USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 889 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 166:sc= -0.0195 (180deg=-0.298) USER MOD Single : A 1 MET N :NH3+ 151:sc= 0.0309 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0318 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 18 MET CE :methyl -130:sc= -0.66 (180deg=-0.999) USER MOD Single : A 19 MET CE :methyl -122:sc= -0.0352 (180deg=-0.302) USER MOD Single : A 29 LYS NZ :NH3+ -158:sc= 0.89 (180deg=0.328) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 162:sc= 1.21 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0.996 K(o=1,f=-3.4!) USER MOD Single : A 64 LYS NZ :NH3+ 176:sc= 0.642 (180deg=0.633) USER MOD Single : A 65 SER OG : rot 7:sc= 0.259 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.137 USER MOD Single : A 86 SER OG : rot -10:sc= 1.06 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 102 LYS NZ :NH3+ -133:sc= -0.0787 (180deg=-0.562) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.0462 USER MOD Single : A 106 MET CE :methyl -174:sc= -2.53! (180deg=-2.8!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.723 0.456 -3.782 1.00 0.00 N ATOM 2 CA MET A 1 2.499 1.582 -4.337 1.00 0.00 C ATOM 3 C MET A 1 3.524 2.079 -3.324 1.00 0.00 C ATOM 4 O MET A 1 3.271 2.052 -2.120 1.00 0.00 O ATOM 5 CB MET A 1 1.559 2.709 -4.782 1.00 0.00 C ATOM 6 CG MET A 1 2.341 3.905 -5.330 1.00 0.00 C ATOM 7 SD MET A 1 3.343 3.540 -6.797 1.00 0.00 S ATOM 8 CE MET A 1 2.023 3.178 -7.983 1.00 0.00 C ATOM 0 H1 MET A 1 0.774 0.445 -4.208 1.00 0.00 H new ATOM 0 H2 MET A 1 2.209 -0.439 -3.995 1.00 0.00 H new ATOM 0 H3 MET A 1 1.638 0.567 -2.751 1.00 0.00 H new ATOM 0 HA MET A 1 3.044 1.234 -5.214 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.878 2.336 -5.547 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.947 3.028 -3.939 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.638 4.701 -5.575 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.994 4.286 -4.545 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.432 3.175 -8.993 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.594 2.200 -7.763 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.247 3.940 -7.908 1.00 0.00 H new ATOM 20 N SER A 2 4.680 2.536 -3.811 1.00 0.00 N ATOM 21 CA SER A 2 5.747 3.041 -2.952 1.00 0.00 C ATOM 22 C SER A 2 6.641 4.004 -3.729 1.00 0.00 C ATOM 23 O SER A 2 6.685 3.961 -4.959 1.00 0.00 O ATOM 24 CB SER A 2 6.562 1.866 -2.407 1.00 0.00 C ATOM 25 OG SER A 2 7.652 2.350 -1.653 1.00 0.00 O ATOM 0 H SER A 2 4.900 2.565 -4.807 1.00 0.00 H new ATOM 0 HA SER A 2 5.310 3.586 -2.115 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.931 1.231 -1.785 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.923 1.249 -3.230 1.00 0.00 H new ATOM 0 HG SER A 2 8.170 1.595 -1.305 1.00 0.00 H new ATOM 31 N ALA A 3 7.356 4.871 -3.009 1.00 0.00 N ATOM 32 CA ALA A 3 8.266 5.835 -3.612 1.00 0.00 C ATOM 33 C ALA A 3 9.571 5.164 -4.052 1.00 0.00 C ATOM 34 O ALA A 3 10.467 5.834 -4.567 1.00 0.00 O ATOM 35 CB ALA A 3 8.542 6.953 -2.608 1.00 0.00 C ATOM 0 H ALA A 3 7.317 4.921 -1.991 1.00 0.00 H new ATOM 0 HA ALA A 3 7.802 6.254 -4.505 1.00 0.00 H new ATOM 0 HB1 ALA A 3 9.223 7.680 -3.051 1.00 0.00 H new ATOM 0 HB2 ALA A 3 7.606 7.446 -2.346 1.00 0.00 H new ATOM 0 HB3 ALA A 3 8.995 6.532 -1.710 1.00 0.00 H new ATOM 41 N LEU A 4 9.679 3.846 -3.849 1.00 0.00 N ATOM 42 CA LEU A 4 10.867 3.091 -4.208 1.00 0.00 C ATOM 43 C LEU A 4 10.473 1.672 -4.609 1.00 0.00 C ATOM 44 O LEU A 4 10.107 0.859 -3.759 1.00 0.00 O ATOM 45 CB LEU A 4 11.829 3.100 -3.013 1.00 0.00 C ATOM 46 CG LEU A 4 12.992 2.117 -3.185 1.00 0.00 C ATOM 47 CD1 LEU A 4 13.776 2.426 -4.454 1.00 0.00 C ATOM 48 CD2 LEU A 4 13.936 2.231 -1.989 1.00 0.00 C ATOM 0 H LEU A 4 8.941 3.280 -3.431 1.00 0.00 H new ATOM 0 HA LEU A 4 11.370 3.544 -5.063 1.00 0.00 H new ATOM 0 HB2 LEU A 4 12.226 4.106 -2.878 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.278 2.850 -2.106 1.00 0.00 H new ATOM 0 HG LEU A 4 12.582 1.109 -3.253 1.00 0.00 H new ATOM 0 HD11 LEU A 4 14.597 1.716 -4.556 1.00 0.00 H new ATOM 0 HD12 LEU A 4 13.116 2.345 -5.318 1.00 0.00 H new ATOM 0 HD13 LEU A 4 14.177 3.438 -4.397 1.00 0.00 H new ATOM 0 HD21 LEU A 4 14.763 1.532 -2.111 1.00 0.00 H new ATOM 0 HD22 LEU A 4 14.325 3.247 -1.928 1.00 0.00 H new ATOM 0 HD23 LEU A 4 13.393 1.995 -1.073 1.00 0.00 H new ATOM 60 N THR A 5 10.553 1.381 -5.911 1.00 0.00 N ATOM 61 CA THR A 5 10.233 0.060 -6.444 1.00 0.00 C ATOM 62 C THR A 5 11.180 -0.328 -7.576 1.00 0.00 C ATOM 63 O THR A 5 11.509 -1.502 -7.722 1.00 0.00 O ATOM 64 CB THR A 5 8.781 0.019 -6.938 1.00 0.00 C ATOM 65 OG1 THR A 5 8.644 0.862 -8.060 1.00 0.00 O ATOM 66 CG2 THR A 5 7.801 0.468 -5.855 1.00 0.00 C ATOM 0 H THR A 5 10.841 2.055 -6.621 1.00 0.00 H new ATOM 0 HA THR A 5 10.356 -0.661 -5.636 1.00 0.00 H new ATOM 0 HB THR A 5 8.548 -1.012 -7.202 1.00 0.00 H new ATOM 0 HG1 THR A 5 7.717 0.836 -8.378 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.784 0.425 -6.244 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.887 -0.191 -4.991 1.00 0.00 H new ATOM 0 HG23 THR A 5 8.032 1.491 -5.556 1.00 0.00 H new ATOM 74 N GLN A 6 11.620 0.640 -8.377 1.00 0.00 N ATOM 75 CA GLN A 6 12.487 0.355 -9.509 1.00 0.00 C ATOM 76 C GLN A 6 13.943 0.463 -9.087 1.00 0.00 C ATOM 77 O GLN A 6 14.428 1.554 -8.795 1.00 0.00 O ATOM 78 CB GLN A 6 12.150 1.309 -10.652 1.00 0.00 C ATOM 79 CG GLN A 6 10.675 1.109 -11.014 1.00 0.00 C ATOM 80 CD GLN A 6 10.269 1.848 -12.285 1.00 0.00 C ATOM 81 OE1 GLN A 6 11.090 2.468 -12.955 1.00 0.00 O ATOM 82 NE2 GLN A 6 8.982 1.775 -12.615 1.00 0.00 N ATOM 0 H GLN A 6 11.389 1.626 -8.260 1.00 0.00 H new ATOM 0 HA GLN A 6 12.326 -0.664 -9.860 1.00 0.00 H new ATOM 0 HB2 GLN A 6 12.333 2.341 -10.354 1.00 0.00 H new ATOM 0 HB3 GLN A 6 12.785 1.109 -11.515 1.00 0.00 H new ATOM 0 HG2 GLN A 6 10.479 0.044 -11.141 1.00 0.00 H new ATOM 0 HG3 GLN A 6 10.054 1.452 -10.187 1.00 0.00 H new ATOM 0 HE21 GLN A 6 8.334 1.248 -12.029 1.00 0.00 H new ATOM 0 HE22 GLN A 6 8.643 2.246 -13.454 1.00 0.00 H new ATOM 91 N ILE A 7 14.641 -0.675 -9.055 1.00 0.00 N ATOM 92 CA ILE A 7 16.012 -0.736 -8.577 1.00 0.00 C ATOM 93 C ILE A 7 16.899 -1.459 -9.583 1.00 0.00 C ATOM 94 O ILE A 7 16.578 -2.569 -10.014 1.00 0.00 O ATOM 95 CB ILE A 7 16.042 -1.414 -7.202 1.00 0.00 C ATOM 96 CG1 ILE A 7 15.172 -0.609 -6.222 1.00 0.00 C ATOM 97 CG2 ILE A 7 17.486 -1.513 -6.698 1.00 0.00 C ATOM 98 CD1 ILE A 7 15.153 -1.226 -4.823 1.00 0.00 C ATOM 0 H ILE A 7 14.267 -1.574 -9.360 1.00 0.00 H new ATOM 0 HA ILE A 7 16.407 0.274 -8.470 1.00 0.00 H new ATOM 0 HB ILE A 7 15.642 -2.425 -7.280 1.00 0.00 H new ATOM 0 HG12 ILE A 7 15.547 0.413 -6.161 1.00 0.00 H new ATOM 0 HG13 ILE A 7 14.153 -0.552 -6.606 1.00 0.00 H new ATOM 0 HG21 ILE A 7 17.498 -1.996 -5.721 1.00 0.00 H new ATOM 0 HG22 ILE A 7 18.077 -2.101 -7.400 1.00 0.00 H new ATOM 0 HG23 ILE A 7 17.911 -0.513 -6.614 1.00 0.00 H new ATOM 0 HD11 ILE A 7 14.526 -0.622 -4.167 1.00 0.00 H new ATOM 0 HD12 ILE A 7 14.752 -2.238 -4.877 1.00 0.00 H new ATOM 0 HD13 ILE A 7 16.168 -1.258 -4.426 1.00 0.00 H new ATOM 110 N LEU A 8 18.021 -0.835 -9.960 1.00 0.00 N ATOM 111 CA LEU A 8 18.999 -1.464 -10.837 1.00 0.00 C ATOM 112 C LEU A 8 20.001 -2.255 -10.000 1.00 0.00 C ATOM 113 O LEU A 8 20.242 -1.924 -8.842 1.00 0.00 O ATOM 114 CB LEU A 8 19.712 -0.407 -11.688 1.00 0.00 C ATOM 115 CG LEU A 8 20.389 -1.060 -12.903 1.00 0.00 C ATOM 116 CD1 LEU A 8 19.354 -1.360 -13.985 1.00 0.00 C ATOM 117 CD2 LEU A 8 21.450 -0.133 -13.493 1.00 0.00 C ATOM 0 H LEU A 8 18.269 0.110 -9.666 1.00 0.00 H new ATOM 0 HA LEU A 8 18.488 -2.149 -11.513 1.00 0.00 H new ATOM 0 HB2 LEU A 8 18.995 0.342 -12.023 1.00 0.00 H new ATOM 0 HB3 LEU A 8 20.457 0.112 -11.085 1.00 0.00 H new ATOM 0 HG LEU A 8 20.858 -1.985 -12.566 1.00 0.00 H new ATOM 0 HD11 LEU A 8 19.846 -1.822 -14.841 1.00 0.00 H new ATOM 0 HD12 LEU A 8 18.600 -2.040 -13.589 1.00 0.00 H new ATOM 0 HD13 LEU A 8 18.876 -0.432 -14.299 1.00 0.00 H new ATOM 0 HD21 LEU A 8 21.917 -0.615 -14.352 1.00 0.00 H new ATOM 0 HD22 LEU A 8 20.983 0.800 -13.809 1.00 0.00 H new ATOM 0 HD23 LEU A 8 22.208 0.078 -12.739 1.00 0.00 H new ATOM 129 N ILE A 9 20.587 -3.296 -10.588 1.00 0.00 N ATOM 130 CA ILE A 9 21.566 -4.125 -9.908 1.00 0.00 C ATOM 131 C ILE A 9 22.847 -4.174 -10.740 1.00 0.00 C ATOM 132 O ILE A 9 22.795 -4.227 -11.966 1.00 0.00 O ATOM 133 CB ILE A 9 20.982 -5.528 -9.690 1.00 0.00 C ATOM 134 CG1 ILE A 9 19.682 -5.460 -8.878 1.00 0.00 C ATOM 135 CG2 ILE A 9 21.995 -6.415 -8.970 1.00 0.00 C ATOM 136 CD1 ILE A 9 18.886 -6.757 -9.046 1.00 0.00 C ATOM 0 H ILE A 9 20.394 -3.584 -11.547 1.00 0.00 H new ATOM 0 HA ILE A 9 21.809 -3.705 -8.932 1.00 0.00 H new ATOM 0 HB ILE A 9 20.758 -5.957 -10.667 1.00 0.00 H new ATOM 0 HG12 ILE A 9 19.911 -5.299 -7.825 1.00 0.00 H new ATOM 0 HG13 ILE A 9 19.083 -4.611 -9.208 1.00 0.00 H new ATOM 0 HG21 ILE A 9 21.569 -7.407 -8.821 1.00 0.00 H new ATOM 0 HG22 ILE A 9 22.901 -6.495 -9.571 1.00 0.00 H new ATOM 0 HG23 ILE A 9 22.240 -5.977 -8.003 1.00 0.00 H new ATOM 0 HD11 ILE A 9 17.966 -6.697 -8.465 1.00 0.00 H new ATOM 0 HD12 ILE A 9 18.642 -6.900 -10.099 1.00 0.00 H new ATOM 0 HD13 ILE A 9 19.483 -7.598 -8.694 1.00 0.00 H new ATOM 148 N VAL A 10 23.999 -4.155 -10.066 1.00 0.00 N ATOM 149 CA VAL A 10 25.292 -4.237 -10.724 1.00 0.00 C ATOM 150 C VAL A 10 26.185 -5.230 -9.997 1.00 0.00 C ATOM 151 O VAL A 10 26.622 -4.975 -8.875 1.00 0.00 O ATOM 152 CB VAL A 10 25.947 -2.853 -10.824 1.00 0.00 C ATOM 153 CG1 VAL A 10 27.192 -2.931 -11.704 1.00 0.00 C ATOM 154 CG2 VAL A 10 24.984 -1.824 -11.413 1.00 0.00 C ATOM 0 H VAL A 10 24.055 -4.082 -9.050 1.00 0.00 H new ATOM 0 HA VAL A 10 25.146 -4.596 -11.743 1.00 0.00 H new ATOM 0 HB VAL A 10 26.219 -2.539 -9.816 1.00 0.00 H new ATOM 0 HG11 VAL A 10 27.652 -1.945 -11.771 1.00 0.00 H new ATOM 0 HG12 VAL A 10 27.902 -3.634 -11.269 1.00 0.00 H new ATOM 0 HG13 VAL A 10 26.912 -3.269 -12.702 1.00 0.00 H new ATOM 0 HG21 VAL A 10 25.478 -0.854 -11.470 1.00 0.00 H new ATOM 0 HG22 VAL A 10 24.683 -2.138 -12.413 1.00 0.00 H new ATOM 0 HG23 VAL A 10 24.102 -1.745 -10.777 1.00 0.00 H new ATOM 164 N GLU A 11 26.451 -6.363 -10.645 1.00 0.00 N ATOM 165 CA GLU A 11 27.221 -7.457 -10.068 1.00 0.00 C ATOM 166 C GLU A 11 28.107 -8.089 -11.139 1.00 0.00 C ATOM 167 O GLU A 11 27.929 -7.825 -12.324 1.00 0.00 O ATOM 168 CB GLU A 11 26.264 -8.518 -9.507 1.00 0.00 C ATOM 169 CG GLU A 11 25.378 -7.979 -8.380 1.00 0.00 C ATOM 170 CD GLU A 11 26.171 -7.663 -7.115 1.00 0.00 C ATOM 171 OE1 GLU A 11 27.349 -8.078 -7.043 1.00 0.00 O ATOM 172 OE2 GLU A 11 25.583 -7.004 -6.227 1.00 0.00 O ATOM 0 H GLU A 11 26.133 -6.546 -11.597 1.00 0.00 H new ATOM 0 HA GLU A 11 27.848 -7.069 -9.265 1.00 0.00 H new ATOM 0 HB2 GLU A 11 25.632 -8.893 -10.312 1.00 0.00 H new ATOM 0 HB3 GLU A 11 26.843 -9.363 -9.135 1.00 0.00 H new ATOM 0 HG2 GLU A 11 24.870 -7.077 -8.721 1.00 0.00 H new ATOM 0 HG3 GLU A 11 24.605 -8.712 -8.147 1.00 0.00 H new ATOM 179 N ASP A 12 29.059 -8.924 -10.718 1.00 0.00 N ATOM 180 CA ASP A 12 29.880 -9.695 -11.642 1.00 0.00 C ATOM 181 C ASP A 12 29.732 -11.191 -11.329 1.00 0.00 C ATOM 182 O ASP A 12 30.462 -12.013 -11.880 1.00 0.00 O ATOM 183 CB ASP A 12 31.342 -9.239 -11.564 1.00 0.00 C ATOM 184 CG ASP A 12 32.000 -9.542 -10.213 1.00 0.00 C ATOM 185 OD1 ASP A 12 31.302 -10.056 -9.315 1.00 0.00 O ATOM 186 OD2 ASP A 12 33.214 -9.251 -10.105 1.00 0.00 O ATOM 0 H ASP A 12 29.278 -9.081 -9.734 1.00 0.00 H new ATOM 0 HA ASP A 12 29.542 -9.525 -12.664 1.00 0.00 H new ATOM 0 HB2 ASP A 12 31.911 -9.728 -12.355 1.00 0.00 H new ATOM 0 HB3 ASP A 12 31.391 -8.166 -11.752 1.00 0.00 H new ATOM 191 N GLU A 13 28.786 -11.534 -10.443 1.00 0.00 N ATOM 192 CA GLU A 13 28.506 -12.912 -10.072 1.00 0.00 C ATOM 193 C GLU A 13 27.024 -13.199 -10.328 1.00 0.00 C ATOM 194 O GLU A 13 26.172 -12.394 -9.951 1.00 0.00 O ATOM 195 CB GLU A 13 28.852 -13.096 -8.586 1.00 0.00 C ATOM 196 CG GLU A 13 28.662 -14.544 -8.119 1.00 0.00 C ATOM 197 CD GLU A 13 29.765 -15.476 -8.636 1.00 0.00 C ATOM 198 OE1 GLU A 13 30.641 -14.992 -9.385 1.00 0.00 O ATOM 199 OE2 GLU A 13 29.712 -16.672 -8.266 1.00 0.00 O ATOM 0 H GLU A 13 28.195 -10.853 -9.966 1.00 0.00 H new ATOM 0 HA GLU A 13 29.103 -13.607 -10.663 1.00 0.00 H new ATOM 0 HB2 GLU A 13 29.886 -12.794 -8.416 1.00 0.00 H new ATOM 0 HB3 GLU A 13 28.225 -12.438 -7.985 1.00 0.00 H new ATOM 0 HG2 GLU A 13 28.648 -14.572 -7.029 1.00 0.00 H new ATOM 0 HG3 GLU A 13 27.693 -14.908 -8.460 1.00 0.00 H new ATOM 206 N PRO A 14 26.697 -14.334 -10.963 1.00 0.00 N ATOM 207 CA PRO A 14 25.324 -14.694 -11.262 1.00 0.00 C ATOM 208 C PRO A 14 24.533 -14.977 -9.990 1.00 0.00 C ATOM 209 O PRO A 14 23.357 -14.627 -9.909 1.00 0.00 O ATOM 210 CB PRO A 14 25.402 -15.950 -12.124 1.00 0.00 C ATOM 211 CG PRO A 14 26.800 -16.520 -11.882 1.00 0.00 C ATOM 212 CD PRO A 14 27.637 -15.314 -11.458 1.00 0.00 C ATOM 0 HA PRO A 14 24.811 -13.878 -11.772 1.00 0.00 H new ATOM 0 HB2 PRO A 14 24.631 -16.668 -11.844 1.00 0.00 H new ATOM 0 HB3 PRO A 14 25.250 -15.714 -13.177 1.00 0.00 H new ATOM 0 HG2 PRO A 14 26.787 -17.287 -11.107 1.00 0.00 H new ATOM 0 HG3 PRO A 14 27.201 -16.984 -12.783 1.00 0.00 H new ATOM 0 HD2 PRO A 14 28.356 -15.590 -10.687 1.00 0.00 H new ATOM 0 HD3 PRO A 14 28.207 -14.919 -12.299 1.00 0.00 H new ATOM 220 N LEU A 15 25.172 -15.609 -9.003 1.00 0.00 N ATOM 221 CA LEU A 15 24.493 -16.028 -7.786 1.00 0.00 C ATOM 222 C LEU A 15 23.968 -14.818 -7.019 1.00 0.00 C ATOM 223 O LEU A 15 22.840 -14.846 -6.535 1.00 0.00 O ATOM 224 CB LEU A 15 25.456 -16.826 -6.904 1.00 0.00 C ATOM 225 CG LEU A 15 25.524 -18.299 -7.320 1.00 0.00 C ATOM 226 CD1 LEU A 15 26.130 -18.472 -8.709 1.00 0.00 C ATOM 227 CD2 LEU A 15 26.382 -19.057 -6.308 1.00 0.00 C ATOM 0 H LEU A 15 26.165 -15.841 -9.029 1.00 0.00 H new ATOM 0 HA LEU A 15 23.647 -16.658 -8.059 1.00 0.00 H new ATOM 0 HB2 LEU A 15 26.451 -16.386 -6.963 1.00 0.00 H new ATOM 0 HB3 LEU A 15 25.138 -16.757 -5.864 1.00 0.00 H new ATOM 0 HG LEU A 15 24.507 -18.690 -7.346 1.00 0.00 H new ATOM 0 HD11 LEU A 15 26.159 -19.531 -8.964 1.00 0.00 H new ATOM 0 HD12 LEU A 15 25.522 -17.939 -9.440 1.00 0.00 H new ATOM 0 HD13 LEU A 15 27.143 -18.069 -8.717 1.00 0.00 H new ATOM 0 HD21 LEU A 15 26.438 -20.108 -6.593 1.00 0.00 H new ATOM 0 HD22 LEU A 15 27.385 -18.632 -6.291 1.00 0.00 H new ATOM 0 HD23 LEU A 15 25.935 -18.973 -5.317 1.00 0.00 H new ATOM 239 N ILE A 16 24.766 -13.754 -6.906 1.00 0.00 N ATOM 240 CA ILE A 16 24.347 -12.570 -6.164 1.00 0.00 C ATOM 241 C ILE A 16 23.295 -11.801 -6.965 1.00 0.00 C ATOM 242 O ILE A 16 22.409 -11.179 -6.384 1.00 0.00 O ATOM 243 CB ILE A 16 25.565 -11.684 -5.873 1.00 0.00 C ATOM 244 CG1 ILE A 16 26.702 -12.478 -5.208 1.00 0.00 C ATOM 245 CG2 ILE A 16 25.161 -10.504 -4.990 1.00 0.00 C ATOM 246 CD1 ILE A 16 26.296 -13.071 -3.856 1.00 0.00 C ATOM 0 H ILE A 16 25.698 -13.691 -7.316 1.00 0.00 H new ATOM 0 HA ILE A 16 23.904 -12.873 -5.215 1.00 0.00 H new ATOM 0 HB ILE A 16 25.936 -11.310 -6.827 1.00 0.00 H new ATOM 0 HG12 ILE A 16 27.016 -13.282 -5.873 1.00 0.00 H new ATOM 0 HG13 ILE A 16 27.563 -11.825 -5.070 1.00 0.00 H new ATOM 0 HG21 ILE A 16 26.034 -9.883 -4.791 1.00 0.00 H new ATOM 0 HG22 ILE A 16 24.402 -9.911 -5.500 1.00 0.00 H new ATOM 0 HG23 ILE A 16 24.758 -10.876 -4.048 1.00 0.00 H new ATOM 0 HD11 ILE A 16 27.137 -13.621 -3.433 1.00 0.00 H new ATOM 0 HD12 ILE A 16 26.009 -12.267 -3.178 1.00 0.00 H new ATOM 0 HD13 ILE A 16 25.453 -13.748 -3.994 1.00 0.00 H new ATOM 258 N ALA A 17 23.391 -11.842 -8.297 1.00 0.00 N ATOM 259 CA ALA A 17 22.478 -11.107 -9.156 1.00 0.00 C ATOM 260 C ALA A 17 21.089 -11.741 -9.147 1.00 0.00 C ATOM 261 O ALA A 17 20.094 -11.038 -8.978 1.00 0.00 O ATOM 262 CB ALA A 17 23.045 -11.076 -10.576 1.00 0.00 C ATOM 0 H ALA A 17 24.097 -12.381 -8.799 1.00 0.00 H new ATOM 0 HA ALA A 17 22.377 -10.088 -8.781 1.00 0.00 H new ATOM 0 HB1 ALA A 17 22.366 -10.526 -11.227 1.00 0.00 H new ATOM 0 HB2 ALA A 17 24.018 -10.585 -10.569 1.00 0.00 H new ATOM 0 HB3 ALA A 17 23.156 -12.095 -10.946 1.00 0.00 H new ATOM 268 N MET A 18 21.007 -13.065 -9.318 1.00 0.00 N ATOM 269 CA MET A 18 19.716 -13.742 -9.395 1.00 0.00 C ATOM 270 C MET A 18 19.031 -13.748 -8.029 1.00 0.00 C ATOM 271 O MET A 18 17.806 -13.838 -7.951 1.00 0.00 O ATOM 272 CB MET A 18 19.914 -15.169 -9.918 1.00 0.00 C ATOM 273 CG MET A 18 20.628 -16.060 -8.896 1.00 0.00 C ATOM 274 SD MET A 18 20.872 -17.774 -9.449 1.00 0.00 S ATOM 275 CE MET A 18 22.046 -17.501 -10.803 1.00 0.00 C ATOM 0 H MET A 18 21.815 -13.682 -9.405 1.00 0.00 H new ATOM 0 HA MET A 18 19.069 -13.203 -10.087 1.00 0.00 H new ATOM 0 HB2 MET A 18 18.945 -15.603 -10.163 1.00 0.00 H new ATOM 0 HB3 MET A 18 20.493 -15.140 -10.841 1.00 0.00 H new ATOM 0 HG2 MET A 18 21.599 -15.623 -8.664 1.00 0.00 H new ATOM 0 HG3 MET A 18 20.052 -16.067 -7.971 1.00 0.00 H new ATOM 0 HE1 MET A 18 21.697 -18.018 -11.697 1.00 0.00 H new ATOM 0 HE2 MET A 18 22.123 -16.433 -11.009 1.00 0.00 H new ATOM 0 HE3 MET A 18 23.025 -17.887 -10.519 1.00 0.00 H new ATOM 285 N MET A 19 19.817 -13.645 -6.952 1.00 0.00 N ATOM 286 CA MET A 19 19.275 -13.560 -5.607 1.00 0.00 C ATOM 287 C MET A 19 18.636 -12.192 -5.372 1.00 0.00 C ATOM 288 O MET A 19 17.643 -12.090 -4.653 1.00 0.00 O ATOM 289 CB MET A 19 20.394 -13.817 -4.596 1.00 0.00 C ATOM 290 CG MET A 19 20.710 -15.314 -4.531 1.00 0.00 C ATOM 291 SD MET A 19 19.419 -16.326 -3.758 1.00 0.00 S ATOM 292 CE MET A 19 19.582 -15.769 -2.044 1.00 0.00 C ATOM 0 H MET A 19 20.836 -13.619 -6.995 1.00 0.00 H new ATOM 0 HA MET A 19 18.499 -14.316 -5.481 1.00 0.00 H new ATOM 0 HB2 MET A 19 21.287 -13.261 -4.881 1.00 0.00 H new ATOM 0 HB3 MET A 19 20.095 -13.457 -3.611 1.00 0.00 H new ATOM 0 HG2 MET A 19 20.882 -15.680 -5.543 1.00 0.00 H new ATOM 0 HG3 MET A 19 21.640 -15.452 -3.980 1.00 0.00 H new ATOM 0 HE1 MET A 19 19.796 -16.624 -1.402 1.00 0.00 H new ATOM 0 HE2 MET A 19 20.396 -15.048 -1.972 1.00 0.00 H new ATOM 0 HE3 MET A 19 18.652 -15.300 -1.724 1.00 0.00 H new ATOM 302 N LEU A 20 19.195 -11.139 -5.977 1.00 0.00 N ATOM 303 CA LEU A 20 18.664 -9.795 -5.821 1.00 0.00 C ATOM 304 C LEU A 20 17.419 -9.602 -6.689 1.00 0.00 C ATOM 305 O LEU A 20 16.513 -8.868 -6.305 1.00 0.00 O ATOM 306 CB LEU A 20 19.750 -8.787 -6.202 1.00 0.00 C ATOM 307 CG LEU A 20 20.829 -8.695 -5.117 1.00 0.00 C ATOM 308 CD1 LEU A 20 22.000 -7.869 -5.636 1.00 0.00 C ATOM 309 CD2 LEU A 20 20.269 -8.024 -3.865 1.00 0.00 C ATOM 0 H LEU A 20 20.016 -11.199 -6.579 1.00 0.00 H new ATOM 0 HA LEU A 20 18.370 -9.638 -4.783 1.00 0.00 H new ATOM 0 HB2 LEU A 20 20.206 -9.080 -7.148 1.00 0.00 H new ATOM 0 HB3 LEU A 20 19.301 -7.806 -6.356 1.00 0.00 H new ATOM 0 HG LEU A 20 21.160 -9.703 -4.867 1.00 0.00 H new ATOM 0 HD11 LEU A 20 22.768 -7.803 -4.866 1.00 0.00 H new ATOM 0 HD12 LEU A 20 22.416 -8.346 -6.523 1.00 0.00 H new ATOM 0 HD13 LEU A 20 21.654 -6.867 -5.891 1.00 0.00 H new ATOM 0 HD21 LEU A 20 21.047 -7.966 -3.104 1.00 0.00 H new ATOM 0 HD22 LEU A 20 19.928 -7.019 -4.113 1.00 0.00 H new ATOM 0 HD23 LEU A 20 19.431 -8.607 -3.483 1.00 0.00 H new ATOM 321 N GLU A 21 17.367 -10.257 -7.851 1.00 0.00 N ATOM 322 CA GLU A 21 16.211 -10.169 -8.730 1.00 0.00 C ATOM 323 C GLU A 21 15.003 -10.869 -8.107 1.00 0.00 C ATOM 324 O GLU A 21 13.864 -10.458 -8.326 1.00 0.00 O ATOM 325 CB GLU A 21 16.551 -10.805 -10.078 1.00 0.00 C ATOM 326 CG GLU A 21 17.598 -9.970 -10.822 1.00 0.00 C ATOM 327 CD GLU A 21 18.130 -10.686 -12.066 1.00 0.00 C ATOM 328 OE1 GLU A 21 18.993 -10.081 -12.741 1.00 0.00 O ATOM 329 OE2 GLU A 21 17.674 -11.822 -12.328 1.00 0.00 O ATOM 0 H GLU A 21 18.116 -10.854 -8.201 1.00 0.00 H new ATOM 0 HA GLU A 21 15.956 -9.119 -8.876 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.928 -11.816 -9.924 1.00 0.00 H new ATOM 0 HB3 GLU A 21 15.649 -10.890 -10.684 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.159 -9.016 -11.114 1.00 0.00 H new ATOM 0 HG3 GLU A 21 18.427 -9.747 -10.150 1.00 0.00 H new ATOM 336 N ASP A 22 15.251 -11.924 -7.326 1.00 0.00 N ATOM 337 CA ASP A 22 14.185 -12.669 -6.670 1.00 0.00 C ATOM 338 C ASP A 22 13.591 -11.864 -5.513 1.00 0.00 C ATOM 339 O ASP A 22 12.376 -11.837 -5.330 1.00 0.00 O ATOM 340 CB ASP A 22 14.748 -14.008 -6.181 1.00 0.00 C ATOM 341 CG ASP A 22 13.706 -14.857 -5.452 1.00 0.00 C ATOM 342 OD1 ASP A 22 14.130 -15.693 -4.625 1.00 0.00 O ATOM 343 OD2 ASP A 22 12.501 -14.669 -5.728 1.00 0.00 O ATOM 0 H ASP A 22 16.188 -12.279 -7.135 1.00 0.00 H new ATOM 0 HA ASP A 22 13.379 -12.855 -7.379 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.135 -14.567 -7.033 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.590 -13.821 -5.514 1.00 0.00 H new ATOM 348 N PHE A 23 14.450 -11.200 -4.730 1.00 0.00 N ATOM 349 CA PHE A 23 13.993 -10.440 -3.579 1.00 0.00 C ATOM 350 C PHE A 23 13.224 -9.169 -3.917 1.00 0.00 C ATOM 351 O PHE A 23 12.415 -8.707 -3.114 1.00 0.00 O ATOM 352 CB PHE A 23 15.147 -10.161 -2.615 1.00 0.00 C ATOM 353 CG PHE A 23 15.576 -11.359 -1.798 1.00 0.00 C ATOM 354 CD1 PHE A 23 16.925 -11.743 -1.771 1.00 0.00 C ATOM 355 CD2 PHE A 23 14.626 -12.090 -1.068 1.00 0.00 C ATOM 356 CE1 PHE A 23 17.321 -12.849 -1.012 1.00 0.00 C ATOM 357 CE2 PHE A 23 15.025 -13.203 -0.317 1.00 0.00 C ATOM 358 CZ PHE A 23 16.373 -13.582 -0.286 1.00 0.00 C ATOM 0 H PHE A 23 15.459 -11.178 -4.878 1.00 0.00 H new ATOM 0 HA PHE A 23 13.263 -11.079 -3.082 1.00 0.00 H new ATOM 0 HB2 PHE A 23 16.003 -9.799 -3.185 1.00 0.00 H new ATOM 0 HB3 PHE A 23 14.854 -9.359 -1.937 1.00 0.00 H new ATOM 0 HD1 PHE A 23 17.657 -11.185 -2.336 1.00 0.00 H new ATOM 0 HD2 PHE A 23 13.587 -11.794 -1.085 1.00 0.00 H new ATOM 0 HE1 PHE A 23 18.361 -13.139 -0.985 1.00 0.00 H new ATOM 0 HE2 PHE A 23 14.292 -13.770 0.239 1.00 0.00 H new ATOM 0 HZ PHE A 23 16.681 -14.438 0.296 1.00 0.00 H new ATOM 368 N LEU A 24 13.459 -8.599 -5.102 1.00 0.00 N ATOM 369 CA LEU A 24 12.736 -7.406 -5.512 1.00 0.00 C ATOM 370 C LEU A 24 11.304 -7.775 -5.894 1.00 0.00 C ATOM 371 O LEU A 24 10.371 -7.050 -5.562 1.00 0.00 O ATOM 372 CB LEU A 24 13.459 -6.739 -6.688 1.00 0.00 C ATOM 373 CG LEU A 24 14.774 -6.097 -6.233 1.00 0.00 C ATOM 374 CD1 LEU A 24 15.559 -5.627 -7.454 1.00 0.00 C ATOM 375 CD2 LEU A 24 14.500 -4.890 -5.335 1.00 0.00 C ATOM 0 H LEU A 24 14.136 -8.943 -5.782 1.00 0.00 H new ATOM 0 HA LEU A 24 12.701 -6.699 -4.683 1.00 0.00 H new ATOM 0 HB2 LEU A 24 13.661 -7.479 -7.462 1.00 0.00 H new ATOM 0 HB3 LEU A 24 12.815 -5.980 -7.132 1.00 0.00 H new ATOM 0 HG LEU A 24 15.346 -6.839 -5.675 1.00 0.00 H new ATOM 0 HD11 LEU A 24 16.495 -5.170 -7.131 1.00 0.00 H new ATOM 0 HD12 LEU A 24 15.775 -6.479 -8.098 1.00 0.00 H new ATOM 0 HD13 LEU A 24 14.969 -4.895 -8.006 1.00 0.00 H new ATOM 0 HD21 LEU A 24 15.446 -4.447 -5.022 1.00 0.00 H new ATOM 0 HD22 LEU A 24 13.918 -4.151 -5.886 1.00 0.00 H new ATOM 0 HD23 LEU A 24 13.941 -5.210 -4.456 1.00 0.00 H new ATOM 387 N GLU A 25 11.120 -8.902 -6.589 1.00 0.00 N ATOM 388 CA GLU A 25 9.795 -9.303 -7.037 1.00 0.00 C ATOM 389 C GLU A 25 8.904 -9.731 -5.869 1.00 0.00 C ATOM 390 O GLU A 25 7.685 -9.574 -5.943 1.00 0.00 O ATOM 391 CB GLU A 25 9.924 -10.443 -8.052 1.00 0.00 C ATOM 392 CG GLU A 25 10.366 -9.928 -9.422 1.00 0.00 C ATOM 393 CD GLU A 25 9.246 -9.187 -10.155 1.00 0.00 C ATOM 394 OE1 GLU A 25 9.535 -8.689 -11.269 1.00 0.00 O ATOM 395 OE2 GLU A 25 8.123 -9.122 -9.608 1.00 0.00 O ATOM 0 H GLU A 25 11.869 -9.544 -6.849 1.00 0.00 H new ATOM 0 HA GLU A 25 9.320 -8.442 -7.507 1.00 0.00 H new ATOM 0 HB2 GLU A 25 10.644 -11.175 -7.688 1.00 0.00 H new ATOM 0 HB3 GLU A 25 8.967 -10.957 -8.147 1.00 0.00 H new ATOM 0 HG2 GLU A 25 11.219 -9.261 -9.299 1.00 0.00 H new ATOM 0 HG3 GLU A 25 10.703 -10.767 -10.031 1.00 0.00 H new ATOM 402 N VAL A 26 9.493 -10.263 -4.792 1.00 0.00 N ATOM 403 CA VAL A 26 8.714 -10.694 -3.637 1.00 0.00 C ATOM 404 C VAL A 26 8.360 -9.539 -2.701 1.00 0.00 C ATOM 405 O VAL A 26 7.397 -9.626 -1.944 1.00 0.00 O ATOM 406 CB VAL A 26 9.427 -11.843 -2.915 1.00 0.00 C ATOM 407 CG1 VAL A 26 10.547 -11.321 -2.019 1.00 0.00 C ATOM 408 CG2 VAL A 26 8.439 -12.624 -2.052 1.00 0.00 C ATOM 0 H VAL A 26 10.499 -10.403 -4.701 1.00 0.00 H new ATOM 0 HA VAL A 26 7.758 -11.070 -4.000 1.00 0.00 H new ATOM 0 HB VAL A 26 9.852 -12.494 -3.679 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.034 -12.159 -1.520 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.277 -10.785 -2.625 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.130 -10.646 -1.271 1.00 0.00 H new ATOM 0 HG21 VAL A 26 8.961 -13.436 -1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 26 7.998 -11.958 -1.310 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.651 -13.036 -2.683 1.00 0.00 H new ATOM 418 N LEU A 27 9.143 -8.454 -2.751 1.00 0.00 N ATOM 419 CA LEU A 27 8.864 -7.248 -1.978 1.00 0.00 C ATOM 420 C LEU A 27 7.934 -6.308 -2.756 1.00 0.00 C ATOM 421 O LEU A 27 7.831 -5.127 -2.429 1.00 0.00 O ATOM 422 CB LEU A 27 10.177 -6.537 -1.628 1.00 0.00 C ATOM 423 CG LEU A 27 10.998 -7.339 -0.612 1.00 0.00 C ATOM 424 CD1 LEU A 27 12.366 -6.674 -0.436 1.00 0.00 C ATOM 425 CD2 LEU A 27 10.303 -7.376 0.748 1.00 0.00 C ATOM 0 H LEU A 27 9.983 -8.392 -3.327 1.00 0.00 H new ATOM 0 HA LEU A 27 8.360 -7.533 -1.055 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.764 -6.388 -2.534 1.00 0.00 H new ATOM 0 HB3 LEU A 27 9.960 -5.549 -1.223 1.00 0.00 H new ATOM 0 HG LEU A 27 11.104 -8.357 -0.986 1.00 0.00 H new ATOM 0 HD11 LEU A 27 12.955 -7.240 0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 27 12.887 -6.654 -1.393 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.231 -5.654 -0.075 1.00 0.00 H new ATOM 0 HD21 LEU A 27 10.907 -7.951 1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.181 -6.360 1.122 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.324 -7.844 0.644 1.00 0.00 H new ATOM 437 N ASP A 28 7.257 -6.830 -3.785 1.00 0.00 N ATOM 438 CA ASP A 28 6.395 -6.043 -4.658 1.00 0.00 C ATOM 439 C ASP A 28 7.133 -4.902 -5.371 1.00 0.00 C ATOM 440 O ASP A 28 6.515 -3.924 -5.792 1.00 0.00 O ATOM 441 CB ASP A 28 5.130 -5.582 -3.922 1.00 0.00 C ATOM 442 CG ASP A 28 4.187 -6.745 -3.602 1.00 0.00 C ATOM 443 OD1 ASP A 28 3.168 -6.481 -2.927 1.00 0.00 O ATOM 444 OD2 ASP A 28 4.493 -7.882 -4.028 1.00 0.00 O ATOM 0 H ASP A 28 7.296 -7.819 -4.033 1.00 0.00 H new ATOM 0 HA ASP A 28 6.070 -6.703 -5.462 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.413 -5.082 -2.996 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.604 -4.848 -4.533 1.00 0.00 H new ATOM 449 N LYS A 29 8.455 -5.035 -5.501 1.00 0.00 N ATOM 450 CA LYS A 29 9.288 -4.091 -6.234 1.00 0.00 C ATOM 451 C LYS A 29 9.544 -4.635 -7.638 1.00 0.00 C ATOM 452 O LYS A 29 9.018 -5.689 -8.000 1.00 0.00 O ATOM 453 CB LYS A 29 10.596 -3.853 -5.471 1.00 0.00 C ATOM 454 CG LYS A 29 10.303 -3.331 -4.063 1.00 0.00 C ATOM 455 CD LYS A 29 11.600 -2.841 -3.412 1.00 0.00 C ATOM 456 CE LYS A 29 11.334 -2.389 -1.974 1.00 0.00 C ATOM 457 NZ LYS A 29 10.329 -1.306 -1.924 1.00 0.00 N ATOM 0 H LYS A 29 8.978 -5.810 -5.095 1.00 0.00 H new ATOM 0 HA LYS A 29 8.780 -3.131 -6.326 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.164 -4.781 -5.411 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.214 -3.136 -6.011 1.00 0.00 H new ATOM 0 HG2 LYS A 29 9.579 -2.518 -4.110 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.857 -4.120 -3.458 1.00 0.00 H new ATOM 0 HD2 LYS A 29 12.342 -3.639 -3.418 1.00 0.00 H new ATOM 0 HD3 LYS A 29 12.015 -2.015 -3.989 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.987 -3.237 -1.383 1.00 0.00 H new ATOM 0 HE3 LYS A 29 12.264 -2.045 -1.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.434 -0.776 -1.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.470 -0.664 -2.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.374 -1.716 -1.971 1.00 0.00 H new ATOM 471 N THR A 30 10.349 -3.926 -8.428 1.00 0.00 N ATOM 472 CA THR A 30 10.618 -4.313 -9.805 1.00 0.00 C ATOM 473 C THR A 30 12.099 -4.295 -10.177 1.00 0.00 C ATOM 474 O THR A 30 12.718 -3.230 -10.183 1.00 0.00 O ATOM 475 CB THR A 30 9.778 -3.479 -10.781 1.00 0.00 C ATOM 476 OG1 THR A 30 8.510 -3.196 -10.228 1.00 0.00 O ATOM 477 CG2 THR A 30 9.608 -4.230 -12.099 1.00 0.00 C ATOM 0 H THR A 30 10.827 -3.075 -8.132 1.00 0.00 H new ATOM 0 HA THR A 30 10.316 -5.357 -9.889 1.00 0.00 H new ATOM 0 HB THR A 30 10.298 -2.539 -10.966 1.00 0.00 H new ATOM 0 HG1 THR A 30 7.988 -2.662 -10.863 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.010 -3.630 -12.785 1.00 0.00 H new ATOM 0 HG22 THR A 30 10.587 -4.418 -12.540 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.105 -5.179 -11.915 1.00 0.00 H new ATOM 485 N PRO A 31 12.679 -5.464 -10.495 1.00 0.00 N ATOM 486 CA PRO A 31 14.011 -5.557 -11.060 1.00 0.00 C ATOM 487 C PRO A 31 13.967 -5.089 -12.515 1.00 0.00 C ATOM 488 O PRO A 31 13.754 -5.882 -13.429 1.00 0.00 O ATOM 489 CB PRO A 31 14.402 -7.033 -10.940 1.00 0.00 C ATOM 490 CG PRO A 31 13.071 -7.780 -10.901 1.00 0.00 C ATOM 491 CD PRO A 31 12.074 -6.772 -10.338 1.00 0.00 C ATOM 0 HA PRO A 31 14.742 -4.930 -10.549 1.00 0.00 H new ATOM 0 HB2 PRO A 31 15.011 -7.352 -11.786 1.00 0.00 H new ATOM 0 HB3 PRO A 31 14.987 -7.217 -10.039 1.00 0.00 H new ATOM 0 HG2 PRO A 31 12.776 -8.115 -11.896 1.00 0.00 H new ATOM 0 HG3 PRO A 31 13.134 -8.668 -10.272 1.00 0.00 H new ATOM 0 HD2 PRO A 31 11.124 -6.827 -10.870 1.00 0.00 H new ATOM 0 HD3 PRO A 31 11.864 -6.979 -9.289 1.00 0.00 H new ATOM 499 N VAL A 32 14.169 -3.785 -12.724 1.00 0.00 N ATOM 500 CA VAL A 32 14.064 -3.165 -14.040 1.00 0.00 C ATOM 501 C VAL A 32 15.210 -3.624 -14.942 1.00 0.00 C ATOM 502 O VAL A 32 15.147 -3.424 -16.153 1.00 0.00 O ATOM 503 CB VAL A 32 14.102 -1.639 -13.893 1.00 0.00 C ATOM 504 CG1 VAL A 32 12.804 -1.122 -13.283 1.00 0.00 C ATOM 505 CG2 VAL A 32 15.257 -1.195 -12.999 1.00 0.00 C ATOM 0 H VAL A 32 14.411 -3.131 -11.980 1.00 0.00 H new ATOM 0 HA VAL A 32 13.120 -3.466 -14.495 1.00 0.00 H new ATOM 0 HB VAL A 32 14.236 -1.228 -14.894 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.853 -0.037 -13.188 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.967 -1.392 -13.926 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.663 -1.566 -12.298 1.00 0.00 H new ATOM 0 HG21 VAL A 32 15.256 -0.108 -12.916 1.00 0.00 H new ATOM 0 HG22 VAL A 32 15.141 -1.635 -12.009 1.00 0.00 H new ATOM 0 HG23 VAL A 32 16.201 -1.524 -13.434 1.00 0.00 H new ATOM 515 N GLY A 33 16.253 -4.234 -14.375 1.00 0.00 N ATOM 516 CA GLY A 33 17.354 -4.746 -15.171 1.00 0.00 C ATOM 517 C GLY A 33 18.603 -4.981 -14.331 1.00 0.00 C ATOM 518 O GLY A 33 18.654 -4.622 -13.155 1.00 0.00 O ATOM 0 H GLY A 33 16.352 -4.382 -13.371 1.00 0.00 H new ATOM 0 HA2 GLY A 33 17.055 -5.681 -15.645 1.00 0.00 H new ATOM 0 HA3 GLY A 33 17.582 -4.041 -15.971 1.00 0.00 H new ATOM 522 N THR A 34 19.616 -5.586 -14.956 1.00 0.00 N ATOM 523 CA THR A 34 20.893 -5.877 -14.319 1.00 0.00 C ATOM 524 C THR A 34 22.036 -5.743 -15.317 1.00 0.00 C ATOM 525 O THR A 34 21.892 -6.133 -16.475 1.00 0.00 O ATOM 526 CB THR A 34 20.869 -7.280 -13.704 1.00 0.00 C ATOM 527 OG1 THR A 34 19.736 -7.436 -12.881 1.00 0.00 O ATOM 528 CG2 THR A 34 22.130 -7.540 -12.879 1.00 0.00 C ATOM 0 H THR A 34 19.567 -5.889 -15.929 1.00 0.00 H new ATOM 0 HA THR A 34 21.057 -5.152 -13.521 1.00 0.00 H new ATOM 0 HB THR A 34 20.828 -7.999 -14.522 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.572 -8.390 -12.728 1.00 0.00 H new ATOM 0 HG21 THR A 34 22.087 -8.543 -12.454 1.00 0.00 H new ATOM 0 HG22 THR A 34 23.008 -7.455 -13.520 1.00 0.00 H new ATOM 0 HG23 THR A 34 22.196 -6.808 -12.074 1.00 0.00 H new ATOM 536 N VAL A 35 23.165 -5.191 -14.871 1.00 0.00 N ATOM 537 CA VAL A 35 24.330 -4.994 -15.719 1.00 0.00 C ATOM 538 C VAL A 35 25.606 -5.399 -14.980 1.00 0.00 C ATOM 539 O VAL A 35 25.573 -5.654 -13.778 1.00 0.00 O ATOM 540 CB VAL A 35 24.385 -3.540 -16.219 1.00 0.00 C ATOM 541 CG1 VAL A 35 23.066 -3.127 -16.876 1.00 0.00 C ATOM 542 CG2 VAL A 35 24.659 -2.587 -15.062 1.00 0.00 C ATOM 0 H VAL A 35 23.293 -4.870 -13.911 1.00 0.00 H new ATOM 0 HA VAL A 35 24.248 -5.638 -16.595 1.00 0.00 H new ATOM 0 HB VAL A 35 25.189 -3.484 -16.953 1.00 0.00 H new ATOM 0 HG11 VAL A 35 23.138 -2.095 -17.218 1.00 0.00 H new ATOM 0 HG12 VAL A 35 22.864 -3.778 -17.726 1.00 0.00 H new ATOM 0 HG13 VAL A 35 22.256 -3.214 -16.152 1.00 0.00 H new ATOM 0 HG21 VAL A 35 24.694 -1.563 -15.434 1.00 0.00 H new ATOM 0 HG22 VAL A 35 23.864 -2.676 -14.321 1.00 0.00 H new ATOM 0 HG23 VAL A 35 25.614 -2.839 -14.602 1.00 0.00 H new ATOM 552 N ASP A 36 26.727 -5.458 -15.702 1.00 0.00 N ATOM 553 CA ASP A 36 28.004 -5.883 -15.139 1.00 0.00 C ATOM 554 C ASP A 36 29.160 -4.938 -15.478 1.00 0.00 C ATOM 555 O ASP A 36 30.308 -5.224 -15.148 1.00 0.00 O ATOM 556 CB ASP A 36 28.321 -7.336 -15.523 1.00 0.00 C ATOM 557 CG ASP A 36 28.175 -7.613 -17.023 1.00 0.00 C ATOM 558 OD1 ASP A 36 27.913 -6.655 -17.785 1.00 0.00 O ATOM 559 OD2 ASP A 36 28.330 -8.799 -17.393 1.00 0.00 O ATOM 0 H ASP A 36 26.772 -5.212 -16.691 1.00 0.00 H new ATOM 0 HA ASP A 36 27.895 -5.836 -14.055 1.00 0.00 H new ATOM 0 HB2 ASP A 36 29.340 -7.572 -15.215 1.00 0.00 H new ATOM 0 HB3 ASP A 36 27.658 -8.003 -14.971 1.00 0.00 H new ATOM 564 N THR A 37 28.853 -3.812 -16.137 1.00 0.00 N ATOM 565 CA THR A 37 29.833 -2.772 -16.444 1.00 0.00 C ATOM 566 C THR A 37 29.280 -1.378 -16.198 1.00 0.00 C ATOM 567 O THR A 37 28.068 -1.175 -16.216 1.00 0.00 O ATOM 568 CB THR A 37 30.395 -2.909 -17.862 1.00 0.00 C ATOM 569 OG1 THR A 37 29.488 -2.344 -18.786 1.00 0.00 O ATOM 570 CG2 THR A 37 30.666 -4.365 -18.241 1.00 0.00 C ATOM 0 H THR A 37 27.913 -3.600 -16.472 1.00 0.00 H new ATOM 0 HA THR A 37 30.664 -2.917 -15.754 1.00 0.00 H new ATOM 0 HB THR A 37 31.347 -2.379 -17.889 1.00 0.00 H new ATOM 0 HG1 THR A 37 29.849 -2.430 -19.693 1.00 0.00 H new ATOM 0 HG21 THR A 37 31.063 -4.409 -19.255 1.00 0.00 H new ATOM 0 HG22 THR A 37 31.391 -4.792 -17.548 1.00 0.00 H new ATOM 0 HG23 THR A 37 29.737 -4.933 -18.190 1.00 0.00 H new ATOM 578 N VAL A 38 30.166 -0.407 -15.968 1.00 0.00 N ATOM 579 CA VAL A 38 29.734 0.952 -15.677 1.00 0.00 C ATOM 580 C VAL A 38 29.137 1.651 -16.891 1.00 0.00 C ATOM 581 O VAL A 38 28.336 2.570 -16.740 1.00 0.00 O ATOM 582 CB VAL A 38 30.860 1.774 -15.046 1.00 0.00 C ATOM 583 CG1 VAL A 38 31.690 0.930 -14.076 1.00 0.00 C ATOM 584 CG2 VAL A 38 31.778 2.369 -16.113 1.00 0.00 C ATOM 0 H VAL A 38 31.177 -0.539 -15.978 1.00 0.00 H new ATOM 0 HA VAL A 38 28.931 0.874 -14.944 1.00 0.00 H new ATOM 0 HB VAL A 38 30.387 2.586 -14.493 1.00 0.00 H new ATOM 0 HG11 VAL A 38 32.481 1.544 -13.645 1.00 0.00 H new ATOM 0 HG12 VAL A 38 31.048 0.554 -13.279 1.00 0.00 H new ATOM 0 HG13 VAL A 38 32.133 0.090 -14.612 1.00 0.00 H new ATOM 0 HG21 VAL A 38 32.567 2.947 -15.633 1.00 0.00 H new ATOM 0 HG22 VAL A 38 32.223 1.565 -16.700 1.00 0.00 H new ATOM 0 HG23 VAL A 38 31.200 3.020 -16.769 1.00 0.00 H new ATOM 594 N ALA A 39 29.518 1.226 -18.099 1.00 0.00 N ATOM 595 CA ALA A 39 28.973 1.799 -19.317 1.00 0.00 C ATOM 596 C ALA A 39 27.493 1.437 -19.445 1.00 0.00 C ATOM 597 O ALA A 39 26.700 2.235 -19.946 1.00 0.00 O ATOM 598 CB ALA A 39 29.767 1.282 -20.516 1.00 0.00 C ATOM 0 H ALA A 39 30.203 0.486 -18.252 1.00 0.00 H new ATOM 0 HA ALA A 39 29.055 2.885 -19.284 1.00 0.00 H new ATOM 0 HB1 ALA A 39 29.361 1.710 -21.433 1.00 0.00 H new ATOM 0 HB2 ALA A 39 30.813 1.572 -20.412 1.00 0.00 H new ATOM 0 HB3 ALA A 39 29.694 0.195 -20.559 1.00 0.00 H new ATOM 604 N GLY A 40 27.123 0.236 -18.991 1.00 0.00 N ATOM 605 CA GLY A 40 25.741 -0.199 -19.002 1.00 0.00 C ATOM 606 C GLY A 40 24.991 0.366 -17.801 1.00 0.00 C ATOM 607 O GLY A 40 23.799 0.641 -17.890 1.00 0.00 O ATOM 0 H GLY A 40 27.774 -0.450 -18.610 1.00 0.00 H new ATOM 0 HA2 GLY A 40 25.259 0.126 -19.924 1.00 0.00 H new ATOM 0 HA3 GLY A 40 25.697 -1.288 -18.986 1.00 0.00 H new ATOM 611 N ALA A 41 25.686 0.539 -16.672 1.00 0.00 N ATOM 612 CA ALA A 41 25.062 1.040 -15.458 1.00 0.00 C ATOM 613 C ALA A 41 24.742 2.529 -15.592 1.00 0.00 C ATOM 614 O ALA A 41 23.723 2.993 -15.082 1.00 0.00 O ATOM 615 CB ALA A 41 26.005 0.789 -14.282 1.00 0.00 C ATOM 0 H ALA A 41 26.682 0.337 -16.581 1.00 0.00 H new ATOM 0 HA ALA A 41 24.121 0.517 -15.286 1.00 0.00 H new ATOM 0 HB1 ALA A 41 25.549 1.160 -13.364 1.00 0.00 H new ATOM 0 HB2 ALA A 41 26.192 -0.281 -14.187 1.00 0.00 H new ATOM 0 HB3 ALA A 41 26.948 1.308 -14.454 1.00 0.00 H new ATOM 621 N LEU A 42 25.606 3.281 -16.283 1.00 0.00 N ATOM 622 CA LEU A 42 25.371 4.697 -16.524 1.00 0.00 C ATOM 623 C LEU A 42 24.249 4.874 -17.537 1.00 0.00 C ATOM 624 O LEU A 42 23.462 5.810 -17.428 1.00 0.00 O ATOM 625 CB LEU A 42 26.655 5.346 -17.049 1.00 0.00 C ATOM 626 CG LEU A 42 27.687 5.543 -15.932 1.00 0.00 C ATOM 627 CD1 LEU A 42 29.031 5.924 -16.549 1.00 0.00 C ATOM 628 CD2 LEU A 42 27.244 6.662 -14.990 1.00 0.00 C ATOM 0 H LEU A 42 26.474 2.926 -16.683 1.00 0.00 H new ATOM 0 HA LEU A 42 25.080 5.177 -15.590 1.00 0.00 H new ATOM 0 HB2 LEU A 42 27.083 4.723 -17.835 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.418 6.310 -17.500 1.00 0.00 H new ATOM 0 HG LEU A 42 27.777 4.614 -15.370 1.00 0.00 H new ATOM 0 HD11 LEU A 42 29.768 6.065 -15.758 1.00 0.00 H new ATOM 0 HD12 LEU A 42 29.363 5.129 -17.217 1.00 0.00 H new ATOM 0 HD13 LEU A 42 28.923 6.850 -17.113 1.00 0.00 H new ATOM 0 HD21 LEU A 42 27.987 6.790 -14.202 1.00 0.00 H new ATOM 0 HD22 LEU A 42 27.145 7.592 -15.550 1.00 0.00 H new ATOM 0 HD23 LEU A 42 26.283 6.403 -14.544 1.00 0.00 H new ATOM 640 N ALA A 43 24.170 3.975 -18.524 1.00 0.00 N ATOM 641 CA ALA A 43 23.154 4.063 -19.561 1.00 0.00 C ATOM 642 C ALA A 43 21.777 3.668 -19.025 1.00 0.00 C ATOM 643 O ALA A 43 20.760 4.111 -19.557 1.00 0.00 O ATOM 644 CB ALA A 43 23.562 3.155 -20.721 1.00 0.00 C ATOM 0 H ALA A 43 24.801 3.180 -18.621 1.00 0.00 H new ATOM 0 HA ALA A 43 23.080 5.095 -19.905 1.00 0.00 H new ATOM 0 HB1 ALA A 43 22.810 3.210 -21.508 1.00 0.00 H new ATOM 0 HB2 ALA A 43 24.525 3.480 -21.116 1.00 0.00 H new ATOM 0 HB3 ALA A 43 23.643 2.127 -20.367 1.00 0.00 H new ATOM 650 N ARG A 44 21.730 2.835 -17.976 1.00 0.00 N ATOM 651 CA ARG A 44 20.468 2.373 -17.414 1.00 0.00 C ATOM 652 C ARG A 44 19.914 3.331 -16.365 1.00 0.00 C ATOM 653 O ARG A 44 18.701 3.495 -16.280 1.00 0.00 O ATOM 654 CB ARG A 44 20.645 0.968 -16.830 1.00 0.00 C ATOM 655 CG ARG A 44 20.727 -0.091 -17.935 1.00 0.00 C ATOM 656 CD ARG A 44 19.465 -0.084 -18.802 1.00 0.00 C ATOM 657 NE ARG A 44 19.400 -1.289 -19.635 1.00 0.00 N ATOM 658 CZ ARG A 44 19.808 -1.343 -20.908 1.00 0.00 C ATOM 659 NH1 ARG A 44 20.342 -0.277 -21.499 1.00 0.00 N ATOM 660 NH2 ARG A 44 19.685 -2.475 -21.595 1.00 0.00 N ATOM 0 H ARG A 44 22.557 2.471 -17.504 1.00 0.00 H new ATOM 0 HA ARG A 44 19.737 2.340 -18.222 1.00 0.00 H new ATOM 0 HB2 ARG A 44 21.551 0.935 -16.225 1.00 0.00 H new ATOM 0 HB3 ARG A 44 19.810 0.740 -16.167 1.00 0.00 H new ATOM 0 HG2 ARG A 44 21.601 0.097 -18.559 1.00 0.00 H new ATOM 0 HG3 ARG A 44 20.860 -1.077 -17.489 1.00 0.00 H new ATOM 0 HD2 ARG A 44 18.582 -0.028 -18.166 1.00 0.00 H new ATOM 0 HD3 ARG A 44 19.458 0.803 -19.436 1.00 0.00 H new ATOM 0 HE ARG A 44 19.020 -2.139 -19.218 1.00 0.00 H new ATOM 0 HH11 ARG A 44 20.445 0.596 -20.981 1.00 0.00 H new ATOM 0 HH12 ARG A 44 20.649 -0.332 -22.470 1.00 0.00 H new ATOM 0 HH21 ARG A 44 19.280 -3.299 -21.151 1.00 0.00 H new ATOM 0 HH22 ARG A 44 19.995 -2.519 -22.566 1.00 0.00 H new ATOM 674 N VAL A 45 20.773 3.968 -15.565 1.00 0.00 N ATOM 675 CA VAL A 45 20.301 4.933 -14.577 1.00 0.00 C ATOM 676 C VAL A 45 19.917 6.265 -15.220 1.00 0.00 C ATOM 677 O VAL A 45 19.137 7.024 -14.649 1.00 0.00 O ATOM 678 CB VAL A 45 21.318 5.075 -13.436 1.00 0.00 C ATOM 679 CG1 VAL A 45 22.531 5.922 -13.824 1.00 0.00 C ATOM 680 CG2 VAL A 45 20.647 5.737 -12.232 1.00 0.00 C ATOM 0 H VAL A 45 21.784 3.834 -15.583 1.00 0.00 H new ATOM 0 HA VAL A 45 19.381 4.553 -14.133 1.00 0.00 H new ATOM 0 HB VAL A 45 21.665 4.069 -13.200 1.00 0.00 H new ATOM 0 HG11 VAL A 45 23.215 5.987 -12.978 1.00 0.00 H new ATOM 0 HG12 VAL A 45 23.042 5.460 -14.669 1.00 0.00 H new ATOM 0 HG13 VAL A 45 22.202 6.923 -14.102 1.00 0.00 H new ATOM 0 HG21 VAL A 45 21.370 5.837 -11.422 1.00 0.00 H new ATOM 0 HG22 VAL A 45 20.281 6.724 -12.516 1.00 0.00 H new ATOM 0 HG23 VAL A 45 19.811 5.122 -11.898 1.00 0.00 H new ATOM 690 N GLU A 46 20.461 6.549 -16.406 1.00 0.00 N ATOM 691 CA GLU A 46 20.160 7.772 -17.135 1.00 0.00 C ATOM 692 C GLU A 46 18.853 7.651 -17.935 1.00 0.00 C ATOM 693 O GLU A 46 18.237 8.664 -18.266 1.00 0.00 O ATOM 694 CB GLU A 46 21.344 8.080 -18.059 1.00 0.00 C ATOM 695 CG GLU A 46 21.056 9.194 -19.072 1.00 0.00 C ATOM 696 CD GLU A 46 20.769 10.546 -18.415 1.00 0.00 C ATOM 697 OE1 GLU A 46 20.468 11.494 -19.174 1.00 0.00 O ATOM 698 OE2 GLU A 46 20.852 10.623 -17.168 1.00 0.00 O ATOM 0 H GLU A 46 21.121 5.935 -16.883 1.00 0.00 H new ATOM 0 HA GLU A 46 20.014 8.588 -16.428 1.00 0.00 H new ATOM 0 HB2 GLU A 46 22.204 8.365 -17.452 1.00 0.00 H new ATOM 0 HB3 GLU A 46 21.620 7.173 -18.597 1.00 0.00 H new ATOM 0 HG2 GLU A 46 21.910 9.297 -19.742 1.00 0.00 H new ATOM 0 HG3 GLU A 46 20.202 8.907 -19.685 1.00 0.00 H new ATOM 705 N ASP A 47 18.421 6.424 -18.246 1.00 0.00 N ATOM 706 CA ASP A 47 17.298 6.216 -19.157 1.00 0.00 C ATOM 707 C ASP A 47 16.144 5.457 -18.490 1.00 0.00 C ATOM 708 O ASP A 47 14.986 5.627 -18.873 1.00 0.00 O ATOM 709 CB ASP A 47 17.811 5.436 -20.374 1.00 0.00 C ATOM 710 CG ASP A 47 16.729 5.215 -21.429 1.00 0.00 C ATOM 711 OD1 ASP A 47 15.822 6.072 -21.525 1.00 0.00 O ATOM 712 OD2 ASP A 47 16.823 4.186 -22.133 1.00 0.00 O ATOM 0 H ASP A 47 18.832 5.565 -17.880 1.00 0.00 H new ATOM 0 HA ASP A 47 16.902 7.187 -19.456 1.00 0.00 H new ATOM 0 HB2 ASP A 47 18.645 5.976 -20.822 1.00 0.00 H new ATOM 0 HB3 ASP A 47 18.196 4.470 -20.046 1.00 0.00 H new ATOM 717 N GLY A 48 16.451 4.622 -17.492 1.00 0.00 N ATOM 718 CA GLY A 48 15.463 3.740 -16.891 1.00 0.00 C ATOM 719 C GLY A 48 14.591 4.445 -15.855 1.00 0.00 C ATOM 720 O GLY A 48 13.604 3.868 -15.398 1.00 0.00 O ATOM 0 H GLY A 48 17.383 4.543 -17.086 1.00 0.00 H new ATOM 0 HA2 GLY A 48 14.827 3.328 -17.674 1.00 0.00 H new ATOM 0 HA3 GLY A 48 15.972 2.900 -16.419 1.00 0.00 H new ATOM 724 N GLY A 49 14.937 5.685 -15.480 1.00 0.00 N ATOM 725 CA GLY A 49 14.169 6.413 -14.478 1.00 0.00 C ATOM 726 C GLY A 49 14.197 5.674 -13.143 1.00 0.00 C ATOM 727 O GLY A 49 13.204 5.658 -12.417 1.00 0.00 O ATOM 0 H GLY A 49 15.737 6.195 -15.855 1.00 0.00 H new ATOM 0 HA2 GLY A 49 14.579 7.415 -14.354 1.00 0.00 H new ATOM 0 HA3 GLY A 49 13.139 6.529 -14.815 1.00 0.00 H new ATOM 731 N ILE A 50 15.340 5.061 -12.825 1.00 0.00 N ATOM 732 CA ILE A 50 15.483 4.182 -11.671 1.00 0.00 C ATOM 733 C ILE A 50 15.333 4.967 -10.365 1.00 0.00 C ATOM 734 O ILE A 50 15.697 6.143 -10.301 1.00 0.00 O ATOM 735 CB ILE A 50 16.860 3.497 -11.713 1.00 0.00 C ATOM 736 CG1 ILE A 50 17.322 3.141 -13.137 1.00 0.00 C ATOM 737 CG2 ILE A 50 16.827 2.247 -10.840 1.00 0.00 C ATOM 738 CD1 ILE A 50 16.500 2.016 -13.760 1.00 0.00 C ATOM 0 H ILE A 50 16.197 5.164 -13.368 1.00 0.00 H new ATOM 0 HA ILE A 50 14.697 3.428 -11.709 1.00 0.00 H new ATOM 0 HB ILE A 50 17.587 4.212 -11.329 1.00 0.00 H new ATOM 0 HG12 ILE A 50 17.255 4.027 -13.768 1.00 0.00 H new ATOM 0 HG13 ILE A 50 18.371 2.847 -13.111 1.00 0.00 H new ATOM 0 HG21 ILE A 50 17.801 1.759 -10.867 1.00 0.00 H new ATOM 0 HG22 ILE A 50 16.589 2.526 -9.814 1.00 0.00 H new ATOM 0 HG23 ILE A 50 16.067 1.562 -11.215 1.00 0.00 H new ATOM 0 HD11 ILE A 50 16.870 1.808 -14.764 1.00 0.00 H new ATOM 0 HD12 ILE A 50 16.588 1.119 -13.147 1.00 0.00 H new ATOM 0 HD13 ILE A 50 15.454 2.317 -13.815 1.00 0.00 H new ATOM 750 N ASP A 51 14.798 4.315 -9.326 1.00 0.00 N ATOM 751 CA ASP A 51 14.597 4.942 -8.023 1.00 0.00 C ATOM 752 C ASP A 51 15.848 4.784 -7.155 1.00 0.00 C ATOM 753 O ASP A 51 16.139 5.653 -6.334 1.00 0.00 O ATOM 754 CB ASP A 51 13.412 4.280 -7.320 1.00 0.00 C ATOM 755 CG ASP A 51 12.123 4.328 -8.139 1.00 0.00 C ATOM 756 OD1 ASP A 51 12.040 5.174 -9.057 1.00 0.00 O ATOM 757 OD2 ASP A 51 11.232 3.506 -7.831 1.00 0.00 O ATOM 0 H ASP A 51 14.495 3.342 -9.369 1.00 0.00 H new ATOM 0 HA ASP A 51 14.399 6.004 -8.171 1.00 0.00 H new ATOM 0 HB2 ASP A 51 13.660 3.241 -7.105 1.00 0.00 H new ATOM 0 HB3 ASP A 51 13.245 4.772 -6.362 1.00 0.00 H new ATOM 762 N ALA A 52 16.581 3.682 -7.331 1.00 0.00 N ATOM 763 CA ALA A 52 17.786 3.402 -6.566 1.00 0.00 C ATOM 764 C ALA A 52 18.615 2.345 -7.301 1.00 0.00 C ATOM 765 O ALA A 52 18.149 1.770 -8.284 1.00 0.00 O ATOM 766 CB ALA A 52 17.400 2.900 -5.173 1.00 0.00 C ATOM 0 H ALA A 52 16.350 2.959 -8.013 1.00 0.00 H new ATOM 0 HA ALA A 52 18.379 4.310 -6.461 1.00 0.00 H new ATOM 0 HB1 ALA A 52 18.302 2.690 -4.599 1.00 0.00 H new ATOM 0 HB2 ALA A 52 16.814 3.663 -4.661 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.809 1.989 -5.265 1.00 0.00 H new ATOM 772 N ALA A 53 19.838 2.079 -6.841 1.00 0.00 N ATOM 773 CA ALA A 53 20.683 1.097 -7.506 1.00 0.00 C ATOM 774 C ALA A 53 21.576 0.352 -6.515 1.00 0.00 C ATOM 775 O ALA A 53 21.724 0.773 -5.367 1.00 0.00 O ATOM 776 CB ALA A 53 21.521 1.792 -8.580 1.00 0.00 C ATOM 0 H ALA A 53 20.257 2.523 -6.024 1.00 0.00 H new ATOM 0 HA ALA A 53 20.041 0.351 -7.975 1.00 0.00 H new ATOM 0 HB1 ALA A 53 22.154 1.058 -9.079 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.861 2.259 -9.311 1.00 0.00 H new ATOM 0 HB3 ALA A 53 22.146 2.555 -8.116 1.00 0.00 H new ATOM 782 N ILE A 54 22.170 -0.755 -6.969 1.00 0.00 N ATOM 783 CA ILE A 54 23.101 -1.549 -6.176 1.00 0.00 C ATOM 784 C ILE A 54 24.410 -1.697 -6.952 1.00 0.00 C ATOM 785 O ILE A 54 24.383 -1.826 -8.173 1.00 0.00 O ATOM 786 CB ILE A 54 22.479 -2.908 -5.825 1.00 0.00 C ATOM 787 CG1 ILE A 54 21.062 -2.706 -5.262 1.00 0.00 C ATOM 788 CG2 ILE A 54 23.378 -3.631 -4.819 1.00 0.00 C ATOM 789 CD1 ILE A 54 20.444 -4.032 -4.808 1.00 0.00 C ATOM 0 H ILE A 54 22.014 -1.125 -7.907 1.00 0.00 H new ATOM 0 HA ILE A 54 23.316 -1.047 -5.232 1.00 0.00 H new ATOM 0 HB ILE A 54 22.399 -3.522 -6.722 1.00 0.00 H new ATOM 0 HG12 ILE A 54 21.099 -2.014 -4.421 1.00 0.00 H new ATOM 0 HG13 ILE A 54 20.429 -2.250 -6.023 1.00 0.00 H new ATOM 0 HG21 ILE A 54 22.939 -4.597 -4.567 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.365 -3.784 -5.257 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.471 -3.028 -3.916 1.00 0.00 H new ATOM 0 HD11 ILE A 54 19.443 -3.852 -4.416 1.00 0.00 H new ATOM 0 HD12 ILE A 54 20.384 -4.715 -5.656 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.065 -4.475 -4.029 1.00 0.00 H new ATOM 801 N LEU A 55 25.551 -1.681 -6.255 1.00 0.00 N ATOM 802 CA LEU A 55 26.851 -1.625 -6.913 1.00 0.00 C ATOM 803 C LEU A 55 27.914 -2.418 -6.160 1.00 0.00 C ATOM 804 O LEU A 55 28.164 -2.166 -4.983 1.00 0.00 O ATOM 805 CB LEU A 55 27.276 -0.158 -7.025 1.00 0.00 C ATOM 806 CG LEU A 55 28.633 -0.011 -7.725 1.00 0.00 C ATOM 807 CD1 LEU A 55 28.538 -0.418 -9.196 1.00 0.00 C ATOM 808 CD2 LEU A 55 29.084 1.447 -7.645 1.00 0.00 C ATOM 0 H LEU A 55 25.596 -1.706 -5.236 1.00 0.00 H new ATOM 0 HA LEU A 55 26.757 -2.077 -7.900 1.00 0.00 H new ATOM 0 HB2 LEU A 55 26.519 0.399 -7.578 1.00 0.00 H new ATOM 0 HB3 LEU A 55 27.331 0.282 -6.029 1.00 0.00 H new ATOM 0 HG LEU A 55 29.350 -0.663 -7.226 1.00 0.00 H new ATOM 0 HD11 LEU A 55 29.514 -0.304 -9.669 1.00 0.00 H new ATOM 0 HD12 LEU A 55 28.220 -1.458 -9.266 1.00 0.00 H new ATOM 0 HD13 LEU A 55 27.813 0.218 -9.703 1.00 0.00 H new ATOM 0 HD21 LEU A 55 30.048 1.557 -8.141 1.00 0.00 H new ATOM 0 HD22 LEU A 55 28.348 2.083 -8.137 1.00 0.00 H new ATOM 0 HD23 LEU A 55 29.178 1.742 -6.600 1.00 0.00 H new ATOM 820 N ASP A 56 28.546 -3.377 -6.843 1.00 0.00 N ATOM 821 CA ASP A 56 29.666 -4.120 -6.284 1.00 0.00 C ATOM 822 C ASP A 56 30.918 -3.236 -6.353 1.00 0.00 C ATOM 823 O ASP A 56 31.087 -2.470 -7.302 1.00 0.00 O ATOM 824 CB ASP A 56 29.849 -5.406 -7.101 1.00 0.00 C ATOM 825 CG ASP A 56 30.841 -6.386 -6.468 1.00 0.00 C ATOM 826 OD1 ASP A 56 30.981 -7.492 -7.033 1.00 0.00 O ATOM 827 OD2 ASP A 56 31.444 -6.027 -5.434 1.00 0.00 O ATOM 0 H ASP A 56 28.294 -3.655 -7.792 1.00 0.00 H new ATOM 0 HA ASP A 56 29.486 -4.389 -5.243 1.00 0.00 H new ATOM 0 HB2 ASP A 56 28.883 -5.898 -7.213 1.00 0.00 H new ATOM 0 HB3 ASP A 56 30.193 -5.147 -8.102 1.00 0.00 H new ATOM 832 N VAL A 57 31.793 -3.337 -5.348 1.00 0.00 N ATOM 833 CA VAL A 57 32.998 -2.520 -5.278 1.00 0.00 C ATOM 834 C VAL A 57 33.887 -2.796 -6.487 1.00 0.00 C ATOM 835 O VAL A 57 34.586 -1.898 -6.956 1.00 0.00 O ATOM 836 CB VAL A 57 33.749 -2.840 -3.980 1.00 0.00 C ATOM 837 CG1 VAL A 57 35.068 -2.074 -3.911 1.00 0.00 C ATOM 838 CG2 VAL A 57 32.898 -2.449 -2.777 1.00 0.00 C ATOM 0 H VAL A 57 31.683 -3.984 -4.567 1.00 0.00 H new ATOM 0 HA VAL A 57 32.725 -1.465 -5.285 1.00 0.00 H new ATOM 0 HB VAL A 57 33.953 -3.911 -3.966 1.00 0.00 H new ATOM 0 HG11 VAL A 57 35.582 -2.318 -2.981 1.00 0.00 H new ATOM 0 HG12 VAL A 57 35.696 -2.354 -4.757 1.00 0.00 H new ATOM 0 HG13 VAL A 57 34.869 -1.003 -3.945 1.00 0.00 H new ATOM 0 HG21 VAL A 57 33.438 -2.679 -1.859 1.00 0.00 H new ATOM 0 HG22 VAL A 57 32.685 -1.381 -2.814 1.00 0.00 H new ATOM 0 HG23 VAL A 57 31.962 -3.007 -2.797 1.00 0.00 H new ATOM 848 N ASN A 58 33.859 -4.034 -6.993 1.00 0.00 N ATOM 849 CA ASN A 58 34.631 -4.418 -8.162 1.00 0.00 C ATOM 850 C ASN A 58 33.714 -5.057 -9.198 1.00 0.00 C ATOM 851 O ASN A 58 32.876 -5.892 -8.865 1.00 0.00 O ATOM 852 CB ASN A 58 35.758 -5.378 -7.764 1.00 0.00 C ATOM 853 CG ASN A 58 36.700 -4.762 -6.735 1.00 0.00 C ATOM 854 OD1 ASN A 58 37.067 -3.595 -6.835 1.00 0.00 O ATOM 855 ND2 ASN A 58 37.099 -5.544 -5.738 1.00 0.00 N ATOM 0 H ASN A 58 33.299 -4.790 -6.599 1.00 0.00 H new ATOM 0 HA ASN A 58 35.084 -3.529 -8.600 1.00 0.00 H new ATOM 0 HB2 ASN A 58 35.327 -6.293 -7.358 1.00 0.00 H new ATOM 0 HB3 ASN A 58 36.325 -5.659 -8.652 1.00 0.00 H new ATOM 0 HD21 ASN A 58 37.730 -5.179 -5.025 1.00 0.00 H new ATOM 0 HD22 ASN A 58 36.774 -6.509 -5.686 1.00 0.00 H new ATOM 862 N LEU A 59 33.885 -4.657 -10.460 1.00 0.00 N ATOM 863 CA LEU A 59 33.119 -5.188 -11.583 1.00 0.00 C ATOM 864 C LEU A 59 34.011 -6.140 -12.378 1.00 0.00 C ATOM 865 O LEU A 59 35.112 -6.471 -11.938 1.00 0.00 O ATOM 866 CB LEU A 59 32.619 -4.014 -12.440 1.00 0.00 C ATOM 867 CG LEU A 59 31.207 -3.573 -12.029 1.00 0.00 C ATOM 868 CD1 LEU A 59 31.093 -3.351 -10.526 1.00 0.00 C ATOM 869 CD2 LEU A 59 30.883 -2.260 -12.738 1.00 0.00 C ATOM 0 H LEU A 59 34.567 -3.948 -10.731 1.00 0.00 H new ATOM 0 HA LEU A 59 32.249 -5.748 -11.241 1.00 0.00 H new ATOM 0 HB2 LEU A 59 33.306 -3.173 -12.342 1.00 0.00 H new ATOM 0 HB3 LEU A 59 32.618 -4.304 -13.491 1.00 0.00 H new ATOM 0 HG LEU A 59 30.511 -4.364 -12.309 1.00 0.00 H new ATOM 0 HD11 LEU A 59 30.078 -3.040 -10.280 1.00 0.00 H new ATOM 0 HD12 LEU A 59 31.325 -4.278 -10.003 1.00 0.00 H new ATOM 0 HD13 LEU A 59 31.794 -2.575 -10.219 1.00 0.00 H new ATOM 0 HD21 LEU A 59 29.882 -1.932 -12.457 1.00 0.00 H new ATOM 0 HD22 LEU A 59 31.609 -1.501 -12.447 1.00 0.00 H new ATOM 0 HD23 LEU A 59 30.926 -2.409 -13.817 1.00 0.00 H new ATOM 881 N ARG A 60 33.541 -6.584 -13.548 1.00 0.00 N ATOM 882 CA ARG A 60 34.301 -7.499 -14.388 1.00 0.00 C ATOM 883 C ARG A 60 35.707 -6.962 -14.637 1.00 0.00 C ATOM 884 O ARG A 60 35.902 -5.756 -14.797 1.00 0.00 O ATOM 885 CB ARG A 60 33.553 -7.748 -15.696 1.00 0.00 C ATOM 886 CG ARG A 60 32.316 -8.599 -15.409 1.00 0.00 C ATOM 887 CD ARG A 60 31.471 -8.774 -16.668 1.00 0.00 C ATOM 888 NE ARG A 60 32.201 -9.510 -17.710 1.00 0.00 N ATOM 889 CZ ARG A 60 31.605 -10.190 -18.694 1.00 0.00 C ATOM 890 NH1 ARG A 60 30.282 -10.210 -18.808 1.00 0.00 N ATOM 891 NH2 ARG A 60 32.341 -10.853 -19.579 1.00 0.00 N ATOM 0 H ARG A 60 32.633 -6.320 -13.931 1.00 0.00 H new ATOM 0 HA ARG A 60 34.406 -8.453 -13.871 1.00 0.00 H new ATOM 0 HB2 ARG A 60 33.261 -6.800 -16.149 1.00 0.00 H new ATOM 0 HB3 ARG A 60 34.202 -8.256 -16.410 1.00 0.00 H new ATOM 0 HG2 ARG A 60 32.621 -9.575 -15.032 1.00 0.00 H new ATOM 0 HG3 ARG A 60 31.719 -8.128 -14.628 1.00 0.00 H new ATOM 0 HD2 ARG A 60 30.553 -9.307 -16.420 1.00 0.00 H new ATOM 0 HD3 ARG A 60 31.178 -7.796 -17.050 1.00 0.00 H new ATOM 0 HE ARG A 60 33.221 -9.501 -17.680 1.00 0.00 H new ATOM 0 HH11 ARG A 60 29.705 -9.701 -18.138 1.00 0.00 H new ATOM 0 HH12 ARG A 60 29.843 -10.734 -19.565 1.00 0.00 H new ATOM 0 HH21 ARG A 60 33.358 -10.842 -19.506 1.00 0.00 H new ATOM 0 HH22 ARG A 60 31.889 -11.373 -20.331 1.00 0.00 H new ATOM 905 N GLY A 61 36.683 -7.870 -14.667 1.00 0.00 N ATOM 906 CA GLY A 61 38.094 -7.510 -14.733 1.00 0.00 C ATOM 907 C GLY A 61 38.657 -7.248 -13.331 1.00 0.00 C ATOM 908 O GLY A 61 39.860 -7.039 -13.179 1.00 0.00 O ATOM 0 H GLY A 61 36.514 -8.876 -14.646 1.00 0.00 H new ATOM 0 HA2 GLY A 61 38.656 -8.312 -15.211 1.00 0.00 H new ATOM 0 HA3 GLY A 61 38.218 -6.621 -15.351 1.00 0.00 H new ATOM 912 N GLY A 62 37.790 -7.267 -12.312 1.00 0.00 N ATOM 913 CA GLY A 62 38.179 -7.109 -10.917 1.00 0.00 C ATOM 914 C GLY A 62 38.563 -5.667 -10.572 1.00 0.00 C ATOM 915 O GLY A 62 38.988 -5.399 -9.448 1.00 0.00 O ATOM 0 H GLY A 62 36.786 -7.395 -12.441 1.00 0.00 H new ATOM 0 HA2 GLY A 62 37.356 -7.425 -10.276 1.00 0.00 H new ATOM 0 HA3 GLY A 62 39.021 -7.767 -10.702 1.00 0.00 H new ATOM 919 N GLU A 63 38.417 -4.740 -11.523 1.00 0.00 N ATOM 920 CA GLU A 63 38.775 -3.347 -11.302 1.00 0.00 C ATOM 921 C GLU A 63 37.701 -2.640 -10.466 1.00 0.00 C ATOM 922 O GLU A 63 36.515 -2.956 -10.576 1.00 0.00 O ATOM 923 CB GLU A 63 38.997 -2.654 -12.650 1.00 0.00 C ATOM 924 CG GLU A 63 39.370 -1.185 -12.430 1.00 0.00 C ATOM 925 CD GLU A 63 39.883 -0.511 -13.701 1.00 0.00 C ATOM 926 OE1 GLU A 63 40.246 0.683 -13.595 1.00 0.00 O ATOM 927 OE2 GLU A 63 39.909 -1.182 -14.757 1.00 0.00 O ATOM 0 H GLU A 63 38.051 -4.936 -12.455 1.00 0.00 H new ATOM 0 HA GLU A 63 39.706 -3.296 -10.737 1.00 0.00 H new ATOM 0 HB2 GLU A 63 39.789 -3.160 -13.202 1.00 0.00 H new ATOM 0 HB3 GLU A 63 38.093 -2.721 -13.256 1.00 0.00 H new ATOM 0 HG2 GLU A 63 38.498 -0.644 -12.063 1.00 0.00 H new ATOM 0 HG3 GLU A 63 40.134 -1.120 -11.655 1.00 0.00 H new ATOM 934 N LYS A 64 38.121 -1.679 -9.631 1.00 0.00 N ATOM 935 CA LYS A 64 37.212 -0.934 -8.767 1.00 0.00 C ATOM 936 C LYS A 64 36.264 -0.068 -9.593 1.00 0.00 C ATOM 937 O LYS A 64 36.590 0.312 -10.718 1.00 0.00 O ATOM 938 CB LYS A 64 38.008 -0.090 -7.763 1.00 0.00 C ATOM 939 CG LYS A 64 38.603 1.200 -8.361 1.00 0.00 C ATOM 940 CD LYS A 64 39.598 0.918 -9.488 1.00 0.00 C ATOM 941 CE LYS A 64 40.227 2.227 -9.961 1.00 0.00 C ATOM 942 NZ LYS A 64 41.140 1.998 -11.101 1.00 0.00 N ATOM 0 H LYS A 64 39.098 -1.402 -9.540 1.00 0.00 H new ATOM 0 HA LYS A 64 36.603 -1.643 -8.207 1.00 0.00 H new ATOM 0 HB2 LYS A 64 37.357 0.175 -6.930 1.00 0.00 H new ATOM 0 HB3 LYS A 64 38.817 -0.696 -7.355 1.00 0.00 H new ATOM 0 HG2 LYS A 64 37.796 1.826 -8.741 1.00 0.00 H new ATOM 0 HG3 LYS A 64 39.101 1.766 -7.574 1.00 0.00 H new ATOM 0 HD2 LYS A 64 40.374 0.236 -9.139 1.00 0.00 H new ATOM 0 HD3 LYS A 64 39.091 0.426 -10.318 1.00 0.00 H new ATOM 0 HE2 LYS A 64 39.443 2.926 -10.254 1.00 0.00 H new ATOM 0 HE3 LYS A 64 40.775 2.688 -9.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 41.501 2.911 -11.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 41.937 1.404 -10.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 40.626 1.518 -11.867 1.00 0.00 H new ATOM 956 N SER A 65 35.092 0.247 -9.039 1.00 0.00 N ATOM 957 CA SER A 65 34.110 1.066 -9.729 1.00 0.00 C ATOM 958 C SER A 65 33.259 1.872 -8.752 1.00 0.00 C ATOM 959 O SER A 65 32.680 1.317 -7.818 1.00 0.00 O ATOM 960 CB SER A 65 33.212 0.180 -10.587 1.00 0.00 C ATOM 961 OG SER A 65 33.925 -0.298 -11.706 1.00 0.00 O ATOM 0 H SER A 65 34.804 -0.058 -8.109 1.00 0.00 H new ATOM 0 HA SER A 65 34.649 1.771 -10.362 1.00 0.00 H new ATOM 0 HB2 SER A 65 32.844 -0.659 -9.996 1.00 0.00 H new ATOM 0 HB3 SER A 65 32.340 0.744 -10.916 1.00 0.00 H new ATOM 0 HG SER A 65 34.868 -0.045 -11.625 1.00 0.00 H new ATOM 967 N THR A 66 33.190 3.186 -8.978 1.00 0.00 N ATOM 968 CA THR A 66 32.266 4.080 -8.287 1.00 0.00 C ATOM 969 C THR A 66 31.586 5.136 -9.176 1.00 0.00 C ATOM 970 O THR A 66 30.943 6.035 -8.633 1.00 0.00 O ATOM 971 CB THR A 66 32.941 4.761 -7.088 1.00 0.00 C ATOM 972 OG1 THR A 66 33.673 5.881 -7.536 1.00 0.00 O ATOM 973 CG2 THR A 66 33.873 3.833 -6.313 1.00 0.00 C ATOM 0 H THR A 66 33.784 3.663 -9.656 1.00 0.00 H new ATOM 0 HA THR A 66 31.466 3.424 -7.944 1.00 0.00 H new ATOM 0 HB THR A 66 32.145 5.059 -6.406 1.00 0.00 H new ATOM 0 HG1 THR A 66 34.103 6.318 -6.771 1.00 0.00 H new ATOM 0 HG21 THR A 66 34.317 4.377 -5.479 1.00 0.00 H new ATOM 0 HG22 THR A 66 33.306 2.984 -5.932 1.00 0.00 H new ATOM 0 HG23 THR A 66 34.662 3.475 -6.974 1.00 0.00 H new ATOM 981 N PRO A 67 31.699 5.083 -10.518 1.00 0.00 N ATOM 982 CA PRO A 67 31.258 6.178 -11.366 1.00 0.00 C ATOM 983 C PRO A 67 29.745 6.370 -11.269 1.00 0.00 C ATOM 984 O PRO A 67 29.250 7.471 -11.495 1.00 0.00 O ATOM 985 CB PRO A 67 31.675 5.797 -12.791 1.00 0.00 C ATOM 986 CG PRO A 67 31.760 4.277 -12.743 1.00 0.00 C ATOM 987 CD PRO A 67 32.225 3.997 -11.322 1.00 0.00 C ATOM 0 HA PRO A 67 31.706 7.124 -11.061 1.00 0.00 H new ATOM 0 HB2 PRO A 67 30.945 6.135 -13.527 1.00 0.00 H new ATOM 0 HB3 PRO A 67 32.631 6.244 -13.062 1.00 0.00 H new ATOM 0 HG2 PRO A 67 30.795 3.814 -12.949 1.00 0.00 H new ATOM 0 HG3 PRO A 67 32.464 3.890 -13.480 1.00 0.00 H new ATOM 0 HD2 PRO A 67 31.854 3.034 -10.971 1.00 0.00 H new ATOM 0 HD3 PRO A 67 33.313 3.959 -11.266 1.00 0.00 H new ATOM 995 N VAL A 68 29.011 5.304 -10.931 1.00 0.00 N ATOM 996 CA VAL A 68 27.569 5.394 -10.768 1.00 0.00 C ATOM 997 C VAL A 68 27.182 5.749 -9.342 1.00 0.00 C ATOM 998 O VAL A 68 26.186 6.430 -9.135 1.00 0.00 O ATOM 999 CB VAL A 68 26.896 4.096 -11.225 1.00 0.00 C ATOM 1000 CG1 VAL A 68 27.363 3.733 -12.631 1.00 0.00 C ATOM 1001 CG2 VAL A 68 27.197 2.934 -10.285 1.00 0.00 C ATOM 0 H VAL A 68 29.397 4.374 -10.767 1.00 0.00 H new ATOM 0 HA VAL A 68 27.211 6.205 -11.402 1.00 0.00 H new ATOM 0 HB VAL A 68 25.820 4.270 -11.217 1.00 0.00 H new ATOM 0 HG11 VAL A 68 26.879 2.809 -12.948 1.00 0.00 H new ATOM 0 HG12 VAL A 68 27.100 4.535 -13.320 1.00 0.00 H new ATOM 0 HG13 VAL A 68 28.444 3.595 -12.631 1.00 0.00 H new ATOM 0 HG21 VAL A 68 26.700 2.034 -10.648 1.00 0.00 H new ATOM 0 HG22 VAL A 68 28.273 2.764 -10.249 1.00 0.00 H new ATOM 0 HG23 VAL A 68 26.834 3.171 -9.285 1.00 0.00 H new ATOM 1011 N ALA A 69 27.951 5.306 -8.344 1.00 0.00 N ATOM 1012 CA ALA A 69 27.617 5.609 -6.962 1.00 0.00 C ATOM 1013 C ALA A 69 27.702 7.118 -6.731 1.00 0.00 C ATOM 1014 O ALA A 69 27.013 7.661 -5.869 1.00 0.00 O ATOM 1015 CB ALA A 69 28.579 4.861 -6.048 1.00 0.00 C ATOM 0 H ALA A 69 28.794 4.746 -8.469 1.00 0.00 H new ATOM 0 HA ALA A 69 26.599 5.290 -6.740 1.00 0.00 H new ATOM 0 HB1 ALA A 69 28.338 5.081 -5.008 1.00 0.00 H new ATOM 0 HB2 ALA A 69 28.488 3.789 -6.223 1.00 0.00 H new ATOM 0 HB3 ALA A 69 29.601 5.177 -6.258 1.00 0.00 H new ATOM 1021 N GLU A 70 28.551 7.793 -7.511 1.00 0.00 N ATOM 1022 CA GLU A 70 28.663 9.240 -7.476 1.00 0.00 C ATOM 1023 C GLU A 70 27.486 9.864 -8.221 1.00 0.00 C ATOM 1024 O GLU A 70 27.051 10.962 -7.884 1.00 0.00 O ATOM 1025 CB GLU A 70 29.979 9.650 -8.141 1.00 0.00 C ATOM 1026 CG GLU A 70 31.186 9.038 -7.421 1.00 0.00 C ATOM 1027 CD GLU A 70 31.468 9.690 -6.067 1.00 0.00 C ATOM 1028 OE1 GLU A 70 32.399 9.194 -5.393 1.00 0.00 O ATOM 1029 OE2 GLU A 70 30.775 10.666 -5.713 1.00 0.00 O ATOM 0 H GLU A 70 29.176 7.345 -8.181 1.00 0.00 H new ATOM 0 HA GLU A 70 28.650 9.589 -6.443 1.00 0.00 H new ATOM 0 HB2 GLU A 70 29.976 9.332 -9.183 1.00 0.00 H new ATOM 0 HB3 GLU A 70 30.066 10.737 -8.140 1.00 0.00 H new ATOM 0 HG2 GLU A 70 31.013 7.972 -7.276 1.00 0.00 H new ATOM 0 HG3 GLU A 70 32.067 9.134 -8.055 1.00 0.00 H new ATOM 1036 N ALA A 71 26.969 9.163 -9.237 1.00 0.00 N ATOM 1037 CA ALA A 71 25.847 9.640 -10.027 1.00 0.00 C ATOM 1038 C ALA A 71 24.535 9.469 -9.261 1.00 0.00 C ATOM 1039 O ALA A 71 23.656 10.319 -9.360 1.00 0.00 O ATOM 1040 CB ALA A 71 25.800 8.881 -11.353 1.00 0.00 C ATOM 0 H ALA A 71 27.322 8.251 -9.528 1.00 0.00 H new ATOM 0 HA ALA A 71 25.979 10.703 -10.228 1.00 0.00 H new ATOM 0 HB1 ALA A 71 24.959 9.238 -11.947 1.00 0.00 H new ATOM 0 HB2 ALA A 71 26.727 9.048 -11.901 1.00 0.00 H new ATOM 0 HB3 ALA A 71 25.680 7.815 -11.158 1.00 0.00 H new ATOM 1046 N LEU A 72 24.395 8.379 -8.499 1.00 0.00 N ATOM 1047 CA LEU A 72 23.208 8.158 -7.685 1.00 0.00 C ATOM 1048 C LEU A 72 23.159 9.231 -6.599 1.00 0.00 C ATOM 1049 O LEU A 72 22.078 9.687 -6.228 1.00 0.00 O ATOM 1050 CB LEU A 72 23.275 6.757 -7.061 1.00 0.00 C ATOM 1051 CG LEU A 72 22.647 5.657 -7.936 1.00 0.00 C ATOM 1052 CD1 LEU A 72 21.134 5.825 -8.012 1.00 0.00 C ATOM 1053 CD2 LEU A 72 23.196 5.623 -9.358 1.00 0.00 C ATOM 0 H LEU A 72 25.093 7.638 -8.433 1.00 0.00 H new ATOM 0 HA LEU A 72 22.306 8.222 -8.294 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.318 6.504 -6.869 1.00 0.00 H new ATOM 0 HB3 LEU A 72 22.768 6.774 -6.096 1.00 0.00 H new ATOM 0 HG LEU A 72 22.910 4.717 -7.451 1.00 0.00 H new ATOM 0 HD11 LEU A 72 20.711 5.037 -8.635 1.00 0.00 H new ATOM 0 HD12 LEU A 72 20.710 5.762 -7.010 1.00 0.00 H new ATOM 0 HD13 LEU A 72 20.897 6.797 -8.445 1.00 0.00 H new ATOM 0 HD21 LEU A 72 22.709 4.824 -9.917 1.00 0.00 H new ATOM 0 HD22 LEU A 72 23.002 6.578 -9.846 1.00 0.00 H new ATOM 0 HD23 LEU A 72 24.271 5.442 -9.329 1.00 0.00 H new ATOM 1065 N ALA A 73 24.324 9.641 -6.089 1.00 0.00 N ATOM 1066 CA ALA A 73 24.397 10.687 -5.083 1.00 0.00 C ATOM 1067 C ALA A 73 24.102 12.060 -5.693 1.00 0.00 C ATOM 1068 O ALA A 73 23.549 12.927 -5.019 1.00 0.00 O ATOM 1069 CB ALA A 73 25.787 10.662 -4.454 1.00 0.00 C ATOM 0 H ALA A 73 25.229 9.258 -6.362 1.00 0.00 H new ATOM 0 HA ALA A 73 23.643 10.506 -4.317 1.00 0.00 H new ATOM 0 HB1 ALA A 73 25.857 11.442 -3.696 1.00 0.00 H new ATOM 0 HB2 ALA A 73 25.960 9.690 -3.992 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.538 10.836 -5.224 1.00 0.00 H new ATOM 1075 N ALA A 74 24.464 12.265 -6.963 1.00 0.00 N ATOM 1076 CA ALA A 74 24.224 13.531 -7.646 1.00 0.00 C ATOM 1077 C ALA A 74 22.755 13.650 -8.060 1.00 0.00 C ATOM 1078 O ALA A 74 22.213 14.752 -8.113 1.00 0.00 O ATOM 1079 CB ALA A 74 25.121 13.606 -8.876 1.00 0.00 C ATOM 0 H ALA A 74 24.927 11.562 -7.539 1.00 0.00 H new ATOM 0 HA ALA A 74 24.453 14.354 -6.969 1.00 0.00 H new ATOM 0 HB1 ALA A 74 24.949 14.549 -9.394 1.00 0.00 H new ATOM 0 HB2 ALA A 74 26.165 13.545 -8.569 1.00 0.00 H new ATOM 0 HB3 ALA A 74 24.891 12.777 -9.545 1.00 0.00 H new ATOM 1085 N ARG A 75 22.120 12.512 -8.347 1.00 0.00 N ATOM 1086 CA ARG A 75 20.718 12.450 -8.740 1.00 0.00 C ATOM 1087 C ARG A 75 19.804 12.401 -7.519 1.00 0.00 C ATOM 1088 O ARG A 75 18.584 12.313 -7.660 1.00 0.00 O ATOM 1089 CB ARG A 75 20.507 11.222 -9.626 1.00 0.00 C ATOM 1090 CG ARG A 75 21.261 11.381 -10.950 1.00 0.00 C ATOM 1091 CD ARG A 75 21.333 10.037 -11.669 1.00 0.00 C ATOM 1092 NE ARG A 75 22.217 10.113 -12.840 1.00 0.00 N ATOM 1093 CZ ARG A 75 21.793 10.287 -14.095 1.00 0.00 C ATOM 1094 NH1 ARG A 75 20.495 10.412 -14.365 1.00 0.00 N ATOM 1095 NH2 ARG A 75 22.668 10.341 -15.093 1.00 0.00 N ATOM 0 H ARG A 75 22.573 11.599 -8.312 1.00 0.00 H new ATOM 0 HA ARG A 75 20.462 13.351 -9.297 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.854 10.328 -9.108 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.443 11.085 -9.820 1.00 0.00 H new ATOM 0 HG2 ARG A 75 20.757 12.114 -11.580 1.00 0.00 H new ATOM 0 HG3 ARG A 75 22.266 11.758 -10.763 1.00 0.00 H new ATOM 0 HD2 ARG A 75 21.697 9.273 -10.983 1.00 0.00 H new ATOM 0 HD3 ARG A 75 20.334 9.734 -11.982 1.00 0.00 H new ATOM 0 HE ARG A 75 23.221 10.027 -12.685 1.00 0.00 H new ATOM 0 HH11 ARG A 75 19.811 10.375 -13.609 1.00 0.00 H new ATOM 0 HH12 ARG A 75 20.185 10.544 -15.328 1.00 0.00 H new ATOM 0 HH21 ARG A 75 23.666 10.250 -14.902 1.00 0.00 H new ATOM 0 HH22 ARG A 75 22.342 10.474 -16.050 1.00 0.00 H new ATOM 1109 N ASP A 76 20.393 12.460 -6.319 1.00 0.00 N ATOM 1110 CA ASP A 76 19.662 12.413 -5.061 1.00 0.00 C ATOM 1111 C ASP A 76 18.770 11.169 -4.969 1.00 0.00 C ATOM 1112 O ASP A 76 17.601 11.254 -4.604 1.00 0.00 O ATOM 1113 CB ASP A 76 18.900 13.732 -4.847 1.00 0.00 C ATOM 1114 CG ASP A 76 18.139 13.759 -3.522 1.00 0.00 C ATOM 1115 OD1 ASP A 76 18.557 13.034 -2.592 1.00 0.00 O ATOM 1116 OD2 ASP A 76 17.144 14.516 -3.451 1.00 0.00 O ATOM 0 H ASP A 76 21.403 12.543 -6.200 1.00 0.00 H new ATOM 0 HA ASP A 76 20.372 12.316 -4.240 1.00 0.00 H new ATOM 0 HB2 ASP A 76 19.604 14.564 -4.875 1.00 0.00 H new ATOM 0 HB3 ASP A 76 18.199 13.880 -5.668 1.00 0.00 H new ATOM 1121 N ILE A 77 19.333 10.005 -5.312 1.00 0.00 N ATOM 1122 CA ILE A 77 18.636 8.727 -5.203 1.00 0.00 C ATOM 1123 C ILE A 77 19.492 7.742 -4.405 1.00 0.00 C ATOM 1124 O ILE A 77 20.714 7.776 -4.503 1.00 0.00 O ATOM 1125 CB ILE A 77 18.276 8.169 -6.589 1.00 0.00 C ATOM 1126 CG1 ILE A 77 19.202 8.698 -7.693 1.00 0.00 C ATOM 1127 CG2 ILE A 77 16.844 8.576 -6.921 1.00 0.00 C ATOM 1128 CD1 ILE A 77 18.814 8.131 -9.059 1.00 0.00 C ATOM 0 H ILE A 77 20.284 9.927 -5.672 1.00 0.00 H new ATOM 0 HA ILE A 77 17.697 8.881 -4.671 1.00 0.00 H new ATOM 0 HB ILE A 77 18.389 7.086 -6.550 1.00 0.00 H new ATOM 0 HG12 ILE A 77 19.154 9.787 -7.721 1.00 0.00 H new ATOM 0 HG13 ILE A 77 20.234 8.430 -7.465 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.574 8.187 -7.903 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.167 8.169 -6.170 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.767 9.663 -6.928 1.00 0.00 H new ATOM 0 HD11 ILE A 77 19.488 8.524 -9.821 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.887 7.044 -9.036 1.00 0.00 H new ATOM 0 HD13 ILE A 77 17.790 8.421 -9.296 1.00 0.00 H new ATOM 1140 N PRO A 78 18.868 6.859 -3.609 1.00 0.00 N ATOM 1141 CA PRO A 78 19.565 5.948 -2.714 1.00 0.00 C ATOM 1142 C PRO A 78 20.371 4.903 -3.485 1.00 0.00 C ATOM 1143 O PRO A 78 20.084 4.609 -4.645 1.00 0.00 O ATOM 1144 CB PRO A 78 18.482 5.278 -1.863 1.00 0.00 C ATOM 1145 CG PRO A 78 17.217 6.105 -2.099 1.00 0.00 C ATOM 1146 CD PRO A 78 17.436 6.711 -3.479 1.00 0.00 C ATOM 0 HA PRO A 78 20.284 6.488 -2.098 1.00 0.00 H new ATOM 0 HB2 PRO A 78 18.335 4.240 -2.160 1.00 0.00 H new ATOM 0 HB3 PRO A 78 18.757 5.272 -0.808 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.321 5.484 -2.072 1.00 0.00 H new ATOM 0 HG3 PRO A 78 17.094 6.876 -1.338 1.00 0.00 H new ATOM 0 HD2 PRO A 78 17.035 6.065 -4.260 1.00 0.00 H new ATOM 0 HD3 PRO A 78 16.931 7.673 -3.571 1.00 0.00 H new ATOM 1154 N PHE A 79 21.388 4.332 -2.832 1.00 0.00 N ATOM 1155 CA PHE A 79 22.192 3.277 -3.425 1.00 0.00 C ATOM 1156 C PHE A 79 22.811 2.343 -2.382 1.00 0.00 C ATOM 1157 O PHE A 79 23.217 2.791 -1.310 1.00 0.00 O ATOM 1158 CB PHE A 79 23.264 3.868 -4.346 1.00 0.00 C ATOM 1159 CG PHE A 79 24.109 4.961 -3.724 1.00 0.00 C ATOM 1160 CD1 PHE A 79 25.424 4.683 -3.322 1.00 0.00 C ATOM 1161 CD2 PHE A 79 23.590 6.255 -3.556 1.00 0.00 C ATOM 1162 CE1 PHE A 79 26.214 5.695 -2.760 1.00 0.00 C ATOM 1163 CE2 PHE A 79 24.379 7.264 -2.989 1.00 0.00 C ATOM 1164 CZ PHE A 79 25.694 6.986 -2.594 1.00 0.00 C ATOM 0 H PHE A 79 21.669 4.590 -1.886 1.00 0.00 H new ATOM 0 HA PHE A 79 21.518 2.663 -4.022 1.00 0.00 H new ATOM 0 HB2 PHE A 79 23.922 3.064 -4.676 1.00 0.00 H new ATOM 0 HB3 PHE A 79 22.777 4.267 -5.236 1.00 0.00 H new ATOM 0 HD1 PHE A 79 25.828 3.689 -3.446 1.00 0.00 H new ATOM 0 HD2 PHE A 79 22.578 6.473 -3.865 1.00 0.00 H new ATOM 0 HE1 PHE A 79 27.227 5.479 -2.454 1.00 0.00 H new ATOM 0 HE2 PHE A 79 23.974 8.256 -2.856 1.00 0.00 H new ATOM 0 HZ PHE A 79 26.306 7.765 -2.163 1.00 0.00 H new ATOM 1174 N VAL A 80 22.880 1.047 -2.700 1.00 0.00 N ATOM 1175 CA VAL A 80 23.500 0.050 -1.838 1.00 0.00 C ATOM 1176 C VAL A 80 24.813 -0.414 -2.456 1.00 0.00 C ATOM 1177 O VAL A 80 24.941 -0.467 -3.678 1.00 0.00 O ATOM 1178 CB VAL A 80 22.564 -1.155 -1.643 1.00 0.00 C ATOM 1179 CG1 VAL A 80 23.229 -2.223 -0.779 1.00 0.00 C ATOM 1180 CG2 VAL A 80 21.276 -0.757 -0.940 1.00 0.00 C ATOM 0 H VAL A 80 22.504 0.664 -3.567 1.00 0.00 H new ATOM 0 HA VAL A 80 23.693 0.501 -0.865 1.00 0.00 H new ATOM 0 HB VAL A 80 22.346 -1.537 -2.640 1.00 0.00 H new ATOM 0 HG11 VAL A 80 22.549 -3.066 -0.654 1.00 0.00 H new ATOM 0 HG12 VAL A 80 24.145 -2.564 -1.262 1.00 0.00 H new ATOM 0 HG13 VAL A 80 23.469 -1.803 0.198 1.00 0.00 H new ATOM 0 HG21 VAL A 80 20.641 -1.635 -0.820 1.00 0.00 H new ATOM 0 HG22 VAL A 80 21.510 -0.342 0.040 1.00 0.00 H new ATOM 0 HG23 VAL A 80 20.753 -0.009 -1.535 1.00 0.00 H new ATOM 1190 N PHE A 81 25.787 -0.752 -1.612 1.00 0.00 N ATOM 1191 CA PHE A 81 27.003 -1.392 -2.071 1.00 0.00 C ATOM 1192 C PHE A 81 26.969 -2.907 -1.921 1.00 0.00 C ATOM 1193 O PHE A 81 26.237 -3.430 -1.083 1.00 0.00 O ATOM 1194 CB PHE A 81 28.237 -0.769 -1.418 1.00 0.00 C ATOM 1195 CG PHE A 81 28.616 0.573 -2.000 1.00 0.00 C ATOM 1196 CD1 PHE A 81 29.381 0.642 -3.174 1.00 0.00 C ATOM 1197 CD2 PHE A 81 28.201 1.753 -1.364 1.00 0.00 C ATOM 1198 CE1 PHE A 81 29.751 1.888 -3.699 1.00 0.00 C ATOM 1199 CE2 PHE A 81 28.563 2.996 -1.895 1.00 0.00 C ATOM 1200 CZ PHE A 81 29.344 3.064 -3.059 1.00 0.00 C ATOM 0 H PHE A 81 25.750 -0.590 -0.606 1.00 0.00 H new ATOM 0 HA PHE A 81 27.072 -1.207 -3.143 1.00 0.00 H new ATOM 0 HB2 PHE A 81 28.054 -0.654 -0.350 1.00 0.00 H new ATOM 0 HB3 PHE A 81 29.079 -1.453 -1.525 1.00 0.00 H new ATOM 0 HD1 PHE A 81 29.685 -0.266 -3.674 1.00 0.00 H new ATOM 0 HD2 PHE A 81 27.603 1.702 -0.466 1.00 0.00 H new ATOM 0 HE1 PHE A 81 30.350 1.940 -4.596 1.00 0.00 H new ATOM 0 HE2 PHE A 81 28.241 3.905 -1.408 1.00 0.00 H new ATOM 0 HZ PHE A 81 29.631 4.024 -3.461 1.00 0.00 H new ATOM 1210 N ALA A 82 27.755 -3.616 -2.726 1.00 0.00 N ATOM 1211 CA ALA A 82 27.873 -5.056 -2.608 1.00 0.00 C ATOM 1212 C ALA A 82 29.340 -5.421 -2.431 1.00 0.00 C ATOM 1213 O ALA A 82 30.219 -4.767 -2.992 1.00 0.00 O ATOM 1214 CB ALA A 82 27.254 -5.733 -3.828 1.00 0.00 C ATOM 0 H ALA A 82 28.321 -3.208 -3.470 1.00 0.00 H new ATOM 0 HA ALA A 82 27.327 -5.411 -1.734 1.00 0.00 H new ATOM 0 HB1 ALA A 82 27.347 -6.815 -3.730 1.00 0.00 H new ATOM 0 HB2 ALA A 82 26.200 -5.465 -3.897 1.00 0.00 H new ATOM 0 HB3 ALA A 82 27.772 -5.404 -4.729 1.00 0.00 H new ATOM 1220 N THR A 83 29.605 -6.462 -1.647 1.00 0.00 N ATOM 1221 CA THR A 83 30.969 -6.874 -1.328 1.00 0.00 C ATOM 1222 C THR A 83 31.041 -8.396 -1.275 1.00 0.00 C ATOM 1223 O THR A 83 30.036 -9.087 -1.432 1.00 0.00 O ATOM 1224 CB THR A 83 31.387 -6.264 0.013 1.00 0.00 C ATOM 1225 OG1 THR A 83 30.472 -6.635 1.017 1.00 0.00 O ATOM 1226 CG2 THR A 83 31.448 -4.741 -0.077 1.00 0.00 C ATOM 0 H THR A 83 28.884 -7.042 -1.217 1.00 0.00 H new ATOM 0 HA THR A 83 31.653 -6.520 -2.099 1.00 0.00 H new ATOM 0 HB THR A 83 32.379 -6.641 0.262 1.00 0.00 H new ATOM 0 HG1 THR A 83 30.747 -6.242 1.872 1.00 0.00 H new ATOM 0 HG21 THR A 83 31.747 -4.331 0.888 1.00 0.00 H new ATOM 0 HG22 THR A 83 32.175 -4.450 -0.836 1.00 0.00 H new ATOM 0 HG23 THR A 83 30.466 -4.353 -0.347 1.00 0.00 H new ATOM 1234 N GLY A 84 32.247 -8.920 -1.047 1.00 0.00 N ATOM 1235 CA GLY A 84 32.484 -10.351 -0.956 1.00 0.00 C ATOM 1236 C GLY A 84 33.949 -10.609 -0.627 1.00 0.00 C ATOM 1237 O GLY A 84 34.642 -9.710 -0.155 1.00 0.00 O ATOM 0 H GLY A 84 33.087 -8.355 -0.921 1.00 0.00 H new ATOM 0 HA2 GLY A 84 31.846 -10.787 -0.187 1.00 0.00 H new ATOM 0 HA3 GLY A 84 32.222 -10.833 -1.898 1.00 0.00 H new ATOM 1241 N GLY A 85 34.426 -11.828 -0.874 1.00 0.00 N ATOM 1242 CA GLY A 85 35.822 -12.166 -0.636 1.00 0.00 C ATOM 1243 C GLY A 85 36.724 -11.280 -1.486 1.00 0.00 C ATOM 1244 O GLY A 85 36.511 -11.158 -2.692 1.00 0.00 O ATOM 0 H GLY A 85 33.863 -12.596 -1.239 1.00 0.00 H new ATOM 0 HA2 GLY A 85 36.061 -12.037 0.420 1.00 0.00 H new ATOM 0 HA3 GLY A 85 35.997 -13.215 -0.876 1.00 0.00 H new ATOM 1248 N SER A 86 37.725 -10.666 -0.848 1.00 0.00 N ATOM 1249 CA SER A 86 38.651 -9.707 -1.460 1.00 0.00 C ATOM 1250 C SER A 86 37.927 -8.563 -2.188 1.00 0.00 C ATOM 1251 O SER A 86 38.555 -7.819 -2.941 1.00 0.00 O ATOM 1252 CB SER A 86 39.653 -10.422 -2.373 1.00 0.00 C ATOM 1253 OG SER A 86 39.028 -10.899 -3.548 1.00 0.00 O ATOM 0 H SER A 86 37.920 -10.828 0.140 1.00 0.00 H new ATOM 0 HA SER A 86 39.209 -9.239 -0.649 1.00 0.00 H new ATOM 0 HB2 SER A 86 40.458 -9.737 -2.639 1.00 0.00 H new ATOM 0 HB3 SER A 86 40.107 -11.255 -1.836 1.00 0.00 H new ATOM 0 HG SER A 86 38.056 -10.818 -3.457 1.00 0.00 H new ATOM 1259 N ASP A 87 36.614 -8.426 -1.972 1.00 0.00 N ATOM 1260 CA ASP A 87 35.806 -7.393 -2.611 1.00 0.00 C ATOM 1261 C ASP A 87 35.169 -6.434 -1.603 1.00 0.00 C ATOM 1262 O ASP A 87 34.402 -5.548 -1.979 1.00 0.00 O ATOM 1263 CB ASP A 87 34.752 -8.035 -3.524 1.00 0.00 C ATOM 1264 CG ASP A 87 35.354 -8.649 -4.787 1.00 0.00 C ATOM 1265 OD1 ASP A 87 36.456 -8.205 -5.183 1.00 0.00 O ATOM 1266 OD2 ASP A 87 34.701 -9.558 -5.347 1.00 0.00 O ATOM 0 H ASP A 87 36.084 -9.033 -1.346 1.00 0.00 H new ATOM 0 HA ASP A 87 36.474 -6.785 -3.222 1.00 0.00 H new ATOM 0 HB2 ASP A 87 34.220 -8.807 -2.969 1.00 0.00 H new ATOM 0 HB3 ASP A 87 34.017 -7.282 -3.807 1.00 0.00 H new ATOM 1271 N ASP A 88 35.487 -6.610 -0.317 1.00 0.00 N ATOM 1272 CA ASP A 88 34.954 -5.776 0.755 1.00 0.00 C ATOM 1273 C ASP A 88 35.773 -4.502 0.976 1.00 0.00 C ATOM 1274 O ASP A 88 35.637 -3.846 2.010 1.00 0.00 O ATOM 1275 CB ASP A 88 34.786 -6.598 2.040 1.00 0.00 C ATOM 1276 CG ASP A 88 36.061 -7.336 2.445 1.00 0.00 C ATOM 1277 OD1 ASP A 88 35.971 -8.129 3.407 1.00 0.00 O ATOM 1278 OD2 ASP A 88 37.110 -7.106 1.799 1.00 0.00 O ATOM 0 H ASP A 88 36.124 -7.338 0.007 1.00 0.00 H new ATOM 0 HA ASP A 88 33.966 -5.433 0.447 1.00 0.00 H new ATOM 0 HB2 ASP A 88 34.482 -5.937 2.851 1.00 0.00 H new ATOM 0 HB3 ASP A 88 33.983 -7.321 1.900 1.00 0.00 H new ATOM 1283 N SER A 89 36.624 -4.154 0.003 1.00 0.00 N ATOM 1284 CA SER A 89 37.490 -2.983 0.073 1.00 0.00 C ATOM 1285 C SER A 89 36.730 -1.686 -0.226 1.00 0.00 C ATOM 1286 O SER A 89 37.297 -0.755 -0.794 1.00 0.00 O ATOM 1287 CB SER A 89 38.665 -3.159 -0.889 1.00 0.00 C ATOM 1288 OG SER A 89 39.473 -4.237 -0.453 1.00 0.00 O ATOM 0 H SER A 89 36.728 -4.686 -0.861 1.00 0.00 H new ATOM 0 HA SER A 89 37.865 -2.899 1.093 1.00 0.00 H new ATOM 0 HB2 SER A 89 38.298 -3.350 -1.897 1.00 0.00 H new ATOM 0 HB3 SER A 89 39.254 -2.243 -0.932 1.00 0.00 H new ATOM 0 HG SER A 89 40.226 -4.352 -1.070 1.00 0.00 H new ATOM 1294 N VAL A 90 35.448 -1.617 0.152 1.00 0.00 N ATOM 1295 CA VAL A 90 34.637 -0.428 -0.092 1.00 0.00 C ATOM 1296 C VAL A 90 35.257 0.787 0.597 1.00 0.00 C ATOM 1297 O VAL A 90 35.831 0.675 1.681 1.00 0.00 O ATOM 1298 CB VAL A 90 33.191 -0.679 0.364 1.00 0.00 C ATOM 1299 CG1 VAL A 90 33.112 -0.927 1.868 1.00 0.00 C ATOM 1300 CG2 VAL A 90 32.302 0.518 0.027 1.00 0.00 C ATOM 0 H VAL A 90 34.954 -2.372 0.627 1.00 0.00 H new ATOM 0 HA VAL A 90 34.613 -0.214 -1.161 1.00 0.00 H new ATOM 0 HB VAL A 90 32.843 -1.566 -0.166 1.00 0.00 H new ATOM 0 HG11 VAL A 90 32.075 -1.101 2.154 1.00 0.00 H new ATOM 0 HG12 VAL A 90 33.710 -1.801 2.125 1.00 0.00 H new ATOM 0 HG13 VAL A 90 33.495 -0.056 2.401 1.00 0.00 H new ATOM 0 HG21 VAL A 90 31.283 0.319 0.358 1.00 0.00 H new ATOM 0 HG22 VAL A 90 32.681 1.406 0.532 1.00 0.00 H new ATOM 0 HG23 VAL A 90 32.307 0.683 -1.050 1.00 0.00 H new ATOM 1310 N ASP A 91 35.135 1.953 -0.043 1.00 0.00 N ATOM 1311 CA ASP A 91 35.780 3.179 0.412 1.00 0.00 C ATOM 1312 C ASP A 91 35.159 3.628 1.737 1.00 0.00 C ATOM 1313 O ASP A 91 33.966 3.435 1.966 1.00 0.00 O ATOM 1314 CB ASP A 91 35.607 4.252 -0.669 1.00 0.00 C ATOM 1315 CG ASP A 91 36.405 5.522 -0.372 1.00 0.00 C ATOM 1316 OD1 ASP A 91 37.285 5.466 0.515 1.00 0.00 O ATOM 1317 OD2 ASP A 91 36.124 6.541 -1.042 1.00 0.00 O ATOM 0 H ASP A 91 34.584 2.069 -0.893 1.00 0.00 H new ATOM 0 HA ASP A 91 36.844 3.010 0.580 1.00 0.00 H new ATOM 0 HB2 ASP A 91 35.921 3.847 -1.631 1.00 0.00 H new ATOM 0 HB3 ASP A 91 34.550 4.504 -0.759 1.00 0.00 H new ATOM 1322 N SER A 92 35.969 4.233 2.616 1.00 0.00 N ATOM 1323 CA SER A 92 35.526 4.668 3.933 1.00 0.00 C ATOM 1324 C SER A 92 34.508 5.801 3.823 1.00 0.00 C ATOM 1325 O SER A 92 33.763 6.060 4.769 1.00 0.00 O ATOM 1326 CB SER A 92 36.737 5.106 4.755 1.00 0.00 C ATOM 1327 OG SER A 92 37.326 6.247 4.168 1.00 0.00 O ATOM 0 H SER A 92 36.951 4.432 2.426 1.00 0.00 H new ATOM 0 HA SER A 92 35.034 3.834 4.434 1.00 0.00 H new ATOM 0 HB2 SER A 92 36.433 5.328 5.778 1.00 0.00 H new ATOM 0 HB3 SER A 92 37.465 4.296 4.808 1.00 0.00 H new ATOM 0 HG SER A 92 38.101 6.525 4.699 1.00 0.00 H new ATOM 1333 N ARG A 93 34.473 6.481 2.672 1.00 0.00 N ATOM 1334 CA ARG A 93 33.513 7.540 2.408 1.00 0.00 C ATOM 1335 C ARG A 93 32.115 6.959 2.167 1.00 0.00 C ATOM 1336 O ARG A 93 31.141 7.705 2.108 1.00 0.00 O ATOM 1337 CB ARG A 93 34.015 8.354 1.213 1.00 0.00 C ATOM 1338 CG ARG A 93 33.004 9.401 0.746 1.00 0.00 C ATOM 1339 CD ARG A 93 33.705 10.369 -0.206 1.00 0.00 C ATOM 1340 NE ARG A 93 32.734 11.119 -1.013 1.00 0.00 N ATOM 1341 CZ ARG A 93 32.463 10.825 -2.289 1.00 0.00 C ATOM 1342 NH1 ARG A 93 33.088 9.820 -2.895 1.00 0.00 N ATOM 1343 NH2 ARG A 93 31.565 11.535 -2.968 1.00 0.00 N ATOM 0 H ARG A 93 35.115 6.306 1.899 1.00 0.00 H new ATOM 0 HA ARG A 93 33.426 8.198 3.273 1.00 0.00 H new ATOM 0 HB2 ARG A 93 34.947 8.850 1.482 1.00 0.00 H new ATOM 0 HB3 ARG A 93 34.240 7.679 0.388 1.00 0.00 H new ATOM 0 HG2 ARG A 93 32.165 8.919 0.244 1.00 0.00 H new ATOM 0 HG3 ARG A 93 32.597 9.941 1.601 1.00 0.00 H new ATOM 0 HD2 ARG A 93 34.320 11.064 0.366 1.00 0.00 H new ATOM 0 HD3 ARG A 93 34.376 9.815 -0.862 1.00 0.00 H new ATOM 0 HE ARG A 93 32.243 11.901 -0.580 1.00 0.00 H new ATOM 0 HH11 ARG A 93 33.779 9.268 -2.386 1.00 0.00 H new ATOM 0 HH12 ARG A 93 32.877 9.601 -3.869 1.00 0.00 H new ATOM 0 HH21 ARG A 93 31.079 12.309 -2.515 1.00 0.00 H new ATOM 0 HH22 ARG A 93 31.363 11.305 -3.941 1.00 0.00 H new ATOM 1357 N PHE A 94 32.018 5.633 2.036 1.00 0.00 N ATOM 1358 CA PHE A 94 30.750 4.951 1.832 1.00 0.00 C ATOM 1359 C PHE A 94 30.507 3.845 2.860 1.00 0.00 C ATOM 1360 O PHE A 94 29.558 3.073 2.729 1.00 0.00 O ATOM 1361 CB PHE A 94 30.660 4.422 0.404 1.00 0.00 C ATOM 1362 CG PHE A 94 30.666 5.512 -0.640 1.00 0.00 C ATOM 1363 CD1 PHE A 94 29.558 6.363 -0.780 1.00 0.00 C ATOM 1364 CD2 PHE A 94 31.782 5.683 -1.468 1.00 0.00 C ATOM 1365 CE1 PHE A 94 29.566 7.373 -1.753 1.00 0.00 C ATOM 1366 CE2 PHE A 94 31.795 6.699 -2.433 1.00 0.00 C ATOM 1367 CZ PHE A 94 30.685 7.540 -2.578 1.00 0.00 C ATOM 0 H PHE A 94 32.822 5.006 2.069 1.00 0.00 H new ATOM 0 HA PHE A 94 29.955 5.681 1.982 1.00 0.00 H new ATOM 0 HB2 PHE A 94 31.497 3.749 0.220 1.00 0.00 H new ATOM 0 HB3 PHE A 94 29.749 3.834 0.299 1.00 0.00 H new ATOM 0 HD1 PHE A 94 28.699 6.240 -0.138 1.00 0.00 H new ATOM 0 HD2 PHE A 94 32.636 5.030 -1.363 1.00 0.00 H new ATOM 0 HE1 PHE A 94 28.710 8.021 -1.866 1.00 0.00 H new ATOM 0 HE2 PHE A 94 32.661 6.833 -3.065 1.00 0.00 H new ATOM 0 HZ PHE A 94 30.692 8.318 -3.327 1.00 0.00 H new ATOM 1377 N ARG A 95 31.361 3.761 3.886 1.00 0.00 N ATOM 1378 CA ARG A 95 31.206 2.779 4.953 1.00 0.00 C ATOM 1379 C ARG A 95 29.961 3.063 5.794 1.00 0.00 C ATOM 1380 O ARG A 95 29.537 2.214 6.574 1.00 0.00 O ATOM 1381 CB ARG A 95 32.463 2.776 5.826 1.00 0.00 C ATOM 1382 CG ARG A 95 33.572 1.921 5.207 1.00 0.00 C ATOM 1383 CD ARG A 95 33.227 0.437 5.300 1.00 0.00 C ATOM 1384 NE ARG A 95 34.338 -0.384 4.799 1.00 0.00 N ATOM 1385 CZ ARG A 95 34.767 -1.508 5.384 1.00 0.00 C ATOM 1386 NH1 ARG A 95 34.200 -1.952 6.505 1.00 0.00 N ATOM 1387 NH2 ARG A 95 35.768 -2.193 4.843 1.00 0.00 N ATOM 0 H ARG A 95 32.172 4.369 3.996 1.00 0.00 H new ATOM 0 HA ARG A 95 31.076 1.793 4.506 1.00 0.00 H new ATOM 0 HB2 ARG A 95 32.819 3.798 5.956 1.00 0.00 H new ATOM 0 HB3 ARG A 95 32.218 2.395 6.817 1.00 0.00 H new ATOM 0 HG2 ARG A 95 33.714 2.201 4.163 1.00 0.00 H new ATOM 0 HG3 ARG A 95 34.515 2.113 5.720 1.00 0.00 H new ATOM 0 HD2 ARG A 95 33.010 0.173 6.335 1.00 0.00 H new ATOM 0 HD3 ARG A 95 32.326 0.231 4.723 1.00 0.00 H new ATOM 0 HE ARG A 95 34.813 -0.077 3.950 1.00 0.00 H new ATOM 0 HH11 ARG A 95 33.430 -1.433 6.927 1.00 0.00 H new ATOM 0 HH12 ARG A 95 34.536 -2.810 6.941 1.00 0.00 H new ATOM 0 HH21 ARG A 95 36.207 -1.862 3.984 1.00 0.00 H new ATOM 0 HH22 ARG A 95 36.098 -3.050 5.286 1.00 0.00 H new ATOM 1401 N ASP A 96 29.379 4.254 5.636 1.00 0.00 N ATOM 1402 CA ASP A 96 28.139 4.623 6.306 1.00 0.00 C ATOM 1403 C ASP A 96 26.902 4.162 5.524 1.00 0.00 C ATOM 1404 O ASP A 96 25.801 4.126 6.069 1.00 0.00 O ATOM 1405 CB ASP A 96 28.104 6.134 6.562 1.00 0.00 C ATOM 1406 CG ASP A 96 28.407 6.964 5.312 1.00 0.00 C ATOM 1407 OD1 ASP A 96 28.493 6.370 4.215 1.00 0.00 O ATOM 1408 OD2 ASP A 96 28.553 8.198 5.474 1.00 0.00 O ATOM 0 H ASP A 96 29.758 4.988 5.038 1.00 0.00 H new ATOM 0 HA ASP A 96 28.113 4.107 7.266 1.00 0.00 H new ATOM 0 HB2 ASP A 96 27.121 6.409 6.943 1.00 0.00 H new ATOM 0 HB3 ASP A 96 28.828 6.381 7.339 1.00 0.00 H new ATOM 1413 N ARG A 97 27.085 3.807 4.248 1.00 0.00 N ATOM 1414 CA ARG A 97 26.019 3.257 3.424 1.00 0.00 C ATOM 1415 C ARG A 97 25.806 1.790 3.805 1.00 0.00 C ATOM 1416 O ARG A 97 26.719 1.151 4.330 1.00 0.00 O ATOM 1417 CB ARG A 97 26.397 3.364 1.942 1.00 0.00 C ATOM 1418 CG ARG A 97 26.702 4.803 1.520 1.00 0.00 C ATOM 1419 CD ARG A 97 25.533 5.727 1.856 1.00 0.00 C ATOM 1420 NE ARG A 97 25.588 6.968 1.073 1.00 0.00 N ATOM 1421 CZ ARG A 97 26.486 7.946 1.248 1.00 0.00 C ATOM 1422 NH1 ARG A 97 27.435 7.853 2.176 1.00 0.00 N ATOM 1423 NH2 ARG A 97 26.433 9.034 0.485 1.00 0.00 N ATOM 0 H ARG A 97 27.978 3.895 3.763 1.00 0.00 H new ATOM 0 HA ARG A 97 25.099 3.817 3.590 1.00 0.00 H new ATOM 0 HB2 ARG A 97 27.268 2.738 1.746 1.00 0.00 H new ATOM 0 HB3 ARG A 97 25.581 2.975 1.333 1.00 0.00 H new ATOM 0 HG2 ARG A 97 27.603 5.151 2.025 1.00 0.00 H new ATOM 0 HG3 ARG A 97 26.903 4.838 0.449 1.00 0.00 H new ATOM 0 HD2 ARG A 97 24.592 5.212 1.659 1.00 0.00 H new ATOM 0 HD3 ARG A 97 25.550 5.965 2.920 1.00 0.00 H new ATOM 0 HE ARG A 97 24.890 7.095 0.341 1.00 0.00 H new ATOM 0 HH11 ARG A 97 27.488 7.026 2.770 1.00 0.00 H new ATOM 0 HH12 ARG A 97 28.110 8.609 2.293 1.00 0.00 H new ATOM 0 HH21 ARG A 97 25.711 9.121 -0.230 1.00 0.00 H new ATOM 0 HH22 ARG A 97 27.115 9.782 0.615 1.00 0.00 H new ATOM 1437 N PRO A 98 24.610 1.241 3.549 1.00 0.00 N ATOM 1438 CA PRO A 98 24.341 -0.167 3.751 1.00 0.00 C ATOM 1439 C PRO A 98 25.112 -0.980 2.718 1.00 0.00 C ATOM 1440 O PRO A 98 25.463 -0.463 1.653 1.00 0.00 O ATOM 1441 CB PRO A 98 22.835 -0.333 3.574 1.00 0.00 C ATOM 1442 CG PRO A 98 22.452 0.833 2.660 1.00 0.00 C ATOM 1443 CD PRO A 98 23.453 1.929 3.020 1.00 0.00 C ATOM 0 HA PRO A 98 24.653 -0.515 4.736 1.00 0.00 H new ATOM 0 HB2 PRO A 98 22.587 -1.294 3.124 1.00 0.00 H new ATOM 0 HB3 PRO A 98 22.311 -0.284 4.528 1.00 0.00 H new ATOM 0 HG2 PRO A 98 22.524 0.556 1.608 1.00 0.00 H new ATOM 0 HG3 PRO A 98 21.426 1.157 2.835 1.00 0.00 H new ATOM 0 HD2 PRO A 98 23.716 2.522 2.144 1.00 0.00 H new ATOM 0 HD3 PRO A 98 23.035 2.615 3.756 1.00 0.00 H new ATOM 1451 N VAL A 99 25.382 -2.249 3.021 1.00 0.00 N ATOM 1452 CA VAL A 99 26.140 -3.097 2.118 1.00 0.00 C ATOM 1453 C VAL A 99 25.687 -4.543 2.243 1.00 0.00 C ATOM 1454 O VAL A 99 25.635 -5.106 3.336 1.00 0.00 O ATOM 1455 CB VAL A 99 27.641 -2.946 2.406 1.00 0.00 C ATOM 1456 CG1 VAL A 99 27.979 -3.204 3.878 1.00 0.00 C ATOM 1457 CG2 VAL A 99 28.458 -3.912 1.553 1.00 0.00 C ATOM 0 H VAL A 99 25.086 -2.706 3.883 1.00 0.00 H new ATOM 0 HA VAL A 99 25.958 -2.787 1.089 1.00 0.00 H new ATOM 0 HB VAL A 99 27.895 -1.915 2.161 1.00 0.00 H new ATOM 0 HG11 VAL A 99 29.052 -3.085 4.031 1.00 0.00 H new ATOM 0 HG12 VAL A 99 27.442 -2.492 4.505 1.00 0.00 H new ATOM 0 HG13 VAL A 99 27.684 -4.218 4.147 1.00 0.00 H new ATOM 0 HG21 VAL A 99 29.518 -3.786 1.775 1.00 0.00 H new ATOM 0 HG22 VAL A 99 28.160 -4.936 1.776 1.00 0.00 H new ATOM 0 HG23 VAL A 99 28.281 -3.704 0.498 1.00 0.00 H new ATOM 1467 N LEU A 100 25.359 -5.140 1.095 1.00 0.00 N ATOM 1468 CA LEU A 100 25.123 -6.569 0.994 1.00 0.00 C ATOM 1469 C LEU A 100 26.452 -7.269 0.705 1.00 0.00 C ATOM 1470 O LEU A 100 27.351 -6.674 0.117 1.00 0.00 O ATOM 1471 CB LEU A 100 24.092 -6.843 -0.104 1.00 0.00 C ATOM 1472 CG LEU A 100 22.739 -6.188 0.217 1.00 0.00 C ATOM 1473 CD1 LEU A 100 21.772 -6.432 -0.934 1.00 0.00 C ATOM 1474 CD2 LEU A 100 22.143 -6.783 1.494 1.00 0.00 C ATOM 0 H LEU A 100 25.251 -4.640 0.213 1.00 0.00 H new ATOM 0 HA LEU A 100 24.722 -6.958 1.930 1.00 0.00 H new ATOM 0 HB2 LEU A 100 24.464 -6.464 -1.056 1.00 0.00 H new ATOM 0 HB3 LEU A 100 23.958 -7.919 -0.219 1.00 0.00 H new ATOM 0 HG LEU A 100 22.897 -5.119 0.359 1.00 0.00 H new ATOM 0 HD11 LEU A 100 20.812 -5.968 -0.707 1.00 0.00 H new ATOM 0 HD12 LEU A 100 22.178 -5.999 -1.848 1.00 0.00 H new ATOM 0 HD13 LEU A 100 21.633 -7.504 -1.071 1.00 0.00 H new ATOM 0 HD21 LEU A 100 21.185 -6.307 1.705 1.00 0.00 H new ATOM 0 HD22 LEU A 100 21.994 -7.855 1.361 1.00 0.00 H new ATOM 0 HD23 LEU A 100 22.824 -6.612 2.327 1.00 0.00 H new ATOM 1486 N GLN A 101 26.582 -8.533 1.115 1.00 0.00 N ATOM 1487 CA GLN A 101 27.840 -9.258 1.004 1.00 0.00 C ATOM 1488 C GLN A 101 27.572 -10.698 0.566 1.00 0.00 C ATOM 1489 O GLN A 101 27.052 -10.925 -0.526 1.00 0.00 O ATOM 1490 CB GLN A 101 28.578 -9.147 2.345 1.00 0.00 C ATOM 1491 CG GLN A 101 30.050 -9.556 2.221 1.00 0.00 C ATOM 1492 CD GLN A 101 30.830 -9.209 3.486 1.00 0.00 C ATOM 1493 OE1 GLN A 101 30.257 -9.091 4.565 1.00 0.00 O ATOM 1494 NE2 GLN A 101 32.143 -9.043 3.357 1.00 0.00 N ATOM 0 H GLN A 101 25.823 -9.074 1.529 1.00 0.00 H new ATOM 0 HA GLN A 101 28.485 -8.829 0.237 1.00 0.00 H new ATOM 0 HB2 GLN A 101 28.515 -8.122 2.711 1.00 0.00 H new ATOM 0 HB3 GLN A 101 28.086 -9.780 3.084 1.00 0.00 H new ATOM 0 HG2 GLN A 101 30.117 -10.627 2.032 1.00 0.00 H new ATOM 0 HG3 GLN A 101 30.499 -9.052 1.365 1.00 0.00 H new ATOM 0 HE21 GLN A 101 32.583 -9.150 2.443 1.00 0.00 H new ATOM 0 HE22 GLN A 101 32.710 -8.809 4.172 1.00 0.00 H new ATOM 1503 N LYS A 102 27.925 -11.670 1.415 1.00 0.00 N ATOM 1504 CA LYS A 102 27.617 -13.082 1.211 1.00 0.00 C ATOM 1505 C LYS A 102 26.104 -13.272 1.037 1.00 0.00 C ATOM 1506 O LYS A 102 25.339 -12.356 1.338 1.00 0.00 O ATOM 1507 CB LYS A 102 28.201 -13.902 2.378 1.00 0.00 C ATOM 1508 CG LYS A 102 27.940 -13.293 3.761 1.00 0.00 C ATOM 1509 CD LYS A 102 26.459 -13.312 4.144 1.00 0.00 C ATOM 1510 CE LYS A 102 26.269 -12.890 5.602 1.00 0.00 C ATOM 1511 NZ LYS A 102 26.950 -13.819 6.527 1.00 0.00 N ATOM 0 H LYS A 102 28.441 -11.490 2.276 1.00 0.00 H new ATOM 0 HA LYS A 102 28.080 -13.447 0.294 1.00 0.00 H new ATOM 0 HB2 LYS A 102 27.779 -14.907 2.349 1.00 0.00 H new ATOM 0 HB3 LYS A 102 29.277 -14.004 2.234 1.00 0.00 H new ATOM 0 HG2 LYS A 102 28.512 -13.842 4.509 1.00 0.00 H new ATOM 0 HG3 LYS A 102 28.302 -12.265 3.775 1.00 0.00 H new ATOM 0 HD2 LYS A 102 25.901 -12.641 3.491 1.00 0.00 H new ATOM 0 HD3 LYS A 102 26.053 -14.312 3.994 1.00 0.00 H new ATOM 0 HE2 LYS A 102 26.659 -11.882 5.744 1.00 0.00 H new ATOM 0 HE3 LYS A 102 25.205 -12.856 5.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 26.305 -14.072 7.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 27.228 -14.679 6.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 27.798 -13.360 6.918 1.00 0.00 H new ATOM 1525 N PRO A 103 25.656 -14.440 0.554 1.00 0.00 N ATOM 1526 CA PRO A 103 24.251 -14.717 0.338 1.00 0.00 C ATOM 1527 C PRO A 103 23.402 -14.317 1.544 1.00 0.00 C ATOM 1528 O PRO A 103 23.833 -14.452 2.690 1.00 0.00 O ATOM 1529 CB PRO A 103 24.169 -16.214 0.037 1.00 0.00 C ATOM 1530 CG PRO A 103 25.542 -16.527 -0.563 1.00 0.00 C ATOM 1531 CD PRO A 103 26.480 -15.567 0.166 1.00 0.00 C ATOM 0 HA PRO A 103 23.849 -14.131 -0.488 1.00 0.00 H new ATOM 0 HB2 PRO A 103 23.982 -16.796 0.939 1.00 0.00 H new ATOM 0 HB3 PRO A 103 23.363 -16.441 -0.661 1.00 0.00 H new ATOM 0 HG2 PRO A 103 25.824 -17.567 -0.397 1.00 0.00 H new ATOM 0 HG3 PRO A 103 25.556 -16.361 -1.640 1.00 0.00 H new ATOM 0 HD2 PRO A 103 26.929 -16.043 1.038 1.00 0.00 H new ATOM 0 HD3 PRO A 103 27.298 -15.251 -0.481 1.00 0.00 H new ATOM 1539 N PHE A 104 22.198 -13.820 1.272 1.00 0.00 N ATOM 1540 CA PHE A 104 21.353 -13.188 2.277 1.00 0.00 C ATOM 1541 C PHE A 104 19.907 -13.664 2.284 1.00 0.00 C ATOM 1542 O PHE A 104 19.387 -14.106 1.257 1.00 0.00 O ATOM 1543 CB PHE A 104 21.469 -11.665 2.176 1.00 0.00 C ATOM 1544 CG PHE A 104 21.697 -11.182 0.759 1.00 0.00 C ATOM 1545 CD1 PHE A 104 22.951 -10.681 0.387 1.00 0.00 C ATOM 1546 CD2 PHE A 104 20.665 -11.253 -0.185 1.00 0.00 C ATOM 1547 CE1 PHE A 104 23.181 -10.284 -0.938 1.00 0.00 C ATOM 1548 CE2 PHE A 104 20.890 -10.843 -1.508 1.00 0.00 C ATOM 1549 CZ PHE A 104 22.153 -10.369 -1.884 1.00 0.00 C ATOM 0 H PHE A 104 21.780 -13.845 0.342 1.00 0.00 H new ATOM 0 HA PHE A 104 21.733 -13.509 3.247 1.00 0.00 H new ATOM 0 HB2 PHE A 104 20.559 -11.210 2.567 1.00 0.00 H new ATOM 0 HB3 PHE A 104 22.291 -11.326 2.806 1.00 0.00 H new ATOM 0 HD1 PHE A 104 23.740 -10.601 1.120 1.00 0.00 H new ATOM 0 HD2 PHE A 104 19.693 -11.624 0.106 1.00 0.00 H new ATOM 0 HE1 PHE A 104 24.152 -9.912 -1.229 1.00 0.00 H new ATOM 0 HE2 PHE A 104 20.092 -10.893 -2.234 1.00 0.00 H new ATOM 0 HZ PHE A 104 22.334 -10.069 -2.905 1.00 0.00 H new ATOM 1559 N THR A 105 19.257 -13.566 3.447 1.00 0.00 N ATOM 1560 CA THR A 105 17.852 -13.923 3.607 1.00 0.00 C ATOM 1561 C THR A 105 16.907 -12.785 3.248 1.00 0.00 C ATOM 1562 O THR A 105 17.348 -11.681 2.929 1.00 0.00 O ATOM 1563 CB THR A 105 17.575 -14.451 5.017 1.00 0.00 C ATOM 1564 OG1 THR A 105 17.323 -13.364 5.880 1.00 0.00 O ATOM 1565 CG2 THR A 105 18.753 -15.258 5.566 1.00 0.00 C ATOM 0 H THR A 105 19.696 -13.235 4.306 1.00 0.00 H new ATOM 0 HA THR A 105 17.652 -14.724 2.895 1.00 0.00 H new ATOM 0 HB THR A 105 16.709 -15.110 4.961 1.00 0.00 H new ATOM 0 HG1 THR A 105 17.144 -13.698 6.784 1.00 0.00 H new ATOM 0 HG21 THR A 105 18.515 -15.614 6.568 1.00 0.00 H new ATOM 0 HG22 THR A 105 18.945 -16.110 4.914 1.00 0.00 H new ATOM 0 HG23 THR A 105 19.640 -14.625 5.607 1.00 0.00 H new ATOM 1573 N MET A 106 15.600 -13.055 3.304 1.00 0.00 N ATOM 1574 CA MET A 106 14.594 -12.043 3.026 1.00 0.00 C ATOM 1575 C MET A 106 14.722 -10.884 4.014 1.00 0.00 C ATOM 1576 O MET A 106 14.406 -9.741 3.681 1.00 0.00 O ATOM 1577 CB MET A 106 13.209 -12.692 3.123 1.00 0.00 C ATOM 1578 CG MET A 106 12.062 -11.703 2.884 1.00 0.00 C ATOM 1579 SD MET A 106 11.754 -11.264 1.153 1.00 0.00 S ATOM 1580 CE MET A 106 12.947 -9.918 0.933 1.00 0.00 C ATOM 0 H MET A 106 15.219 -13.971 3.541 1.00 0.00 H new ATOM 0 HA MET A 106 14.736 -11.641 2.023 1.00 0.00 H new ATOM 0 HB2 MET A 106 13.141 -13.500 2.395 1.00 0.00 H new ATOM 0 HB3 MET A 106 13.093 -13.141 4.109 1.00 0.00 H new ATOM 0 HG2 MET A 106 11.148 -12.127 3.301 1.00 0.00 H new ATOM 0 HG3 MET A 106 12.272 -10.789 3.440 1.00 0.00 H new ATOM 0 HE1 MET A 106 12.810 -9.467 -0.050 1.00 0.00 H new ATOM 0 HE2 MET A 106 12.790 -9.163 1.704 1.00 0.00 H new ATOM 0 HE3 MET A 106 13.960 -10.313 1.012 1.00 0.00 H new ATOM 1590 N ASP A 107 15.191 -11.175 5.230 1.00 0.00 N ATOM 1591 CA ASP A 107 15.382 -10.162 6.251 1.00 0.00 C ATOM 1592 C ASP A 107 16.711 -9.431 6.092 1.00 0.00 C ATOM 1593 O ASP A 107 16.862 -8.312 6.579 1.00 0.00 O ATOM 1594 CB ASP A 107 15.282 -10.801 7.639 1.00 0.00 C ATOM 1595 CG ASP A 107 13.877 -11.320 7.949 1.00 0.00 C ATOM 1596 OD1 ASP A 107 12.966 -11.086 7.122 1.00 0.00 O ATOM 1597 OD2 ASP A 107 13.727 -11.956 9.016 1.00 0.00 O ATOM 0 H ASP A 107 15.446 -12.117 5.526 1.00 0.00 H new ATOM 0 HA ASP A 107 14.593 -9.418 6.136 1.00 0.00 H new ATOM 0 HB2 ASP A 107 15.993 -11.625 7.708 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.569 -10.069 8.393 1.00 0.00 H new ATOM 1602 N GLY A 108 17.675 -10.056 5.407 1.00 0.00 N ATOM 1603 CA GLY A 108 18.995 -9.472 5.218 1.00 0.00 C ATOM 1604 C GLY A 108 18.955 -8.333 4.204 1.00 0.00 C ATOM 1605 O GLY A 108 19.636 -7.325 4.379 1.00 0.00 O ATOM 0 H GLY A 108 17.558 -10.972 4.974 1.00 0.00 H new ATOM 0 HA2 GLY A 108 19.371 -9.101 6.171 1.00 0.00 H new ATOM 0 HA3 GLY A 108 19.690 -10.240 4.879 1.00 0.00 H new ATOM 1609 N VAL A 109 18.156 -8.484 3.143 1.00 0.00 N ATOM 1610 CA VAL A 109 17.995 -7.424 2.157 1.00 0.00 C ATOM 1611 C VAL A 109 17.050 -6.347 2.675 1.00 0.00 C ATOM 1612 O VAL A 109 17.166 -5.188 2.288 1.00 0.00 O ATOM 1613 CB VAL A 109 17.499 -8.006 0.826 1.00 0.00 C ATOM 1614 CG1 VAL A 109 18.405 -9.147 0.375 1.00 0.00 C ATOM 1615 CG2 VAL A 109 16.069 -8.524 0.950 1.00 0.00 C ATOM 0 H VAL A 109 17.616 -9.327 2.950 1.00 0.00 H new ATOM 0 HA VAL A 109 18.965 -6.958 1.983 1.00 0.00 H new ATOM 0 HB VAL A 109 17.522 -7.205 0.088 1.00 0.00 H new ATOM 0 HG11 VAL A 109 18.040 -9.549 -0.570 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.421 -8.775 0.243 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.402 -9.934 1.129 1.00 0.00 H new ATOM 0 HG21 VAL A 109 15.745 -8.930 -0.008 1.00 0.00 H new ATOM 0 HG22 VAL A 109 16.030 -9.307 1.708 1.00 0.00 H new ATOM 0 HG23 VAL A 109 15.409 -7.706 1.239 1.00 0.00 H new ATOM 1625 N ALA A 110 16.118 -6.721 3.554 1.00 0.00 N ATOM 1626 CA ALA A 110 15.217 -5.761 4.169 1.00 0.00 C ATOM 1627 C ALA A 110 15.985 -4.907 5.178 1.00 0.00 C ATOM 1628 O ALA A 110 15.620 -3.761 5.425 1.00 0.00 O ATOM 1629 CB ALA A 110 14.075 -6.507 4.857 1.00 0.00 C ATOM 0 H ALA A 110 15.972 -7.685 3.852 1.00 0.00 H new ATOM 0 HA ALA A 110 14.800 -5.105 3.405 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.398 -5.789 5.319 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.530 -7.098 4.120 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.481 -7.168 5.623 1.00 0.00 H new ATOM 1635 N LYS A 111 17.053 -5.469 5.757 1.00 0.00 N ATOM 1636 CA LYS A 111 17.895 -4.762 6.711 1.00 0.00 C ATOM 1637 C LYS A 111 18.693 -3.667 6.010 1.00 0.00 C ATOM 1638 O LYS A 111 18.865 -2.578 6.552 1.00 0.00 O ATOM 1639 CB LYS A 111 18.837 -5.778 7.356 1.00 0.00 C ATOM 1640 CG LYS A 111 19.679 -5.144 8.460 1.00 0.00 C ATOM 1641 CD LYS A 111 20.626 -6.205 9.019 1.00 0.00 C ATOM 1642 CE LYS A 111 21.329 -5.666 10.264 1.00 0.00 C ATOM 1643 NZ LYS A 111 22.244 -6.670 10.841 1.00 0.00 N ATOM 0 H LYS A 111 17.352 -6.427 5.573 1.00 0.00 H new ATOM 0 HA LYS A 111 17.278 -4.286 7.473 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.256 -6.602 7.769 1.00 0.00 H new ATOM 0 HB3 LYS A 111 19.493 -6.201 6.595 1.00 0.00 H new ATOM 0 HG2 LYS A 111 20.246 -4.300 8.067 1.00 0.00 H new ATOM 0 HG3 LYS A 111 19.037 -4.756 9.250 1.00 0.00 H new ATOM 0 HD2 LYS A 111 20.069 -7.109 9.267 1.00 0.00 H new ATOM 0 HD3 LYS A 111 21.363 -6.482 8.265 1.00 0.00 H new ATOM 0 HE2 LYS A 111 21.888 -4.766 10.007 1.00 0.00 H new ATOM 0 HE3 LYS A 111 20.586 -5.378 11.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 22.706 -6.274 11.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 21.705 -7.519 11.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 22.967 -6.926 10.138 1.00 0.00 H new ATOM 1657 N ALA A 112 19.176 -3.959 4.801 1.00 0.00 N ATOM 1658 CA ALA A 112 19.978 -3.015 4.040 1.00 0.00 C ATOM 1659 C ALA A 112 19.115 -1.880 3.496 1.00 0.00 C ATOM 1660 O ALA A 112 19.532 -0.724 3.515 1.00 0.00 O ATOM 1661 CB ALA A 112 20.673 -3.760 2.903 1.00 0.00 C ATOM 0 H ALA A 112 19.021 -4.850 4.330 1.00 0.00 H new ATOM 0 HA ALA A 112 20.727 -2.569 4.694 1.00 0.00 H new ATOM 0 HB1 ALA A 112 21.278 -3.061 2.326 1.00 0.00 H new ATOM 0 HB2 ALA A 112 21.314 -4.538 3.316 1.00 0.00 H new ATOM 0 HB3 ALA A 112 19.924 -4.214 2.254 1.00 0.00 H new ATOM 1667 N LEU A 113 17.913 -2.203 3.008 1.00 0.00 N ATOM 1668 CA LEU A 113 17.022 -1.205 2.435 1.00 0.00 C ATOM 1669 C LEU A 113 16.384 -0.355 3.537 1.00 0.00 C ATOM 1670 O LEU A 113 15.990 0.780 3.283 1.00 0.00 O ATOM 1671 CB LEU A 113 15.940 -1.905 1.610 1.00 0.00 C ATOM 1672 CG LEU A 113 16.533 -2.589 0.375 1.00 0.00 C ATOM 1673 CD1 LEU A 113 15.455 -3.434 -0.299 1.00 0.00 C ATOM 1674 CD2 LEU A 113 17.040 -1.553 -0.628 1.00 0.00 C ATOM 0 H LEU A 113 17.539 -3.152 3.001 1.00 0.00 H new ATOM 0 HA LEU A 113 17.598 -0.543 1.788 1.00 0.00 H new ATOM 0 HB2 LEU A 113 15.431 -2.645 2.228 1.00 0.00 H new ATOM 0 HB3 LEU A 113 15.190 -1.178 1.300 1.00 0.00 H new ATOM 0 HG LEU A 113 17.367 -3.214 0.694 1.00 0.00 H new ATOM 0 HD11 LEU A 113 15.873 -3.923 -1.179 1.00 0.00 H new ATOM 0 HD12 LEU A 113 15.095 -4.190 0.399 1.00 0.00 H new ATOM 0 HD13 LEU A 113 14.626 -2.794 -0.599 1.00 0.00 H new ATOM 0 HD21 LEU A 113 17.457 -2.062 -1.497 1.00 0.00 H new ATOM 0 HD22 LEU A 113 16.213 -0.916 -0.942 1.00 0.00 H new ATOM 0 HD23 LEU A 113 17.812 -0.941 -0.161 1.00 0.00 H new ATOM 1686 N ALA A 114 16.279 -0.891 4.759 1.00 0.00 N ATOM 1687 CA ALA A 114 15.758 -0.118 5.874 1.00 0.00 C ATOM 1688 C ALA A 114 16.795 0.908 6.321 1.00 0.00 C ATOM 1689 O ALA A 114 16.449 2.050 6.625 1.00 0.00 O ATOM 1690 CB ALA A 114 15.407 -1.060 7.024 1.00 0.00 C ATOM 0 H ALA A 114 16.547 -1.847 4.992 1.00 0.00 H new ATOM 0 HA ALA A 114 14.858 0.412 5.564 1.00 0.00 H new ATOM 0 HB1 ALA A 114 15.016 -0.482 7.861 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.653 -1.774 6.692 1.00 0.00 H new ATOM 0 HB3 ALA A 114 16.301 -1.597 7.340 1.00 0.00 H new ATOM 1696 N ALA A 115 18.068 0.505 6.356 1.00 0.00 N ATOM 1697 CA ALA A 115 19.163 1.386 6.722 1.00 0.00 C ATOM 1698 C ALA A 115 19.461 2.377 5.597 1.00 0.00 C ATOM 1699 O ALA A 115 20.173 3.360 5.798 1.00 0.00 O ATOM 1700 CB ALA A 115 20.392 0.542 7.053 1.00 0.00 C ATOM 0 H ALA A 115 18.361 -0.445 6.129 1.00 0.00 H new ATOM 0 HA ALA A 115 18.883 1.968 7.600 1.00 0.00 H new ATOM 0 HB1 ALA A 115 21.219 1.196 7.329 1.00 0.00 H new ATOM 0 HB2 ALA A 115 20.163 -0.124 7.885 1.00 0.00 H new ATOM 0 HB3 ALA A 115 20.673 -0.050 6.182 1.00 0.00 H new ATOM 1706 N LEU A 116 18.920 2.125 4.399 1.00 0.00 N ATOM 1707 CA LEU A 116 19.112 2.996 3.254 1.00 0.00 C ATOM 1708 C LEU A 116 18.226 4.243 3.348 1.00 0.00 C ATOM 1709 O LEU A 116 18.559 5.286 2.786 1.00 0.00 O ATOM 1710 CB LEU A 116 18.788 2.191 1.995 1.00 0.00 C ATOM 1711 CG LEU A 116 19.178 2.922 0.719 1.00 0.00 C ATOM 1712 CD1 LEU A 116 20.683 3.157 0.659 1.00 0.00 C ATOM 1713 CD2 LEU A 116 18.778 2.053 -0.468 1.00 0.00 C ATOM 0 H LEU A 116 18.339 1.310 4.205 1.00 0.00 H new ATOM 0 HA LEU A 116 20.144 3.346 3.224 1.00 0.00 H new ATOM 0 HB2 LEU A 116 19.309 1.234 2.035 1.00 0.00 H new ATOM 0 HB3 LEU A 116 17.720 1.972 1.973 1.00 0.00 H new ATOM 0 HG LEU A 116 18.673 3.888 0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 116 20.933 3.681 -0.263 1.00 0.00 H new ATOM 0 HD12 LEU A 116 20.992 3.759 1.514 1.00 0.00 H new ATOM 0 HD13 LEU A 116 21.202 2.199 0.684 1.00 0.00 H new ATOM 0 HD21 LEU A 116 19.048 2.557 -1.396 1.00 0.00 H new ATOM 0 HD22 LEU A 116 19.298 1.097 -0.410 1.00 0.00 H new ATOM 0 HD23 LEU A 116 17.702 1.883 -0.448 1.00 0.00 H new ATOM 1725 N LEU A 117 17.096 4.131 4.057 1.00 0.00 N ATOM 1726 CA LEU A 117 16.119 5.212 4.160 1.00 0.00 C ATOM 1727 C LEU A 117 16.095 5.805 5.570 1.00 0.00 C ATOM 1728 O LEU A 117 15.491 6.858 5.779 1.00 0.00 O ATOM 1729 CB LEU A 117 14.732 4.662 3.807 1.00 0.00 C ATOM 1730 CG LEU A 117 14.442 4.729 2.303 1.00 0.00 C ATOM 1731 CD1 LEU A 117 15.382 3.829 1.498 1.00 0.00 C ATOM 1732 CD2 LEU A 117 13.006 4.270 2.061 1.00 0.00 C ATOM 0 H LEU A 117 16.837 3.290 4.572 1.00 0.00 H new ATOM 0 HA LEU A 117 16.400 6.005 3.467 1.00 0.00 H new ATOM 0 HB2 LEU A 117 14.658 3.628 4.143 1.00 0.00 H new ATOM 0 HB3 LEU A 117 13.972 5.227 4.346 1.00 0.00 H new ATOM 0 HG LEU A 117 14.593 5.758 1.976 1.00 0.00 H new ATOM 0 HD11 LEU A 117 15.141 3.907 0.438 1.00 0.00 H new ATOM 0 HD12 LEU A 117 16.413 4.143 1.660 1.00 0.00 H new ATOM 0 HD13 LEU A 117 15.262 2.795 1.822 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.785 4.312 0.994 1.00 0.00 H new ATOM 0 HD22 LEU A 117 12.887 3.246 2.416 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.320 4.923 2.600 1.00 0.00 H new ATOM 1744 N VAL A 118 16.740 5.141 6.536 1.00 0.00 N ATOM 1745 CA VAL A 118 16.736 5.594 7.926 1.00 0.00 C ATOM 1746 C VAL A 118 17.500 6.907 8.108 1.00 0.00 C ATOM 1747 O VAL A 118 17.065 7.705 8.967 1.00 0.00 O ATOM 1748 CB VAL A 118 17.258 4.481 8.839 1.00 0.00 C ATOM 1749 CG1 VAL A 118 18.771 4.355 8.715 1.00 0.00 C ATOM 1750 CG2 VAL A 118 16.910 4.769 10.296 1.00 0.00 C ATOM 0 H VAL A 118 17.272 4.286 6.377 1.00 0.00 H new ATOM 0 HA VAL A 118 15.707 5.812 8.213 1.00 0.00 H new ATOM 0 HB VAL A 118 16.784 3.550 8.529 1.00 0.00 H new ATOM 0 HG11 VAL A 118 19.125 3.559 9.371 1.00 0.00 H new ATOM 0 HG12 VAL A 118 19.033 4.119 7.684 1.00 0.00 H new ATOM 0 HG13 VAL A 118 19.239 5.297 9.002 1.00 0.00 H new ATOM 0 HG21 VAL A 118 17.290 3.965 10.927 1.00 0.00 H new ATOM 0 HG22 VAL A 118 17.363 5.713 10.599 1.00 0.00 H new ATOM 0 HG23 VAL A 118 15.827 4.835 10.405 1.00 0.00 H new TER 1760 VAL A 118