -19.386 1.00 0.00 C ATOM 0 H VAL B 25 41.044 -9.575 -18.369 1.00 0.00 H new ATOM 0 HA VAL B 25 40.032 -10.551 -20.960 1.00 0.00 H new ATOM 0 HB VAL B 25 39.251 -11.516 -18.177 1.00 0.00 H new ATOM 0 HG11 VAL B 25 37.798 -13.110 -19.362 1.00 0.00 H new ATOM 0 HG12 VAL B 25 37.326 -11.424 -19.678 1.00 0.00 H new ATOM 0 HG13 VAL B 25 38.225 -12.342 -20.910 1.00 0.00 H new ATOM 0 HG21 VAL B 25 40.159 -13.682 -18.915 1.00 0.00 H new ATOM 0 HG22 VAL B 25 40.684 -12.937 -20.444 1.00 0.00 H new ATOM 0 HG23 VAL B 25 41.406 -12.413 -18.904 1.00 0.00 H new ATOM 1371 N ILE B 26 38.307 -8.774 -20.849 1.00 0.00 N ATOM 1372 CA ILE B 26 37.251 -7.769 -20.828 1.00 0.00 C ATOM 1373 C ILE B 26 35.872 -8.420 -20.822 1.00 0.00 C ATOM 1374 O ILE B 26 35.564 -9.257 -21.671 1.00 0.00 O ATOM 1375 CB ILE B 26 37.353 -6.821 -22.038 1.00 0.00 C ATOM 1376 CG1 ILE B 26 38.702 -6.100 -22.037 1.00 0.00 C ATOM 1377 CG2 ILE B 26 36.210 -5.817 -22.021 1.00 0.00 C ATOM 1378 CD1 ILE B 26 38.961 -5.305 -20.776 1.00 0.00 C ATOM 0 H ILE B 26 38.663 -8.993 -21.780 1.00 0.00 H new ATOM 0 HA ILE B 26 37.382 -7.193 -19.912 1.00 0.00 H new ATOM 0 HB ILE B 26 37.279 -7.412 -22.951 1.00 0.00 H new ATOM 0 HG12 ILE B 26 39.497 -6.834 -22.164 1.00 0.00 H new ATOM 0 HG13 ILE B 26 38.747 -5.430 -22.895 1.00 0.00 H new ATOM 0 HG21 ILE B 26 36.295 -5.154 -22.882 1.00 0.00 H new ATOM 0 HG22 ILE B 26 35.259 -6.348 -22.065 1.00 0.00 H new ATOM 0 HG23 ILE B 26 36.256 -5.229 -21.104 1.00 0.00 H new ATOM 0 HD11 ILE B 26 39.935 -4.821 -20.845 1.00 0.00 H new ATOM 0 HD12 ILE B 26 38.186 -4.547 -20.658 1.00 0.00 H new ATOM 0 HD13 ILE B 26 38.948 -5.974 -19.915 1.00 0.00 H new ATOM 1390 N LEU B 27 35.045 -8.030 -19.858 1.00 0.00 N ATOM 1391 CA LEU B 27 33.697 -8.575 -19.741 1.00 0.00 C ATOM 1392 C LEU B 27 32.655 -7.460 -19.766 1.00 0.00 C ATOM 1393 O LEU B 27 32.978 -6.289 -19.559 1.00 0.00 O ATOM 1394 CB LEU B 27 33.563 -9.385 -18.450 1.00 0.00 C ATOM 1395 CG LEU B 27 33.854 -10.881 -18.564 1.00 0.00 C ATOM 1396 CD1 LEU B 27 32.615 -11.632 -19.026 1.00 0.00 C ATOM 1397 CD2 LEU B 27 35.015 -11.128 -19.516 1.00 0.00 C ATOM 0 H LEU B 27 35.284 -7.339 -19.147 1.00 0.00 H new ATOM 0 HA LEU B 27 33.521 -9.231 -20.594 1.00 0.00 H new ATOM 0 HB2 LEU B 27 34.237 -8.960 -17.706 1.00 0.00 H new ATOM 0 HB3 LEU B 27 32.549 -9.260 -18.070 1.00 0.00 H new ATOM 0 HG LEU B 27 34.133 -11.253 -17.578 1.00 0.00 H new ATOM 0 HD11 LEU B 27 32.841 -12.696 -19.101 1.00 0.00 H new ATOM 0 HD12 LEU B 27 31.810 -11.482 -18.307 1.00 0.00 H new ATOM 0 HD13 LEU B 27 32.305 -11.257 -20.001 1.00 0.00 H new ATOM 0 HD21 LEU B 27 35.208 -12.199 -19.585 1.00 0.00 H new ATOM 0 HD22 LEU B 27 34.765 -10.740 -20.503 1.00 0.00 H new ATOM 0 HD23 LEU B 27 35.905 -10.622 -19.143 1.00 0.00 H new ATOM 1409 N THR B 28 31.404 -7.831 -20.017 1.00 0.00 N ATOM 1410 CA THR B 28 30.315 -6.864 -20.068 1.00 0.00 C ATOM 1411 C THR B 28 29.171 -7.276 -19.148 1.00 0.00 C ATOM 1412 O THR B 28 28.926 -8.465 -18.941 1.00 0.00 O ATOM 1413 CB THR B 28 29.774 -6.702 -21.501 1.00 0.00 C ATOM 1414 OG1 THR B 28 30.655 -7.339 -22.432 1.00 0.00 O ATOM 1415 CG2 THR B 28 29.626 -5.231 -21.860 1.00 0.00 C ATOM 0 H THR B 28 31.120 -8.795 -20.188 1.00 0.00 H new ATOM 0 HA THR B 28 30.723 -5.911 -19.732 1.00 0.00 H new ATOM 0 HB THR B 28 28.792 -7.173 -21.551 1.00 0.00 H new ATOM 0 HG1 THR B 28 30.611 -8.311 -22.312 1.00 0.00 H new ATOM 0 HG21 THR B 28 29.243 -5.141 -22.876 1.00 0.00 H new ATOM 0 HG22 THR B 28 28.932 -4.755 -21.167 1.00 0.00 H new ATOM 0 HG23 THR B 28 30.597 -4.741 -21.794 1.00 0.00 H new ATOM 1423 N ILE B 29 28.474 -6.286 -18.600 1.00 0.00 N ATOM 1424 CA ILE B 29 27.354 -6.547 -17.704 1.00 0.00 C ATOM 1425 C ILE B 29 26.086 -5.855 -18.193 1.00 0.00 C ATOM 1426 O ILE B 29 26.143 -4.766 -18.764 1.00 0.00 O ATOM 1427 CB ILE B 29 27.660 -6.078 -16.270 1.00 0.00 C ATOM 1428 CG1 ILE B 29 28.885 -6.813 -15.720 1.00 0.00 C ATOM 1429 CG2 ILE B 29 26.454 -6.303 -15.370 1.00 0.00 C ATOM 1430 CD1 ILE B 29 28.678 -8.304 -15.571 1.00 0.00 C ATOM 0 H ILE B 29 28.665 -5.297 -18.761 1.00 0.00 H new ATOM 0 HA ILE B 29 27.198 -7.626 -17.700 1.00 0.00 H new ATOM 0 HB ILE B 29 27.879 -5.010 -16.292 1.00 0.00 H new ATOM 0 HG12 ILE B 29 29.732 -6.636 -16.382 1.00 0.00 H new ATOM 0 HG13 ILE B 29 29.146 -6.392 -14.749 1.00 0.00 H new ATOM 0 HG21 ILE B 29 26.686 -5.966 -14.360 1.00 0.00 H new ATOM 0 HG22 ILE B 29 25.603 -5.740 -15.754 1.00 0.00 H new ATOM 0 HG23 ILE B 29 26.207 -7.365 -15.351 1.00 0.00 H new ATOM 0 HD11 ILE B 29 29.586 -8.760 -15.177 1.00 0.00 H new ATOM 0 HD12 ILE B 29 27.851 -8.490 -14.885 1.00 0.00 H new ATOM 0 HD13 ILE B 29 28.447 -8.738 -16.544 1.00 0.00 H new ATOM 1442 N GLN B 30 24.943 -6.494 -17.964 1.00 0.00 N ATOM 1443 CA GLN B 30 23.661 -5.939 -18.380 1.00 0.00 C ATOM 1444 C GLN B 30 22.704 -5.833 -17.197 1.00 0.00 C ATOM 1445 O GLN B 30 22.135 -6.832 -16.757 1.00 0.00 O ATOM 1446 CB GLN B 30 23.040 -6.804 -19.478 1.00 0.00 C ATOM 1447 CG GLN B 30 23.228 -6.238 -20.877 1.00 0.00 C ATOM 1448 CD GLN B 30 21.914 -5.893 -21.549 1.00 0.00 C ATOM 1449 OE1 GLN B 30 21.172 -6.777 -21.979 1.00 0.00 O ATOM 1450 NE2 GLN B 30 21.619 -4.602 -21.643 1.00 0.00 N ATOM 0 H GLN B 30 24.879 -7.396 -17.493 1.00 0.00 H new ATOM 0 HA GLN B 30 23.837 -4.937 -18.772 1.00 0.00 H new ATOM 0 HB2 GLN B 30 23.479 -7.801 -19.436 1.00 0.00 H new ATOM 0 HB3 GLN B 30 21.974 -6.917 -19.281 1.00 0.00 H new ATOM 0 HG2 GLN B 30 23.849 -5.344 -20.823 1.00 0.00 H new ATOM 0 HG3 GLN B 30 23.765 -6.963 -21.489 1.00 0.00 H new ATOM 0 HE21 GLN B 30 22.263 -3.903 -21.273 1.00 0.00 H new ATOM 0 HE22 GLN B 30 20.748 -4.309 -22.085 1.00 0.00 H new ATOM 1459 N GLN B 31 22.532 -4.618 -16.688 1.00 0.00 N ATOM 1460 CA GLN B 31 21.644 -4.383 -15.556 1.00 0.00 C ATOM 1461 C GLN B 31 20.200 -4.223 -16.020 1.00 0.00 C ATOM 1462 O GLN B 31 19.804 -3.160 -16.497 1.00 0.00 O ATOM 1463 CB GLN B 31 22.085 -3.138 -14.785 1.00 0.00 C ATOM 1464 CG GLN B 31 22.514 -3.427 -13.356 1.00 0.00 C ATOM 1465 CD GLN B 31 22.728 -2.165 -12.543 1.00 0.00 C ATOM 1466 OE1 GLN B 31 23.839 -1.640 -12.470 1.00 0.00 O ATOM 1467 NE2 GLN B 31 21.660 -1.670 -11.928 1.00 0.00 N ATOM 0 H GLN B 31 22.996 -3.781 -17.041 1.00 0.00 H new ATOM 0 HA GLN B 31 21.700 -5.249 -14.897 1.00 0.00 H new ATOM 0 HB2 GLN B 31 22.912 -2.667 -15.315 1.00 0.00 H new ATOM 0 HB3 GLN B 31 21.265 -2.420 -14.771 1.00 0.00 H new ATOM 0 HG2 GLN B 31 21.757 -4.043 -12.871 1.00 0.00 H new ATOM 0 HG3 GLN B 31 23.437 -4.007 -13.368 1.00 0.00 H new ATOM 0 HE21 GLN B 31 20.758 -2.138 -12.016 1.00 0.00 H new ATOM 0 HE22 GLN B 31 21.742 -0.822 -11.368 1.00 0.00 H new ATOM 1524 N SER B 35 10.130 -3.158 -15.089 1.00 0.00 N ATOM 1525 CA SER B 35 9.242 -2.755 -14.005 1.00 0.00 C ATOM 1526 C SER B 35 7.969 -3.595 -14.004 1.00 0.00 C ATOM 1527 O SER B 35 7.068 -3.377 -14.814 1.00 0.00 O ATOM 1528 CB SER B 35 8.888 -1.272 -14.132 1.00 0.00 C ATOM 1529 OG SER B 35 9.924 -0.554 -14.779 1.00 0.00 O ATOM 0 HA SER B 35 9.764 -2.917 -13.062 1.00 0.00 H new ATOM 0 HB2 SER B 35 7.960 -1.163 -14.694 1.00 0.00 H new ATOM 0 HB3 SER B 35 8.713 -0.851 -13.142 1.00 0.00 H new ATOM 0 HG SER B 35 10.538 -1.184 -15.211 1.00 0.00 H new ATOM 1535 N ASP B 36 7.903 -4.557 -13.090 1.00 0.00 N ATOM 1536 CA ASP B 36 6.741 -5.430 -12.981 1.00 0.00 C ATOM 1537 C ASP B 36 5.663 -4.795 -12.108 1.00 0.00 C ATOM 1538 O ASP B 36 5.920 -4.413 -10.967 1.00 0.00 O ATOM 1539 CB ASP B 36 7.148 -6.787 -12.405 1.00 0.00 C ATOM 1540 CG ASP B 36 8.053 -7.566 -13.339 1.00 0.00 C ATOM 1541 OD1 ASP B 36 8.571 -6.962 -14.301 1.00 0.00 O ATOM 1542 OD2 ASP B 36 8.242 -8.779 -13.109 1.00 0.00 O ATOM 0 H ASP B 36 8.641 -4.752 -12.414 1.00 0.00 H new ATOM 0 HA ASP B 36 6.333 -5.576 -13.981 1.00 0.00 H new ATOM 0 HB2 ASP B 36 7.657 -6.636 -11.453 1.00 0.00 H new ATOM 0 HB3 ASP B 36 6.253 -7.374 -12.198 1.00 0.00 H new ATOM 1547 N VAL B 37 4.456 -4.685 -12.654 1.00 0.00 N ATOM 1548 CA VAL B 37 3.339 -4.096 -11.925 1.00 0.00 C ATOM 1549 C VAL B 37 2.439 -5.175 -11.333 1.00 0.00 C ATOM 1550 O VAL B 37 1.927 -6.033 -12.052 1.00 0.00 O ATOM 1551 CB VAL B 37 2.496 -3.181 -12.833 1.00 0.00 C ATOM 1552 CG1 VAL B 37 1.570 -2.307 -12.000 1.00 0.00 C ATOM 1553 CG2 VAL B 37 3.397 -2.329 -13.714 1.00 0.00 C ATOM 0 H VAL B 37 4.227 -4.996 -13.598 1.00 0.00 H new ATOM 0 HA VAL B 37 3.766 -3.501 -11.118 1.00 0.00 H new ATOM 0 HB VAL B 37 1.881 -3.807 -13.479 1.00 0.00 H new ATOM 0 HG11 VAL B 37 0.983 -1.668 -12.659 1.00 0.00 H new ATOM 0 HG12 VAL B 37 0.901 -2.939 -11.416 1.00 0.00 H new ATOM 0 HG13 VAL B 37 2.162 -1.687 -11.327 1.00 0.00 H new ATOM 0 HG21 VAL B 37 2.785 -1.689 -14.349 1.00 0.00 H new ATOM 0 HG22 VAL B 37 4.040 -1.711 -13.087 1.00 0.00 H new ATOM 0 HG23 VAL B 37 4.013 -2.976 -14.338 1.00 0.00 H new ATOM 1563 N TRP B 38 2.249 -5.124 -10.020 1.00 0.00 N ATOM 1564 CA TRP B 38 1.410 -6.098 -9.331 1.00 0.00 C ATOM 1565 C TRP B 38 0.411 -5.402 -8.413 1.00 0.00 C ATOM 1566 O TRP B 38 0.716 -4.370 -7.815 1.00 0.00 O ATOM 1567 CB TRP B 38 2.275 -7.067 -8.523 1.00 0.00 C ATOM 1568 CG TRP B 38 3.622 -6.510 -8.173 1.00 0.00 C ATOM 1569 CD1 TRP B 38 4.592 -6.104 -9.043 1.00 0.00 C ATOM 1570 CD2 TRP B 38 4.147 -6.301 -6.857 1.00 0.00 C ATOM 1571 NE1 TRP B 38 5.689 -5.655 -8.349 1.00 0.00 N ATOM 1572 CE2 TRP B 38 5.440 -5.764 -7.006 1.00 0.00 C ATOM 1573 CE3 TRP B 38 3.649 -6.512 -5.569 1.00 0.00 C ATOM 1574 CZ2 TRP B 38 6.241 -5.438 -5.914 1.00 0.00 C ATOM 1575 CZ3 TRP B 38 4.445 -6.189 -4.486 1.00 0.00 C ATOM 1576 CH2 TRP B 38 5.728 -5.656 -4.664 1.00 0.00 C ATOM 0 H TRP B 38 2.664 -4.419 -9.411 1.00 0.00 H new ATOM 0 HA TRP B 38 0.855 -6.659 -10.083 1.00 0.00 H new ATOM 0 HB2 TRP B 38 1.750 -7.333 -7.605 1.00 0.00 H new ATOM 0 HB3 TRP B 38 2.407 -7.987 -9.093 1.00 0.00 H new ATOM 0 HD1 TRP B 38 4.509 -6.132 -10.119 1.00 0.00 H new ATOM 0 HE1 TRP B 38 6.549 -5.298 -8.766 1.00 0.00 H new ATOM 0 HE3 TRP B 38 2.660 -6.920 -5.422 1.00 0.00 H new ATOM 0 HZ2 TRP B 38 7.231 -5.028 -6.049 1.00 0.00 H new ATOM 0 HZ3 TRP B 38 4.071 -6.350 -3.486 1.00 0.00 H new ATOM 0 HH2 TRP B 38 6.325 -5.412 -3.797 1.00 0.00 H new ATOM 1587 N LEU B 39 -0.784 -5.974 -8.305 1.00 0.00 N ATOM 1588 CA LEU B 39 -1.829 -5.408 -7.458 1.00 0.00 C ATOM 1589 C LEU B 39 -2.178 -6.357 -6.317 1.00 0.00 C ATOM 1590 O LEU B 39 -2.000 -7.570 -6.429 1.00 0.00 O ATOM 1591 CB LEU B 39 -3.078 -5.108 -8.289 1.00 0.00 C ATOM 1592 CG LEU B 39 -4.310 -4.653 -7.506 1.00 0.00 C ATOM 1593 CD1 LEU B 39 -4.047 -3.322 -6.820 1.00 0.00 C ATOM 1594 CD2 LEU B 39 -5.519 -4.552 -8.426 1.00 0.00 C ATOM 0 H LEU B 39 -1.053 -6.828 -8.793 1.00 0.00 H new ATOM 0 HA LEU B 39 -1.453 -4.479 -7.030 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -2.829 -4.336 -9.017 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -3.340 -6.004 -8.852 1.00 0.00 H new ATOM 0 HG LEU B 39 -4.523 -5.397 -6.738 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -4.936 -3.015 -6.268 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -3.210 -3.427 -6.130 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -3.807 -2.568 -7.569 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -6.387 -4.227 -7.852 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -5.315 -3.830 -9.216 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -5.722 -5.527 -8.869 1.00 0.00 H new ATOM 1606 N ALA B 40 -2.680 -5.798 -5.221 1.00 0.00 N ATOM 1607 CA ALA B 40 -3.059 -6.595 -4.061 1.00 0.00 C ATOM 1608 C ALA B 40 -4.571 -6.777 -3.991 1.00 0.00 C ATOM 1609 O ALA B 40 -5.062 -7.793 -3.499 1.00 0.00 O ATOM 1610 CB ALA B 40 -2.543 -5.947 -2.784 1.00 0.00 C ATOM 0 H ALA B 40 -2.834 -4.796 -5.112 1.00 0.00 H new ATOM 0 HA ALA B 40 -2.605 -7.581 -4.164 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -2.833 -6.553 -1.926 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.456 -5.875 -2.826 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -2.969 -4.949 -2.684 1.00 0.00 H new ATOM 1616 N ASP B 41 -5.305 -5.785 -4.484 1.00 0.00 N ATOM 1617 CA ASP B 41 -6.763 -5.836 -4.477 1.00 0.00 C ATOM 1618 C ASP B 41 -7.292 -6.429 -5.780 1.00 0.00 C ATOM 1619 O ASP B 41 -7.539 -5.707 -6.745 1.00 0.00 O ATOM 1620 CB ASP B 41 -7.342 -4.437 -4.267 1.00 0.00 C ATOM 1621 CG ASP B 41 -8.645 -4.460 -3.492 1.00 0.00 C ATOM 1622 OD1 ASP B 41 -9.552 -5.227 -3.878 1.00 0.00 O ATOM 1623 OD2 ASP B 41 -8.757 -3.712 -2.499 1.00 0.00 O ATOM 0 H ASP B 41 -4.915 -4.936 -4.893 1.00 0.00 H new ATOM 0 HA ASP B 41 -7.076 -6.478 -3.653 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.616 -3.823 -3.734 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -7.507 -3.966 -5.236 1.00 0.00 H new ATOM 1628 N GLU B 42 -7.461 -7.747 -5.798 1.00 0.00 N ATOM 1629 CA GLU B 42 -7.959 -8.436 -6.983 1.00 0.00 C ATOM 1630 C GLU B 42 -9.217 -7.759 -7.518 1.00 0.00 C ATOM 1631 O GLU B 42 -9.396 -7.626 -8.729 1.00 0.00 O ATOM 1632 CB GLU B 42 -8.254 -9.903 -6.661 1.00 0.00 C ATOM 1633 CG GLU B 42 -7.008 -10.729 -6.390 1.00 0.00 C ATOM 1634 CD GLU B 42 -7.330 -12.157 -5.995 1.00 0.00 C ATOM 1635 OE1 GLU B 42 -7.515 -12.995 -6.902 1.00 0.00 O ATOM 1636 OE2 GLU B 42 -7.396 -12.437 -4.780 1.00 0.00 O ATOM 0 H GLU B 42 -7.261 -8.359 -5.007 1.00 0.00 H new ATOM 0 HA GLU B 42 -7.187 -8.388 -7.751 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -8.908 -9.951 -5.790 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -8.800 -10.346 -7.494 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -6.380 -10.735 -7.281 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -6.430 -10.258 -5.595 1.00 0.00 H new ATOM 1643 N SER B 43 -10.086 -7.332 -6.607 1.00 0.00 N ATOM 1644 CA SER B 43 -11.330 -6.672 -6.987 1.00 0.00 C ATOM 1645 C SER B 43 -11.057 -5.494 -7.917 1.00 0.00 C ATOM 1646 O SER B 43 -11.829 -5.227 -8.838 1.00 0.00 O ATOM 1647 CB SER B 43 -12.077 -6.191 -5.741 1.00 0.00 C ATOM 1648 OG SER B 43 -13.465 -6.063 -5.997 1.00 0.00 O ATOM 0 H SER B 43 -9.952 -7.431 -5.601 1.00 0.00 H new ATOM 0 HA SER B 43 -11.950 -7.395 -7.517 1.00 0.00 H new ATOM 0 HB2 SER B 43 -11.918 -6.894 -4.924 1.00 0.00 H new ATOM 0 HB3 SER B 43 -11.673 -5.231 -5.419 1.00 0.00 H new ATOM 0 HG SER B 43 -13.920 -5.756 -5.185 1.00 0.00 H new ATOM 1654 N GLN B 44 -9.955 -4.795 -7.669 1.00 0.00 N ATOM 1655 CA GLN B 44 -9.581 -3.645 -8.484 1.00 0.00 C ATOM 1656 C GLN B 44 -8.753 -4.078 -9.689 1.00 0.00 C ATOM 1657 O GLN B 44 -8.561 -3.310 -10.631 1.00 0.00 O ATOM 1658 CB GLN B 44 -8.795 -2.634 -7.647 1.00 0.00 C ATOM 1659 CG GLN B 44 -9.593 -1.392 -7.285 1.00 0.00 C ATOM 1660 CD GLN B 44 -11.025 -1.710 -6.900 1.00 0.00 C ATOM 1661 OE1 GLN B 44 -11.274 -2.457 -5.953 1.00 0.00 O ATOM 1662 NE2 GLN B 44 -11.975 -1.143 -7.633 1.00 0.00 N ATOM 0 H GLN B 44 -9.306 -5.004 -6.911 1.00 0.00 H new ATOM 0 HA GLN B 44 -10.496 -3.174 -8.845 1.00 0.00 H new ATOM 0 HB2 GLN B 44 -8.457 -3.118 -6.731 1.00 0.00 H new ATOM 0 HB3 GLN B 44 -7.903 -2.335 -8.197 1.00 0.00 H new ATOM 0 HG2 GLN B 44 -9.104 -0.879 -6.457 1.00 0.00 H new ATOM 0 HG3 GLN B 44 -9.592 -0.705 -8.131 1.00 0.00 H new ATOM 0 HE21 GLN B 44 -11.723 -0.531 -8.409 1.00 0.00 H new ATOM 0 HE22 GLN B 44 -12.957 -1.320 -7.420 1.00 0.00 H new ATOM 1671 N ALA B 45 -8.264 -5.314 -9.652 1.00 0.00 N ATOM 1672 CA ALA B 45 -7.458 -5.849 -10.742 1.00 0.00 C ATOM 1673 C ALA B 45 -8.163 -5.675 -12.083 1.00 0.00 C ATOM 1674 O ALA B 45 -7.517 -5.595 -13.127 1.00 0.00 O ATOM 1675 CB ALA B 45 -7.145 -7.318 -10.495 1.00 0.00 C ATOM 0 H ALA B 45 -8.412 -5.963 -8.879 1.00 0.00 H new ATOM 0 HA ALA B 45 -6.523 -5.290 -10.778 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.542 -7.705 -11.317 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -6.593 -7.420 -9.561 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -8.075 -7.882 -10.430 1.00 0.00 H new ATOM 1681 N GLU B 46 -9.491 -5.618 -12.046 1.00 0.00 N ATOM 1682 CA GLU B 46 -10.282 -5.454 -13.260 1.00 0.00 C ATOM 1683 C GLU B 46 -10.277 -4.000 -13.721 1.00 0.00 C ATOM 1684 O GLU B 46 -9.947 -3.702 -14.869 1.00 0.00 O ATOM 1685 CB GLU B 46 -11.720 -5.922 -13.024 1.00 0.00 C ATOM 1686 CG GLU B 46 -11.822 -7.360 -12.547 1.00 0.00 C ATOM 1687 CD GLU B 46 -13.137 -7.652 -11.850 1.00 0.00 C ATOM 1688 OE1 GLU B 46 -13.757 -6.699 -11.333 1.00 0.00 O ATOM 1689 OE2 GLU B 46 -13.544 -8.832 -11.821 1.00 0.00 O ATOM 0 H GLU B 46 -10.041 -5.683 -11.189 1.00 0.00 H new ATOM 0 HA GLU B 46 -9.832 -6.065 -14.042 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -12.189 -5.270 -12.287 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -12.285 -5.815 -13.950 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -11.710 -8.030 -13.399 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -10.999 -7.572 -11.865 1.00 0.00 H new ATOM 1696 N ARG B 47 -10.646 -3.098 -12.817 1.00 0.00 N ATOM 1697 CA ARG B 47 -10.686 -1.674 -13.131 1.00 0.00 C ATOM 1698 C ARG B 47 -9.319 -1.181 -13.595 1.00 0.00 C ATOM 1699 O ARG B 47 -9.222 -0.315 -14.465 1.00 0.00 O ATOM 1700 CB ARG B 47 -11.141 -0.874 -11.909 1.00 0.00 C ATOM 1701 CG ARG B 47 -10.010 -0.514 -10.960 1.00 0.00 C ATOM 1702 CD ARG B 47 -9.406 0.839 -11.302 1.00 0.00 C ATOM 1703 NE ARG B 47 -10.129 1.937 -10.666 1.00 0.00 N ATOM 1704 CZ ARG B 47 -10.082 3.194 -11.094 1.00 0.00 C ATOM 1705 NH1 ARG B 47 -9.350 3.509 -12.154 1.00 0.00 N ATOM 1706 NH2 ARG B 47 -10.768 4.137 -10.462 1.00 0.00 N ATOM 0 H ARG B 47 -10.921 -3.328 -11.862 1.00 0.00 H new ATOM 0 HA ARG B 47 -11.400 -1.526 -13.941 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -11.627 0.042 -12.245 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -11.890 -1.451 -11.366 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -10.384 -0.499 -9.936 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -9.237 -1.281 -11.006 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -8.363 0.861 -10.986 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -9.415 0.977 -12.383 1.00 0.00 H new ATOM 0 HE ARG B 47 -10.702 1.727 -9.848 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -8.822 2.786 -12.642 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -9.315 4.475 -12.481 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -11.332 3.897 -9.647 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -10.731 5.102 -10.791 1.00 0.00 H new ATOM 1720 N VAL B 48 -8.264 -1.738 -13.008 1.00 0.00 N ATOM 1721 CA VAL B 48 -6.902 -1.355 -13.361 1.00 0.00 C ATOM 1722 C VAL B 48 -6.508 -1.922 -14.720 1.00 0.00 C ATOM 1723 O VAL B 48 -5.872 -1.242 -15.526 1.00 0.00 O ATOM 1724 CB VAL B 48 -5.892 -1.836 -12.303 1.00 0.00 C ATOM 1725 CG1 VAL B 48 -6.199 -1.215 -10.949 1.00 0.00 C ATOM 1726 CG2 VAL B 48 -5.896 -3.355 -12.216 1.00 0.00 C ATOM 0 H VAL B 48 -8.327 -2.456 -12.286 1.00 0.00 H new ATOM 0 HA VAL B 48 -6.879 -0.266 -13.404 1.00 0.00 H new ATOM 0 HB VAL B 48 -4.895 -1.514 -12.605 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -5.475 -1.567 -10.215 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -6.140 -0.129 -11.025 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -7.202 -1.503 -10.636 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -5.177 -3.678 -11.464 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -6.892 -3.701 -11.938 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -5.623 -3.776 -13.184 1.00 0.00 H new ATOM 1736 N ARG B 49 -6.889 -3.170 -14.968 1.00 0.00 N ATOM 1737 CA ARG B 49 -6.575 -3.829 -16.230 1.00 0.00 C ATOM 1738 C ARG B 49 -7.150 -3.049 -17.409 1.00 0.00 C ATOM 1739 O ARG B 49 -6.487 -2.872 -18.431 1.00 0.00 O ATOM 1740 CB ARG B 49 -7.122 -5.258 -16.234 1.00 0.00 C ATOM 1741 CG ARG B 49 -6.069 -6.314 -15.944 1.00 0.00 C ATOM 1742 CD ARG B 49 -6.677 -7.540 -15.280 1.00 0.00 C ATOM 1743 NE ARG B 49 -6.191 -8.782 -15.873 1.00 0.00 N ATOM 1744 CZ ARG B 49 -6.768 -9.963 -15.683 1.00 0.00 C ATOM 1745 NH1 ARG B 49 -7.847 -10.062 -14.920 1.00 0.00 N ATOM 1746 NH2 ARG B 49 -6.266 -11.049 -16.257 1.00 0.00 N ATOM 0 H ARG B 49 -7.416 -3.746 -14.311 1.00 0.00 H new ATOM 0 HA ARG B 49 -5.490 -3.862 -16.333 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -7.916 -5.336 -15.492 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -7.572 -5.463 -17.205 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -5.580 -6.607 -16.873 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -5.299 -5.893 -15.298 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -6.441 -7.530 -14.216 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -7.763 -7.498 -15.366 1.00 0.00 H new ATOM 0 HE ARG B 49 -5.362 -8.741 -16.466 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -8.236 -9.230 -14.477 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -8.288 -10.970 -14.776 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -5.436 -10.977 -16.845 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -6.710 -11.955 -16.110 1.00 0.00 H new ATOM 1760 N ALA B 50 -8.386 -2.586 -17.259 1.00 0.00 N ATOM 1761 CA ALA B 50 -9.049 -1.824 -18.310 1.00 0.00 C ATOM 1762 C ALA B 50 -8.393 -0.461 -18.497 1.00 0.00 C ATOM 1763 O ALA B 50 -7.949 -0.122 -19.593 1.00 0.00 O ATOM 1764 CB ALA B 50 -10.528 -1.661 -17.990 1.00 0.00 C ATOM 0 H ALA B 50 -8.949 -2.725 -16.420 1.00 0.00 H new ATOM 0 HA ALA B 50 -8.949 -2.377 -19.244 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.011 -1.090 -18.783 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.994 -2.643 -17.914 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.639 -1.133 -17.043 1.00 0.00 H new ATOM 1770 N GLU B 51 -8.336 0.316 -17.420 1.00 0.00 N ATOM 1771 CA GLU B 51 -7.734 1.644 -17.468 1.00 0.00 C ATOM 1772 C GLU B 51 -6.292 1.570 -17.961 1.00 0.00 C ATOM 1773 O GLU B 51 -5.836 2.432 -18.714 1.00 0.00 O ATOM 1774 CB GLU B 51 -7.779 2.299 -16.086 1.00 0.00 C ATOM 1775 CG GLU B 51 -9.183 2.655 -15.627 1.00 0.00 C ATOM 1776 CD GLU B 51 -10.030 3.241 -16.740 1.00 0.00 C ATOM 1777 OE1 GLU B 51 -9.800 4.414 -17.104 1.00 0.00 O ATOM 1778 OE2 GLU B 51 -10.922 2.529 -17.245 1.00 0.00 O ATOM 0 H GLU B 51 -8.699 0.050 -16.505 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.309 2.250 -18.168 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -7.328 1.624 -15.358 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.171 3.203 -16.102 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -9.671 1.762 -15.236 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -9.123 3.370 -14.807 1.00 0.00 H new ATOM 1785 N LEU B 52 -5.578 0.536 -17.531 1.00 0.00 N ATOM 1786 CA LEU B 52 -4.187 0.349 -17.927 1.00 0.00 C ATOM 1787 C LEU B 52 -4.072 0.146 -19.434 1.00 0.00 C ATOM 1788 O LEU B 52 -3.306 0.835 -20.107 1.00 0.00 O ATOM 1789 CB LEU B 52 -3.583 -0.850 -17.192 1.00 0.00 C ATOM 1790 CG LEU B 52 -2.091 -1.093 -17.418 1.00 0.00 C ATOM 1791 CD1 LEU B 52 -1.474 -1.782 -16.210 1.00 0.00 C ATOM 1792 CD2 LEU B 52 -1.869 -1.920 -18.676 1.00 0.00 C ATOM 0 H LEU B 52 -5.940 -0.186 -16.908 1.00 0.00 H new ATOM 0 HA LEU B 52 -3.635 1.249 -17.657 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -3.751 -0.718 -16.123 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -4.126 -1.746 -17.492 1.00 0.00 H new ATOM 0 HG LEU B 52 -1.602 -0.128 -17.551 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -0.411 -1.947 -16.389 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -1.600 -1.153 -15.329 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -1.967 -2.740 -16.046 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -0.801 -2.083 -18.821 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -2.372 -2.881 -18.573 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -2.275 -1.389 -19.537 1.00 0.00 H new ATOM 1804 N ALA B 53 -4.841 -0.803 -19.959 1.00 0.00 N ATOM 1805 CA ALA B 53 -4.830 -1.093 -21.387 1.00 0.00 C ATOM 1806 C ALA B 53 -5.237 0.131 -22.199 1.00 0.00 C ATOM 1807 O ALA B 53 -4.795 0.310 -23.334 1.00 0.00 O ATOM 1808 CB ALA B 53 -5.751 -2.264 -21.695 1.00 0.00 C ATOM 0 H ALA B 53 -5.480 -1.384 -19.416 1.00 0.00 H new ATOM 0 HA ALA B 53 -3.812 -1.362 -21.670 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -5.733 -2.469 -22.765 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -5.413 -3.146 -21.150 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -6.768 -2.017 -21.390 1.00 0.00 H new ATOM 1814 N ARG B 54 -6.083 0.971 -21.612 1.00 0.00 N ATOM 1815 CA ARG B 54 -6.551 2.178 -22.282 1.00 0.00 C ATOM 1816 C ARG B 54 -5.496 3.278 -22.222 1.00 0.00 C ATOM 1817 O ARG B 54 -5.428 4.138 -23.101 1.00 0.00 O ATOM 1818 CB ARG B 54 -7.852 2.669 -21.645 1.00 0.00 C ATOM 1819 CG ARG B 54 -9.093 1.973 -22.180 1.00 0.00 C ATOM 1820 CD ARG B 54 -10.339 2.387 -21.413 1.00 0.00 C ATOM 1821 NE ARG B 54 -10.767 3.741 -21.754 1.00 0.00 N ATOM 1822 CZ ARG B 54 -11.768 4.369 -21.148 1.00 0.00 C ATOM 1823 NH1 ARG B 54 -12.440 3.769 -20.175 1.00 0.00 N ATOM 1824 NH2 ARG B 54 -12.098 5.601 -21.514 1.00 0.00 N ATOM 0 H ARG B 54 -6.459 0.838 -20.673 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.736 1.933 -23.328 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -7.798 2.519 -20.567 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -7.947 3.742 -21.813 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.219 2.212 -23.236 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.964 0.893 -22.111 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -11.146 1.687 -21.628 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.142 2.328 -20.343 1.00 0.00 H new ATOM 0 HE ARG B 54 -10.270 4.231 -22.498 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -12.189 2.822 -19.890 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.208 4.254 -19.712 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -11.583 6.066 -22.261 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -12.867 6.083 -21.048 1.00 0.00 H new ATOM 1838 N PHE B 55 -4.674 3.246 -21.178 1.00 0.00 N ATOM 1839 CA PHE B 55 -3.623 4.241 -21.001 1.00 0.00 C ATOM 1840 C PHE B 55 -2.390 3.882 -21.826 1.00 0.00 C ATOM 1841 O PHE B 55 -1.722 4.757 -22.378 1.00 0.00 O ATOM 1842 CB PHE B 55 -3.245 4.357 -19.523 1.00 0.00 C ATOM 1843 CG PHE B 55 -2.602 5.668 -19.170 1.00 0.00 C ATOM 1844 CD1 PHE B 55 -3.235 6.866 -19.460 1.00 0.00 C ATOM 1845 CD2 PHE B 55 -1.364 5.703 -18.548 1.00 0.00 C ATOM 1846 CE1 PHE B 55 -2.645 8.073 -19.138 1.00 0.00 C ATOM 1847 CE2 PHE B 55 -0.770 6.907 -18.222 1.00 0.00 C ATOM 1848 CZ PHE B 55 -1.412 8.094 -18.517 1.00 0.00 C ATOM 0 H PHE B 55 -4.716 2.541 -20.442 1.00 0.00 H new ATOM 0 HA PHE B 55 -4.004 5.201 -21.348 1.00 0.00 H new ATOM 0 HB2 PHE B 55 -4.141 4.225 -18.916 1.00 0.00 H new ATOM 0 HB3 PHE B 55 -2.563 3.546 -19.266 1.00 0.00 H new ATOM 0 HD1 PHE B 55 -4.201 6.856 -19.943 1.00 0.00 H new ATOM 0 HD2 PHE B 55 -0.858 4.778 -18.315 1.00 0.00 H new ATOM 0 HE1 PHE B 55 -3.148 9.000 -19.372 1.00 0.00 H new ATOM 0 HE2 PHE B 55 0.195 6.920 -17.737 1.00 0.00 H new ATOM 0 HZ PHE B 55 -0.950 9.037 -18.262 1.00 0.00 H new ATOM 1858 N LEU B 56 -2.094 2.589 -21.904 1.00 0.00 N ATOM 1859 CA LEU B 56 -0.942 2.113 -22.661 1.00 0.00 C ATOM 1860 C LEU B 56 -1.010 2.583 -24.111 1.00 0.00 C ATOM 1861 O LEU B 56 0.002 2.969 -24.696 1.00 0.00 O ATOM 1862 CB LEU B 56 -0.869 0.586 -22.611 1.00 0.00 C ATOM 1863 CG LEU B 56 0.125 -0.007 -21.612 1.00 0.00 C ATOM 1864 CD1 LEU B 56 -0.186 -1.474 -21.356 1.00 0.00 C ATOM 1865 CD2 LEU B 56 1.551 0.158 -22.117 1.00 0.00 C ATOM 0 H LEU B 56 -2.636 1.852 -21.452 1.00 0.00 H new ATOM 0 HA LEU B 56 -0.043 2.529 -22.206 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -1.862 0.202 -22.376 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.614 0.222 -23.606 1.00 0.00 H new ATOM 0 HG LEU B 56 0.030 0.533 -20.670 1.00 0.00 H new ATOM 0 HD11 LEU B 56 0.532 -1.879 -20.643 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -1.193 -1.567 -20.950 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -0.120 -2.029 -22.292 1.00 0.00 H new ATOM 0 HD21 LEU B 56 2.245 -0.270 -21.393 1.00 0.00 H new ATOM 0 HD22 LEU B 56 1.660 -0.356 -23.072 1.00 0.00 H new ATOM 0 HD23 LEU B 56 1.770 1.218 -22.248 1.00 0.00 H new