USER MOD reduce.3.24.130724 H: found=0, std=0, add=721, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 720 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 LYS NZ :NH3+ -142:sc= 0.972 (180deg=0) USER MOD Set 1.2: A 23 TYR OH : rot -30:sc= 0.458 USER MOD Single : A 1 MET CE :methyl -160:sc=-0.00864 (180deg=-0.307) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.23 USER MOD Single : A 9 GLN : amide:sc= -0.243 K(o=-0.24,f=-0.89) USER MOD Single : A 13 SER OG : rot -80:sc= -0.143 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -5.43! C(o=-5.4!,f=-18!) USER MOD Single : A 39 GLN : amide:sc= -0.129 K(o=-0.13,f=-2.2!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot -113:sc= 0.0648 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl -140:sc= -5.27! (180deg=-8.97!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -152:sc= -1.17 USER MOD Single : A 60 TYR OH : rot -175:sc= 0.107 USER MOD Single : A 64 SER OG : rot 140:sc= 0.00667 USER MOD Single : A 65 SER OG : rot 180:sc= 0.0052 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.525) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 THR OG1 : rot 82:sc= 0.00884 USER MOD Single : B 22 GLN : amide:sc= 0 X(o=0,f=-0.052) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.934 -7.663 -2.950 1.00 0.00 N ATOM 2 CA MET A 1 0.853 -6.787 -3.486 1.00 0.00 C ATOM 3 C MET A 1 -0.517 -7.423 -3.233 1.00 0.00 C ATOM 4 O MET A 1 -1.103 -8.026 -4.111 1.00 0.00 O ATOM 5 CB MET A 1 1.130 -6.688 -4.986 1.00 0.00 C ATOM 6 CG MET A 1 1.796 -5.347 -5.297 1.00 0.00 C ATOM 7 SD MET A 1 0.832 -4.471 -6.553 1.00 0.00 S ATOM 8 CE MET A 1 1.156 -5.606 -7.923 1.00 0.00 C ATOM 0 H1 MET A 1 2.859 -7.221 -3.127 1.00 0.00 H new ATOM 0 H2 MET A 1 1.802 -7.791 -1.926 1.00 0.00 H new ATOM 0 H3 MET A 1 1.896 -8.589 -3.422 1.00 0.00 H new ATOM 0 HA MET A 1 0.841 -5.807 -3.009 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.775 -7.508 -5.302 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.199 -6.781 -5.545 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.865 -4.745 -4.391 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.814 -5.508 -5.652 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.965 -5.099 -8.869 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.196 -5.930 -7.889 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.502 -6.474 -7.839 1.00 0.00 H new ATOM 18 N ALA A 2 -1.032 -7.294 -2.042 1.00 0.00 N ATOM 19 CA ALA A 2 -2.363 -7.893 -1.737 1.00 0.00 C ATOM 20 C ALA A 2 -2.829 -7.466 -0.343 1.00 0.00 C ATOM 21 O ALA A 2 -3.616 -6.553 -0.194 1.00 0.00 O ATOM 22 CB ALA A 2 -2.139 -9.405 -1.787 1.00 0.00 C ATOM 0 H ALA A 2 -0.590 -6.800 -1.267 1.00 0.00 H new ATOM 0 HA ALA A 2 -3.131 -7.571 -2.441 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -3.076 -9.919 -1.572 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.789 -9.688 -2.780 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.392 -9.687 -1.045 1.00 0.00 H new ATOM 28 N ASP A 3 -2.350 -8.120 0.680 1.00 0.00 N ATOM 29 CA ASP A 3 -2.767 -7.750 2.063 1.00 0.00 C ATOM 30 C ASP A 3 -1.573 -7.838 3.019 1.00 0.00 C ATOM 31 O ASP A 3 -0.485 -8.221 2.636 1.00 0.00 O ATOM 32 CB ASP A 3 -3.834 -8.778 2.441 1.00 0.00 C ATOM 33 CG ASP A 3 -5.223 -8.165 2.256 1.00 0.00 C ATOM 34 OD1 ASP A 3 -5.613 -7.964 1.118 1.00 0.00 O ATOM 35 OD2 ASP A 3 -5.872 -7.905 3.256 1.00 0.00 O ATOM 0 H ASP A 3 -1.688 -8.894 0.618 1.00 0.00 H new ATOM 0 HA ASP A 3 -3.144 -6.729 2.122 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -3.732 -9.668 1.820 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -3.699 -9.094 3.476 1.00 0.00 H new ATOM 40 N THR A 4 -1.769 -7.486 4.259 1.00 0.00 N ATOM 41 CA THR A 4 -0.647 -7.548 5.239 1.00 0.00 C ATOM 42 C THR A 4 -1.091 -8.293 6.503 1.00 0.00 C ATOM 43 O THR A 4 -2.267 -8.492 6.735 1.00 0.00 O ATOM 44 CB THR A 4 -0.322 -6.089 5.561 1.00 0.00 C ATOM 45 OG1 THR A 4 -0.419 -5.313 4.375 1.00 0.00 O ATOM 46 CG2 THR A 4 1.097 -5.991 6.123 1.00 0.00 C ATOM 0 H THR A 4 -2.658 -7.158 4.637 1.00 0.00 H new ATOM 0 HA THR A 4 0.219 -8.080 4.845 1.00 0.00 H new ATOM 0 HB THR A 4 -1.028 -5.714 6.301 1.00 0.00 H new ATOM 0 HG1 THR A 4 -0.213 -4.377 4.579 1.00 0.00 H new ATOM 0 HG21 THR A 4 1.327 -4.950 6.352 1.00 0.00 H new ATOM 0 HG22 THR A 4 1.170 -6.587 7.033 1.00 0.00 H new ATOM 0 HG23 THR A 4 1.807 -6.366 5.386 1.00 0.00 H new ATOM 54 N ASP A 5 -0.161 -8.704 7.321 1.00 0.00 N ATOM 55 CA ASP A 5 -0.536 -9.435 8.566 1.00 0.00 C ATOM 56 C ASP A 5 0.701 -9.670 9.438 1.00 0.00 C ATOM 57 O ASP A 5 0.971 -10.777 9.862 1.00 0.00 O ATOM 58 CB ASP A 5 -1.115 -10.765 8.083 1.00 0.00 C ATOM 59 CG ASP A 5 -2.594 -10.846 8.464 1.00 0.00 C ATOM 60 OD1 ASP A 5 -2.897 -10.660 9.630 1.00 0.00 O ATOM 61 OD2 ASP A 5 -3.399 -11.092 7.580 1.00 0.00 O ATOM 0 H ASP A 5 0.840 -8.566 7.182 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.248 -8.877 9.174 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -1.002 -10.852 7.002 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.568 -11.595 8.529 1.00 0.00 H new ATOM 66 N THR A 6 1.452 -8.639 9.712 1.00 0.00 N ATOM 67 CA THR A 6 2.669 -8.805 10.558 1.00 0.00 C ATOM 68 C THR A 6 3.692 -9.699 9.851 1.00 0.00 C ATOM 69 O THR A 6 4.744 -9.249 9.441 1.00 0.00 O ATOM 70 CB THR A 6 2.170 -9.471 11.841 1.00 0.00 C ATOM 71 OG1 THR A 6 0.892 -8.951 12.177 1.00 0.00 O ATOM 72 CG2 THR A 6 3.154 -9.193 12.979 1.00 0.00 C ATOM 0 H THR A 6 1.276 -7.688 9.387 1.00 0.00 H new ATOM 0 HA THR A 6 3.165 -7.855 10.757 1.00 0.00 H new ATOM 0 HB THR A 6 2.094 -10.547 11.686 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.570 -9.378 12.998 1.00 0.00 H new ATOM 0 HG21 THR A 6 2.797 -9.668 13.893 1.00 0.00 H new ATOM 0 HG22 THR A 6 4.133 -9.595 12.720 1.00 0.00 H new ATOM 0 HG23 THR A 6 3.234 -8.117 13.137 1.00 0.00 H new ATOM 80 N ALA A 7 3.391 -10.960 9.702 1.00 0.00 N ATOM 81 CA ALA A 7 4.348 -11.879 9.019 1.00 0.00 C ATOM 82 C ALA A 7 4.444 -11.519 7.535 1.00 0.00 C ATOM 83 O ALA A 7 5.506 -11.540 6.946 1.00 0.00 O ATOM 84 CB ALA A 7 3.753 -13.276 9.198 1.00 0.00 C ATOM 0 H ALA A 7 2.525 -11.394 10.023 1.00 0.00 H new ATOM 0 HA ALA A 7 5.355 -11.814 9.430 1.00 0.00 H new ATOM 0 HB1 ALA A 7 4.401 -14.011 8.721 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.668 -13.502 10.261 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.765 -13.312 8.740 1.00 0.00 H new ATOM 90 N GLU A 8 3.338 -11.184 6.930 1.00 0.00 N ATOM 91 CA GLU A 8 3.356 -10.815 5.486 1.00 0.00 C ATOM 92 C GLU A 8 4.114 -9.501 5.294 1.00 0.00 C ATOM 93 O GLU A 8 4.812 -9.310 4.317 1.00 0.00 O ATOM 94 CB GLU A 8 1.887 -10.650 5.099 1.00 0.00 C ATOM 95 CG GLU A 8 1.696 -11.059 3.636 1.00 0.00 C ATOM 96 CD GLU A 8 2.264 -9.972 2.724 1.00 0.00 C ATOM 97 OE1 GLU A 8 2.065 -8.807 3.027 1.00 0.00 O ATOM 98 OE2 GLU A 8 2.890 -10.322 1.737 1.00 0.00 O ATOM 0 H GLU A 8 2.420 -11.150 7.374 1.00 0.00 H new ATOM 0 HA GLU A 8 3.854 -11.565 4.871 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.259 -11.264 5.744 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.576 -9.615 5.242 1.00 0.00 H new ATOM 0 HG2 GLU A 8 2.197 -12.008 3.444 1.00 0.00 H new ATOM 0 HG3 GLU A 8 0.637 -11.209 3.425 1.00 0.00 H new ATOM 105 N GLN A 9 3.979 -8.591 6.220 1.00 0.00 N ATOM 106 CA GLN A 9 4.689 -7.285 6.094 1.00 0.00 C ATOM 107 C GLN A 9 6.204 -7.509 6.065 1.00 0.00 C ATOM 108 O GLN A 9 6.907 -6.952 5.245 1.00 0.00 O ATOM 109 CB GLN A 9 4.287 -6.500 7.343 1.00 0.00 C ATOM 110 CG GLN A 9 5.001 -5.146 7.347 1.00 0.00 C ATOM 111 CD GLN A 9 4.034 -4.058 6.876 1.00 0.00 C ATOM 112 OE1 GLN A 9 3.058 -3.768 7.540 1.00 0.00 O ATOM 113 NE2 GLN A 9 4.264 -3.440 5.751 1.00 0.00 N ATOM 0 H GLN A 9 3.408 -8.695 7.059 1.00 0.00 H new ATOM 0 HA GLN A 9 4.429 -6.757 5.177 1.00 0.00 H new ATOM 0 HB2 GLN A 9 3.207 -6.354 7.362 1.00 0.00 H new ATOM 0 HB3 GLN A 9 4.548 -7.063 8.239 1.00 0.00 H new ATOM 0 HG2 GLN A 9 5.363 -4.917 8.349 1.00 0.00 H new ATOM 0 HG3 GLN A 9 5.873 -5.181 6.693 1.00 0.00 H new ATOM 0 HE21 GLN A 9 5.083 -3.683 5.194 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.625 -2.713 5.428 1.00 0.00 H new ATOM 122 N VAL A 10 6.711 -8.324 6.949 1.00 0.00 N ATOM 123 CA VAL A 10 8.179 -8.583 6.966 1.00 0.00 C ATOM 124 C VAL A 10 8.631 -9.135 5.611 1.00 0.00 C ATOM 125 O VAL A 10 9.632 -8.716 5.062 1.00 0.00 O ATOM 126 CB VAL A 10 8.386 -9.624 8.066 1.00 0.00 C ATOM 127 CG1 VAL A 10 9.840 -10.098 8.054 1.00 0.00 C ATOM 128 CG2 VAL A 10 8.063 -8.999 9.424 1.00 0.00 C ATOM 0 H VAL A 10 6.173 -8.821 7.659 1.00 0.00 H new ATOM 0 HA VAL A 10 8.757 -7.678 7.150 1.00 0.00 H new ATOM 0 HB VAL A 10 7.727 -10.474 7.891 1.00 0.00 H new ATOM 0 HG11 VAL A 10 9.987 -10.840 8.839 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.070 -10.543 7.086 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.501 -9.249 8.229 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.210 -9.740 10.210 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.722 -8.149 9.599 1.00 0.00 H new ATOM 0 HG23 VAL A 10 7.026 -8.662 9.432 1.00 0.00 H new ATOM 138 N ILE A 11 7.901 -10.069 5.066 1.00 0.00 N ATOM 139 CA ILE A 11 8.290 -10.643 3.747 1.00 0.00 C ATOM 140 C ILE A 11 8.444 -9.520 2.721 1.00 0.00 C ATOM 141 O ILE A 11 9.431 -9.440 2.017 1.00 0.00 O ATOM 142 CB ILE A 11 7.141 -11.576 3.361 1.00 0.00 C ATOM 143 CG1 ILE A 11 7.130 -12.782 4.305 1.00 0.00 C ATOM 144 CG2 ILE A 11 7.337 -12.059 1.923 1.00 0.00 C ATOM 145 CD1 ILE A 11 5.776 -13.488 4.215 1.00 0.00 C ATOM 0 H ILE A 11 7.053 -10.459 5.477 1.00 0.00 H new ATOM 0 HA ILE A 11 9.241 -11.175 3.787 1.00 0.00 H new ATOM 0 HB ILE A 11 6.195 -11.041 3.439 1.00 0.00 H new ATOM 0 HG12 ILE A 11 7.930 -13.472 4.039 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.316 -12.458 5.329 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.518 -12.724 1.648 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.350 -11.202 1.250 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.282 -12.596 1.845 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.768 -14.346 4.887 1.00 0.00 H new ATOM 0 HD12 ILE A 11 4.985 -12.795 4.502 1.00 0.00 H new ATOM 0 HD13 ILE A 11 5.609 -13.826 3.192 1.00 0.00 H new ATOM 157 N ALA A 12 7.483 -8.640 2.640 1.00 0.00 N ATOM 158 CA ALA A 12 7.592 -7.515 1.670 1.00 0.00 C ATOM 159 C ALA A 12 8.865 -6.723 1.964 1.00 0.00 C ATOM 160 O ALA A 12 9.599 -6.351 1.070 1.00 0.00 O ATOM 161 CB ALA A 12 6.352 -6.653 1.912 1.00 0.00 C ATOM 0 H ALA A 12 6.631 -8.652 3.201 1.00 0.00 H new ATOM 0 HA ALA A 12 7.644 -7.852 0.635 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.362 -5.802 1.232 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.456 -7.247 1.736 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.353 -6.295 2.941 1.00 0.00 H new ATOM 167 N SER A 13 9.139 -6.480 3.217 1.00 0.00 N ATOM 168 CA SER A 13 10.374 -5.730 3.576 1.00 0.00 C ATOM 169 C SER A 13 11.599 -6.586 3.252 1.00 0.00 C ATOM 170 O SER A 13 12.597 -6.100 2.757 1.00 0.00 O ATOM 171 CB SER A 13 10.269 -5.483 5.079 1.00 0.00 C ATOM 172 OG SER A 13 8.928 -5.140 5.406 1.00 0.00 O ATOM 0 H SER A 13 8.561 -6.769 4.006 1.00 0.00 H new ATOM 0 HA SER A 13 10.475 -4.795 3.025 1.00 0.00 H new ATOM 0 HB2 SER A 13 10.573 -6.374 5.628 1.00 0.00 H new ATOM 0 HB3 SER A 13 10.944 -4.681 5.375 1.00 0.00 H new ATOM 0 HG SER A 13 8.772 -4.195 5.197 1.00 0.00 H new ATOM 178 N PHE A 14 11.524 -7.864 3.513 1.00 0.00 N ATOM 179 CA PHE A 14 12.679 -8.753 3.205 1.00 0.00 C ATOM 180 C PHE A 14 12.847 -8.866 1.690 1.00 0.00 C ATOM 181 O PHE A 14 13.945 -8.818 1.170 1.00 0.00 O ATOM 182 CB PHE A 14 12.313 -10.108 3.812 1.00 0.00 C ATOM 183 CG PHE A 14 12.892 -10.209 5.202 1.00 0.00 C ATOM 184 CD1 PHE A 14 14.243 -9.916 5.422 1.00 0.00 C ATOM 185 CD2 PHE A 14 12.077 -10.598 6.273 1.00 0.00 C ATOM 186 CE1 PHE A 14 14.779 -10.011 6.711 1.00 0.00 C ATOM 187 CE2 PHE A 14 12.613 -10.692 7.563 1.00 0.00 C ATOM 188 CZ PHE A 14 13.965 -10.398 7.782 1.00 0.00 C ATOM 0 H PHE A 14 10.715 -8.329 3.925 1.00 0.00 H new ATOM 0 HA PHE A 14 13.619 -8.376 3.608 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.230 -10.221 3.849 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.697 -10.914 3.187 1.00 0.00 H new ATOM 0 HD1 PHE A 14 14.872 -9.617 4.597 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.035 -10.825 6.104 1.00 0.00 H new ATOM 0 HE1 PHE A 14 15.822 -9.786 6.880 1.00 0.00 H new ATOM 0 HE2 PHE A 14 11.984 -10.991 8.389 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.379 -10.470 8.777 1.00 0.00 H new ATOM 198 N ARG A 15 11.764 -9.003 0.975 1.00 0.00 N ATOM 199 CA ARG A 15 11.860 -9.104 -0.507 1.00 0.00 C ATOM 200 C ARG A 15 12.660 -7.917 -1.047 1.00 0.00 C ATOM 201 O ARG A 15 13.555 -8.071 -1.854 1.00 0.00 O ATOM 202 CB ARG A 15 10.415 -9.052 -1.005 1.00 0.00 C ATOM 203 CG ARG A 15 10.343 -9.614 -2.424 1.00 0.00 C ATOM 204 CD ARG A 15 8.899 -9.545 -2.926 1.00 0.00 C ATOM 205 NE ARG A 15 9.013 -9.358 -4.400 1.00 0.00 N ATOM 206 CZ ARG A 15 9.414 -8.215 -4.887 1.00 0.00 C ATOM 207 NH1 ARG A 15 9.716 -7.228 -4.086 1.00 0.00 N ATOM 208 NH2 ARG A 15 9.516 -8.058 -6.179 1.00 0.00 N ATOM 0 H ARG A 15 10.818 -9.049 1.354 1.00 0.00 H new ATOM 0 HA ARG A 15 12.364 -10.013 -0.835 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.770 -9.628 -0.342 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.051 -8.025 -0.991 1.00 0.00 H new ATOM 0 HG2 ARG A 15 10.997 -9.046 -3.085 1.00 0.00 H new ATOM 0 HG3 ARG A 15 10.695 -10.646 -2.437 1.00 0.00 H new ATOM 0 HD2 ARG A 15 8.353 -10.457 -2.685 1.00 0.00 H new ATOM 0 HD3 ARG A 15 8.359 -8.719 -2.464 1.00 0.00 H new ATOM 0 HE ARG A 15 8.777 -10.125 -5.030 1.00 0.00 H new ATOM 0 HH11 ARG A 15 9.639 -7.349 -3.076 1.00 0.00 H new ATOM 0 HH12 ARG A 15 10.029 -6.337 -4.471 1.00 0.00 H new ATOM 0 HH21 ARG A 15 9.283 -8.828 -6.806 1.00 0.00 H new ATOM 0 HH22 ARG A 15 9.829 -7.166 -6.561 1.00 0.00 H new ATOM 222 N ILE A 16 12.350 -6.732 -0.594 1.00 0.00 N ATOM 223 CA ILE A 16 13.098 -5.534 -1.069 1.00 0.00 C ATOM 224 C ILE A 16 14.582 -5.691 -0.735 1.00 0.00 C ATOM 225 O ILE A 16 15.444 -5.392 -1.537 1.00 0.00 O ATOM 226 CB ILE A 16 12.496 -4.358 -0.298 1.00 0.00 C ATOM 227 CG1 ILE A 16 11.074 -4.093 -0.797 1.00 0.00 C ATOM 228 CG2 ILE A 16 13.353 -3.110 -0.522 1.00 0.00 C ATOM 229 CD1 ILE A 16 10.499 -2.872 -0.075 1.00 0.00 C ATOM 0 H ILE A 16 11.612 -6.543 0.084 1.00 0.00 H new ATOM 0 HA ILE A 16 13.020 -5.391 -2.147 1.00 0.00 H new ATOM 0 HB ILE A 16 12.470 -4.597 0.765 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.081 -3.922 -1.874 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.445 -4.965 -0.616 1.00 0.00 H new ATOM 0 HG21 ILE A 16 12.925 -2.271 0.027 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.367 -3.296 -0.167 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.379 -2.872 -1.585 1.00 0.00 H new ATOM 0 HD11 ILE A 16 9.486 -2.683 -0.430 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.478 -3.061 0.998 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.123 -2.002 -0.278 1.00 0.00 H new ATOM 241 N LEU A 17 14.885 -6.164 0.443 1.00 0.00 N ATOM 242 CA LEU A 17 16.313 -6.347 0.829 1.00 0.00 C ATOM 243 C LEU A 17 16.965 -7.394 -0.077 1.00 0.00 C ATOM 244 O LEU A 17 18.088 -7.238 -0.515 1.00 0.00 O ATOM 245 CB LEU A 17 16.275 -6.839 2.276 1.00 0.00 C ATOM 246 CG LEU A 17 16.629 -5.685 3.215 1.00 0.00 C ATOM 247 CD1 LEU A 17 15.671 -4.518 2.972 1.00 0.00 C ATOM 248 CD2 LEU A 17 16.504 -6.152 4.667 1.00 0.00 C ATOM 0 H LEU A 17 14.205 -6.432 1.155 1.00 0.00 H new ATOM 0 HA LEU A 17 16.892 -5.429 0.730 1.00 0.00 H new ATOM 0 HB2 LEU A 17 15.284 -7.225 2.514 1.00 0.00 H new ATOM 0 HB3 LEU A 17 16.978 -7.661 2.411 1.00 0.00 H new ATOM 0 HG LEU A 17 17.652 -5.362 3.023 1.00 0.00 H new ATOM 0 HD11 LEU A 17 15.923 -3.695 3.641 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.759 -4.185 1.938 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.648 -4.841 3.164 1.00 0.00 H new ATOM 0 HD21 LEU A 17 16.756 -5.330 5.337 1.00 0.00 H new ATOM 0 HD22 LEU A 17 15.481 -6.475 4.858 1.00 0.00 H new ATOM 0 HD23 LEU A 17 17.186 -6.984 4.842 1.00 0.00 H new ATOM 260 N ALA A 18 16.267 -8.458 -0.363 1.00 0.00 N ATOM 261 CA ALA A 18 16.843 -9.514 -1.243 1.00 0.00 C ATOM 262 C ALA A 18 16.849 -9.041 -2.700 1.00 0.00 C ATOM 263 O ALA A 18 17.320 -9.728 -3.584 1.00 0.00 O ATOM 264 CB ALA A 18 15.920 -10.721 -1.074 1.00 0.00 C ATOM 0 H ALA A 18 15.322 -8.642 -0.025 1.00 0.00 H new ATOM 0 HA ALA A 18 17.874 -9.752 -0.982 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.279 -11.543 -1.693 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.913 -11.030 -0.029 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.909 -10.452 -1.380 1.00 0.00 H new ATOM 270 N SER A 19 16.325 -7.873 -2.956 1.00 0.00 N ATOM 271 CA SER A 19 16.299 -7.357 -4.356 1.00 0.00 C ATOM 272 C SER A 19 15.400 -8.236 -5.228 1.00 0.00 C ATOM 273 O SER A 19 15.871 -9.016 -6.032 1.00 0.00 O ATOM 274 CB SER A 19 17.747 -7.430 -4.834 1.00 0.00 C ATOM 275 OG SER A 19 18.022 -6.316 -5.673 1.00 0.00 O ATOM 0 H SER A 19 15.914 -7.254 -2.257 1.00 0.00 H new ATOM 0 HA SER A 19 15.903 -6.343 -4.414 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.424 -7.432 -3.980 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.916 -8.360 -5.377 1.00 0.00 H new ATOM 0 HG SER A 19 18.952 -6.359 -5.980 1.00 0.00 H new ATOM 281 N ASP A 20 14.110 -8.116 -5.077 1.00 0.00 N ATOM 282 CA ASP A 20 13.182 -8.944 -5.900 1.00 0.00 C ATOM 283 C ASP A 20 13.605 -10.416 -5.860 1.00 0.00 C ATOM 284 O ASP A 20 13.888 -11.019 -6.875 1.00 0.00 O ATOM 285 CB ASP A 20 13.309 -8.390 -7.319 1.00 0.00 C ATOM 286 CG ASP A 20 12.149 -8.906 -8.173 1.00 0.00 C ATOM 287 OD1 ASP A 20 11.263 -9.531 -7.616 1.00 0.00 O ATOM 288 OD2 ASP A 20 12.169 -8.667 -9.369 1.00 0.00 O ATOM 0 H ASP A 20 13.658 -7.481 -4.420 1.00 0.00 H new ATOM 0 HA ASP A 20 12.156 -8.899 -5.534 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.302 -7.300 -7.297 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.260 -8.694 -7.756 1.00 0.00 H new ATOM 293 N LYS A 21 13.650 -10.999 -4.692 1.00 0.00 N ATOM 294 CA LYS A 21 14.053 -12.430 -4.587 1.00 0.00 C ATOM 295 C LYS A 21 13.338 -13.094 -3.410 1.00 0.00 C ATOM 296 O LYS A 21 13.111 -12.474 -2.389 1.00 0.00 O ATOM 297 CB LYS A 21 15.563 -12.401 -4.354 1.00 0.00 C ATOM 298 CG LYS A 21 16.281 -12.214 -5.693 1.00 0.00 C ATOM 299 CD LYS A 21 17.568 -13.040 -5.704 1.00 0.00 C ATOM 300 CE LYS A 21 18.497 -12.521 -6.804 1.00 0.00 C ATOM 301 NZ LYS A 21 19.106 -13.742 -7.401 1.00 0.00 N ATOM 0 H LYS A 21 13.425 -10.546 -3.806 1.00 0.00 H new ATOM 0 HA LYS A 21 13.791 -13.000 -5.478 1.00 0.00 H new ATOM 0 HB2 LYS A 21 15.822 -11.589 -3.674 1.00 0.00 H new ATOM 0 HB3 LYS A 21 15.887 -13.328 -3.882 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.631 -12.523 -6.512 1.00 0.00 H new ATOM 0 HG3 LYS A 21 16.512 -11.160 -5.850 1.00 0.00 H new ATOM 0 HD2 LYS A 21 18.063 -12.975 -4.735 1.00 0.00 H new ATOM 0 HD3 LYS A 21 17.337 -14.091 -5.874 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.945 -11.950 -7.550 1.00 0.00 H new ATOM 0 HE3 LYS A 21 19.260 -11.858 -6.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 20.102 -13.555 -7.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 19.052 -14.526 -6.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 18.590 -14.000 -8.267 1.00 0.00 H new ATOM 315 N PRO A 22 13.009 -14.343 -3.595 1.00 0.00 N ATOM 316 CA PRO A 22 12.313 -15.075 -2.506 1.00 0.00 C ATOM 317 C PRO A 22 13.313 -15.477 -1.419 1.00 0.00 C ATOM 318 O PRO A 22 12.973 -16.155 -0.469 1.00 0.00 O ATOM 319 CB PRO A 22 11.725 -16.314 -3.186 1.00 0.00 C ATOM 320 CG PRO A 22 12.432 -16.424 -4.498 1.00 0.00 C ATOM 321 CD PRO A 22 12.871 -15.039 -4.879 1.00 0.00 C ATOM 0 HA PRO A 22 11.546 -14.473 -2.020 1.00 0.00 H new ATOM 0 HB2 PRO A 22 11.882 -17.206 -2.580 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.649 -16.210 -3.328 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.290 -17.092 -4.419 1.00 0.00 H new ATOM 0 HG3 PRO A 22 11.772 -16.842 -5.258 1.00 0.00 H new ATOM 0 HD2 PRO A 22 13.813 -15.056 -5.427 1.00 0.00 H new ATOM 0 HD3 PRO A 22 12.138 -14.551 -5.521 1.00 0.00 H new ATOM 329 N TYR A 23 14.546 -15.065 -1.550 1.00 0.00 N ATOM 330 CA TYR A 23 15.564 -15.426 -0.519 1.00 0.00 C ATOM 331 C TYR A 23 16.619 -14.322 -0.404 1.00 0.00 C ATOM 332 O TYR A 23 16.613 -13.363 -1.150 1.00 0.00 O ATOM 333 CB TYR A 23 16.195 -16.723 -1.024 1.00 0.00 C ATOM 334 CG TYR A 23 16.867 -16.475 -2.354 1.00 0.00 C ATOM 335 CD1 TYR A 23 16.120 -16.529 -3.536 1.00 0.00 C ATOM 336 CD2 TYR A 23 18.238 -16.192 -2.404 1.00 0.00 C ATOM 337 CE1 TYR A 23 16.743 -16.300 -4.769 1.00 0.00 C ATOM 338 CE2 TYR A 23 18.861 -15.964 -3.637 1.00 0.00 C ATOM 339 CZ TYR A 23 18.114 -16.019 -4.818 1.00 0.00 C ATOM 340 OH TYR A 23 18.728 -15.794 -6.034 1.00 0.00 O ATOM 0 H TYR A 23 14.892 -14.496 -2.323 1.00 0.00 H new ATOM 0 HA TYR A 23 15.124 -15.545 0.471 1.00 0.00 H new ATOM 0 HB2 TYR A 23 16.922 -17.091 -0.301 1.00 0.00 H new ATOM 0 HB3 TYR A 23 15.432 -17.494 -1.129 1.00 0.00 H new ATOM 0 HD1 TYR A 23 15.063 -16.747 -3.497 1.00 0.00 H new ATOM 0 HD2 TYR A 23 18.814 -16.150 -1.492 1.00 0.00 H new ATOM 0 HE1 TYR A 23 16.167 -16.340 -5.681 1.00 0.00 H new ATOM 0 HE2 TYR A 23 19.918 -15.746 -3.676 1.00 0.00 H new ATOM 0 HH TYR A 23 18.266 -16.303 -6.733 1.00 0.00 H new ATOM 350 N ILE A 24 17.527 -14.452 0.526 1.00 0.00 N ATOM 351 CA ILE A 24 18.584 -13.411 0.689 1.00 0.00 C ATOM 352 C ILE A 24 19.858 -14.039 1.262 1.00 0.00 C ATOM 353 O ILE A 24 19.819 -15.077 1.892 1.00 0.00 O ATOM 354 CB ILE A 24 17.993 -12.396 1.670 1.00 0.00 C ATOM 355 CG1 ILE A 24 18.938 -11.198 1.796 1.00 0.00 C ATOM 356 CG2 ILE A 24 17.816 -13.051 3.041 1.00 0.00 C ATOM 357 CD1 ILE A 24 18.459 -10.288 2.928 1.00 0.00 C ATOM 0 H ILE A 24 17.583 -15.233 1.180 1.00 0.00 H new ATOM 0 HA ILE A 24 18.859 -12.947 -0.258 1.00 0.00 H new ATOM 0 HB ILE A 24 17.024 -12.059 1.302 1.00 0.00 H new ATOM 0 HG12 ILE A 24 19.953 -11.541 1.996 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.968 -10.644 0.858 1.00 0.00 H new ATOM 0 HG21 ILE A 24 17.395 -12.327 3.739 1.00 0.00 H new ATOM 0 HG22 ILE A 24 17.143 -13.904 2.953 1.00 0.00 H new ATOM 0 HG23 ILE A 24 18.784 -13.390 3.410 1.00 0.00 H new ATOM 0 HD11 ILE A 24 19.131 -9.435 3.018 1.00 0.00 H new ATOM 0 HD12 ILE A 24 17.451 -9.934 2.709 1.00 0.00 H new ATOM 0 HD13 ILE A 24 18.452 -10.845 3.865 1.00 0.00 H new ATOM 369 N LEU A 25 20.986 -13.420 1.046 1.00 0.00 N ATOM 370 CA LEU A 25 22.261 -13.985 1.576 1.00 0.00 C ATOM 371 C LEU A 25 22.529 -13.456 2.987 1.00 0.00 C ATOM 372 O LEU A 25 22.153 -12.352 3.329 1.00 0.00 O ATOM 373 CB LEU A 25 23.341 -13.497 0.610 1.00 0.00 C ATOM 374 CG LEU A 25 23.242 -14.276 -0.703 1.00 0.00 C ATOM 375 CD1 LEU A 25 22.407 -13.479 -1.709 1.00 0.00 C ATOM 376 CD2 LEU A 25 24.644 -14.500 -1.271 1.00 0.00 C ATOM 0 H LEU A 25 21.081 -12.548 0.526 1.00 0.00 H new ATOM 0 HA LEU A 25 22.233 -15.073 1.644 1.00 0.00 H new ATOM 0 HB2 LEU A 25 23.220 -12.430 0.422 1.00 0.00 H new ATOM 0 HB3 LEU A 25 24.328 -13.633 1.052 1.00 0.00 H new ATOM 0 HG LEU A 25 22.766 -15.239 -0.517 1.00 0.00 H new ATOM 0 HD11 LEU A 25 22.337 -14.034 -2.644 1.00 0.00 H new ATOM 0 HD12 LEU A 25 21.407 -13.319 -1.306 1.00 0.00 H new ATOM 0 HD13 LEU A 25 22.882 -12.516 -1.894 1.00 0.00 H new ATOM 0 HD21 LEU A 25 24.573 -15.055 -2.206 1.00 0.00 H new ATOM 0 HD22 LEU A 25 25.120 -13.537 -1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 25 25.240 -15.068 -0.556 1.00 0.00 H new ATOM 388 N ALA A 26 23.175 -14.236 3.809 1.00 0.00 N ATOM 389 CA ALA A 26 23.468 -13.778 5.198 1.00 0.00 C ATOM 390 C ALA A 26 24.279 -12.481 5.162 1.00 0.00 C ATOM 391 O ALA A 26 24.122 -11.614 5.999 1.00 0.00 O ATOM 392 CB ALA A 26 24.287 -14.905 5.826 1.00 0.00 C ATOM 0 H ALA A 26 23.513 -15.171 3.580 1.00 0.00 H new ATOM 0 HA ALA A 26 22.560 -13.572 5.766 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.542 -14.641 6.852 1.00 0.00 H new ATOM 0 HB2 ALA A 26 23.703 -15.825 5.822 1.00 0.00 H new ATOM 0 HB3 ALA A 26 25.201 -15.054 5.252 1.00 0.00 H new ATOM 398 N GLU A 27 25.140 -12.340 4.197 1.00 0.00 N ATOM 399 CA GLU A 27 25.955 -11.097 4.100 1.00 0.00 C ATOM 400 C GLU A 27 25.070 -9.922 3.681 1.00 0.00 C ATOM 401 O GLU A 27 25.279 -8.796 4.087 1.00 0.00 O ATOM 402 CB GLU A 27 26.997 -11.393 3.023 1.00 0.00 C ATOM 403 CG GLU A 27 28.213 -12.070 3.658 1.00 0.00 C ATOM 404 CD GLU A 27 29.056 -12.732 2.566 1.00 0.00 C ATOM 405 OE1 GLU A 27 29.030 -12.244 1.448 1.00 0.00 O ATOM 406 OE2 GLU A 27 29.711 -13.716 2.866 1.00 0.00 O ATOM 0 H GLU A 27 25.316 -13.032 3.469 1.00 0.00 H new ATOM 0 HA GLU A 27 26.416 -10.827 5.050 1.00 0.00 H new ATOM 0 HB2 GLU A 27 26.569 -12.038 2.256 1.00 0.00 H new ATOM 0 HB3 GLU A 27 27.299 -10.469 2.531 1.00 0.00 H new ATOM 0 HG2 GLU A 27 28.810 -11.336 4.199 1.00 0.00 H new ATOM 0 HG3 GLU A 27 27.890 -12.815 4.385 1.00 0.00 H new ATOM 413 N GLU A 28 24.085 -10.176 2.862 1.00 0.00 N ATOM 414 CA GLU A 28 23.190 -9.074 2.403 1.00 0.00 C ATOM 415 C GLU A 28 22.447 -8.458 3.589 1.00 0.00 C ATOM 416 O GLU A 28 22.453 -7.258 3.777 1.00 0.00 O ATOM 417 CB GLU A 28 22.205 -9.740 1.442 1.00 0.00 C ATOM 418 CG GLU A 28 21.613 -8.684 0.508 1.00 0.00 C ATOM 419 CD GLU A 28 22.590 -8.408 -0.636 1.00 0.00 C ATOM 420 OE1 GLU A 28 22.557 -9.144 -1.608 1.00 0.00 O ATOM 421 OE2 GLU A 28 23.356 -7.465 -0.520 1.00 0.00 O ATOM 0 H GLU A 28 23.861 -11.099 2.491 1.00 0.00 H new ATOM 0 HA GLU A 28 23.745 -8.266 1.927 1.00 0.00 H new ATOM 0 HB2 GLU A 28 22.711 -10.512 0.862 1.00 0.00 H new ATOM 0 HB3 GLU A 28 21.410 -10.232 2.002 1.00 0.00 H new ATOM 0 HG2 GLU A 28 20.659 -9.029 0.110 1.00 0.00 H new ATOM 0 HG3 GLU A 28 21.414 -7.765 1.060 1.00 0.00 H new ATOM 428 N LEU A 29 21.816 -9.263 4.401 1.00 0.00 N ATOM 429 CA LEU A 29 21.092 -8.698 5.574 1.00 0.00 C ATOM 430 C LEU A 29 22.104 -8.106 6.555 1.00 0.00 C ATOM 431 O LEU A 29 21.842 -7.121 7.215 1.00 0.00 O ATOM 432 CB LEU A 29 20.324 -9.870 6.198 1.00 0.00 C ATOM 433 CG LEU A 29 21.291 -10.837 6.885 1.00 0.00 C ATOM 434 CD1 LEU A 29 21.685 -10.286 8.257 1.00 0.00 C ATOM 435 CD2 LEU A 29 20.605 -12.193 7.064 1.00 0.00 C ATOM 0 H LEU A 29 21.771 -10.277 4.304 1.00 0.00 H new ATOM 0 HA LEU A 29 20.406 -7.897 5.297 1.00 0.00 H new ATOM 0 HB2 LEU A 29 19.600 -9.495 6.921 1.00 0.00 H new ATOM 0 HB3 LEU A 29 19.761 -10.396 5.427 1.00 0.00 H new ATOM 0 HG LEU A 29 22.185 -10.952 6.272 1.00 0.00 H new ATOM 0 HD11 LEU A 29 22.373 -10.977 8.743 1.00 0.00 H new ATOM 0 HD12 LEU A 29 22.170 -9.317 8.135 1.00 0.00 H new ATOM 0 HD13 LEU A 29 20.793 -10.170 8.872 1.00 0.00 H new ATOM 0 HD21 LEU A 29 21.290 -12.886 7.553 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.713 -12.071 7.678 1.00 0.00 H new ATOM 0 HD23 LEU A 29 20.323 -12.590 6.089 1.00 0.00 H new ATOM 447 N ARG A 30 23.268 -8.694 6.642 1.00 0.00 N ATOM 448 CA ARG A 30 24.304 -8.156 7.568 1.00 0.00 C ATOM 449 C ARG A 30 24.613 -6.702 7.204 1.00 0.00 C ATOM 450 O ARG A 30 24.882 -5.880 8.057 1.00 0.00 O ATOM 451 CB ARG A 30 25.532 -9.041 7.342 1.00 0.00 C ATOM 452 CG ARG A 30 26.615 -8.686 8.362 1.00 0.00 C ATOM 453 CD ARG A 30 27.985 -8.706 7.680 1.00 0.00 C ATOM 454 NE ARG A 30 28.965 -8.894 8.786 1.00 0.00 N ATOM 455 CZ ARG A 30 29.046 -10.041 9.406 1.00 0.00 C ATOM 456 NH1 ARG A 30 28.261 -11.028 9.066 1.00 0.00 N ATOM 457 NH2 ARG A 30 29.911 -10.201 10.369 1.00 0.00 N ATOM 0 H ARG A 30 23.544 -9.521 6.113 1.00 0.00 H new ATOM 0 HA ARG A 30 23.984 -8.167 8.610 1.00 0.00 H new ATOM 0 HB2 ARG A 30 25.258 -10.092 7.438 1.00 0.00 H new ATOM 0 HB3 ARG A 30 25.912 -8.902 6.330 1.00 0.00 H new ATOM 0 HG2 ARG A 30 26.422 -7.700 8.785 1.00 0.00 H new ATOM 0 HG3 ARG A 30 26.598 -9.396 9.188 1.00 0.00 H new ATOM 0 HD2 ARG A 30 28.052 -9.515 6.952 1.00 0.00 H new ATOM 0 HD3 ARG A 30 28.171 -7.777 7.142 1.00 0.00 H new ATOM 0 HE ARG A 30 29.575 -8.124 9.060 1.00 0.00 H new ATOM 0 HH11 ARG A 30 27.582 -10.904 8.315 1.00 0.00 H new ATOM 0 HH12 ARG A 30 28.327 -11.922 9.552 1.00 0.00 H new ATOM 0 HH21 ARG A 30 30.524 -9.431 10.637 1.00 0.00 H new ATOM 0 HH22 ARG A 30 29.975 -11.096 10.854 1.00 0.00 H new ATOM 471 N ARG A 31 24.573 -6.382 5.938 1.00 0.00 N ATOM 472 CA ARG A 31 24.860 -4.982 5.508 1.00 0.00 C ATOM 473 C ARG A 31 23.563 -4.173 5.443 1.00 0.00 C ATOM 474 O ARG A 31 23.554 -2.975 5.645 1.00 0.00 O ATOM 475 CB ARG A 31 25.475 -5.117 4.115 1.00 0.00 C ATOM 476 CG ARG A 31 26.396 -3.926 3.844 1.00 0.00 C ATOM 477 CD ARG A 31 27.456 -4.326 2.815 1.00 0.00 C ATOM 478 NE ARG A 31 28.593 -3.394 3.054 1.00 0.00 N ATOM 479 CZ ARG A 31 29.789 -3.694 2.622 1.00 0.00 C ATOM 480 NH1 ARG A 31 29.994 -4.811 1.977 1.00 0.00 N ATOM 481 NH2 ARG A 31 30.783 -2.875 2.834 1.00 0.00 N ATOM 0 H ARG A 31 24.354 -7.031 5.182 1.00 0.00 H new ATOM 0 HA ARG A 31 25.524 -4.464 6.201 1.00 0.00 H new ATOM 0 HB2 ARG A 31 26.037 -6.048 4.043 1.00 0.00 H new ATOM 0 HB3 ARG A 31 24.688 -5.160 3.362 1.00 0.00 H new ATOM 0 HG2 ARG A 31 25.816 -3.080 3.475 1.00 0.00 H new ATOM 0 HG3 ARG A 31 26.875 -3.605 4.769 1.00 0.00 H new ATOM 0 HD2 ARG A 31 27.762 -5.364 2.946 1.00 0.00 H new ATOM 0 HD3 ARG A 31 27.075 -4.232 1.798 1.00 0.00 H new ATOM 0 HE ARG A 31 28.438 -2.520 3.556 1.00 0.00 H new ATOM 0 HH11 ARG A 31 29.219 -5.453 1.809 1.00 0.00 H new ATOM 0 HH12 ARG A 31 30.929 -5.042 1.641 1.00 0.00 H new ATOM 0 HH21 ARG A 31 30.626 -2.001 3.337 1.00 0.00 H new ATOM 0 HH22 ARG A 31 31.717 -3.109 2.497 1.00 0.00 H new ATOM 495 N GLU A 32 22.464 -4.819 5.159 1.00 0.00 N ATOM 496 CA GLU A 32 21.167 -4.088 5.079 1.00 0.00 C ATOM 497 C GLU A 32 20.578 -3.898 6.480 1.00 0.00 C ATOM 498 O GLU A 32 19.790 -3.004 6.716 1.00 0.00 O ATOM 499 CB GLU A 32 20.261 -4.985 4.237 1.00 0.00 C ATOM 500 CG GLU A 32 20.936 -5.284 2.896 1.00 0.00 C ATOM 501 CD GLU A 32 20.299 -4.426 1.801 1.00 0.00 C ATOM 502 OE1 GLU A 32 19.911 -3.309 2.102 1.00 0.00 O ATOM 503 OE2 GLU A 32 20.212 -4.899 0.680 1.00 0.00 O ATOM 0 H GLU A 32 22.409 -5.821 4.979 1.00 0.00 H new ATOM 0 HA GLU A 32 21.279 -3.095 4.644 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.058 -5.915 4.768 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.301 -4.496 4.071 1.00 0.00 H new ATOM 0 HG2 GLU A 32 22.004 -5.076 2.960 1.00 0.00 H new ATOM 0 HG3 GLU A 32 20.831 -6.341 2.652 1.00 0.00 H new ATOM 510 N LEU A 33 20.955 -4.732 7.411 1.00 0.00 N ATOM 511 CA LEU A 33 20.418 -4.600 8.793 1.00 0.00 C ATOM 512 C LEU A 33 21.563 -4.364 9.782 1.00 0.00 C ATOM 513 O LEU A 33 22.653 -4.870 9.601 1.00 0.00 O ATOM 514 CB LEU A 33 19.736 -5.938 9.073 1.00 0.00 C ATOM 515 CG LEU A 33 18.229 -5.805 8.847 1.00 0.00 C ATOM 516 CD1 LEU A 33 17.565 -7.174 9.006 1.00 0.00 C ATOM 517 CD2 LEU A 33 17.641 -4.835 9.873 1.00 0.00 C ATOM 0 H LEU A 33 21.612 -5.499 7.273 1.00 0.00 H new ATOM 0 HA LEU A 33 19.731 -3.760 8.896 1.00 0.00 H new ATOM 0 HB2 LEU A 33 20.145 -6.709 8.420 1.00 0.00 H new ATOM 0 HB3 LEU A 33 19.934 -6.251 10.098 1.00 0.00 H new ATOM 0 HG LEU A 33 18.047 -5.426 7.841 1.00 0.00 H new ATOM 0 HD11 LEU A 33 16.491 -7.078 8.845 1.00 0.00 H new ATOM 0 HD12 LEU A 33 17.981 -7.867 8.275 1.00 0.00 H new ATOM 0 HD13 LEU A 33 17.749 -7.553 10.011 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.567 -4.741 9.711 1.00 0.00 H new ATOM 0 HD22 LEU A 33 17.825 -5.214 10.879 1.00 0.00 H new ATOM 0 HD23 LEU A 33 18.112 -3.858 9.762 1.00 0.00 H new ATOM 529 N PRO A 34 21.273 -3.605 10.802 1.00 0.00 N ATOM 530 CA PRO A 34 22.323 -3.326 11.815 1.00 0.00 C ATOM 531 C PRO A 34 22.918 -4.637 12.338 1.00 0.00 C ATOM 532 O PRO A 34 22.303 -5.680 12.244 1.00 0.00 O ATOM 533 CB PRO A 34 21.596 -2.571 12.933 1.00 0.00 C ATOM 534 CG PRO A 34 20.150 -2.542 12.546 1.00 0.00 C ATOM 535 CD PRO A 34 20.076 -2.811 11.070 1.00 0.00 C ATOM 0 HA PRO A 34 23.153 -2.749 11.408 1.00 0.00 H new ATOM 0 HB2 PRO A 34 21.732 -3.070 13.892 1.00 0.00 H new ATOM 0 HB3 PRO A 34 21.990 -1.561 13.041 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.589 -3.293 13.102 1.00 0.00 H new ATOM 0 HG3 PRO A 34 19.708 -1.574 12.783 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.168 -3.354 10.807 1.00 0.00 H new ATOM 0 HD3 PRO A 34 20.072 -1.886 10.494 1.00 0.00 H new ATOM 543 N PRO A 35 24.106 -4.533 12.869 1.00 0.00 N ATOM 544 CA PRO A 35 24.778 -5.749 13.401 1.00 0.00 C ATOM 545 C PRO A 35 23.844 -6.515 14.344 1.00 0.00 C ATOM 546 O PRO A 35 23.808 -7.729 14.343 1.00 0.00 O ATOM 547 CB PRO A 35 25.991 -5.216 14.163 1.00 0.00 C ATOM 548 CG PRO A 35 25.720 -3.763 14.384 1.00 0.00 C ATOM 549 CD PRO A 35 24.800 -3.311 13.285 1.00 0.00 C ATOM 0 HA PRO A 35 25.058 -6.445 12.610 1.00 0.00 H new ATOM 0 HB2 PRO A 35 26.120 -5.739 15.110 1.00 0.00 H new ATOM 0 HB3 PRO A 35 26.908 -5.361 13.592 1.00 0.00 H new ATOM 0 HG2 PRO A 35 25.262 -3.601 15.360 1.00 0.00 H new ATOM 0 HG3 PRO A 35 26.648 -3.192 14.368 1.00 0.00 H new ATOM 0 HD2 PRO A 35 24.098 -2.556 13.639 1.00 0.00 H new ATOM 0 HD3 PRO A 35 25.355 -2.868 12.458 1.00 0.00 H new ATOM 557 N ASP A 36 23.093 -5.817 15.151 1.00 0.00 N ATOM 558 CA ASP A 36 22.169 -6.511 16.093 1.00 0.00 C ATOM 559 C ASP A 36 21.085 -7.268 15.319 1.00 0.00 C ATOM 560 O ASP A 36 20.793 -8.413 15.604 1.00 0.00 O ATOM 561 CB ASP A 36 21.549 -5.393 16.934 1.00 0.00 C ATOM 562 CG ASP A 36 21.656 -5.752 18.418 1.00 0.00 C ATOM 563 OD1 ASP A 36 21.734 -6.931 18.718 1.00 0.00 O ATOM 564 OD2 ASP A 36 21.658 -4.840 19.229 1.00 0.00 O ATOM 0 H ASP A 36 23.079 -4.798 15.199 1.00 0.00 H new ATOM 0 HA ASP A 36 22.686 -7.247 16.709 1.00 0.00 H new ATOM 0 HB2 ASP A 36 22.060 -4.450 16.739 1.00 0.00 H new ATOM 0 HB3 ASP A 36 20.504 -5.252 16.657 1.00 0.00 H new ATOM 569 N GLN A 37 20.484 -6.638 14.347 1.00 0.00 N ATOM 570 CA GLN A 37 19.416 -7.322 13.560 1.00 0.00 C ATOM 571 C GLN A 37 20.013 -8.431 12.687 1.00 0.00 C ATOM 572 O GLN A 37 19.428 -9.482 12.516 1.00 0.00 O ATOM 573 CB GLN A 37 18.804 -6.225 12.688 1.00 0.00 C ATOM 574 CG GLN A 37 18.064 -5.219 13.573 1.00 0.00 C ATOM 575 CD GLN A 37 16.813 -5.877 14.158 1.00 0.00 C ATOM 576 OE1 GLN A 37 16.417 -6.943 13.730 1.00 0.00 O ATOM 577 NE2 GLN A 37 16.171 -5.283 15.126 1.00 0.00 N ATOM 0 H GLN A 37 20.685 -5.679 14.063 1.00 0.00 H new ATOM 0 HA GLN A 37 18.675 -7.797 14.204 1.00 0.00 H new ATOM 0 HB2 GLN A 37 19.585 -5.720 12.120 1.00 0.00 H new ATOM 0 HB3 GLN A 37 18.116 -6.663 11.964 1.00 0.00 H new ATOM 0 HG2 GLN A 37 18.717 -4.876 14.376 1.00 0.00 H new ATOM 0 HG3 GLN A 37 17.787 -4.341 12.990 1.00 0.00 H new ATOM 0 HE21 GLN A 37 16.504 -4.388 15.485 1.00 0.00 H new ATOM 0 HE22 GLN A 37 15.336 -5.713 15.524 1.00 0.00 H new ATOM 586 N ALA A 38 21.169 -8.201 12.125 1.00 0.00 N ATOM 587 CA ALA A 38 21.797 -9.238 11.254 1.00 0.00 C ATOM 588 C ALA A 38 21.986 -10.551 12.021 1.00 0.00 C ATOM 589 O ALA A 38 21.753 -11.623 11.501 1.00 0.00 O ATOM 590 CB ALA A 38 23.153 -8.651 10.857 1.00 0.00 C ATOM 0 H ALA A 38 21.706 -7.340 12.231 1.00 0.00 H new ATOM 0 HA ALA A 38 21.178 -9.471 10.387 1.00 0.00 H new ATOM 0 HB1 ALA A 38 23.680 -9.355 10.213 1.00 0.00 H new ATOM 0 HB2 ALA A 38 23.001 -7.714 10.322 1.00 0.00 H new ATOM 0 HB3 ALA A 38 23.745 -8.465 11.753 1.00 0.00 H new ATOM 596 N GLN A 39 22.418 -10.476 13.250 1.00 0.00 N ATOM 597 CA GLN A 39 22.631 -11.721 14.045 1.00 0.00 C ATOM 598 C GLN A 39 21.318 -12.498 14.197 1.00 0.00 C ATOM 599 O GLN A 39 21.270 -13.696 14.000 1.00 0.00 O ATOM 600 CB GLN A 39 23.127 -11.236 15.407 1.00 0.00 C ATOM 601 CG GLN A 39 23.683 -12.417 16.204 1.00 0.00 C ATOM 602 CD GLN A 39 25.198 -12.494 16.013 1.00 0.00 C ATOM 603 OE1 GLN A 39 25.754 -11.807 15.179 1.00 0.00 O ATOM 604 NE2 GLN A 39 25.897 -13.308 16.757 1.00 0.00 N ATOM 0 H GLN A 39 22.633 -9.607 13.739 1.00 0.00 H new ATOM 0 HA GLN A 39 23.339 -12.397 13.565 1.00 0.00 H new ATOM 0 HB2 GLN A 39 23.899 -10.478 15.275 1.00 0.00 H new ATOM 0 HB3 GLN A 39 22.311 -10.767 15.956 1.00 0.00 H new ATOM 0 HG2 GLN A 39 23.445 -12.300 17.261 1.00 0.00 H new ATOM 0 HG3 GLN A 39 23.217 -13.345 15.873 1.00 0.00 H new ATOM 0 HE21 GLN A 39 25.432 -13.885 17.457 1.00 0.00 H new ATOM 0 HE22 GLN A 39 26.908 -13.367 16.638 1.00 0.00 H new ATOM 613 N TYR A 40 20.256 -11.828 14.550 1.00 0.00 N ATOM 614 CA TYR A 40 18.952 -12.534 14.722 1.00 0.00 C ATOM 615 C TYR A 40 18.453 -13.078 13.380 1.00 0.00 C ATOM 616 O TYR A 40 17.983 -14.194 13.290 1.00 0.00 O ATOM 617 CB TYR A 40 17.994 -11.468 15.257 1.00 0.00 C ATOM 618 CG TYR A 40 17.711 -11.731 16.717 1.00 0.00 C ATOM 619 CD1 TYR A 40 18.768 -11.994 17.598 1.00 0.00 C ATOM 620 CD2 TYR A 40 16.393 -11.718 17.189 1.00 0.00 C ATOM 621 CE1 TYR A 40 18.506 -12.240 18.952 1.00 0.00 C ATOM 622 CE2 TYR A 40 16.132 -11.964 18.543 1.00 0.00 C ATOM 623 CZ TYR A 40 17.188 -12.225 19.424 1.00 0.00 C ATOM 624 OH TYR A 40 16.931 -12.469 20.757 1.00 0.00 O ATOM 0 H TYR A 40 20.233 -10.824 14.727 1.00 0.00 H new ATOM 0 HA TYR A 40 19.034 -13.388 15.395 1.00 0.00 H new ATOM 0 HB2 TYR A 40 18.430 -10.477 15.133 1.00 0.00 H new ATOM 0 HB3 TYR A 40 17.065 -11.481 14.688 1.00 0.00 H new ATOM 0 HD1 TYR A 40 19.785 -12.007 17.233 1.00 0.00 H new ATOM 0 HD2 TYR A 40 15.578 -11.518 16.509 1.00 0.00 H new ATOM 0 HE1 TYR A 40 19.321 -12.441 19.632 1.00 0.00 H new ATOM 0 HE2 TYR A 40 15.115 -11.952 18.907 1.00 0.00 H new ATOM 0 HH TYR A 40 15.966 -12.420 20.918 1.00 0.00 H new ATOM 634 N CYS A 41 18.542 -12.296 12.340 1.00 0.00 N ATOM 635 CA CYS A 41 18.064 -12.765 11.006 1.00 0.00 C ATOM 636 C CYS A 41 18.870 -13.978 10.529 1.00 0.00 C ATOM 637 O CYS A 41 18.325 -14.929 10.003 1.00 0.00 O ATOM 638 CB CYS A 41 18.287 -11.578 10.070 1.00 0.00 C ATOM 639 SG CYS A 41 16.836 -10.497 10.106 1.00 0.00 S ATOM 0 H CYS A 41 18.925 -11.351 12.355 1.00 0.00 H new ATOM 0 HA CYS A 41 17.021 -13.080 11.038 1.00 0.00 H new ATOM 0 HB2 CYS A 41 19.174 -11.023 10.375 1.00 0.00 H new ATOM 0 HB3 CYS A 41 18.465 -11.931 9.054 1.00 0.00 H new ATOM 0 HG CYS A 41 16.247 -10.522 8.947 1.00 0.00 H new ATOM 645 N ILE A 42 20.164 -13.951 10.696 1.00 0.00 N ATOM 646 CA ILE A 42 20.999 -15.099 10.239 1.00 0.00 C ATOM 647 C ILE A 42 20.851 -16.286 11.197 1.00 0.00 C ATOM 648 O ILE A 42 21.273 -17.387 10.905 1.00 0.00 O ATOM 649 CB ILE A 42 22.431 -14.572 10.262 1.00 0.00 C ATOM 650 CG1 ILE A 42 22.613 -13.546 9.140 1.00 0.00 C ATOM 651 CG2 ILE A 42 23.408 -15.731 10.057 1.00 0.00 C ATOM 652 CD1 ILE A 42 23.873 -12.719 9.401 1.00 0.00 C ATOM 0 H ILE A 42 20.679 -13.184 11.129 1.00 0.00 H new ATOM 0 HA ILE A 42 20.705 -15.454 9.251 1.00 0.00 H new ATOM 0 HB ILE A 42 22.628 -14.100 11.224 1.00 0.00 H new ATOM 0 HG12 ILE A 42 22.691 -14.053 8.179 1.00 0.00 H new ATOM 0 HG13 ILE A 42 21.742 -12.893 9.086 1.00 0.00 H new ATOM 0 HG21 ILE A 42 24.430 -15.353 10.074 1.00 0.00 H new ATOM 0 HG22 ILE A 42 23.278 -16.462 10.855 1.00 0.00 H new ATOM 0 HG23 ILE A 42 23.213 -16.206 9.096 1.00 0.00 H new ATOM 0 HD11 ILE A 42 24.001 -11.989 8.602 1.00 0.00 H new ATOM 0 HD12 ILE A 42 23.776 -12.200 10.354 1.00 0.00 H new ATOM 0 HD13 ILE A 42 24.741 -13.378 9.433 1.00 0.00 H new ATOM 664 N LYS A 43 20.267 -16.068 12.341 1.00 0.00 N ATOM 665 CA LYS A 43 20.105 -17.178 13.323 1.00 0.00 C ATOM 666 C LYS A 43 18.871 -18.029 12.997 1.00 0.00 C ATOM 667 O LYS A 43 18.721 -19.128 13.494 1.00 0.00 O ATOM 668 CB LYS A 43 19.920 -16.479 14.667 1.00 0.00 C ATOM 669 CG LYS A 43 20.992 -16.958 15.649 1.00 0.00 C ATOM 670 CD LYS A 43 20.345 -17.825 16.730 1.00 0.00 C ATOM 671 CE LYS A 43 21.377 -18.820 17.270 1.00 0.00 C ATOM 672 NZ LYS A 43 21.564 -18.441 18.699 1.00 0.00 N ATOM 0 H LYS A 43 19.894 -15.167 12.640 1.00 0.00 H new ATOM 0 HA LYS A 43 20.959 -17.855 13.313 1.00 0.00 H new ATOM 0 HB2 LYS A 43 19.987 -15.399 14.538 1.00 0.00 H new ATOM 0 HB3 LYS A 43 18.928 -16.691 15.065 1.00 0.00 H new ATOM 0 HG2 LYS A 43 21.756 -17.528 15.120 1.00 0.00 H new ATOM 0 HG3 LYS A 43 21.491 -16.103 16.105 1.00 0.00 H new ATOM 0 HD2 LYS A 43 19.971 -17.198 17.539 1.00 0.00 H new ATOM 0 HD3 LYS A 43 19.489 -18.360 16.319 1.00 0.00 H new ATOM 0 HE2 LYS A 43 21.023 -19.847 17.177 1.00 0.00 H new ATOM 0 HE3 LYS A 43 22.315 -18.755 16.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 22.258 -19.078 19.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 21.908 -17.461 18.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 20.656 -18.519 19.200 1.00 0.00 H new ATOM 686 N ARG A 44 17.984 -17.533 12.178 1.00 0.00 N ATOM 687 CA ARG A 44 16.764 -18.327 11.846 1.00 0.00 C ATOM 688 C ARG A 44 16.718 -18.664 10.352 1.00 0.00 C ATOM 689 O ARG A 44 16.629 -19.816 9.979 1.00 0.00 O ATOM 690 CB ARG A 44 15.593 -17.425 12.233 1.00 0.00 C ATOM 691 CG ARG A 44 14.865 -18.032 13.434 1.00 0.00 C ATOM 692 CD ARG A 44 15.792 -18.026 14.653 1.00 0.00 C ATOM 693 NE ARG A 44 15.814 -16.609 15.111 1.00 0.00 N ATOM 694 CZ ARG A 44 16.158 -16.320 16.337 1.00 0.00 C ATOM 695 NH1 ARG A 44 16.496 -17.270 17.167 1.00 0.00 N ATOM 696 NH2 ARG A 44 16.168 -15.076 16.733 1.00 0.00 N ATOM 0 H ARG A 44 18.049 -16.620 11.727 1.00 0.00 H new ATOM 0 HA ARG A 44 16.742 -19.280 12.374 1.00 0.00 H new ATOM 0 HB2 ARG A 44 15.954 -16.426 12.478 1.00 0.00 H new ATOM 0 HB3 ARG A 44 14.907 -17.319 11.393 1.00 0.00 H new ATOM 0 HG2 ARG A 44 13.961 -17.463 13.649 1.00 0.00 H new ATOM 0 HG3 ARG A 44 14.554 -19.051 13.206 1.00 0.00 H new ATOM 0 HD2 ARG A 44 15.421 -18.688 15.435 1.00 0.00 H new ATOM 0 HD3 ARG A 44 16.792 -18.372 14.391 1.00 0.00 H new ATOM 0 HE ARG A 44 15.560 -15.862 14.465 1.00 0.00 H new ATOM 0 HH11 ARG A 44 16.492 -18.242 16.858 1.00 0.00 H new ATOM 0 HH12 ARG A 44 16.764 -17.040 18.124 1.00 0.00 H new ATOM 0 HH21 ARG A 44 15.907 -14.332 16.085 1.00 0.00 H new ATOM 0 HH22 ARG A 44 16.436 -14.848 17.690 1.00 0.00 H new ATOM 710 N MET A 45 16.763 -17.666 9.502 1.00 0.00 N ATOM 711 CA MET A 45 16.715 -17.907 8.024 1.00 0.00 C ATOM 712 C MET A 45 17.324 -19.266 7.655 1.00 0.00 C ATOM 713 O MET A 45 18.520 -19.385 7.477 1.00 0.00 O ATOM 714 CB MET A 45 17.544 -16.773 7.424 1.00 0.00 C ATOM 715 CG MET A 45 16.830 -16.222 6.191 1.00 0.00 C ATOM 716 SD MET A 45 17.330 -14.506 5.920 1.00 0.00 S ATOM 717 CE MET A 45 16.333 -13.778 7.243 1.00 0.00 C ATOM 0 H MET A 45 16.832 -16.685 9.772 1.00 0.00 H new ATOM 0 HA MET A 45 15.691 -17.925 7.652 1.00 0.00 H new ATOM 0 HB2 MET A 45 17.685 -15.982 8.160 1.00 0.00 H new ATOM 0 HB3 MET A 45 18.535 -17.136 7.152 1.00 0.00 H new ATOM 0 HG2 MET A 45 17.074 -16.825 5.317 1.00 0.00 H new ATOM 0 HG3 MET A 45 15.750 -16.280 6.327 1.00 0.00 H new ATOM 0 HE1 MET A 45 15.902 -12.838 6.899 1.00 0.00 H new ATOM 0 HE2 MET A 45 15.532 -14.466 7.516 1.00 0.00 H new ATOM 0 HE3 MET A 45 16.963 -13.591 8.113 1.00 0.00 H new ATOM 727 N PRO A 46 16.466 -20.246 7.549 1.00 0.00 N ATOM 728 CA PRO A 46 16.951 -21.606 7.189 1.00 0.00 C ATOM 729 C PRO A 46 17.664 -21.576 5.836 1.00 0.00 C ATOM 730 O PRO A 46 17.862 -20.530 5.250 1.00 0.00 O ATOM 731 CB PRO A 46 15.682 -22.459 7.109 1.00 0.00 C ATOM 732 CG PRO A 46 14.550 -21.486 7.063 1.00 0.00 C ATOM 733 CD PRO A 46 15.016 -20.240 7.757 1.00 0.00 C ATOM 0 HA PRO A 46 17.667 -21.997 7.912 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.691 -23.093 6.223 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.598 -23.119 7.972 1.00 0.00 H new ATOM 0 HG2 PRO A 46 14.268 -21.271 6.032 1.00 0.00 H new ATOM 0 HG3 PRO A 46 13.669 -21.896 7.556 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.555 -19.349 7.332 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.764 -20.254 8.817 1.00 0.00 H new ATOM 741 N ALA A 47 18.052 -22.717 5.333 1.00 0.00 N ATOM 742 CA ALA A 47 18.753 -22.752 4.017 1.00 0.00 C ATOM 743 C ALA A 47 17.738 -22.664 2.871 1.00 0.00 C ATOM 744 O ALA A 47 17.463 -23.638 2.199 1.00 0.00 O ATOM 745 CB ALA A 47 19.480 -24.097 3.988 1.00 0.00 C ATOM 0 H ALA A 47 17.914 -23.625 5.776 1.00 0.00 H new ATOM 0 HA ALA A 47 19.441 -21.915 3.895 1.00 0.00 H new ATOM 0 HB1 ALA A 47 20.021 -24.198 3.047 1.00 0.00 H new ATOM 0 HB2 ALA A 47 20.184 -24.148 4.819 1.00 0.00 H new ATOM 0 HB3 ALA A 47 18.754 -24.905 4.077 1.00 0.00 H new ATOM 751 N TYR A 48 17.185 -21.503 2.642 1.00 0.00 N ATOM 752 CA TYR A 48 16.195 -21.353 1.536 1.00 0.00 C ATOM 753 C TYR A 48 15.229 -22.548 1.515 1.00 0.00 C ATOM 754 O TYR A 48 14.507 -22.782 2.464 1.00 0.00 O ATOM 755 CB TYR A 48 17.045 -21.304 0.262 1.00 0.00 C ATOM 756 CG TYR A 48 16.200 -20.872 -0.921 1.00 0.00 C ATOM 757 CD1 TYR A 48 14.829 -20.622 -0.766 1.00 0.00 C ATOM 758 CD2 TYR A 48 16.797 -20.725 -2.180 1.00 0.00 C ATOM 759 CE1 TYR A 48 14.060 -20.223 -1.866 1.00 0.00 C ATOM 760 CE2 TYR A 48 16.027 -20.327 -3.279 1.00 0.00 C ATOM 761 CZ TYR A 48 14.660 -20.076 -3.123 1.00 0.00 C ATOM 762 OH TYR A 48 13.902 -19.683 -4.208 1.00 0.00 O ATOM 0 H TYR A 48 17.376 -20.653 3.172 1.00 0.00 H new ATOM 0 HA TYR A 48 15.575 -20.463 1.645 1.00 0.00 H new ATOM 0 HB2 TYR A 48 17.875 -20.610 0.397 1.00 0.00 H new ATOM 0 HB3 TYR A 48 17.478 -22.285 0.068 1.00 0.00 H new ATOM 0 HD1 TYR A 48 14.366 -20.737 0.203 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.852 -20.919 -2.303 1.00 0.00 H new ATOM 0 HE1 TYR A 48 13.005 -20.029 -1.745 1.00 0.00 H new ATOM 0 HE2 TYR A 48 16.489 -20.214 -4.249 1.00 0.00 H new ATOM 0 HH TYR A 48 14.472 -19.629 -5.003 1.00 0.00 H new ATOM 772 N SER A 49 15.202 -23.303 0.446 1.00 0.00 N ATOM 773 CA SER A 49 14.275 -24.470 0.382 1.00 0.00 C ATOM 774 C SER A 49 15.031 -25.769 0.679 1.00 0.00 C ATOM 775 O SER A 49 16.241 -25.832 0.579 1.00 0.00 O ATOM 776 CB SER A 49 13.749 -24.471 -1.053 1.00 0.00 C ATOM 777 OG SER A 49 12.339 -24.298 -1.036 1.00 0.00 O ATOM 0 H SER A 49 15.780 -23.161 -0.382 1.00 0.00 H new ATOM 0 HA SER A 49 13.471 -24.401 1.115 1.00 0.00 H new ATOM 0 HB2 SER A 49 14.218 -23.671 -1.625 1.00 0.00 H new ATOM 0 HB3 SER A 49 14.006 -25.408 -1.546 1.00 0.00 H new ATOM 0 HG SER A 49 11.999 -24.296 -1.955 1.00 0.00 H new ATOM 783 N GLY A 50 14.326 -26.804 1.045 1.00 0.00 N ATOM 784 CA GLY A 50 15.001 -28.097 1.350 1.00 0.00 C ATOM 785 C GLY A 50 15.537 -28.713 0.055 1.00 0.00 C ATOM 786 O GLY A 50 16.576 -29.343 0.053 1.00 0.00 O ATOM 0 H GLY A 50 13.311 -26.810 1.146 1.00 0.00 H new ATOM 0 HA2 GLY A 50 15.818 -27.936 2.053 1.00 0.00 H new ATOM 0 HA3 GLY A 50 14.300 -28.781 1.827 1.00 0.00 H new ATOM 790 N PRO A 51 14.807 -28.506 -1.008 1.00 0.00 N ATOM 791 CA PRO A 51 15.259 -29.068 -2.308 1.00 0.00 C ATOM 792 C PRO A 51 15.590 -27.939 -3.287 1.00 0.00 C ATOM 793 O PRO A 51 14.813 -27.026 -3.485 1.00 0.00 O ATOM 794 CB PRO A 51 14.064 -29.875 -2.801 1.00 0.00 C ATOM 795 CG PRO A 51 12.879 -29.261 -2.134 1.00 0.00 C ATOM 796 CD PRO A 51 13.354 -28.662 -0.837 1.00 0.00 C ATOM 0 HA PRO A 51 16.160 -29.674 -2.216 1.00 0.00 H new ATOM 0 HB2 PRO A 51 13.975 -29.825 -3.886 1.00 0.00 H new ATOM 0 HB3 PRO A 51 14.163 -30.928 -2.537 1.00 0.00 H new ATOM 0 HG2 PRO A 51 12.434 -28.496 -2.770 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.109 -30.011 -1.952 1.00 0.00 H new ATOM 0 HD2 PRO A 51 12.873 -27.703 -0.644 1.00 0.00 H new ATOM 0 HD3 PRO A 51 13.122 -29.311 0.007 1.00 0.00 H new ATOM 804 N GLY A 52 16.740 -27.993 -3.902 1.00 0.00 N ATOM 805 CA GLY A 52 17.121 -26.924 -4.866 1.00 0.00 C ATOM 806 C GLY A 52 17.928 -25.848 -4.137 1.00 0.00 C ATOM 807 O GLY A 52 18.825 -26.145 -3.372 1.00 0.00 O ATOM 0 H GLY A 52 17.432 -28.732 -3.778 1.00 0.00 H new ATOM 0 HA2 GLY A 52 17.709 -27.346 -5.681 1.00 0.00 H new ATOM 0 HA3 GLY A 52 16.228 -26.485 -5.312 1.00 0.00 H new ATOM 811 N SER A 53 17.619 -24.602 -4.367 1.00 0.00 N ATOM 812 CA SER A 53 18.367 -23.514 -3.690 1.00 0.00 C ATOM 813 C SER A 53 19.859 -23.650 -3.971 1.00 0.00 C ATOM 814 O SER A 53 20.298 -24.533 -4.682 1.00 0.00 O ATOM 815 CB SER A 53 18.085 -23.699 -2.200 1.00 0.00 C ATOM 816 OG SER A 53 19.020 -22.938 -1.446 1.00 0.00 O ATOM 0 H SER A 53 16.878 -24.293 -4.997 1.00 0.00 H new ATOM 0 HA SER A 53 18.064 -22.527 -4.040 1.00 0.00 H new ATOM 0 HB2 SER A 53 17.069 -23.380 -1.968 1.00 0.00 H new ATOM 0 HB3 SER A 53 18.157 -24.753 -1.933 1.00 0.00 H new ATOM 0 HG SER A 53 19.156 -23.360 -0.572 1.00 0.00 H new ATOM 822 N VAL A 54 20.635 -22.775 -3.414 1.00 0.00 N ATOM 823 CA VAL A 54 22.110 -22.828 -3.631 1.00 0.00 C ATOM 824 C VAL A 54 22.837 -22.914 -2.286 1.00 0.00 C ATOM 825 O VAL A 54 22.261 -22.646 -1.250 1.00 0.00 O ATOM 826 CB VAL A 54 22.453 -21.520 -4.344 1.00 0.00 C ATOM 827 CG1 VAL A 54 21.625 -21.401 -5.625 1.00 0.00 C ATOM 828 CG2 VAL A 54 22.137 -20.341 -3.422 1.00 0.00 C ATOM 0 H VAL A 54 20.315 -22.017 -2.812 1.00 0.00 H new ATOM 0 HA VAL A 54 22.412 -23.699 -4.212 1.00 0.00 H new ATOM 0 HB VAL A 54 23.513 -21.512 -4.597 1.00 0.00 H new ATOM 0 HG11 VAL A 54 21.871 -20.468 -6.132 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.849 -22.241 -6.282 1.00 0.00 H new ATOM 0 HG13 VAL A 54 20.564 -21.409 -5.375 1.00 0.00 H new ATOM 0 HG21 VAL A 54 22.381 -19.407 -3.929 1.00 0.00 H new ATOM 0 HG22 VAL A 54 21.077 -20.351 -3.170 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.728 -20.424 -2.510 1.00 0.00 H new ATOM 838 N PRO A 55 24.086 -23.288 -2.349 1.00 0.00 N ATOM 839 CA PRO A 55 24.872 -23.399 -1.090 1.00 0.00 C ATOM 840 C PRO A 55 25.251 -22.009 -0.574 1.00 0.00 C ATOM 841 O PRO A 55 26.408 -21.710 -0.356 1.00 0.00 O ATOM 842 CB PRO A 55 26.120 -24.186 -1.487 1.00 0.00 C ATOM 843 CG PRO A 55 25.757 -24.879 -2.759 1.00 0.00 C ATOM 844 CD PRO A 55 24.733 -24.020 -3.445 1.00 0.00 C ATOM 0 HA PRO A 55 24.314 -23.886 -0.290 1.00 0.00 H new ATOM 0 HB2 PRO A 55 26.974 -23.524 -1.629 1.00 0.00 H new ATOM 0 HB3 PRO A 55 26.397 -24.902 -0.713 1.00 0.00 H new ATOM 0 HG2 PRO A 55 26.635 -25.012 -3.391 1.00 0.00 H new ATOM 0 HG3 PRO A 55 25.356 -25.872 -2.557 1.00 0.00 H new ATOM 0 HD2 PRO A 55 25.197 -23.340 -4.159 1.00 0.00 H new ATOM 0 HD3 PRO A 55 24.015 -24.623 -4.000 1.00 0.00 H new ATOM 852 N GLY A 56 24.283 -21.157 -0.377 1.00 0.00 N ATOM 853 CA GLY A 56 24.585 -19.787 0.126 1.00 0.00 C ATOM 854 C GLY A 56 23.322 -18.926 0.052 1.00 0.00 C ATOM 855 O GLY A 56 23.381 -17.742 -0.213 1.00 0.00 O ATOM 0 H GLY A 56 23.295 -21.350 -0.543 1.00 0.00 H new ATOM 0 HA2 GLY A 56 24.944 -19.837 1.154 1.00 0.00 H new ATOM 0 HA3 GLY A 56 25.380 -19.337 -0.468 1.00 0.00 H new ATOM 859 N ALA A 57 22.178 -19.512 0.282 1.00 0.00 N ATOM 860 CA ALA A 57 20.913 -18.725 0.223 1.00 0.00 C ATOM 861 C ALA A 57 20.027 -19.056 1.427 1.00 0.00 C ATOM 862 O ALA A 57 19.758 -20.206 1.716 1.00 0.00 O ATOM 863 CB ALA A 57 20.238 -19.161 -1.077 1.00 0.00 C ATOM 0 H ALA A 57 22.065 -20.500 0.508 1.00 0.00 H new ATOM 0 HA ALA A 57 21.093 -17.650 0.249 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.296 -18.625 -1.195 1.00 0.00 H new ATOM 0 HB2 ALA A 57 20.892 -18.936 -1.920 1.00 0.00 H new ATOM 0 HB3 ALA A 57 20.044 -20.233 -1.044 1.00 0.00 H new ATOM 869 N LEU A 58 19.570 -18.057 2.131 1.00 0.00 N ATOM 870 CA LEU A 58 18.701 -18.313 3.314 1.00 0.00 C ATOM 871 C LEU A 58 17.286 -17.797 3.039 1.00 0.00 C ATOM 872 O LEU A 58 17.084 -16.926 2.216 1.00 0.00 O ATOM 873 CB LEU A 58 19.346 -17.529 4.460 1.00 0.00 C ATOM 874 CG LEU A 58 20.778 -18.024 4.694 1.00 0.00 C ATOM 875 CD1 LEU A 58 20.816 -19.555 4.645 1.00 0.00 C ATOM 876 CD2 LEU A 58 21.696 -17.457 3.609 1.00 0.00 C ATOM 0 H LEU A 58 19.761 -17.074 1.938 1.00 0.00 H new ATOM 0 HA LEU A 58 18.618 -19.374 3.548 1.00 0.00 H new ATOM 0 HB2 LEU A 58 19.354 -16.465 4.224 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.758 -17.649 5.370 1.00 0.00 H new ATOM 0 HG LEU A 58 21.117 -17.689 5.674 1.00 0.00 H new ATOM 0 HD11 LEU A 58 21.837 -19.899 4.812 1.00 0.00 H new ATOM 0 HD12 LEU A 58 20.165 -19.960 5.420 1.00 0.00 H new ATOM 0 HD13 LEU A 58 20.473 -19.896 3.668 1.00 0.00 H new ATOM 0 HD21 LEU A 58 22.715 -17.808 3.774 1.00 0.00 H new ATOM 0 HD22 LEU A 58 21.351 -17.790 2.630 1.00 0.00 H new ATOM 0 HD23 LEU A 58 21.677 -16.368 3.649 1.00 0.00 H new ATOM 888 N ASP A 59 16.303 -18.325 3.716 1.00 0.00 N ATOM 889 CA ASP A 59 14.909 -17.855 3.478 1.00 0.00 C ATOM 890 C ASP A 59 14.385 -17.097 4.699 1.00 0.00 C ATOM 891 O ASP A 59 14.132 -17.672 5.739 1.00 0.00 O ATOM 892 CB ASP A 59 14.096 -19.130 3.256 1.00 0.00 C ATOM 893 CG ASP A 59 13.624 -19.191 1.802 1.00 0.00 C ATOM 894 OD1 ASP A 59 14.076 -18.374 1.017 1.00 0.00 O ATOM 895 OD2 ASP A 59 12.820 -20.057 1.498 1.00 0.00 O ATOM 0 H ASP A 59 16.404 -19.057 4.419 1.00 0.00 H new ATOM 0 HA ASP A 59 14.845 -17.173 2.630 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.702 -20.005 3.489 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.238 -19.148 3.928 1.00 0.00 H new ATOM 900 N TYR A 60 14.210 -15.809 4.577 1.00 0.00 N ATOM 901 CA TYR A 60 13.693 -15.012 5.724 1.00 0.00 C ATOM 902 C TYR A 60 12.194 -15.265 5.890 1.00 0.00 C ATOM 903 O TYR A 60 11.632 -15.064 6.948 1.00 0.00 O ATOM 904 CB TYR A 60 13.949 -13.556 5.336 1.00 0.00 C ATOM 905 CG TYR A 60 13.293 -13.268 4.007 1.00 0.00 C ATOM 906 CD1 TYR A 60 11.903 -13.114 3.930 1.00 0.00 C ATOM 907 CD2 TYR A 60 14.074 -13.158 2.849 1.00 0.00 C ATOM 908 CE1 TYR A 60 11.295 -12.850 2.697 1.00 0.00 C ATOM 909 CE2 TYR A 60 13.465 -12.895 1.617 1.00 0.00 C ATOM 910 CZ TYR A 60 12.075 -12.740 1.540 1.00 0.00 C ATOM 911 OH TYR A 60 11.475 -12.481 0.324 1.00 0.00 O ATOM 0 H TYR A 60 14.403 -15.274 3.730 1.00 0.00 H new ATOM 0 HA TYR A 60 14.173 -15.272 6.668 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.553 -12.889 6.102 1.00 0.00 H new ATOM 0 HB3 TYR A 60 15.021 -13.368 5.273 1.00 0.00 H new ATOM 0 HD1 TYR A 60 11.300 -13.199 4.822 1.00 0.00 H new ATOM 0 HD2 TYR A 60 15.146 -13.276 2.907 1.00 0.00 H new ATOM 0 HE1 TYR A 60 10.223 -12.731 2.638 1.00 0.00 H new ATOM 0 HE2 TYR A 60 14.067 -12.811 0.724 1.00 0.00 H new ATOM 0 HH TYR A 60 12.150 -12.509 -0.386 1.00 0.00 H new ATOM 921 N ALA A 61 11.542 -15.713 4.849 1.00 0.00 N ATOM 922 CA ALA A 61 10.081 -15.985 4.949 1.00 0.00 C ATOM 923 C ALA A 61 9.823 -16.963 6.092 1.00 0.00 C ATOM 924 O ALA A 61 8.870 -16.831 6.834 1.00 0.00 O ATOM 925 CB ALA A 61 9.700 -16.612 3.608 1.00 0.00 C ATOM 0 H ALA A 61 11.958 -15.901 3.937 1.00 0.00 H new ATOM 0 HA ALA A 61 9.499 -15.086 5.151 1.00 0.00 H new ATOM 0 HB1 ALA A 61 8.635 -16.842 3.603 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.924 -15.912 2.803 1.00 0.00 H new ATOM 0 HB3 ALA A 61 10.270 -17.529 3.460 1.00 0.00 H new ATOM 931 N ALA A 62 10.676 -17.937 6.250 1.00 0.00 N ATOM 932 CA ALA A 62 10.488 -18.912 7.358 1.00 0.00 C ATOM 933 C ALA A 62 10.577 -18.175 8.692 1.00 0.00 C ATOM 934 O ALA A 62 9.931 -18.523 9.660 1.00 0.00 O ATOM 935 CB ALA A 62 11.635 -19.913 7.215 1.00 0.00 C ATOM 0 H ALA A 62 11.493 -18.099 5.661 1.00 0.00 H new ATOM 0 HA ALA A 62 9.520 -19.412 7.321 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.562 -20.665 8.001 1.00 0.00 H new ATOM 0 HB2 ALA A 62 11.575 -20.399 6.241 1.00 0.00 H new ATOM 0 HB3 ALA A 62 12.587 -19.390 7.301 1.00 0.00 H new ATOM 941 N PHE A 63 11.376 -17.153 8.730 1.00 0.00 N ATOM 942 CA PHE A 63 11.536 -16.359 9.980 1.00 0.00 C ATOM 943 C PHE A 63 10.200 -15.726 10.384 1.00 0.00 C ATOM 944 O PHE A 63 9.869 -15.645 11.551 1.00 0.00 O ATOM 945 CB PHE A 63 12.550 -15.275 9.615 1.00 0.00 C ATOM 946 CG PHE A 63 13.109 -14.650 10.871 1.00 0.00 C ATOM 947 CD1 PHE A 63 12.252 -14.026 11.787 1.00 0.00 C ATOM 948 CD2 PHE A 63 14.485 -14.691 11.118 1.00 0.00 C ATOM 949 CE1 PHE A 63 12.774 -13.446 12.949 1.00 0.00 C ATOM 950 CE2 PHE A 63 15.005 -14.110 12.279 1.00 0.00 C ATOM 951 CZ PHE A 63 14.150 -13.487 13.195 1.00 0.00 C ATOM 0 H PHE A 63 11.934 -16.827 7.941 1.00 0.00 H new ATOM 0 HA PHE A 63 11.863 -16.968 10.823 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.357 -15.705 9.022 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.074 -14.512 8.999 1.00 0.00 H new ATOM 0 HD1 PHE A 63 11.189 -13.993 11.597 1.00 0.00 H new ATOM 0 HD2 PHE A 63 15.146 -15.171 10.412 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.114 -12.966 13.656 1.00 0.00 H new ATOM 0 HE2 PHE A 63 16.068 -14.142 12.469 1.00 0.00 H new ATOM 0 HZ PHE A 63 14.552 -13.038 14.091 1.00 0.00 H new ATOM 961 N SER A 64 9.437 -15.269 9.429 1.00 0.00 N ATOM 962 CA SER A 64 8.129 -14.630 9.758 1.00 0.00 C ATOM 963 C SER A 64 7.243 -15.586 10.563 1.00 0.00 C ATOM 964 O SER A 64 6.698 -15.225 11.588 1.00 0.00 O ATOM 965 CB SER A 64 7.491 -14.326 8.403 1.00 0.00 C ATOM 966 OG SER A 64 8.385 -13.537 7.629 1.00 0.00 O ATOM 0 H SER A 64 9.662 -15.310 8.435 1.00 0.00 H new ATOM 0 HA SER A 64 8.254 -13.735 10.368 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.261 -15.254 7.880 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.548 -13.797 8.543 1.00 0.00 H new ATOM 0 HG SER A 64 8.365 -13.839 6.697 1.00 0.00 H new ATOM 972 N SER A 65 7.086 -16.798 10.108 1.00 0.00 N ATOM 973 CA SER A 65 6.225 -17.766 10.847 1.00 0.00 C ATOM 974 C SER A 65 6.839 -18.109 12.208 1.00 0.00 C ATOM 975 O SER A 65 6.140 -18.304 13.182 1.00 0.00 O ATOM 976 CB SER A 65 6.173 -19.008 9.958 1.00 0.00 C ATOM 977 OG SER A 65 5.829 -18.623 8.633 1.00 0.00 O ATOM 0 H SER A 65 7.516 -17.161 9.257 1.00 0.00 H new ATOM 0 HA SER A 65 5.233 -17.359 11.045 1.00 0.00 H new ATOM 0 HB2 SER A 65 7.139 -19.514 9.963 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.440 -19.716 10.345 1.00 0.00 H new ATOM 0 HG SER A 65 5.796 -19.417 8.060 1.00 0.00 H new ATOM 983 N ALA A 66 8.138 -18.195 12.282 1.00 0.00 N ATOM 984 CA ALA A 66 8.790 -18.535 13.580 1.00 0.00 C ATOM 985 C ALA A 66 8.808 -17.322 14.515 1.00 0.00 C ATOM 986 O ALA A 66 8.777 -17.459 15.722 1.00 0.00 O ATOM 987 CB ALA A 66 10.215 -18.947 13.211 1.00 0.00 C ATOM 0 H ALA A 66 8.777 -18.045 11.501 1.00 0.00 H new ATOM 0 HA ALA A 66 8.256 -19.325 14.108 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.762 -19.213 14.115 1.00 0.00 H new ATOM 0 HB2 ALA A 66 10.183 -19.805 12.540 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.717 -18.117 12.714 1.00 0.00 H new ATOM 993 N LEU A 67 8.866 -16.136 13.973 1.00 0.00 N ATOM 994 CA LEU A 67 8.894 -14.926 14.844 1.00 0.00 C ATOM 995 C LEU A 67 7.483 -14.619 15.358 1.00 0.00 C ATOM 996 O LEU A 67 7.278 -14.369 16.529 1.00 0.00 O ATOM 997 CB LEU A 67 9.414 -13.815 13.915 1.00 0.00 C ATOM 998 CG LEU A 67 8.654 -12.503 14.142 1.00 0.00 C ATOM 999 CD1 LEU A 67 8.871 -12.025 15.579 1.00 0.00 C ATOM 1000 CD2 LEU A 67 9.168 -11.440 13.167 1.00 0.00 C ATOM 0 H LEU A 67 8.895 -15.953 12.970 1.00 0.00 H new ATOM 0 HA LEU A 67 9.519 -15.041 15.730 1.00 0.00 H new ATOM 0 HB2 LEU A 67 10.478 -13.658 14.092 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.306 -14.126 12.876 1.00 0.00 H new ATOM 0 HG LEU A 67 7.590 -12.668 13.973 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.330 -11.092 15.738 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.503 -12.781 16.273 1.00 0.00 H new ATOM 0 HD13 LEU A 67 9.935 -11.861 15.751 1.00 0.00 H new ATOM 0 HD21 LEU A 67 8.628 -10.507 13.328 1.00 0.00 H new ATOM 0 HD22 LEU A 67 10.233 -11.277 13.335 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.010 -11.779 12.143 1.00 0.00 H new ATOM 1012 N TYR A 68 6.519 -14.639 14.488 1.00 0.00 N ATOM 1013 CA TYR A 68 5.120 -14.352 14.920 1.00 0.00 C ATOM 1014 C TYR A 68 4.334 -15.654 15.087 1.00 0.00 C ATOM 1015 O TYR A 68 3.121 -15.652 15.163 1.00 0.00 O ATOM 1016 CB TYR A 68 4.528 -13.497 13.801 1.00 0.00 C ATOM 1017 CG TYR A 68 4.865 -12.046 14.053 1.00 0.00 C ATOM 1018 CD1 TYR A 68 4.461 -11.432 15.245 1.00 0.00 C ATOM 1019 CD2 TYR A 68 5.583 -11.317 13.098 1.00 0.00 C ATOM 1020 CE1 TYR A 68 4.776 -10.088 15.481 1.00 0.00 C ATOM 1021 CE2 TYR A 68 5.897 -9.973 13.335 1.00 0.00 C ATOM 1022 CZ TYR A 68 5.494 -9.359 14.526 1.00 0.00 C ATOM 1023 OH TYR A 68 5.804 -8.035 14.761 1.00 0.00 O ATOM 0 H TYR A 68 6.635 -14.841 13.495 1.00 0.00 H new ATOM 0 HA TYR A 68 5.082 -13.842 15.883 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.926 -13.813 12.837 1.00 0.00 H new ATOM 0 HB3 TYR A 68 3.447 -13.630 13.759 1.00 0.00 H new ATOM 0 HD1 TYR A 68 3.907 -11.995 15.982 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.895 -11.791 12.179 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.465 -9.614 16.400 1.00 0.00 H new ATOM 0 HE2 TYR A 68 6.451 -9.410 12.598 1.00 0.00 H new ATOM 0 HH TYR A 68 6.306 -7.676 13.999 1.00 0.00 H new ATOM 1033 N GLY A 69 5.013 -16.768 15.145 1.00 0.00 N ATOM 1034 CA GLY A 69 4.300 -18.066 15.309 1.00 0.00 C ATOM 1035 C GLY A 69 4.206 -18.413 16.795 1.00 0.00 C ATOM 1036 O GLY A 69 4.564 -19.497 17.213 1.00 0.00 O ATOM 0 H GLY A 69 6.029 -16.835 15.086 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.302 -18.002 14.876 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.830 -18.854 14.774 1.00 0.00 H new ATOM 1040 N GLU A 70 3.728 -17.502 17.598 1.00 0.00 N ATOM 1041 CA GLU A 70 3.613 -17.782 19.058 1.00 0.00 C ATOM 1042 C GLU A 70 2.221 -17.395 19.565 1.00 0.00 C ATOM 1043 O GLU A 70 1.446 -18.233 19.977 1.00 0.00 O ATOM 1044 CB GLU A 70 4.685 -16.911 19.713 1.00 0.00 C ATOM 1045 CG GLU A 70 6.041 -17.614 19.624 1.00 0.00 C ATOM 1046 CD GLU A 70 6.202 -18.562 20.815 1.00 0.00 C ATOM 1047 OE1 GLU A 70 5.434 -18.437 21.755 1.00 0.00 O ATOM 1048 OE2 GLU A 70 7.091 -19.396 20.767 1.00 0.00 O ATOM 0 H GLU A 70 3.412 -16.577 17.307 1.00 0.00 H new ATOM 0 HA GLU A 70 3.750 -18.839 19.288 1.00 0.00 H new ATOM 0 HB2 GLU A 70 4.733 -15.941 19.217 1.00 0.00 H new ATOM 0 HB3 GLU A 70 4.429 -16.724 20.756 1.00 0.00 H new ATOM 0 HG2 GLU A 70 6.114 -18.171 18.690 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.845 -16.878 19.620 1.00 0.00 H new ATOM 1055 N SER A 71 1.899 -16.130 19.538 1.00 0.00 N ATOM 1056 CA SER A 71 0.556 -15.693 20.018 1.00 0.00 C ATOM 1057 C SER A 71 -0.543 -16.301 19.143 1.00 0.00 C ATOM 1058 O SER A 71 -0.663 -15.991 17.974 1.00 0.00 O ATOM 1059 CB SER A 71 0.566 -14.171 19.888 1.00 0.00 C ATOM 1060 OG SER A 71 1.109 -13.602 21.072 1.00 0.00 O ATOM 0 H SER A 71 2.506 -15.381 19.205 1.00 0.00 H new ATOM 0 HA SER A 71 0.358 -16.013 21.041 1.00 0.00 H new ATOM 0 HB2 SER A 71 1.158 -13.872 19.023 1.00 0.00 H new ATOM 0 HB3 SER A 71 -0.446 -13.802 19.725 1.00 0.00 H new ATOM 0 HG SER A 71 1.118 -12.625 20.991 1.00 0.00 H new ATOM 1066 N ASP A 72 -1.346 -17.167 19.700 1.00 0.00 N ATOM 1067 CA ASP A 72 -2.436 -17.796 18.900 1.00 0.00 C ATOM 1068 C ASP A 72 -3.498 -16.754 18.539 1.00 0.00 C ATOM 1069 O ASP A 72 -4.285 -16.342 19.368 1.00 0.00 O ATOM 1070 CB ASP A 72 -3.027 -18.870 19.813 1.00 0.00 C ATOM 1071 CG ASP A 72 -2.011 -19.998 19.997 1.00 0.00 C ATOM 1072 OD1 ASP A 72 -1.841 -20.774 19.070 1.00 0.00 O ATOM 1073 OD2 ASP A 72 -1.420 -20.069 21.062 1.00 0.00 O ATOM 0 H ASP A 72 -1.294 -17.466 20.674 1.00 0.00 H new ATOM 0 HA ASP A 72 -2.071 -18.214 17.962 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -3.286 -18.438 20.780 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -3.948 -19.262 19.382 1.00 0.00 H new ATOM 1078 N LEU A 73 -3.526 -16.325 17.307 1.00 0.00 N ATOM 1079 CA LEU A 73 -4.537 -15.311 16.893 1.00 0.00 C ATOM 1080 C LEU A 73 -5.940 -15.763 17.308 1.00 0.00 C ATOM 1081 O LEU A 73 -6.478 -15.315 18.301 1.00 0.00 O ATOM 1082 CB LEU A 73 -4.425 -15.240 15.370 1.00 0.00 C ATOM 1083 CG LEU A 73 -4.905 -13.871 14.886 1.00 0.00 C ATOM 1084 CD1 LEU A 73 -3.733 -12.887 14.894 1.00 0.00 C ATOM 1085 CD2 LEU A 73 -5.450 -13.997 13.461 1.00 0.00 C ATOM 0 H LEU A 73 -2.893 -16.633 16.569 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.365 -14.341 17.360 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -3.392 -15.404 15.063 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -5.023 -16.029 14.914 1.00 0.00 H new ATOM 0 HG LEU A 73 -5.691 -13.508 15.548 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -4.075 -11.911 14.549 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.341 -12.797 15.907 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -2.948 -13.251 14.232 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -5.792 -13.022 13.115 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -4.662 -14.360 12.801 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -6.284 -14.699 13.451 1.00 0.00 H new TER 1097 LEU A 73 ATOM 1098 N GLY B 7 13.944 6.426 -1.309 1.00 0.00 N ATOM 1099 CA GLY B 7 14.825 5.310 -0.862 1.00 0.00 C ATOM 1100 C GLY B 7 14.089 3.979 -1.024 1.00 0.00 C ATOM 1101 O GLY B 7 14.572 3.065 -1.661 1.00 0.00 O ATOM 0 HA2 GLY B 7 15.744 5.302 -1.447 1.00 0.00 H new ATOM 0 HA3 GLY B 7 15.112 5.454 0.180 1.00 0.00 H new ATOM 1105 N LYS B 8 12.922 3.863 -0.451 1.00 0.00 N ATOM 1106 CA LYS B 8 12.155 2.589 -0.572 1.00 0.00 C ATOM 1107 C LYS B 8 12.891 1.459 0.155 1.00 0.00 C ATOM 1108 O LYS B 8 12.386 0.886 1.099 1.00 0.00 O ATOM 1109 CB LYS B 8 12.084 2.307 -2.072 1.00 0.00 C ATOM 1110 CG LYS B 8 10.694 1.774 -2.426 1.00 0.00 C ATOM 1111 CD LYS B 8 10.829 0.598 -3.396 1.00 0.00 C ATOM 1112 CE LYS B 8 11.408 -0.610 -2.655 1.00 0.00 C ATOM 1113 NZ LYS B 8 11.240 -1.753 -3.595 1.00 0.00 N ATOM 0 H LYS B 8 12.466 4.594 0.095 1.00 0.00 H new ATOM 0 HA LYS B 8 11.163 2.660 -0.126 1.00 0.00 H new ATOM 0 HB2 LYS B 8 12.290 3.218 -2.634 1.00 0.00 H new ATOM 0 HB3 LYS B 8 12.846 1.580 -2.353 1.00 0.00 H new ATOM 0 HG2 LYS B 8 10.174 1.456 -1.522 1.00 0.00 H new ATOM 0 HG3 LYS B 8 10.094 2.564 -2.877 1.00 0.00 H new ATOM 0 HD2 LYS B 8 9.856 0.347 -3.818 1.00 0.00 H new ATOM 0 HD3 LYS B 8 11.477 0.872 -4.229 1.00 0.00 H new ATOM 0 HE2 LYS B 8 12.458 -0.455 -2.406 1.00 0.00 H new ATOM 0 HE3 LYS B 8 10.881 -0.788 -1.718 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 11.891 -2.519 -3.329 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 10.260 -2.099 -3.549 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 11.451 -1.440 -4.564 1.00 0.00 H new ATOM 1127 N LYS B 9 14.081 1.134 -0.274 1.00 0.00 N ATOM 1128 CA LYS B 9 14.841 0.043 0.399 1.00 0.00 C ATOM 1129 C LYS B 9 15.043 0.381 1.878 1.00 0.00 C ATOM 1130 O LYS B 9 14.938 -0.469 2.740 1.00 0.00 O ATOM 1131 CB LYS B 9 16.186 -0.019 -0.329 1.00 0.00 C ATOM 1132 CG LYS B 9 16.661 -1.471 -0.399 1.00 0.00 C ATOM 1133 CD LYS B 9 18.183 -1.505 -0.557 1.00 0.00 C ATOM 1134 CE LYS B 9 18.563 -0.978 -1.942 1.00 0.00 C ATOM 1135 NZ LYS B 9 19.786 -0.157 -1.717 1.00 0.00 N ATOM 0 H LYS B 9 14.558 1.576 -1.060 1.00 0.00 H new ATOM 0 HA LYS B 9 14.317 -0.912 0.358 1.00 0.00 H new ATOM 0 HB2 LYS B 9 16.087 0.391 -1.334 1.00 0.00 H new ATOM 0 HB3 LYS B 9 16.923 0.591 0.193 1.00 0.00 H new ATOM 0 HG2 LYS B 9 16.367 -2.005 0.505 1.00 0.00 H new ATOM 0 HG3 LYS B 9 16.186 -1.980 -1.238 1.00 0.00 H new ATOM 0 HD2 LYS B 9 18.653 -0.898 0.217 1.00 0.00 H new ATOM 0 HD3 LYS B 9 18.550 -2.524 -0.430 1.00 0.00 H new ATOM 0 HE2 LYS B 9 18.758 -1.796 -2.636 1.00 0.00 H new ATOM 0 HE3 LYS B 9 17.759 -0.380 -2.372 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 20.109 0.240 -2.622 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 19.568 0.617 -1.058 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 20.536 -0.754 -1.314 1.00 0.00 H new ATOM 1149 N ALA B 10 15.328 1.619 2.179 1.00 0.00 N ATOM 1150 CA ALA B 10 15.529 2.011 3.603 1.00 0.00 C ATOM 1151 C ALA B 10 14.234 1.796 4.390 1.00 0.00 C ATOM 1152 O ALA B 10 14.252 1.422 5.545 1.00 0.00 O ATOM 1153 CB ALA B 10 15.890 3.497 3.558 1.00 0.00 C ATOM 0 H ALA B 10 15.430 2.375 1.502 1.00 0.00 H new ATOM 0 HA ALA B 10 16.304 1.421 4.092 1.00 0.00 H new ATOM 0 HB1 ALA B 10 16.054 3.862 4.572 1.00 0.00 H new ATOM 0 HB2 ALA B 10 16.799 3.633 2.972 1.00 0.00 H new ATOM 0 HB3 ALA B 10 15.075 4.056 3.099 1.00 0.00 H new ATOM 1159 N GLU B 11 13.110 2.027 3.768 1.00 0.00 N ATOM 1160 CA GLU B 11 11.812 1.833 4.474 1.00 0.00 C ATOM 1161 C GLU B 11 11.607 0.352 4.803 1.00 0.00 C ATOM 1162 O GLU B 11 11.134 0.002 5.866 1.00 0.00 O ATOM 1163 CB GLU B 11 10.749 2.316 3.488 1.00 0.00 C ATOM 1164 CG GLU B 11 9.560 2.890 4.260 1.00 0.00 C ATOM 1165 CD GLU B 11 8.618 1.756 4.665 1.00 0.00 C ATOM 1166 OE1 GLU B 11 8.642 0.729 4.007 1.00 0.00 O ATOM 1167 OE2 GLU B 11 7.889 1.933 5.627 1.00 0.00 O ATOM 0 H GLU B 11 13.035 2.342 2.801 1.00 0.00 H new ATOM 0 HA GLU B 11 11.769 2.377 5.418 1.00 0.00 H new ATOM 0 HB2 GLU B 11 11.168 3.075 2.828 1.00 0.00 H new ATOM 0 HB3 GLU B 11 10.422 1.490 2.856 1.00 0.00 H new ATOM 0 HG2 GLU B 11 9.910 3.420 5.146 1.00 0.00 H new ATOM 0 HG3 GLU B 11 9.029 3.615 3.644 1.00 0.00 H new ATOM 1174 N ALA B 12 11.959 -0.519 3.897 1.00 0.00 N ATOM 1175 CA ALA B 12 11.785 -1.977 4.157 1.00 0.00 C ATOM 1176 C ALA B 12 12.644 -2.404 5.350 1.00 0.00 C ATOM 1177 O ALA B 12 12.216 -3.165 6.194 1.00 0.00 O ATOM 1178 CB ALA B 12 12.262 -2.666 2.878 1.00 0.00 C ATOM 0 H ALA B 12 12.359 -0.285 2.989 1.00 0.00 H new ATOM 0 HA ALA B 12 10.754 -2.236 4.398 1.00 0.00 H new ATOM 0 HB1 ALA B 12 12.166 -3.746 2.989 1.00 0.00 H new ATOM 0 HB2 ALA B 12 11.655 -2.332 2.037 1.00 0.00 H new ATOM 0 HB3 ALA B 12 13.306 -2.412 2.695 1.00 0.00 H new ATOM 1184 N VAL B 13 13.852 -1.916 5.428 1.00 0.00 N ATOM 1185 CA VAL B 13 14.732 -2.292 6.572 1.00 0.00 C ATOM 1186 C VAL B 13 14.121 -1.794 7.885 1.00 0.00 C ATOM 1187 O VAL B 13 14.144 -2.475 8.890 1.00 0.00 O ATOM 1188 CB VAL B 13 16.063 -1.592 6.296 1.00 0.00 C ATOM 1189 CG1 VAL B 13 17.058 -1.924 7.409 1.00 0.00 C ATOM 1190 CG2 VAL B 13 16.622 -2.075 4.954 1.00 0.00 C ATOM 0 H VAL B 13 14.267 -1.275 4.752 1.00 0.00 H new ATOM 0 HA VAL B 13 14.855 -3.371 6.666 1.00 0.00 H new ATOM 0 HB VAL B 13 15.905 -0.514 6.261 1.00 0.00 H new ATOM 0 HG11 VAL B 13 18.006 -1.424 7.210 1.00 0.00 H new ATOM 0 HG12 VAL B 13 16.661 -1.583 8.365 1.00 0.00 H new ATOM 0 HG13 VAL B 13 17.217 -3.002 7.446 1.00 0.00 H new ATOM 0 HG21 VAL B 13 17.571 -1.577 4.755 1.00 0.00 H new ATOM 0 HG22 VAL B 13 16.779 -3.153 4.992 1.00 0.00 H new ATOM 0 HG23 VAL B 13 15.915 -1.839 4.159 1.00 0.00 H new ATOM 1200 N ALA B 14 13.575 -0.608 7.880 1.00 0.00 N ATOM 1201 CA ALA B 14 12.962 -0.062 9.124 1.00 0.00 C ATOM 1202 C ALA B 14 11.815 -0.963 9.590 1.00 0.00 C ATOM 1203 O ALA B 14 11.633 -1.192 10.769 1.00 0.00 O ATOM 1204 CB ALA B 14 12.432 1.318 8.730 1.00 0.00 C ATOM 0 H ALA B 14 13.527 0.007 7.067 1.00 0.00 H new ATOM 0 HA ALA B 14 13.676 -0.007 9.946 1.00 0.00 H new ATOM 0 HB1 ALA B 14 11.964 1.788 9.595 1.00 0.00 H new ATOM 0 HB2 ALA B 14 13.257 1.939 8.382 1.00 0.00 H new ATOM 0 HB3 ALA B 14 11.697 1.211 7.932 1.00 0.00 H new ATOM 1210 N THR B 15 11.040 -1.476 8.674 1.00 0.00 N ATOM 1211 CA THR B 15 9.905 -2.361 9.066 1.00 0.00 C ATOM 1212 C THR B 15 10.432 -3.659 9.684 1.00 0.00 C ATOM 1213 O THR B 15 9.930 -4.130 10.685 1.00 0.00 O ATOM 1214 CB THR B 15 9.164 -2.650 7.761 1.00 0.00 C ATOM 1215 OG1 THR B 15 8.536 -1.461 7.302 1.00 0.00 O ATOM 1216 CG2 THR B 15 8.106 -3.728 8.001 1.00 0.00 C ATOM 0 H THR B 15 11.143 -1.321 7.671 1.00 0.00 H new ATOM 0 HA THR B 15 9.257 -1.898 9.811 1.00 0.00 H new ATOM 0 HB THR B 15 9.872 -3.000 7.010 1.00 0.00 H new ATOM 0 HG1 THR B 15 9.191 -0.908 6.827 1.00 0.00 H new ATOM 0 HG21 THR B 15 7.578 -3.933 7.070 1.00 0.00 H new ATOM 0 HG22 THR B 15 8.589 -4.640 8.353 1.00 0.00 H new ATOM 0 HG23 THR B 15 7.396 -3.380 8.751 1.00 0.00 H new ATOM 1224 N VAL B 16 11.440 -4.241 9.093 1.00 0.00 N ATOM 1225 CA VAL B 16 11.999 -5.509 9.644 1.00 0.00 C ATOM 1226 C VAL B 16 12.671 -5.252 10.996 1.00 0.00 C ATOM 1227 O VAL B 16 12.554 -6.036 11.917 1.00 0.00 O ATOM 1228 CB VAL B 16 13.030 -5.969 8.613 1.00 0.00 C ATOM 1229 CG1 VAL B 16 13.673 -7.276 9.076 1.00 0.00 C ATOM 1230 CG2 VAL B 16 12.339 -6.193 7.266 1.00 0.00 C ATOM 0 H VAL B 16 11.901 -3.893 8.252 1.00 0.00 H new ATOM 0 HA VAL B 16 11.227 -6.259 9.812 1.00 0.00 H new ATOM 0 HB VAL B 16 13.800 -5.204 8.507 1.00 0.00 H new ATOM 0 HG11 VAL B 16 14.407 -7.601 8.339 1.00 0.00 H new ATOM 0 HG12 VAL B 16 14.166 -7.119 10.035 1.00 0.00 H new ATOM 0 HG13 VAL B 16 12.904 -8.041 9.184 1.00 0.00 H new ATOM 0 HG21 VAL B 16 13.073 -6.521 6.530 1.00 0.00 H new ATOM 0 HG22 VAL B 16 11.569 -6.956 7.375 1.00 0.00 H new ATOM 0 HG23 VAL B 16 11.882 -5.261 6.932 1.00 0.00 H new ATOM 1240 N VAL B 17 13.377 -4.162 11.121 1.00 0.00 N ATOM 1241 CA VAL B 17 14.058 -3.861 12.413 1.00 0.00 C ATOM 1242 C VAL B 17 13.039 -3.797 13.554 1.00 0.00 C ATOM 1243 O VAL B 17 13.218 -4.401 14.592 1.00 0.00 O ATOM 1244 CB VAL B 17 14.716 -2.497 12.205 1.00 0.00 C ATOM 1245 CG1 VAL B 17 15.375 -2.044 13.509 1.00 0.00 C ATOM 1246 CG2 VAL B 17 15.778 -2.608 11.109 1.00 0.00 C ATOM 0 H VAL B 17 13.512 -3.468 10.386 1.00 0.00 H new ATOM 0 HA VAL B 17 14.783 -4.629 12.683 1.00 0.00 H new ATOM 0 HB VAL B 17 13.960 -1.769 11.909 1.00 0.00 H new ATOM 0 HG11 VAL B 17 15.844 -1.071 13.361 1.00 0.00 H new ATOM 0 HG12 VAL B 17 14.619 -1.967 14.291 1.00 0.00 H new ATOM 0 HG13 VAL B 17 16.132 -2.770 13.806 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.249 -1.636 10.959 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.533 -3.335 11.407 1.00 0.00 H new ATOM 0 HG23 VAL B 17 15.309 -2.932 10.180 1.00 0.00 H new ATOM 1256 N ALA B 18 11.971 -3.068 13.370 1.00 0.00 N ATOM 1257 CA ALA B 18 10.947 -2.970 14.449 1.00 0.00 C ATOM 1258 C ALA B 18 10.306 -4.338 14.698 1.00 0.00 C ATOM 1259 O ALA B 18 10.031 -4.710 15.821 1.00 0.00 O ATOM 1260 CB ALA B 18 9.907 -1.980 13.925 1.00 0.00 C ATOM 0 H ALA B 18 11.764 -2.538 12.523 1.00 0.00 H new ATOM 0 HA ALA B 18 11.378 -2.644 15.395 1.00 0.00 H new ATOM 0 HB1 ALA B 18 9.118 -1.855 14.666 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.383 -1.018 13.736 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.477 -2.360 12.998 1.00 0.00 H new ATOM 1266 N ALA B 19 10.066 -5.089 13.658 1.00 0.00 N ATOM 1267 CA ALA B 19 9.442 -6.432 13.838 1.00 0.00 C ATOM 1268 C ALA B 19 10.411 -7.371 14.562 1.00 0.00 C ATOM 1269 O ALA B 19 10.040 -8.069 15.486 1.00 0.00 O ATOM 1270 CB ALA B 19 9.163 -6.934 12.421 1.00 0.00 C ATOM 0 H ALA B 19 10.274 -4.832 12.693 1.00 0.00 H new ATOM 0 HA ALA B 19 8.534 -6.389 14.439 1.00 0.00 H new ATOM 0 HB1 ALA B 19 8.702 -7.921 12.469 1.00 0.00 H new ATOM 0 HB2 ALA B 19 8.489 -6.242 11.916 1.00 0.00 H new ATOM 0 HB3 ALA B 19 10.099 -6.997 11.867 1.00 0.00 H new ATOM 1276 N VAL B 20 11.648 -7.394 14.150 1.00 0.00 N ATOM 1277 CA VAL B 20 12.639 -8.288 14.816 1.00 0.00 C ATOM 1278 C VAL B 20 12.899 -7.811 16.247 1.00 0.00 C ATOM 1279 O VAL B 20 12.916 -8.590 17.179 1.00 0.00 O ATOM 1280 CB VAL B 20 13.907 -8.173 13.973 1.00 0.00 C ATOM 1281 CG1 VAL B 20 15.037 -8.956 14.644 1.00 0.00 C ATOM 1282 CG2 VAL B 20 13.648 -8.749 12.579 1.00 0.00 C ATOM 0 H VAL B 20 12.016 -6.833 13.382 1.00 0.00 H new ATOM 0 HA VAL B 20 12.288 -9.318 14.882 1.00 0.00 H new ATOM 0 HB VAL B 20 14.191 -7.124 13.886 1.00 0.00 H new ATOM 0 HG11 VAL B 20 15.943 -8.875 14.043 1.00 0.00 H new ATOM 0 HG12 VAL B 20 15.223 -8.548 15.637 1.00 0.00 H new ATOM 0 HG13 VAL B 20 14.752 -10.004 14.730 1.00 0.00 H new ATOM 0 HG21 VAL B 20 14.553 -8.667 11.977 1.00 0.00 H new ATOM 0 HG22 VAL B 20 13.364 -9.798 12.666 1.00 0.00 H new ATOM 0 HG23 VAL B 20 12.842 -8.193 12.100 1.00 0.00 H new ATOM 1292 N ASP B 21 13.101 -6.534 16.429 1.00 0.00 N ATOM 1293 CA ASP B 21 13.358 -6.009 17.800 1.00 0.00 C ATOM 1294 C ASP B 21 12.199 -6.373 18.731 1.00 0.00 C ATOM 1295 O ASP B 21 12.397 -6.697 19.886 1.00 0.00 O ATOM 1296 CB ASP B 21 13.454 -4.493 17.629 1.00 0.00 C ATOM 1297 CG ASP B 21 14.350 -3.912 18.724 1.00 0.00 C ATOM 1298 OD1 ASP B 21 13.830 -3.593 19.782 1.00 0.00 O ATOM 1299 OD2 ASP B 21 15.541 -3.795 18.488 1.00 0.00 O ATOM 0 H ASP B 21 13.099 -5.833 15.688 1.00 0.00 H new ATOM 0 HA ASP B 21 14.262 -6.428 18.242 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.860 -4.252 16.646 1.00 0.00 H new ATOM 0 HB3 ASP B 21 12.461 -4.047 17.682 1.00 0.00 H new ATOM 1304 N GLN B 22 10.991 -6.326 18.239 1.00 0.00 N ATOM 1305 CA GLN B 22 9.825 -6.674 19.099 1.00 0.00 C ATOM 1306 C GLN B 22 10.026 -8.060 19.715 1.00 0.00 C ATOM 1307 O GLN B 22 9.808 -8.263 20.892 1.00 0.00 O ATOM 1308 CB GLN B 22 8.621 -6.672 18.157 1.00 0.00 C ATOM 1309 CG GLN B 22 7.485 -5.859 18.782 1.00 0.00 C ATOM 1310 CD GLN B 22 6.738 -6.723 19.799 1.00 0.00 C ATOM 1311 OE1 GLN B 22 6.178 -7.744 19.452 1.00 0.00 O ATOM 1312 NE2 GLN B 22 6.706 -6.354 21.050 1.00 0.00 N ATOM 0 H GLN B 22 10.762 -6.062 17.281 1.00 0.00 H new ATOM 0 HA GLN B 22 9.693 -5.974 19.924 1.00 0.00 H new ATOM 0 HB2 GLN B 22 8.900 -6.245 17.194 1.00 0.00 H new ATOM 0 HB3 GLN B 22 8.291 -7.694 17.970 1.00 0.00 H new ATOM 0 HG2 GLN B 22 7.885 -4.970 19.269 1.00 0.00 H new ATOM 0 HG3 GLN B 22 6.800 -5.517 18.007 1.00 0.00 H new ATOM 0 HE21 GLN B 22 7.176 -5.497 21.341 1.00 0.00 H new ATOM 0 HE22 GLN B 22 6.211 -6.923 21.737 1.00 0.00 H new ATOM 1321 N ALA B 23 10.446 -9.012 18.928 1.00 0.00 N ATOM 1322 CA ALA B 23 10.669 -10.381 19.473 1.00 0.00 C ATOM 1323 C ALA B 23 11.800 -10.352 20.503 1.00 0.00 C ATOM 1324 O ALA B 23 11.746 -11.014 21.520 1.00 0.00 O ATOM 1325 CB ALA B 23 11.063 -11.230 18.264 1.00 0.00 C ATOM 0 H ALA B 23 10.644 -8.902 17.934 1.00 0.00 H new ATOM 0 HA ALA B 23 9.787 -10.779 19.976 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.245 -12.256 18.584 1.00 0.00 H new ATOM 0 HB2 ALA B 23 10.256 -11.216 17.531 1.00 0.00 H new ATOM 0 HB3 ALA B 23 11.969 -10.824 17.814 1.00 0.00 H new ATOM 1331 N ARG B 24 12.825 -9.583 20.249 1.00 0.00 N ATOM 1332 CA ARG B 24 13.959 -9.504 21.213 1.00 0.00 C ATOM 1333 C ARG B 24 13.466 -8.955 22.555 1.00 0.00 C ATOM 1334 O ARG B 24 13.923 -9.356 23.607 1.00 0.00 O ATOM 1335 CB ARG B 24 14.959 -8.541 20.572 1.00 0.00 C ATOM 1336 CG ARG B 24 16.183 -8.394 21.477 1.00 0.00 C ATOM 1337 CD ARG B 24 17.424 -8.147 20.617 1.00 0.00 C ATOM 1338 NE ARG B 24 18.444 -7.604 21.556 1.00 0.00 N ATOM 1339 CZ ARG B 24 18.384 -6.357 21.942 1.00 0.00 C ATOM 1340 NH1 ARG B 24 17.426 -5.581 21.510 1.00 0.00 N ATOM 1341 NH2 ARG B 24 19.285 -5.885 22.759 1.00 0.00 N ATOM 0 H ARG B 24 12.925 -9.006 19.414 1.00 0.00 H new ATOM 0 HA ARG B 24 14.406 -10.478 21.411 1.00 0.00 H new ATOM 0 HB2 ARG B 24 15.261 -8.913 19.593 1.00 0.00 H new ATOM 0 HB3 ARG B 24 14.492 -7.569 20.414 1.00 0.00 H new ATOM 0 HG2 ARG B 24 16.038 -7.567 22.172 1.00 0.00 H new ATOM 0 HG3 ARG B 24 16.316 -9.294 22.077 1.00 0.00 H new ATOM 0 HD2 ARG B 24 17.770 -9.069 20.149 1.00 0.00 H new ATOM 0 HD3 ARG B 24 17.213 -7.442 19.813 1.00 0.00 H new ATOM 0 HE ARG B 24 19.192 -8.207 21.899 1.00 0.00 H new ATOM 0 HH11 ARG B 24 16.722 -5.948 20.870 1.00 0.00 H new ATOM 0 HH12 ARG B 24 17.382 -4.608 21.813 1.00 0.00 H new ATOM 0 HH21 ARG B 24 20.035 -6.489 23.095 1.00 0.00 H new ATOM 0 HH22 ARG B 24 19.240 -4.912 23.061 1.00 0.00 H new ATOM 1355 N VAL B 25 12.535 -8.041 22.525 1.00 0.00 N ATOM 1356 CA VAL B 25 12.010 -7.469 23.798 1.00 0.00 C ATOM 1357 C VAL B 25 11.055 -8.457 24.466 1.00 0.00 C ATOM 1358 O VAL B 25 10.814 -8.399 25.656 1.00 0.00 O ATOM 1359 CB VAL B 25 11.268 -6.197 23.389 1.00 0.00 C ATOM 1360 CG1 VAL B 25 10.566 -5.602 24.611 1.00 0.00 C ATOM 1361 CG2 VAL B 25 12.265 -5.183 22.829 1.00 0.00 C ATOM 0 H VAL B 25 12.115 -7.666 21.675 1.00 0.00 H new ATOM 0 HA VAL B 25 12.805 -7.262 24.515 1.00 0.00 H new ATOM 0 HB VAL B 25 10.528 -6.437 22.626 1.00 0.00 H new ATOM 0 HG11 VAL B 25 10.036 -4.695 24.320 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.855 -6.325 25.010 1.00 0.00 H new ATOM 0 HG13 VAL B 25 11.306 -5.362 25.374 1.00 0.00 H new ATOM 0 HG21 VAL B 25 11.736 -4.276 22.537 1.00 0.00 H new ATOM 0 HG22 VAL B 25 13.006 -4.942 23.591 1.00 0.00 H new ATOM 0 HG23 VAL B 25 12.765 -5.607 21.958 1.00 0.00 H new ATOM 1371 N ARG B 26 10.511 -9.365 23.708 1.00 0.00 N ATOM 1372 CA ARG B 26 9.569 -10.362 24.294 1.00 0.00 C ATOM 1373 C ARG B 26 10.340 -11.592 24.780 1.00 0.00 C ATOM 1374 O ARG B 26 9.784 -12.659 24.948 1.00 0.00 O ATOM 1375 CB ARG B 26 8.627 -10.739 23.150 1.00 0.00 C ATOM 1376 CG ARG B 26 7.216 -10.953 23.703 1.00 0.00 C ATOM 1377 CD ARG B 26 6.662 -12.284 23.190 1.00 0.00 C ATOM 1378 NE ARG B 26 5.194 -12.203 23.429 1.00 0.00 N ATOM 1379 CZ ARG B 26 4.715 -12.363 24.632 1.00 0.00 C ATOM 1380 NH1 ARG B 26 5.519 -12.612 25.632 1.00 0.00 N ATOM 1381 NH2 ARG B 26 3.429 -12.277 24.839 1.00 0.00 N ATOM 0 H ARG B 26 10.677 -9.462 22.706 1.00 0.00 H new ATOM 0 HA ARG B 26 9.028 -9.964 25.152 1.00 0.00 H new ATOM 0 HB2 ARG B 26 8.619 -9.951 22.397 1.00 0.00 H new ATOM 0 HB3 ARG B 26 8.978 -11.646 22.659 1.00 0.00 H new ATOM 0 HG2 ARG B 26 7.237 -10.952 24.793 1.00 0.00 H new ATOM 0 HG3 ARG B 26 6.566 -10.134 23.396 1.00 0.00 H new ATOM 0 HD2 ARG B 26 6.883 -12.423 22.132 1.00 0.00 H new ATOM 0 HD3 ARG B 26 7.103 -13.127 23.721 1.00 0.00 H new ATOM 0 HE ARG B 26 4.561 -12.022 22.650 1.00 0.00 H new ATOM 0 HH11 ARG B 26 6.524 -12.682 25.473 1.00 0.00 H new ATOM 0 HH12 ARG B 26 5.141 -12.737 26.571 1.00 0.00 H new ATOM 0 HH21 ARG B 26 2.799 -12.085 24.060 1.00 0.00 H new ATOM 0 HH22 ARG B 26 3.054 -12.402 25.779 1.00 0.00 H new ATOM 1395 N GLU B 27 11.617 -11.450 25.005 1.00 0.00 N ATOM 1396 CA GLU B 27 12.424 -12.611 25.479 1.00 0.00 C ATOM 1397 C GLU B 27 12.766 -12.452 26.963 1.00 0.00 C ATOM 1398 O GLU B 27 13.324 -11.453 27.371 1.00 0.00 O ATOM 1399 CB GLU B 27 13.692 -12.581 24.628 1.00 0.00 C ATOM 1400 CG GLU B 27 14.353 -13.960 24.655 1.00 0.00 C ATOM 1401 CD GLU B 27 13.418 -14.983 24.007 1.00 0.00 C ATOM 1402 OE1 GLU B 27 12.585 -14.575 23.214 1.00 0.00 O ATOM 1403 OE2 GLU B 27 13.551 -16.155 24.315 1.00 0.00 O ATOM 0 H GLU B 27 12.137 -10.581 24.881 1.00 0.00 H new ATOM 0 HA GLU B 27 11.888 -13.555 25.380 1.00 0.00 H new ATOM 0 HB2 GLU B 27 13.449 -12.302 23.603 1.00 0.00 H new ATOM 0 HB3 GLU B 27 14.381 -11.827 25.009 1.00 0.00 H new ATOM 0 HG2 GLU B 27 15.303 -13.931 24.122 1.00 0.00 H new ATOM 0 HG3 GLU B 27 14.572 -14.251 25.682 1.00 0.00 H new ATOM 1410 N PRO B 28 12.414 -13.455 27.724 1.00 0.00 N ATOM 1411 CA PRO B 28 12.702 -13.397 29.181 1.00 0.00 C ATOM 1412 C PRO B 28 14.206 -13.244 29.418 1.00 0.00 C ATOM 1413 O PRO B 28 14.635 -12.746 30.440 1.00 0.00 O ATOM 1414 CB PRO B 28 12.209 -14.740 29.730 1.00 0.00 C ATOM 1415 CG PRO B 28 11.477 -15.402 28.605 1.00 0.00 C ATOM 1416 CD PRO B 28 11.985 -14.796 27.329 1.00 0.00 C ATOM 0 HA PRO B 28 12.217 -12.550 29.666 1.00 0.00 H new ATOM 0 HB2 PRO B 28 13.044 -15.354 30.067 1.00 0.00 H new ATOM 0 HB3 PRO B 28 11.554 -14.594 30.589 1.00 0.00 H new ATOM 0 HG2 PRO B 28 11.648 -16.478 28.615 1.00 0.00 H new ATOM 0 HG3 PRO B 28 10.402 -15.249 28.702 1.00 0.00 H new ATOM 0 HD2 PRO B 28 12.811 -15.374 26.913 1.00 0.00 H new ATOM 0 HD3 PRO B 28 11.207 -14.758 26.567 1.00 0.00 H new ATOM 1424 N ARG B 29 15.009 -13.670 28.484 1.00 0.00 N ATOM 1425 CA ARG B 29 16.485 -13.552 28.658 1.00 0.00 C ATOM 1426 C ARG B 29 17.063 -12.576 27.630 1.00 0.00 C ATOM 1427 O ARG B 29 16.865 -11.380 27.713 1.00 0.00 O ATOM 1428 CB ARG B 29 17.024 -14.963 28.426 1.00 0.00 C ATOM 1429 CG ARG B 29 18.552 -14.942 28.487 1.00 0.00 C ATOM 1430 CD ARG B 29 19.002 -14.198 29.746 1.00 0.00 C ATOM 1431 NE ARG B 29 20.341 -14.766 30.066 1.00 0.00 N ATOM 1432 CZ ARG B 29 21.391 -14.395 29.384 1.00 0.00 C ATOM 1433 NH1 ARG B 29 21.273 -13.518 28.424 1.00 0.00 N ATOM 1434 NH2 ARG B 29 22.560 -14.900 29.664 1.00 0.00 N ATOM 0 H ARG B 29 14.708 -14.095 27.607 1.00 0.00 H new ATOM 0 HA ARG B 29 16.757 -13.170 29.642 1.00 0.00 H new ATOM 0 HB2 ARG B 29 16.629 -15.643 29.180 1.00 0.00 H new ATOM 0 HB3 ARG B 29 16.693 -15.335 27.456 1.00 0.00 H new ATOM 0 HG2 ARG B 29 18.940 -15.960 28.495 1.00 0.00 H new ATOM 0 HG3 ARG B 29 18.955 -14.454 27.600 1.00 0.00 H new ATOM 0 HD2 ARG B 29 19.060 -13.124 29.571 1.00 0.00 H new ATOM 0 HD3 ARG B 29 18.301 -14.350 30.567 1.00 0.00 H new ATOM 0 HE ARG B 29 20.438 -15.446 30.820 1.00 0.00 H new ATOM 0 HH11 ARG B 29 20.359 -13.121 28.205 1.00 0.00 H new ATOM 0 HH12 ARG B 29 22.095 -13.230 27.893 1.00 0.00 H new ATOM 0 HH21 ARG B 29 22.653 -15.584 30.415 1.00 0.00 H new ATOM 0 HH22 ARG B 29 23.381 -14.611 29.132 1.00 0.00 H new TER 1448 ARG B 29