USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 955 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 92 HIS : no HD1:sc= -7.82! C(o=-9.7!,f=-11!) USER MOD Set 1.2: A 99 GLN : amide:sc= -1.91 K(o=-9.7,f=-12!) USER MOD Set 2.1: A 73 MET CE :methyl -151:sc= -0.132 (180deg=0) USER MOD Set 2.2: A 123 THR OG1 : rot -63:sc= 0.222 USER MOD Single : A 1 MET CE :methyl -154:sc= 0 (180deg=-0.00138) USER MOD Single : A 1 MET N :NH3+ 159:sc= 0.00268 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0459 USER MOD Single : A 10 SER OG : rot -17:sc= 0.147 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot 180:sc= -1.68! USER MOD Single : A 38 HIS : no HD1:sc= -6.39! K(o=-6.4!,f=-1.4) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot 52:sc= 0.59 USER MOD Single : A 49 ASN : amide:sc= -3.93! C(o=-3.9!,f=-11!) USER MOD Single : A 54 GLN : amide:sc= -5.97! C(o=-6!,f=-3.3!) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -3.84! C(o=-3.8!,f=-3.6!) USER MOD Single : A 72 HIS : no HE2:sc= -6.38! C(o=-6.4!,f=-10!) USER MOD Single : A 75 ASN : amide:sc= -2.25 K(o=-2.3,f=-5.6!) USER MOD Single : A 102 CYS SG : rot -67:sc= 0.521 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -37:sc= 0.768 USER MOD Single : A 111 ASN : amide:sc= -0.0132 X(o=-0.013,f=0) USER MOD Single : A 113 ASN : amide:sc= -0.0954 K(o=-0.095,f=-1.2) USER MOD Single : A 121 THR OG1 : rot 79:sc= 0.761 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 76.301 26.145 -19.892 1.00 1.00 N ATOM 2 CA MET A 1 76.631 24.699 -20.023 1.00 1.00 C ATOM 3 C MET A 1 75.346 23.877 -19.904 1.00 1.00 C ATOM 4 O MET A 1 74.341 24.346 -19.368 1.00 1.00 O ATOM 5 CB MET A 1 77.635 24.317 -18.914 1.00 1.00 C ATOM 6 CG MET A 1 78.756 23.428 -19.477 1.00 1.00 C ATOM 7 SD MET A 1 79.905 24.444 -20.437 1.00 1.00 S ATOM 8 CE MET A 1 80.967 24.966 -19.065 1.00 1.00 C ATOM 0 H1 MET A 1 77.154 26.672 -19.617 1.00 1.00 H new ATOM 0 H2 MET A 1 75.950 26.505 -20.802 1.00 1.00 H new ATOM 0 H3 MET A 1 75.568 26.269 -19.165 1.00 1.00 H new ATOM 0 HA MET A 1 77.083 24.494 -20.994 1.00 1.00 H new ATOM 0 HB2 MET A 1 78.064 25.219 -18.479 1.00 1.00 H new ATOM 0 HB3 MET A 1 77.116 23.792 -18.112 1.00 1.00 H new ATOM 0 HG2 MET A 1 79.285 22.932 -18.663 1.00 1.00 H new ATOM 0 HG3 MET A 1 78.333 22.645 -20.106 1.00 1.00 H new ATOM 0 HE1 MET A 1 81.437 25.918 -19.311 1.00 1.00 H new ATOM 0 HE2 MET A 1 80.366 25.080 -18.163 1.00 1.00 H new ATOM 0 HE3 MET A 1 81.738 24.214 -18.895 1.00 1.00 H new ATOM 18 N SER A 2 75.394 22.651 -20.409 1.00 1.00 N ATOM 19 CA SER A 2 74.254 21.735 -20.379 1.00 1.00 C ATOM 20 C SER A 2 74.270 20.904 -19.100 1.00 1.00 C ATOM 21 O SER A 2 73.517 19.941 -18.977 1.00 1.00 O ATOM 22 CB SER A 2 74.288 20.814 -21.596 1.00 1.00 C ATOM 23 OG SER A 2 75.403 19.939 -21.496 1.00 1.00 O ATOM 0 H SER A 2 76.225 22.260 -20.853 1.00 1.00 H new ATOM 0 HA SER A 2 73.337 22.324 -20.402 1.00 1.00 H new ATOM 0 HB2 SER A 2 73.364 20.238 -21.656 1.00 1.00 H new ATOM 0 HB3 SER A 2 74.356 21.404 -22.510 1.00 1.00 H new ATOM 0 HG SER A 2 75.425 19.346 -22.276 1.00 1.00 H new ATOM 29 N ASP A 3 75.117 21.317 -18.154 1.00 1.00 N ATOM 30 CA ASP A 3 75.246 20.656 -16.844 1.00 1.00 C ATOM 31 C ASP A 3 76.662 20.841 -16.304 1.00 1.00 C ATOM 32 O ASP A 3 77.634 20.361 -16.887 1.00 1.00 O ATOM 33 CB ASP A 3 74.895 19.152 -16.919 1.00 1.00 C ATOM 34 CG ASP A 3 75.443 18.391 -15.705 1.00 1.00 C ATOM 35 OD1 ASP A 3 75.527 18.987 -14.642 1.00 1.00 O ATOM 36 OD2 ASP A 3 75.769 17.225 -15.860 1.00 1.00 O ATOM 0 H ASP A 3 75.735 22.120 -18.271 1.00 1.00 H new ATOM 0 HA ASP A 3 74.533 21.124 -16.165 1.00 1.00 H new ATOM 0 HB2 ASP A 3 73.813 19.031 -16.969 1.00 1.00 H new ATOM 0 HB3 ASP A 3 75.306 18.726 -17.834 1.00 1.00 H new ATOM 41 N PHE A 4 76.761 21.536 -15.176 1.00 1.00 N ATOM 42 CA PHE A 4 78.057 21.777 -14.549 1.00 1.00 C ATOM 43 C PHE A 4 77.892 21.953 -13.045 1.00 1.00 C ATOM 44 O PHE A 4 76.875 22.463 -12.583 1.00 1.00 O ATOM 45 CB PHE A 4 78.709 23.025 -15.163 1.00 1.00 C ATOM 46 CG PHE A 4 80.205 22.968 -14.958 1.00 1.00 C ATOM 47 CD1 PHE A 4 80.999 22.247 -15.857 1.00 1.00 C ATOM 48 CD2 PHE A 4 80.793 23.619 -13.869 1.00 1.00 C ATOM 49 CE1 PHE A 4 82.382 22.176 -15.667 1.00 1.00 C ATOM 50 CE2 PHE A 4 82.178 23.550 -13.679 1.00 1.00 C ATOM 51 CZ PHE A 4 82.973 22.827 -14.578 1.00 1.00 C ATOM 0 H PHE A 4 75.967 21.940 -14.680 1.00 1.00 H new ATOM 0 HA PHE A 4 78.702 20.917 -14.727 1.00 1.00 H new ATOM 0 HB2 PHE A 4 78.479 23.081 -16.227 1.00 1.00 H new ATOM 0 HB3 PHE A 4 78.302 23.925 -14.701 1.00 1.00 H new ATOM 0 HD1 PHE A 4 80.543 21.745 -16.698 1.00 1.00 H new ATOM 0 HD2 PHE A 4 80.179 24.174 -13.175 1.00 1.00 H new ATOM 0 HE1 PHE A 4 82.994 21.619 -16.360 1.00 1.00 H new ATOM 0 HE2 PHE A 4 82.634 24.054 -12.840 1.00 1.00 H new ATOM 0 HZ PHE A 4 84.042 22.772 -14.431 1.00 1.00 H new ATOM 61 N ASP A 5 78.901 21.536 -12.283 1.00 1.00 N ATOM 62 CA ASP A 5 78.853 21.663 -10.833 1.00 1.00 C ATOM 63 C ASP A 5 80.272 21.717 -10.274 1.00 1.00 C ATOM 64 O ASP A 5 81.198 21.160 -10.869 1.00 1.00 O ATOM 65 CB ASP A 5 78.104 20.466 -10.220 1.00 1.00 C ATOM 66 CG ASP A 5 76.952 20.041 -11.127 1.00 1.00 C ATOM 67 OD1 ASP A 5 75.976 20.770 -11.197 1.00 1.00 O ATOM 68 OD2 ASP A 5 77.062 18.990 -11.736 1.00 1.00 O ATOM 0 H ASP A 5 79.755 21.111 -12.645 1.00 1.00 H new ATOM 0 HA ASP A 5 78.325 22.582 -10.577 1.00 1.00 H new ATOM 0 HB2 ASP A 5 78.791 19.632 -10.079 1.00 1.00 H new ATOM 0 HB3 ASP A 5 77.721 20.734 -9.235 1.00 1.00 H new ATOM 73 N THR A 6 80.434 22.390 -9.133 1.00 1.00 N ATOM 74 CA THR A 6 81.753 22.509 -8.502 1.00 1.00 C ATOM 75 C THR A 6 82.510 21.186 -8.645 1.00 1.00 C ATOM 76 O THR A 6 81.907 20.123 -8.656 1.00 1.00 O ATOM 77 CB THR A 6 81.603 22.873 -7.016 1.00 1.00 C ATOM 78 OG1 THR A 6 80.559 23.823 -6.867 1.00 1.00 O ATOM 79 CG2 THR A 6 82.913 23.472 -6.484 1.00 1.00 C ATOM 0 H THR A 6 79.679 22.857 -8.631 1.00 1.00 H new ATOM 0 HA THR A 6 82.314 23.301 -8.997 1.00 1.00 H new ATOM 0 HB THR A 6 81.367 21.971 -6.451 1.00 1.00 H new ATOM 0 HG1 THR A 6 80.461 24.055 -5.920 1.00 1.00 H new ATOM 0 HG21 THR A 6 82.795 23.726 -5.431 1.00 1.00 H new ATOM 0 HG22 THR A 6 83.717 22.744 -6.594 1.00 1.00 H new ATOM 0 HG23 THR A 6 83.158 24.371 -7.049 1.00 1.00 H new ATOM 87 N GLU A 7 83.808 21.252 -8.853 1.00 1.00 N ATOM 88 CA GLU A 7 84.611 20.071 -9.111 1.00 1.00 C ATOM 89 C GLU A 7 84.327 18.948 -8.138 1.00 1.00 C ATOM 90 O GLU A 7 84.048 17.845 -8.589 1.00 1.00 O ATOM 91 CB GLU A 7 86.093 20.463 -9.015 1.00 1.00 C ATOM 92 CG GLU A 7 86.984 19.311 -9.479 1.00 1.00 C ATOM 93 CD GLU A 7 88.444 19.655 -9.207 1.00 1.00 C ATOM 94 OE1 GLU A 7 88.865 19.498 -8.073 1.00 1.00 O ATOM 95 OE2 GLU A 7 89.119 20.074 -10.134 1.00 1.00 O ATOM 0 H GLU A 7 84.338 22.124 -8.848 1.00 1.00 H new ATOM 0 HA GLU A 7 84.359 19.703 -10.106 1.00 1.00 H new ATOM 0 HB2 GLU A 7 86.282 21.345 -9.626 1.00 1.00 H new ATOM 0 HB3 GLU A 7 86.339 20.729 -7.987 1.00 1.00 H new ATOM 0 HG2 GLU A 7 86.712 18.394 -8.956 1.00 1.00 H new ATOM 0 HG3 GLU A 7 86.835 19.128 -10.543 1.00 1.00 H new ATOM 102 N ARG A 8 84.369 19.156 -6.830 1.00 1.00 N ATOM 103 CA ARG A 8 84.073 18.072 -5.918 1.00 1.00 C ATOM 104 C ARG A 8 82.635 17.624 -6.101 1.00 1.00 C ATOM 105 O ARG A 8 82.319 16.446 -6.043 1.00 1.00 O ATOM 106 CB ARG A 8 84.266 18.585 -4.479 1.00 1.00 C ATOM 107 CG ARG A 8 83.174 19.624 -4.172 1.00 1.00 C ATOM 108 CD ARG A 8 83.475 20.382 -2.879 1.00 1.00 C ATOM 109 NE ARG A 8 82.388 21.322 -2.619 1.00 1.00 N ATOM 110 CZ ARG A 8 82.110 21.753 -1.391 1.00 1.00 C ATOM 111 NH1 ARG A 8 82.846 21.385 -0.382 1.00 1.00 N ATOM 112 NH2 ARG A 8 81.098 22.555 -1.199 1.00 1.00 N ATOM 0 H ARG A 8 84.600 20.046 -6.388 1.00 1.00 H new ATOM 0 HA ARG A 8 84.735 17.229 -6.115 1.00 1.00 H new ATOM 0 HB2 ARG A 8 84.208 17.757 -3.772 1.00 1.00 H new ATOM 0 HB3 ARG A 8 85.254 19.032 -4.367 1.00 1.00 H new ATOM 0 HG2 ARG A 8 83.097 20.329 -5.000 1.00 1.00 H new ATOM 0 HG3 ARG A 8 82.208 19.125 -4.087 1.00 1.00 H new ATOM 0 HD2 ARG A 8 83.577 19.684 -2.048 1.00 1.00 H new ATOM 0 HD3 ARG A 8 84.422 20.915 -2.966 1.00 1.00 H new ATOM 0 HE ARG A 8 81.826 21.658 -3.401 1.00 1.00 H new ATOM 0 HH11 ARG A 8 83.641 20.763 -0.530 1.00 1.00 H new ATOM 0 HH12 ARG A 8 82.628 21.719 0.557 1.00 1.00 H new ATOM 0 HH21 ARG A 8 80.523 22.849 -1.989 1.00 1.00 H new ATOM 0 HH22 ARG A 8 80.882 22.887 -0.259 1.00 1.00 H new ATOM 126 N VAL A 9 81.775 18.587 -6.384 1.00 1.00 N ATOM 127 CA VAL A 9 80.391 18.237 -6.606 1.00 1.00 C ATOM 128 C VAL A 9 80.326 17.323 -7.820 1.00 1.00 C ATOM 129 O VAL A 9 79.764 16.243 -7.749 1.00 1.00 O ATOM 130 CB VAL A 9 79.508 19.478 -6.789 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.076 19.042 -7.127 1.00 1.00 C ATOM 132 CG2 VAL A 9 79.499 20.282 -5.483 1.00 1.00 C ATOM 0 H VAL A 9 82.001 19.579 -6.463 1.00 1.00 H new ATOM 0 HA VAL A 9 80.001 17.720 -5.729 1.00 1.00 H new ATOM 0 HB VAL A 9 79.900 20.092 -7.599 1.00 1.00 H new ATOM 0 HG11 VAL A 9 77.448 19.924 -7.257 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.081 18.461 -8.049 1.00 1.00 H new ATOM 0 HG13 VAL A 9 77.680 18.432 -6.315 1.00 1.00 H new ATOM 0 HG21 VAL A 9 78.873 21.166 -5.604 1.00 1.00 H new ATOM 0 HG22 VAL A 9 79.101 19.664 -4.678 1.00 1.00 H new ATOM 0 HG23 VAL A 9 80.516 20.588 -5.237 1.00 1.00 H new ATOM 142 N SER A 10 80.919 17.746 -8.928 1.00 1.00 N ATOM 143 CA SER A 10 80.930 16.945 -10.147 1.00 1.00 C ATOM 144 C SER A 10 81.771 15.657 -10.025 1.00 1.00 C ATOM 145 O SER A 10 81.367 14.601 -10.514 1.00 1.00 O ATOM 146 CB SER A 10 81.485 17.790 -11.288 1.00 1.00 C ATOM 147 OG SER A 10 82.809 18.199 -10.963 1.00 1.00 O ATOM 0 H SER A 10 81.400 18.642 -9.009 1.00 1.00 H new ATOM 0 HA SER A 10 79.901 16.638 -10.337 1.00 1.00 H new ATOM 0 HB2 SER A 10 81.485 17.217 -12.215 1.00 1.00 H new ATOM 0 HB3 SER A 10 80.852 18.662 -11.453 1.00 1.00 H new ATOM 0 HG SER A 10 82.961 18.082 -10.002 1.00 1.00 H new ATOM 153 N ARG A 11 82.914 15.735 -9.339 1.00 1.00 N ATOM 154 CA ARG A 11 83.760 14.548 -9.134 1.00 1.00 C ATOM 155 C ARG A 11 83.125 13.660 -8.064 1.00 1.00 C ATOM 156 O ARG A 11 82.827 12.493 -8.275 1.00 1.00 O ATOM 157 CB ARG A 11 85.153 15.026 -8.675 1.00 1.00 C ATOM 158 CG ARG A 11 86.156 13.852 -8.645 1.00 1.00 C ATOM 159 CD ARG A 11 86.987 13.822 -9.935 1.00 1.00 C ATOM 160 NE ARG A 11 87.969 14.907 -9.924 1.00 1.00 N ATOM 161 CZ ARG A 11 89.092 14.831 -10.633 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.339 13.770 -11.351 1.00 1.00 N ATOM 163 NH2 ARG A 11 89.951 15.817 -10.612 1.00 1.00 N ATOM 0 H ARG A 11 83.274 16.592 -8.920 1.00 1.00 H new ATOM 0 HA ARG A 11 83.854 13.973 -10.055 1.00 1.00 H new ATOM 0 HB2 ARG A 11 85.516 15.802 -9.349 1.00 1.00 H new ATOM 0 HB3 ARG A 11 85.080 15.473 -7.683 1.00 1.00 H new ATOM 0 HG2 ARG A 11 86.815 13.951 -7.783 1.00 1.00 H new ATOM 0 HG3 ARG A 11 85.619 12.910 -8.529 1.00 1.00 H new ATOM 0 HD2 ARG A 11 87.495 12.862 -10.028 1.00 1.00 H new ATOM 0 HD3 ARG A 11 86.333 13.922 -10.801 1.00 1.00 H new ATOM 0 HE ARG A 11 87.789 15.738 -9.361 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.671 12.999 -11.369 1.00 1.00 H new ATOM 0 HH12 ARG A 11 90.200 13.711 -11.895 1.00 1.00 H new ATOM 0 HH21 ARG A 11 89.761 16.647 -10.051 1.00 1.00 H new ATOM 0 HH22 ARG A 11 90.811 15.756 -11.157 1.00 1.00 H new ATOM 177 N ALA A 12 83.052 14.257 -6.878 1.00 1.00 N ATOM 178 CA ALA A 12 82.562 13.512 -5.704 1.00 1.00 C ATOM 179 C ALA A 12 81.302 12.798 -6.159 1.00 1.00 C ATOM 180 O ALA A 12 81.072 11.640 -5.841 1.00 1.00 O ATOM 181 CB ALA A 12 82.260 14.392 -4.487 1.00 1.00 C ATOM 0 H ALA A 12 83.315 15.226 -6.698 1.00 1.00 H new ATOM 0 HA ALA A 12 83.341 12.829 -5.366 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.905 13.769 -3.666 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.167 14.913 -4.181 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.493 15.122 -4.747 1.00 1.00 H new ATOM 187 N VAL A 13 80.546 13.487 -6.993 1.00 1.00 N ATOM 188 CA VAL A 13 79.374 12.849 -7.553 1.00 1.00 C ATOM 189 C VAL A 13 79.838 11.613 -8.331 1.00 1.00 C ATOM 190 O VAL A 13 79.354 10.536 -8.086 1.00 1.00 O ATOM 191 CB VAL A 13 78.555 13.806 -8.447 1.00 1.00 C ATOM 192 CG1 VAL A 13 77.627 13.008 -9.382 1.00 1.00 C ATOM 193 CG2 VAL A 13 77.685 14.730 -7.565 1.00 1.00 C ATOM 0 H VAL A 13 80.713 14.449 -7.288 1.00 1.00 H new ATOM 0 HA VAL A 13 78.702 12.556 -6.746 1.00 1.00 H new ATOM 0 HB VAL A 13 79.251 14.398 -9.041 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.057 13.698 -10.005 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.225 12.355 -10.017 1.00 1.00 H new ATOM 0 HG13 VAL A 13 76.941 12.406 -8.786 1.00 1.00 H new ATOM 0 HG21 VAL A 13 77.109 15.403 -8.200 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.004 14.126 -6.966 1.00 1.00 H new ATOM 0 HG23 VAL A 13 78.327 15.314 -6.906 1.00 1.00 H new ATOM 203 N ALA A 14 80.813 11.735 -9.227 1.00 1.00 N ATOM 204 CA ALA A 14 81.259 10.539 -9.951 1.00 1.00 C ATOM 205 C ALA A 14 81.809 9.477 -8.986 1.00 1.00 C ATOM 206 O ALA A 14 81.283 8.379 -8.927 1.00 1.00 O ATOM 207 CB ALA A 14 82.354 10.921 -10.946 1.00 1.00 C ATOM 0 H ALA A 14 81.293 12.603 -9.465 1.00 1.00 H new ATOM 0 HA ALA A 14 80.399 10.122 -10.476 1.00 1.00 H new ATOM 0 HB1 ALA A 14 82.684 10.032 -11.483 1.00 1.00 H new ATOM 0 HB2 ALA A 14 81.962 11.649 -11.656 1.00 1.00 H new ATOM 0 HB3 ALA A 14 83.198 11.355 -10.410 1.00 1.00 H new ATOM 213 N ALA A 15 82.897 9.784 -8.286 1.00 1.00 N ATOM 214 CA ALA A 15 83.513 8.776 -7.396 1.00 1.00 C ATOM 215 C ALA A 15 82.462 8.199 -6.447 1.00 1.00 C ATOM 216 O ALA A 15 82.268 6.988 -6.353 1.00 1.00 O ATOM 217 CB ALA A 15 84.617 9.424 -6.554 1.00 1.00 C ATOM 0 H ALA A 15 83.366 10.689 -8.307 1.00 1.00 H new ATOM 0 HA ALA A 15 83.931 7.983 -8.016 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.065 8.674 -5.902 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.382 9.836 -7.212 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.191 10.224 -5.948 1.00 1.00 H new ATOM 223 N ALA A 16 81.824 9.104 -5.750 1.00 1.00 N ATOM 224 CA ALA A 16 80.806 8.708 -4.792 1.00 1.00 C ATOM 225 C ALA A 16 79.668 7.991 -5.548 1.00 1.00 C ATOM 226 O ALA A 16 79.251 6.892 -5.177 1.00 1.00 O ATOM 227 CB ALA A 16 80.289 9.921 -4.009 1.00 1.00 C ATOM 0 H ALA A 16 81.983 10.109 -5.821 1.00 1.00 H new ATOM 0 HA ALA A 16 81.234 8.022 -4.061 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.528 9.598 -3.299 1.00 1.00 H new ATOM 0 HB2 ALA A 16 81.115 10.385 -3.470 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.856 10.643 -4.701 1.00 1.00 H new ATOM 233 N LEU A 17 79.156 8.667 -6.569 1.00 1.00 N ATOM 234 CA LEU A 17 78.020 8.084 -7.316 1.00 1.00 C ATOM 235 C LEU A 17 78.427 6.704 -7.852 1.00 1.00 C ATOM 236 O LEU A 17 77.718 5.724 -7.627 1.00 1.00 O ATOM 237 CB LEU A 17 77.482 8.932 -8.487 1.00 1.00 C ATOM 238 CG LEU A 17 76.175 8.293 -9.050 1.00 1.00 C ATOM 239 CD1 LEU A 17 74.945 8.986 -8.444 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.129 8.440 -10.575 1.00 1.00 C ATOM 0 H LEU A 17 79.481 9.577 -6.897 1.00 1.00 H new ATOM 0 HA LEU A 17 77.203 8.030 -6.596 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.283 9.949 -8.149 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.233 8.998 -9.274 1.00 1.00 H new ATOM 0 HG LEU A 17 76.167 7.236 -8.785 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.038 8.532 -8.844 1.00 1.00 H new ATOM 0 HD12 LEU A 17 74.960 8.872 -7.360 1.00 1.00 H new ATOM 0 HD13 LEU A 17 74.963 10.046 -8.698 1.00 1.00 H new ATOM 0 HD21 LEU A 17 75.212 7.990 -10.956 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.152 9.497 -10.839 1.00 1.00 H new ATOM 0 HD23 LEU A 17 76.990 7.937 -11.015 1.00 1.00 H new ATOM 252 N VAL A 18 79.560 6.620 -8.544 1.00 1.00 N ATOM 253 CA VAL A 18 79.984 5.316 -9.058 1.00 1.00 C ATOM 254 C VAL A 18 80.382 4.425 -7.879 1.00 1.00 C ATOM 255 O VAL A 18 79.839 3.333 -7.710 1.00 1.00 O ATOM 256 CB VAL A 18 81.125 5.409 -10.104 1.00 1.00 C ATOM 257 CG1 VAL A 18 80.846 6.530 -11.146 1.00 1.00 C ATOM 258 CG2 VAL A 18 82.476 5.644 -9.415 1.00 1.00 C ATOM 0 H VAL A 18 80.180 7.401 -8.757 1.00 1.00 H new ATOM 0 HA VAL A 18 79.141 4.876 -9.591 1.00 1.00 H new ATOM 0 HB VAL A 18 81.166 4.458 -10.634 1.00 1.00 H new ATOM 0 HG11 VAL A 18 81.664 6.570 -11.865 1.00 1.00 H new ATOM 0 HG12 VAL A 18 79.913 6.317 -11.668 1.00 1.00 H new ATOM 0 HG13 VAL A 18 80.765 7.490 -10.635 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.262 5.706 -10.167 1.00 1.00 H new ATOM 0 HG22 VAL A 18 82.439 6.576 -8.851 1.00 1.00 H new ATOM 0 HG23 VAL A 18 82.687 4.817 -8.737 1.00 1.00 H new ATOM 268 N GLY A 19 81.329 4.891 -7.065 1.00 1.00 N ATOM 269 CA GLY A 19 81.782 4.123 -5.908 1.00 1.00 C ATOM 270 C GLY A 19 80.642 3.859 -4.919 1.00 1.00 C ATOM 271 O GLY A 19 79.475 4.071 -5.235 1.00 1.00 O ATOM 0 H GLY A 19 81.794 5.791 -7.185 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.200 3.174 -6.243 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.583 4.664 -5.404 1.00 1.00 H new ATOM 275 N PRO A 20 80.968 3.371 -3.747 1.00 1.00 N ATOM 276 CA PRO A 20 79.967 3.035 -2.691 1.00 1.00 C ATOM 277 C PRO A 20 79.479 4.230 -1.846 1.00 1.00 C ATOM 278 O PRO A 20 78.355 4.217 -1.372 1.00 1.00 O ATOM 279 CB PRO A 20 80.695 1.987 -1.823 1.00 1.00 C ATOM 280 CG PRO A 20 82.175 2.157 -2.088 1.00 1.00 C ATOM 281 CD PRO A 20 82.339 3.096 -3.299 1.00 1.00 C ATOM 0 HA PRO A 20 79.042 2.676 -3.142 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.471 2.136 -0.767 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.369 0.979 -2.079 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.673 2.574 -1.213 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.639 1.192 -2.289 1.00 1.00 H new ATOM 0 HD2 PRO A 20 82.856 4.014 -3.021 1.00 1.00 H new ATOM 0 HD3 PRO A 20 82.926 2.626 -4.088 1.00 1.00 H new ATOM 289 N GLY A 21 80.351 5.210 -1.613 1.00 1.00 N ATOM 290 CA GLY A 21 79.977 6.350 -0.748 1.00 1.00 C ATOM 291 C GLY A 21 78.730 7.075 -1.275 1.00 1.00 C ATOM 292 O GLY A 21 77.736 7.242 -0.568 1.00 1.00 O ATOM 0 H GLY A 21 81.296 5.248 -1.994 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.790 5.993 0.265 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.809 7.052 -0.690 1.00 1.00 H new ATOM 296 N GLY A 22 78.819 7.533 -2.502 1.00 1.00 N ATOM 297 CA GLY A 22 77.686 8.277 -3.075 1.00 1.00 C ATOM 298 C GLY A 22 76.476 7.377 -2.990 1.00 1.00 C ATOM 299 O GLY A 22 75.421 7.763 -2.490 1.00 1.00 O ATOM 0 H GLY A 22 79.626 7.418 -3.116 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.516 9.203 -2.526 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.890 8.552 -4.110 1.00 1.00 H new ATOM 303 N VAL A 23 76.654 6.168 -3.467 1.00 1.00 N ATOM 304 CA VAL A 23 75.573 5.193 -3.435 1.00 1.00 C ATOM 305 C VAL A 23 75.169 4.913 -1.987 1.00 1.00 C ATOM 306 O VAL A 23 73.999 4.673 -1.699 1.00 1.00 O ATOM 307 CB VAL A 23 75.979 3.893 -4.139 1.00 1.00 C ATOM 308 CG1 VAL A 23 74.783 2.931 -4.184 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.414 4.223 -5.565 1.00 1.00 C ATOM 0 H VAL A 23 77.524 5.832 -3.879 1.00 1.00 H new ATOM 0 HA VAL A 23 74.719 5.608 -3.970 1.00 1.00 H new ATOM 0 HB VAL A 23 76.797 3.421 -3.595 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.077 2.009 -4.685 1.00 1.00 H new ATOM 0 HG12 VAL A 23 74.460 2.705 -3.168 1.00 1.00 H new ATOM 0 HG13 VAL A 23 73.963 3.396 -4.731 1.00 1.00 H new ATOM 0 HG21 VAL A 23 76.706 3.306 -6.078 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.586 4.690 -6.099 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.261 4.909 -5.538 1.00 1.00 H new ATOM 319 N ALA A 24 76.151 4.929 -1.080 1.00 1.00 N ATOM 320 CA ALA A 24 75.830 4.651 0.311 1.00 1.00 C ATOM 321 C ALA A 24 74.770 5.638 0.794 1.00 1.00 C ATOM 322 O ALA A 24 73.688 5.214 1.203 1.00 1.00 O ATOM 323 CB ALA A 24 77.074 4.739 1.200 1.00 1.00 C ATOM 0 H ALA A 24 77.133 5.123 -1.277 1.00 1.00 H new ATOM 0 HA ALA A 24 75.445 3.634 0.379 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.799 4.526 2.233 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.813 4.012 0.864 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.496 5.742 1.137 1.00 1.00 H new ATOM 329 N LEU A 25 75.059 6.949 0.786 1.00 1.00 N ATOM 330 CA LEU A 25 74.075 7.906 1.268 1.00 1.00 C ATOM 331 C LEU A 25 72.842 7.949 0.379 1.00 1.00 C ATOM 332 O LEU A 25 71.722 8.035 0.882 1.00 1.00 O ATOM 333 CB LEU A 25 74.690 9.311 1.385 1.00 1.00 C ATOM 334 CG LEU A 25 73.716 10.278 2.126 1.00 1.00 C ATOM 335 CD1 LEU A 25 74.516 11.283 2.965 1.00 1.00 C ATOM 336 CD2 LEU A 25 72.851 11.064 1.125 1.00 1.00 C ATOM 0 H LEU A 25 75.938 7.352 0.461 1.00 1.00 H new ATOM 0 HA LEU A 25 73.762 7.572 2.257 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.636 9.256 1.924 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.911 9.701 0.391 1.00 1.00 H new ATOM 0 HG LEU A 25 73.071 9.675 2.765 1.00 1.00 H new ATOM 0 HD11 LEU A 25 73.829 11.955 3.480 1.00 1.00 H new ATOM 0 HD12 LEU A 25 75.118 10.747 3.699 1.00 1.00 H new ATOM 0 HD13 LEU A 25 75.170 11.862 2.313 1.00 1.00 H new ATOM 0 HD21 LEU A 25 72.181 11.731 1.668 1.00 1.00 H new ATOM 0 HD22 LEU A 25 73.495 11.651 0.470 1.00 1.00 H new ATOM 0 HD23 LEU A 25 72.263 10.368 0.527 1.00 1.00 H new ATOM 348 N VAL A 26 73.021 7.930 -0.943 1.00 1.00 N ATOM 349 CA VAL A 26 71.850 8.015 -1.803 1.00 1.00 C ATOM 350 C VAL A 26 70.913 6.843 -1.507 1.00 1.00 C ATOM 351 O VAL A 26 69.745 7.055 -1.182 1.00 1.00 O ATOM 352 CB VAL A 26 72.279 7.997 -3.280 1.00 1.00 C ATOM 353 CG1 VAL A 26 71.050 7.860 -4.181 1.00 1.00 C ATOM 354 CG2 VAL A 26 73.005 9.301 -3.624 1.00 1.00 C ATOM 0 H VAL A 26 73.920 7.860 -1.419 1.00 1.00 H new ATOM 0 HA VAL A 26 71.324 8.949 -1.607 1.00 1.00 H new ATOM 0 HB VAL A 26 72.945 7.149 -3.441 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.364 7.848 -5.225 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.530 6.931 -3.948 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.380 8.703 -4.013 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.307 9.284 -4.671 1.00 1.00 H new ATOM 0 HG22 VAL A 26 72.337 10.145 -3.453 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.888 9.403 -2.993 1.00 1.00 H new ATOM 364 N VAL A 27 71.398 5.612 -1.659 1.00 1.00 N ATOM 365 CA VAL A 27 70.554 4.430 -1.445 1.00 1.00 C ATOM 366 C VAL A 27 70.056 4.305 -0.002 1.00 1.00 C ATOM 367 O VAL A 27 68.937 3.863 0.231 1.00 1.00 O ATOM 368 CB VAL A 27 71.336 3.153 -1.842 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.234 2.682 -0.682 1.00 1.00 C ATOM 370 CG2 VAL A 27 70.351 2.031 -2.205 1.00 1.00 C ATOM 0 H VAL A 27 72.360 5.404 -1.927 1.00 1.00 H new ATOM 0 HA VAL A 27 69.673 4.548 -2.076 1.00 1.00 H new ATOM 0 HB VAL A 27 71.963 3.389 -2.702 1.00 1.00 H new ATOM 0 HG11 VAL A 27 72.774 1.784 -0.982 1.00 1.00 H new ATOM 0 HG12 VAL A 27 72.947 3.468 -0.431 1.00 1.00 H new ATOM 0 HG13 VAL A 27 71.617 2.461 0.189 1.00 1.00 H new ATOM 0 HG21 VAL A 27 70.906 1.135 -2.483 1.00 1.00 H new ATOM 0 HG22 VAL A 27 69.716 1.812 -1.346 1.00 1.00 H new ATOM 0 HG23 VAL A 27 69.731 2.348 -3.043 1.00 1.00 H new ATOM 380 N LYS A 28 70.896 4.672 0.953 1.00 1.00 N ATOM 381 CA LYS A 28 70.505 4.553 2.353 1.00 1.00 C ATOM 382 C LYS A 28 69.339 5.497 2.605 1.00 1.00 C ATOM 383 O LYS A 28 68.295 5.107 3.126 1.00 1.00 O ATOM 384 CB LYS A 28 71.718 4.875 3.240 1.00 1.00 C ATOM 385 CG LYS A 28 71.382 4.738 4.728 1.00 1.00 C ATOM 386 CD LYS A 28 72.690 4.860 5.532 1.00 1.00 C ATOM 387 CE LYS A 28 72.435 4.728 7.047 1.00 1.00 C ATOM 388 NZ LYS A 28 72.538 6.079 7.676 1.00 1.00 N ATOM 0 H LYS A 28 71.831 5.046 0.794 1.00 1.00 H new ATOM 0 HA LYS A 28 70.182 3.540 2.594 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.541 4.205 2.989 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.060 5.890 3.036 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.677 5.512 5.031 1.00 1.00 H new ATOM 0 HG3 LYS A 28 70.905 3.778 4.923 1.00 1.00 H new ATOM 0 HD2 LYS A 28 73.389 4.088 5.211 1.00 1.00 H new ATOM 0 HD3 LYS A 28 73.159 5.822 5.323 1.00 1.00 H new ATOM 0 HE2 LYS A 28 71.448 4.303 7.227 1.00 1.00 H new ATOM 0 HE3 LYS A 28 73.161 4.048 7.493 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 72.367 6.000 8.699 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 73.489 6.466 7.513 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 71.829 6.713 7.255 1.00 1.00 H new ATOM 402 N VAL A 29 69.557 6.744 2.242 1.00 1.00 N ATOM 403 CA VAL A 29 68.533 7.767 2.449 1.00 1.00 C ATOM 404 C VAL A 29 67.265 7.390 1.698 1.00 1.00 C ATOM 405 O VAL A 29 66.166 7.500 2.241 1.00 1.00 O ATOM 406 CB VAL A 29 69.007 9.153 2.006 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.833 10.145 2.085 1.00 1.00 C ATOM 408 CG2 VAL A 29 70.119 9.623 2.942 1.00 1.00 C ATOM 0 H VAL A 29 70.418 7.078 1.808 1.00 1.00 H new ATOM 0 HA VAL A 29 68.329 7.815 3.519 1.00 1.00 H new ATOM 0 HB VAL A 29 69.377 9.103 0.982 1.00 1.00 H new ATOM 0 HG11 VAL A 29 68.169 11.133 1.770 1.00 1.00 H new ATOM 0 HG12 VAL A 29 67.029 9.810 1.430 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.468 10.196 3.111 1.00 1.00 H new ATOM 0 HG21 VAL A 29 70.462 10.610 2.633 1.00 1.00 H new ATOM 0 HG22 VAL A 29 69.738 9.674 3.962 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.951 8.920 2.900 1.00 1.00 H new ATOM 418 N CYS A 30 67.409 6.952 0.452 1.00 1.00 N ATOM 419 CA CYS A 30 66.216 6.587 -0.296 1.00 1.00 C ATOM 420 C CYS A 30 65.546 5.378 0.381 1.00 1.00 C ATOM 421 O CYS A 30 64.357 5.426 0.694 1.00 1.00 O ATOM 422 CB CYS A 30 66.535 6.328 -1.801 1.00 1.00 C ATOM 423 SG CYS A 30 66.887 4.582 -2.150 1.00 1.00 S ATOM 0 H CYS A 30 68.295 6.845 -0.041 1.00 1.00 H new ATOM 0 HA CYS A 30 65.514 7.421 -0.283 1.00 1.00 H new ATOM 0 HB2 CYS A 30 65.690 6.653 -2.409 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.392 6.934 -2.096 1.00 1.00 H new ATOM 0 HG CYS A 30 67.142 4.435 -3.416 1.00 1.00 H new ATOM 428 N ALA A 31 66.273 4.278 0.535 1.00 1.00 N ATOM 429 CA ALA A 31 65.719 3.036 1.087 1.00 1.00 C ATOM 430 C ALA A 31 65.250 3.092 2.534 1.00 1.00 C ATOM 431 O ALA A 31 64.122 2.705 2.841 1.00 1.00 O ATOM 432 CB ALA A 31 66.811 1.967 1.015 1.00 1.00 C ATOM 0 H ALA A 31 67.260 4.216 0.284 1.00 1.00 H new ATOM 0 HA ALA A 31 64.832 2.827 0.489 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.429 1.029 1.419 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.109 1.820 -0.023 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.674 2.289 1.598 1.00 1.00 H new ATOM 438 N GLY A 32 66.137 3.481 3.428 1.00 1.00 N ATOM 439 CA GLY A 32 65.803 3.470 4.838 1.00 1.00 C ATOM 440 C GLY A 32 65.980 2.041 5.375 1.00 1.00 C ATOM 441 O GLY A 32 64.996 1.338 5.595 1.00 1.00 O ATOM 0 H GLY A 32 67.079 3.804 3.209 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.445 4.161 5.384 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.776 3.805 4.986 1.00 1.00 H new ATOM 445 N LEU A 33 67.259 1.639 5.525 1.00 1.00 N ATOM 446 CA LEU A 33 67.672 0.293 6.000 1.00 1.00 C ATOM 447 C LEU A 33 67.633 -0.752 4.863 1.00 1.00 C ATOM 448 O LEU A 33 66.559 -1.131 4.431 1.00 1.00 O ATOM 449 CB LEU A 33 66.800 -0.214 7.175 1.00 1.00 C ATOM 450 CG LEU A 33 67.157 0.546 8.471 1.00 1.00 C ATOM 451 CD1 LEU A 33 65.955 0.557 9.418 1.00 1.00 C ATOM 452 CD2 LEU A 33 68.343 -0.129 9.180 1.00 1.00 C ATOM 0 H LEU A 33 68.051 2.248 5.317 1.00 1.00 H new ATOM 0 HA LEU A 33 68.697 0.409 6.351 1.00 1.00 H new ATOM 0 HB2 LEU A 33 65.745 -0.073 6.941 1.00 1.00 H new ATOM 0 HB3 LEU A 33 66.955 -1.283 7.317 1.00 1.00 H new ATOM 0 HG LEU A 33 67.428 1.568 8.205 1.00 1.00 H new ATOM 0 HD11 LEU A 33 66.215 1.095 10.330 1.00 1.00 H new ATOM 0 HD12 LEU A 33 65.114 1.051 8.932 1.00 1.00 H new ATOM 0 HD13 LEU A 33 65.679 -0.468 9.667 1.00 1.00 H new ATOM 0 HD21 LEU A 33 68.582 0.419 10.091 1.00 1.00 H new ATOM 0 HD22 LEU A 33 68.079 -1.156 9.433 1.00 1.00 H new ATOM 0 HD23 LEU A 33 69.210 -0.129 8.519 1.00 1.00 H new ATOM 464 N PRO A 34 68.766 -1.250 4.381 1.00 1.00 N ATOM 465 CA PRO A 34 68.790 -2.298 3.298 1.00 1.00 C ATOM 466 C PRO A 34 67.961 -3.543 3.639 1.00 1.00 C ATOM 467 O PRO A 34 67.695 -4.383 2.780 1.00 1.00 O ATOM 468 CB PRO A 34 70.280 -2.661 3.166 1.00 1.00 C ATOM 469 CG PRO A 34 71.020 -1.471 3.680 1.00 1.00 C ATOM 470 CD PRO A 34 70.142 -0.866 4.777 1.00 1.00 C ATOM 0 HA PRO A 34 68.347 -1.919 2.377 1.00 1.00 H new ATOM 0 HB2 PRO A 34 70.520 -3.554 3.743 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.544 -2.871 2.129 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.994 -1.759 4.075 1.00 1.00 H new ATOM 0 HG3 PRO A 34 71.200 -0.750 2.883 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.400 -1.261 5.759 1.00 1.00 H new ATOM 0 HD3 PRO A 34 70.256 0.217 4.829 1.00 1.00 H new ATOM 478 N GLY A 35 67.602 -3.664 4.902 1.00 1.00 N ATOM 479 CA GLY A 35 66.839 -4.840 5.316 1.00 1.00 C ATOM 480 C GLY A 35 65.560 -4.945 4.476 1.00 1.00 C ATOM 481 O GLY A 35 65.285 -5.979 3.868 1.00 1.00 O ATOM 0 H GLY A 35 67.813 -2.993 5.641 1.00 1.00 H new ATOM 0 HA2 GLY A 35 67.442 -5.739 5.192 1.00 1.00 H new ATOM 0 HA3 GLY A 35 66.587 -4.768 6.374 1.00 1.00 H new ATOM 485 N VAL A 36 64.772 -3.880 4.497 1.00 1.00 N ATOM 486 CA VAL A 36 63.491 -3.873 3.778 1.00 1.00 C ATOM 487 C VAL A 36 63.661 -3.855 2.250 1.00 1.00 C ATOM 488 O VAL A 36 63.333 -4.840 1.590 1.00 1.00 O ATOM 489 CB VAL A 36 62.619 -2.691 4.247 1.00 1.00 C ATOM 490 CG1 VAL A 36 63.371 -1.350 4.101 1.00 1.00 C ATOM 491 CG2 VAL A 36 61.321 -2.658 3.422 1.00 1.00 C ATOM 0 H VAL A 36 64.986 -3.016 4.995 1.00 1.00 H new ATOM 0 HA VAL A 36 62.987 -4.808 4.020 1.00 1.00 H new ATOM 0 HB VAL A 36 62.383 -2.830 5.302 1.00 1.00 H new ATOM 0 HG11 VAL A 36 62.731 -0.535 4.439 1.00 1.00 H new ATOM 0 HG12 VAL A 36 64.278 -1.374 4.705 1.00 1.00 H new ATOM 0 HG13 VAL A 36 63.636 -1.193 3.055 1.00 1.00 H new ATOM 0 HG21 VAL A 36 60.702 -1.823 3.751 1.00 1.00 H new ATOM 0 HG22 VAL A 36 61.564 -2.536 2.366 1.00 1.00 H new ATOM 0 HG23 VAL A 36 60.776 -3.592 3.563 1.00 1.00 H new ATOM 501 N ILE A 37 64.132 -2.723 1.705 1.00 1.00 N ATOM 502 CA ILE A 37 64.311 -2.538 0.241 1.00 1.00 C ATOM 503 C ILE A 37 63.704 -3.653 -0.605 1.00 1.00 C ATOM 504 O ILE A 37 64.459 -4.382 -1.246 1.00 1.00 O ATOM 505 CB ILE A 37 65.824 -2.456 -0.145 1.00 1.00 C ATOM 506 CG1 ILE A 37 66.410 -1.176 0.425 1.00 1.00 C ATOM 507 CG2 ILE A 37 66.029 -2.471 -1.706 1.00 1.00 C ATOM 508 CD1 ILE A 37 67.890 -1.047 0.021 1.00 1.00 C ATOM 0 H ILE A 37 64.401 -1.908 2.257 1.00 1.00 H new ATOM 0 HA ILE A 37 63.789 -1.605 0.028 1.00 1.00 H new ATOM 0 HB ILE A 37 66.329 -3.329 0.268 1.00 1.00 H new ATOM 0 HG12 ILE A 37 65.849 -0.316 0.060 1.00 1.00 H new ATOM 0 HG13 ILE A 37 66.320 -1.178 1.511 1.00 1.00 H new ATOM 0 HG21 ILE A 37 67.093 -2.413 -1.934 1.00 1.00 H new ATOM 0 HG22 ILE A 37 65.620 -3.394 -2.118 1.00 1.00 H new ATOM 0 HG23 ILE A 37 65.516 -1.617 -2.149 1.00 1.00 H new ATOM 0 HD11 ILE A 37 68.301 -0.126 0.434 1.00 1.00 H new ATOM 0 HD12 ILE A 37 68.448 -1.899 0.408 1.00 1.00 H new ATOM 0 HD13 ILE A 37 67.970 -1.024 -1.066 1.00 1.00 H new ATOM 520 N HIS A 38 62.384 -3.840 -0.694 1.00 1.00 N ATOM 521 CA HIS A 38 61.852 -4.877 -1.552 1.00 1.00 C ATOM 522 C HIS A 38 60.740 -4.228 -2.379 1.00 1.00 C ATOM 523 O HIS A 38 59.762 -3.729 -1.830 1.00 1.00 O ATOM 524 CB HIS A 38 61.229 -5.965 -0.668 1.00 1.00 C ATOM 525 CG HIS A 38 60.192 -5.361 0.283 1.00 1.00 C ATOM 526 ND1 HIS A 38 59.267 -6.160 0.943 1.00 1.00 N ATOM 527 CD2 HIS A 38 59.912 -4.065 0.707 1.00 1.00 C ATOM 528 CE1 HIS A 38 58.497 -5.359 1.710 1.00 1.00 C ATOM 529 NE2 HIS A 38 58.850 -4.079 1.602 1.00 1.00 N ATOM 0 H HIS A 38 61.685 -3.294 -0.190 1.00 1.00 H new ATOM 0 HA HIS A 38 62.624 -5.312 -2.186 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.758 -6.723 -1.293 1.00 1.00 H new ATOM 0 HB3 HIS A 38 62.009 -6.465 -0.094 1.00 1.00 H new ATOM 0 HD2 HIS A 38 60.442 -3.180 0.387 1.00 1.00 H new ATOM 0 HE1 HIS A 38 57.691 -5.713 2.336 1.00 1.00 H new ATOM 0 HE2 HIS A 38 58.430 -3.279 2.076 1.00 1.00 H new ATOM 537 N THR A 39 60.894 -4.210 -3.693 1.00 1.00 N ATOM 538 CA THR A 39 59.885 -3.580 -4.552 1.00 1.00 C ATOM 539 C THR A 39 58.993 -4.644 -5.202 1.00 1.00 C ATOM 540 O THR A 39 59.505 -5.524 -5.891 1.00 1.00 O ATOM 541 CB THR A 39 60.575 -2.758 -5.641 1.00 1.00 C ATOM 542 OG1 THR A 39 61.677 -2.051 -5.080 1.00 1.00 O ATOM 543 CG2 THR A 39 59.578 -1.765 -6.249 1.00 1.00 C ATOM 0 H THR A 39 61.689 -4.614 -4.188 1.00 1.00 H new ATOM 0 HA THR A 39 59.264 -2.927 -3.938 1.00 1.00 H new ATOM 0 HB THR A 39 60.936 -3.426 -6.423 1.00 1.00 H new ATOM 0 HG1 THR A 39 62.119 -1.526 -5.780 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.073 -1.181 -7.025 1.00 1.00 H new ATOM 0 HG22 THR A 39 58.741 -2.311 -6.684 1.00 1.00 H new ATOM 0 HG23 THR A 39 59.210 -1.096 -5.471 1.00 1.00 H new ATOM 551 N PRO A 40 57.686 -4.600 -5.016 1.00 1.00 N ATOM 552 CA PRO A 40 56.785 -5.615 -5.633 1.00 1.00 C ATOM 553 C PRO A 40 57.058 -5.823 -7.122 1.00 1.00 C ATOM 554 O PRO A 40 57.002 -6.950 -7.615 1.00 1.00 O ATOM 555 CB PRO A 40 55.372 -5.033 -5.421 1.00 1.00 C ATOM 556 CG PRO A 40 55.483 -4.148 -4.221 1.00 1.00 C ATOM 557 CD PRO A 40 56.923 -3.617 -4.203 1.00 1.00 C ATOM 0 HA PRO A 40 56.927 -6.597 -5.182 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.044 -4.470 -6.295 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.641 -5.825 -5.259 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.768 -3.327 -4.277 1.00 1.00 H new ATOM 0 HG3 PRO A 40 55.262 -4.702 -3.309 1.00 1.00 H new ATOM 0 HD2 PRO A 40 56.983 -2.616 -4.629 1.00 1.00 H new ATOM 0 HD3 PRO A 40 57.311 -3.554 -3.186 1.00 1.00 H new ATOM 565 N ALA A 41 57.381 -4.743 -7.839 1.00 1.00 N ATOM 566 CA ALA A 41 57.697 -4.821 -9.269 1.00 1.00 C ATOM 567 C ALA A 41 59.070 -4.208 -9.530 1.00 1.00 C ATOM 568 O ALA A 41 59.331 -3.088 -9.090 1.00 1.00 O ATOM 569 CB ALA A 41 56.643 -4.063 -10.081 1.00 1.00 C ATOM 0 H ALA A 41 57.431 -3.801 -7.451 1.00 1.00 H new ATOM 0 HA ALA A 41 57.702 -5.868 -9.571 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.886 -4.126 -11.142 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.662 -4.505 -9.906 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.630 -3.017 -9.774 1.00 1.00 H new ATOM 575 N ARG A 42 59.939 -4.890 -10.256 1.00 1.00 N ATOM 576 CA ARG A 42 61.240 -4.309 -10.554 1.00 1.00 C ATOM 577 C ARG A 42 61.957 -5.120 -11.623 1.00 1.00 C ATOM 578 O ARG A 42 61.578 -6.253 -11.920 1.00 1.00 O ATOM 579 CB ARG A 42 62.101 -4.197 -9.283 1.00 1.00 C ATOM 580 CG ARG A 42 62.368 -5.581 -8.683 1.00 1.00 C ATOM 581 CD ARG A 42 63.206 -5.434 -7.408 1.00 1.00 C ATOM 582 NE ARG A 42 63.640 -6.744 -6.944 1.00 1.00 N ATOM 583 CZ ARG A 42 62.779 -7.612 -6.427 1.00 1.00 C ATOM 584 NH1 ARG A 42 61.510 -7.313 -6.357 1.00 1.00 N ATOM 585 NH2 ARG A 42 63.203 -8.769 -6.002 1.00 1.00 N ATOM 0 H ARG A 42 59.777 -5.820 -10.641 1.00 1.00 H new ATOM 0 HA ARG A 42 61.080 -3.302 -10.938 1.00 1.00 H new ATOM 0 HB2 ARG A 42 63.047 -3.710 -9.521 1.00 1.00 H new ATOM 0 HB3 ARG A 42 61.595 -3.569 -8.550 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.425 -6.078 -8.456 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.892 -6.207 -9.405 1.00 1.00 H new ATOM 0 HD2 ARG A 42 64.073 -4.803 -7.603 1.00 1.00 H new ATOM 0 HD3 ARG A 42 62.620 -4.940 -6.633 1.00 1.00 H new ATOM 0 HE ARG A 42 64.625 -7.000 -7.018 1.00 1.00 H new ATOM 0 HH11 ARG A 42 61.179 -6.411 -6.700 1.00 1.00 H new ATOM 0 HH12 ARG A 42 60.850 -7.981 -5.959 1.00 1.00 H new ATOM 0 HH21 ARG A 42 64.193 -9.005 -6.067 1.00 1.00 H new ATOM 0 HH22 ARG A 42 62.545 -9.439 -5.604 1.00 1.00 H new ATOM 599 N ARG A 43 63.004 -4.536 -12.188 1.00 1.00 N ATOM 600 CA ARG A 43 63.777 -5.230 -13.214 1.00 1.00 C ATOM 601 C ARG A 43 64.460 -6.440 -12.581 1.00 1.00 C ATOM 602 O ARG A 43 65.401 -7.001 -13.126 1.00 1.00 O ATOM 603 CB ARG A 43 64.850 -4.314 -13.820 1.00 1.00 C ATOM 604 CG ARG A 43 65.349 -4.921 -15.144 1.00 1.00 C ATOM 605 CD ARG A 43 66.520 -4.118 -15.712 1.00 1.00 C ATOM 606 NE ARG A 43 67.326 -5.000 -16.553 1.00 1.00 N ATOM 607 CZ ARG A 43 68.090 -4.532 -17.531 1.00 1.00 C ATOM 608 NH1 ARG A 43 68.094 -3.258 -17.809 1.00 1.00 N ATOM 609 NH2 ARG A 43 68.829 -5.357 -18.223 1.00 1.00 N ATOM 0 H ARG A 43 63.336 -3.599 -11.960 1.00 1.00 H new ATOM 0 HA ARG A 43 63.098 -5.538 -14.009 1.00 1.00 H new ATOM 0 HB2 ARG A 43 64.439 -3.320 -13.995 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.681 -4.198 -13.124 1.00 1.00 H new ATOM 0 HG2 ARG A 43 65.658 -5.954 -14.981 1.00 1.00 H new ATOM 0 HG3 ARG A 43 64.534 -4.943 -15.868 1.00 1.00 H new ATOM 0 HD2 ARG A 43 66.152 -3.273 -16.294 1.00 1.00 H new ATOM 0 HD3 ARG A 43 67.126 -3.709 -14.903 1.00 1.00 H new ATOM 0 HE ARG A 43 67.300 -6.005 -16.383 1.00 1.00 H new ATOM 0 HH11 ARG A 43 67.508 -2.617 -17.274 1.00 1.00 H new ATOM 0 HH12 ARG A 43 68.683 -2.902 -18.562 1.00 1.00 H new ATOM 0 HH21 ARG A 43 68.816 -6.354 -18.010 1.00 1.00 H new ATOM 0 HH22 ARG A 43 69.419 -5.004 -18.977 1.00 1.00 H new ATOM 623 N GLY A 44 63.978 -6.849 -11.420 1.00 1.00 N ATOM 624 CA GLY A 44 64.549 -7.985 -10.730 1.00 1.00 C ATOM 625 C GLY A 44 65.773 -7.572 -9.928 1.00 1.00 C ATOM 626 O GLY A 44 66.143 -8.245 -8.968 1.00 1.00 O ATOM 0 H GLY A 44 63.193 -6.410 -10.939 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.805 -8.424 -10.066 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.824 -8.754 -11.452 1.00 1.00 H new ATOM 630 N PHE A 45 66.425 -6.477 -10.336 1.00 1.00 N ATOM 631 CA PHE A 45 67.632 -6.015 -9.648 1.00 1.00 C ATOM 632 C PHE A 45 67.944 -4.548 -10.044 1.00 1.00 C ATOM 633 O PHE A 45 67.443 -4.069 -11.054 1.00 1.00 O ATOM 634 CB PHE A 45 68.842 -6.943 -10.000 1.00 1.00 C ATOM 635 CG PHE A 45 68.366 -8.206 -10.705 1.00 1.00 C ATOM 636 CD1 PHE A 45 67.721 -8.109 -11.944 1.00 1.00 C ATOM 637 CD2 PHE A 45 68.554 -9.465 -10.115 1.00 1.00 C ATOM 638 CE1 PHE A 45 67.263 -9.264 -12.592 1.00 1.00 C ATOM 639 CE2 PHE A 45 68.098 -10.619 -10.766 1.00 1.00 C ATOM 640 CZ PHE A 45 67.450 -10.519 -12.003 1.00 1.00 C ATOM 0 H PHE A 45 66.140 -5.902 -11.129 1.00 1.00 H new ATOM 0 HA PHE A 45 67.462 -6.057 -8.572 1.00 1.00 H new ATOM 0 HB2 PHE A 45 69.544 -6.407 -10.639 1.00 1.00 H new ATOM 0 HB3 PHE A 45 69.379 -7.209 -9.090 1.00 1.00 H new ATOM 0 HD1 PHE A 45 67.576 -7.141 -12.401 1.00 1.00 H new ATOM 0 HD2 PHE A 45 69.050 -9.545 -9.159 1.00 1.00 H new ATOM 0 HE1 PHE A 45 66.765 -9.185 -13.547 1.00 1.00 H new ATOM 0 HE2 PHE A 45 68.247 -11.588 -10.312 1.00 1.00 H new ATOM 0 HZ PHE A 45 67.095 -11.409 -12.501 1.00 1.00 H new ATOM 650 N PHE A 46 68.819 -3.911 -9.234 1.00 1.00 N ATOM 651 CA PHE A 46 69.323 -2.507 -9.433 1.00 1.00 C ATOM 652 C PHE A 46 69.519 -1.773 -8.097 1.00 1.00 C ATOM 653 O PHE A 46 69.839 -0.582 -8.097 1.00 1.00 O ATOM 654 CB PHE A 46 68.396 -1.605 -10.329 1.00 1.00 C ATOM 655 CG PHE A 46 69.029 -1.331 -11.700 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.351 -2.382 -12.577 1.00 1.00 C ATOM 657 CD2 PHE A 46 69.278 -0.002 -12.098 1.00 1.00 C ATOM 658 CE1 PHE A 46 69.916 -2.107 -13.831 1.00 1.00 C ATOM 659 CE2 PHE A 46 69.846 0.265 -13.351 1.00 1.00 C ATOM 660 CZ PHE A 46 70.162 -0.787 -14.217 1.00 1.00 C ATOM 0 H PHE A 46 69.210 -4.355 -8.404 1.00 1.00 H new ATOM 0 HA PHE A 46 70.273 -2.648 -9.948 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.432 -2.095 -10.464 1.00 1.00 H new ATOM 0 HB3 PHE A 46 68.205 -0.660 -9.820 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.163 -3.404 -12.284 1.00 1.00 H new ATOM 0 HD2 PHE A 46 69.030 0.814 -11.435 1.00 1.00 H new ATOM 0 HE1 PHE A 46 70.162 -2.918 -14.500 1.00 1.00 H new ATOM 0 HE2 PHE A 46 70.040 1.285 -13.649 1.00 1.00 H new ATOM 0 HZ PHE A 46 70.596 -0.579 -15.184 1.00 1.00 H new ATOM 670 N ARG A 47 69.319 -2.457 -6.977 1.00 1.00 N ATOM 671 CA ARG A 47 69.469 -1.821 -5.658 1.00 1.00 C ATOM 672 C ARG A 47 70.594 -2.488 -4.878 1.00 1.00 C ATOM 673 O ARG A 47 71.551 -2.971 -5.483 1.00 1.00 O ATOM 674 CB ARG A 47 68.134 -1.915 -4.893 1.00 1.00 C ATOM 675 CG ARG A 47 66.960 -1.773 -5.893 1.00 1.00 C ATOM 676 CD ARG A 47 66.606 -3.143 -6.522 1.00 1.00 C ATOM 677 NE ARG A 47 66.351 -2.999 -7.955 1.00 1.00 N ATOM 678 CZ ARG A 47 65.263 -2.384 -8.409 1.00 1.00 C ATOM 679 NH1 ARG A 47 64.428 -1.830 -7.576 1.00 1.00 N ATOM 680 NH2 ARG A 47 65.037 -2.326 -9.695 1.00 1.00 N ATOM 0 H ARG A 47 69.055 -3.442 -6.946 1.00 1.00 H new ATOM 0 HA ARG A 47 69.728 -0.770 -5.785 1.00 1.00 H new ATOM 0 HB2 ARG A 47 68.068 -2.869 -4.370 1.00 1.00 H new ATOM 0 HB3 ARG A 47 68.079 -1.132 -4.137 1.00 1.00 H new ATOM 0 HG2 ARG A 47 66.088 -1.366 -5.382 1.00 1.00 H new ATOM 0 HG3 ARG A 47 67.228 -1.066 -6.678 1.00 1.00 H new ATOM 0 HD2 ARG A 47 67.424 -3.846 -6.361 1.00 1.00 H new ATOM 0 HD3 ARG A 47 65.727 -3.559 -6.030 1.00 1.00 H new ATOM 0 HE ARG A 47 67.023 -3.379 -8.621 1.00 1.00 H new ATOM 0 HH11 ARG A 47 64.608 -1.867 -6.573 1.00 1.00 H new ATOM 0 HH12 ARG A 47 63.594 -1.359 -7.927 1.00 1.00 H new ATOM 0 HH21 ARG A 47 65.695 -2.752 -10.348 1.00 1.00 H new ATOM 0 HH22 ARG A 47 64.203 -1.855 -10.046 1.00 1.00 H new ATOM 694 N CYS A 48 70.459 -2.498 -3.541 1.00 1.00 N ATOM 695 CA CYS A 48 71.466 -3.111 -2.640 1.00 1.00 C ATOM 696 C CYS A 48 72.409 -4.014 -3.430 1.00 1.00 C ATOM 697 O CYS A 48 72.086 -5.177 -3.670 1.00 1.00 O ATOM 698 CB CYS A 48 70.757 -3.959 -1.572 1.00 1.00 C ATOM 699 SG CYS A 48 69.749 -5.233 -2.386 1.00 1.00 S ATOM 0 H CYS A 48 69.662 -2.089 -3.053 1.00 1.00 H new ATOM 0 HA CYS A 48 72.038 -2.311 -2.169 1.00 1.00 H new ATOM 0 HB2 CYS A 48 71.491 -4.425 -0.915 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.127 -3.325 -0.947 1.00 1.00 H new ATOM 0 HG CYS A 48 70.479 -5.880 -3.246 1.00 1.00 H new ATOM 704 N ASN A 49 73.562 -3.496 -3.874 1.00 1.00 N ATOM 705 CA ASN A 49 74.498 -4.290 -4.674 1.00 1.00 C ATOM 706 C ASN A 49 75.868 -4.299 -3.969 1.00 1.00 C ATOM 707 O ASN A 49 76.278 -3.274 -3.420 1.00 1.00 O ATOM 708 CB ASN A 49 74.585 -3.635 -6.086 1.00 1.00 C ATOM 709 CG ASN A 49 76.026 -3.482 -6.587 1.00 1.00 C ATOM 710 OD1 ASN A 49 76.610 -4.434 -7.101 1.00 1.00 O ATOM 711 ND2 ASN A 49 76.629 -2.326 -6.477 1.00 1.00 N ATOM 0 H ASN A 49 73.865 -2.539 -3.694 1.00 1.00 H new ATOM 0 HA ASN A 49 74.167 -5.323 -4.780 1.00 1.00 H new ATOM 0 HB2 ASN A 49 74.021 -4.240 -6.796 1.00 1.00 H new ATOM 0 HB3 ASN A 49 74.111 -2.654 -6.055 1.00 1.00 H new ATOM 0 HD21 ASN A 49 77.584 -2.214 -6.818 1.00 1.00 H new ATOM 0 HD22 ASN A 49 76.144 -1.536 -6.051 1.00 1.00 H new ATOM 718 N PRO A 50 76.578 -5.405 -3.958 1.00 1.00 N ATOM 719 CA PRO A 50 77.910 -5.473 -3.288 1.00 1.00 C ATOM 720 C PRO A 50 78.992 -4.735 -4.083 1.00 1.00 C ATOM 721 O PRO A 50 79.984 -5.329 -4.495 1.00 1.00 O ATOM 722 CB PRO A 50 78.192 -6.979 -3.195 1.00 1.00 C ATOM 723 CG PRO A 50 77.447 -7.581 -4.346 1.00 1.00 C ATOM 724 CD PRO A 50 76.210 -6.700 -4.566 1.00 1.00 C ATOM 0 HA PRO A 50 77.913 -4.985 -2.313 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.260 -7.186 -3.264 1.00 1.00 H new ATOM 0 HB3 PRO A 50 77.848 -7.388 -2.245 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.069 -7.608 -5.241 1.00 1.00 H new ATOM 0 HG3 PRO A 50 77.158 -8.609 -4.127 1.00 1.00 H new ATOM 0 HD2 PRO A 50 75.981 -6.592 -5.626 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.327 -7.127 -4.091 1.00 1.00 H new ATOM 732 N GLU A 51 78.776 -3.433 -4.283 1.00 1.00 N ATOM 733 CA GLU A 51 79.715 -2.575 -5.017 1.00 1.00 C ATOM 734 C GLU A 51 79.777 -2.931 -6.502 1.00 1.00 C ATOM 735 O GLU A 51 80.122 -2.084 -7.330 1.00 1.00 O ATOM 736 CB GLU A 51 81.129 -2.655 -4.421 1.00 1.00 C ATOM 737 CG GLU A 51 81.097 -2.245 -2.943 1.00 1.00 C ATOM 738 CD GLU A 51 80.612 -3.412 -2.088 1.00 1.00 C ATOM 739 OE1 GLU A 51 80.982 -4.535 -2.386 1.00 1.00 O ATOM 740 OE2 GLU A 51 79.878 -3.164 -1.145 1.00 1.00 O ATOM 0 H GLU A 51 77.949 -2.943 -3.943 1.00 1.00 H new ATOM 0 HA GLU A 51 79.339 -1.557 -4.919 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.517 -3.669 -4.518 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.804 -2.002 -4.974 1.00 1.00 H new ATOM 0 HG2 GLU A 51 82.092 -1.936 -2.621 1.00 1.00 H new ATOM 0 HG3 GLU A 51 80.438 -1.387 -2.809 1.00 1.00 H new ATOM 747 N ARG A 52 79.446 -4.173 -6.847 1.00 1.00 N ATOM 748 CA ARG A 52 79.484 -4.584 -8.250 1.00 1.00 C ATOM 749 C ARG A 52 78.549 -3.709 -9.066 1.00 1.00 C ATOM 750 O ARG A 52 77.843 -2.865 -8.515 1.00 1.00 O ATOM 751 CB ARG A 52 79.058 -6.041 -8.406 1.00 1.00 C ATOM 752 CG ARG A 52 79.869 -6.931 -7.464 1.00 1.00 C ATOM 753 CD ARG A 52 81.348 -6.913 -7.854 1.00 1.00 C ATOM 754 NE ARG A 52 82.036 -8.021 -7.205 1.00 1.00 N ATOM 755 CZ ARG A 52 82.206 -8.047 -5.889 1.00 1.00 C ATOM 756 NH1 ARG A 52 81.770 -7.061 -5.152 1.00 1.00 N ATOM 757 NH2 ARG A 52 82.811 -9.059 -5.334 1.00 1.00 N ATOM 0 H ARG A 52 79.155 -4.899 -6.192 1.00 1.00 H new ATOM 0 HA ARG A 52 80.509 -4.476 -8.606 1.00 1.00 H new ATOM 0 HB2 ARG A 52 77.995 -6.142 -8.188 1.00 1.00 H new ATOM 0 HB3 ARG A 52 79.204 -6.362 -9.437 1.00 1.00 H new ATOM 0 HG2 ARG A 52 79.753 -6.585 -6.437 1.00 1.00 H new ATOM 0 HG3 ARG A 52 79.489 -7.952 -7.501 1.00 1.00 H new ATOM 0 HD2 ARG A 52 81.450 -6.992 -8.936 1.00 1.00 H new ATOM 0 HD3 ARG A 52 81.801 -5.967 -7.559 1.00 1.00 H new ATOM 0 HE ARG A 52 82.393 -8.790 -7.772 1.00 1.00 H new ATOM 0 HH11 ARG A 52 81.298 -6.269 -5.588 1.00 1.00 H new ATOM 0 HH12 ARG A 52 81.902 -7.083 -4.141 1.00 1.00 H new ATOM 0 HH21 ARG A 52 83.152 -9.828 -5.911 1.00 1.00 H new ATOM 0 HH22 ARG A 52 82.943 -9.082 -4.323 1.00 1.00 H new ATOM 771 N ILE A 53 78.555 -3.898 -10.388 1.00 1.00 N ATOM 772 CA ILE A 53 77.710 -3.102 -11.272 1.00 1.00 C ATOM 773 C ILE A 53 76.441 -3.863 -11.654 1.00 1.00 C ATOM 774 O ILE A 53 76.422 -5.089 -11.769 1.00 1.00 O ATOM 775 CB ILE A 53 78.512 -2.674 -12.516 1.00 1.00 C ATOM 776 CG1 ILE A 53 77.690 -1.680 -13.389 1.00 1.00 C ATOM 777 CG2 ILE A 53 78.938 -3.902 -13.327 1.00 1.00 C ATOM 778 CD1 ILE A 53 76.907 -2.394 -14.503 1.00 1.00 C ATOM 0 H ILE A 53 79.132 -4.591 -10.864 1.00 1.00 H new ATOM 0 HA ILE A 53 77.394 -2.203 -10.742 1.00 1.00 H new ATOM 0 HB ILE A 53 79.413 -2.158 -12.185 1.00 1.00 H new ATOM 0 HG12 ILE A 53 76.995 -1.131 -12.754 1.00 1.00 H new ATOM 0 HG13 ILE A 53 78.363 -0.947 -13.833 1.00 1.00 H new ATOM 0 HG21 ILE A 53 79.503 -3.582 -14.202 1.00 1.00 H new ATOM 0 HG22 ILE A 53 79.561 -4.548 -12.709 1.00 1.00 H new ATOM 0 HG23 ILE A 53 78.053 -4.451 -13.648 1.00 1.00 H new ATOM 0 HD11 ILE A 53 76.350 -1.659 -15.084 1.00 1.00 H new ATOM 0 HD12 ILE A 53 77.602 -2.922 -15.156 1.00 1.00 H new ATOM 0 HD13 ILE A 53 76.213 -3.108 -14.060 1.00 1.00 H new ATOM 790 N GLN A 54 75.387 -3.086 -11.787 1.00 1.00 N ATOM 791 CA GLN A 54 74.076 -3.652 -12.097 1.00 1.00 C ATOM 792 C GLN A 54 74.096 -4.322 -13.482 1.00 1.00 C ATOM 793 O GLN A 54 73.578 -3.770 -14.452 1.00 1.00 O ATOM 794 CB GLN A 54 72.991 -2.551 -12.062 1.00 1.00 C ATOM 795 CG GLN A 54 73.621 -1.180 -12.342 1.00 1.00 C ATOM 796 CD GLN A 54 74.241 -0.619 -11.066 1.00 1.00 C ATOM 797 OE1 GLN A 54 74.577 0.563 -11.005 1.00 1.00 O ATOM 798 NE2 GLN A 54 74.404 -1.403 -10.036 1.00 1.00 N ATOM 0 H GLN A 54 75.403 -2.071 -11.688 1.00 1.00 H new ATOM 0 HA GLN A 54 73.840 -4.404 -11.344 1.00 1.00 H new ATOM 0 HB2 GLN A 54 72.221 -2.764 -12.804 1.00 1.00 H new ATOM 0 HB3 GLN A 54 72.502 -2.543 -11.088 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.383 -1.272 -13.116 1.00 1.00 H new ATOM 0 HG3 GLN A 54 72.864 -0.493 -12.720 1.00 1.00 H new ATOM 0 HE21 GLN A 54 74.124 -2.382 -10.091 1.00 1.00 H new ATOM 0 HE22 GLN A 54 74.811 -1.037 -9.176 1.00 1.00 H new ATOM 807 N ILE A 55 74.643 -5.547 -13.541 1.00 1.00 N ATOM 808 CA ILE A 55 74.680 -6.346 -14.770 1.00 1.00 C ATOM 809 C ILE A 55 74.614 -7.835 -14.400 1.00 1.00 C ATOM 810 O ILE A 55 74.946 -8.212 -13.277 1.00 1.00 O ATOM 811 CB ILE A 55 75.956 -6.013 -15.605 1.00 1.00 C ATOM 812 CG1 ILE A 55 75.558 -5.298 -16.907 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.761 -7.274 -15.969 1.00 1.00 C ATOM 814 CD1 ILE A 55 76.795 -4.725 -17.616 1.00 1.00 C ATOM 0 H ILE A 55 75.071 -6.008 -12.738 1.00 1.00 H new ATOM 0 HA ILE A 55 73.820 -6.103 -15.394 1.00 1.00 H new ATOM 0 HB ILE A 55 76.582 -5.371 -14.985 1.00 1.00 H new ATOM 0 HG12 ILE A 55 75.045 -5.996 -17.568 1.00 1.00 H new ATOM 0 HG13 ILE A 55 74.856 -4.494 -16.686 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.639 -6.990 -16.550 1.00 1.00 H new ATOM 0 HG22 ILE A 55 77.077 -7.780 -15.057 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.138 -7.946 -16.559 1.00 1.00 H new ATOM 0 HD11 ILE A 55 76.489 -4.224 -18.534 1.00 1.00 H new ATOM 0 HD12 ILE A 55 77.291 -4.009 -16.960 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.484 -5.535 -17.857 1.00 1.00 H new ATOM 826 N GLY A 56 74.161 -8.670 -15.333 1.00 1.00 N ATOM 827 CA GLY A 56 74.030 -10.112 -15.083 1.00 1.00 C ATOM 828 C GLY A 56 72.561 -10.490 -15.015 1.00 1.00 C ATOM 829 O GLY A 56 72.202 -11.658 -14.916 1.00 1.00 O ATOM 0 H GLY A 56 73.878 -8.378 -16.268 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.523 -10.674 -15.876 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.526 -10.375 -14.149 1.00 1.00 H new ATOM 833 N ASP A 57 71.721 -9.473 -15.084 1.00 1.00 N ATOM 834 CA ASP A 57 70.284 -9.693 -15.055 1.00 1.00 C ATOM 835 C ASP A 57 69.808 -10.121 -16.437 1.00 1.00 C ATOM 836 O ASP A 57 69.619 -9.293 -17.331 1.00 1.00 O ATOM 837 CB ASP A 57 69.573 -8.414 -14.632 1.00 1.00 C ATOM 838 CG ASP A 57 70.126 -7.222 -15.408 1.00 1.00 C ATOM 839 OD1 ASP A 57 71.075 -7.409 -16.151 1.00 1.00 O ATOM 840 OD2 ASP A 57 69.597 -6.137 -15.237 1.00 1.00 O ATOM 0 H ASP A 57 72.004 -8.496 -15.160 1.00 1.00 H new ATOM 0 HA ASP A 57 70.053 -10.479 -14.336 1.00 1.00 H new ATOM 0 HB2 ASP A 57 68.502 -8.508 -14.811 1.00 1.00 H new ATOM 0 HB3 ASP A 57 69.704 -8.253 -13.562 1.00 1.00 H new ATOM 845 N TRP A 58 69.643 -11.437 -16.600 1.00 1.00 N ATOM 846 CA TRP A 58 69.222 -12.035 -17.868 1.00 1.00 C ATOM 847 C TRP A 58 67.707 -12.045 -18.051 1.00 1.00 C ATOM 848 O TRP A 58 66.937 -11.628 -17.195 1.00 1.00 O ATOM 849 CB TRP A 58 69.735 -13.473 -18.028 1.00 1.00 C ATOM 850 CG TRP A 58 71.190 -13.577 -17.675 1.00 1.00 C ATOM 851 CD1 TRP A 58 71.664 -13.681 -16.416 1.00 1.00 C ATOM 852 CD2 TRP A 58 72.362 -13.630 -18.555 1.00 1.00 C ATOM 853 NE1 TRP A 58 73.042 -13.772 -16.456 1.00 1.00 N ATOM 854 CE2 TRP A 58 73.521 -13.748 -17.749 1.00 1.00 C ATOM 855 CE3 TRP A 58 72.538 -13.580 -19.956 1.00 1.00 C ATOM 856 CZ2 TRP A 58 74.801 -13.817 -18.304 1.00 1.00 C ATOM 857 CZ3 TRP A 58 73.829 -13.649 -20.515 1.00 1.00 C ATOM 858 CH2 TRP A 58 74.956 -13.768 -19.690 1.00 1.00 C ATOM 0 H TRP A 58 69.798 -12.117 -15.856 1.00 1.00 H new ATOM 0 HA TRP A 58 69.664 -11.397 -18.634 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.156 -14.141 -17.390 1.00 1.00 H new ATOM 0 HB3 TRP A 58 69.584 -13.803 -19.056 1.00 1.00 H new ATOM 0 HD1 TRP A 58 71.062 -13.691 -15.519 1.00 1.00 H new ATOM 0 HE1 TRP A 58 73.634 -13.848 -15.629 1.00 1.00 H new ATOM 0 HE3 TRP A 58 71.677 -13.488 -20.602 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 75.666 -13.908 -17.664 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 73.952 -13.610 -21.587 1.00 1.00 H new ATOM 0 HH2 TRP A 58 75.943 -13.822 -20.126 1.00 1.00 H new ATOM 869 N ARG A 59 67.348 -12.526 -19.229 1.00 1.00 N ATOM 870 CA ARG A 59 65.942 -12.635 -19.623 1.00 1.00 C ATOM 871 C ARG A 59 65.349 -13.995 -19.223 1.00 1.00 C ATOM 872 O ARG A 59 64.383 -14.069 -18.469 1.00 1.00 O ATOM 873 CB ARG A 59 65.783 -12.458 -21.139 1.00 1.00 C ATOM 874 CG ARG A 59 66.456 -11.143 -21.616 1.00 1.00 C ATOM 875 CD ARG A 59 67.708 -11.461 -22.443 1.00 1.00 C ATOM 876 NE ARG A 59 67.344 -12.226 -23.628 1.00 1.00 N ATOM 877 CZ ARG A 59 68.258 -12.904 -24.314 1.00 1.00 C ATOM 878 NH1 ARG A 59 69.505 -12.880 -23.934 1.00 1.00 N ATOM 879 NH2 ARG A 59 67.907 -13.592 -25.367 1.00 1.00 N ATOM 0 H ARG A 59 68.008 -12.850 -19.936 1.00 1.00 H new ATOM 0 HA ARG A 59 65.406 -11.843 -19.101 1.00 1.00 H new ATOM 0 HB2 ARG A 59 66.228 -13.308 -21.657 1.00 1.00 H new ATOM 0 HB3 ARG A 59 64.724 -12.445 -21.399 1.00 1.00 H new ATOM 0 HG2 ARG A 59 65.754 -10.562 -22.214 1.00 1.00 H new ATOM 0 HG3 ARG A 59 66.725 -10.530 -20.756 1.00 1.00 H new ATOM 0 HD2 ARG A 59 68.204 -10.536 -22.736 1.00 1.00 H new ATOM 0 HD3 ARG A 59 68.418 -12.026 -21.840 1.00 1.00 H new ATOM 0 HE ARG A 59 66.372 -12.241 -23.936 1.00 1.00 H new ATOM 0 HH11 ARG A 59 69.777 -12.342 -23.112 1.00 1.00 H new ATOM 0 HH12 ARG A 59 70.208 -13.400 -24.459 1.00 1.00 H new ATOM 0 HH21 ARG A 59 66.931 -13.609 -25.663 1.00 1.00 H new ATOM 0 HH22 ARG A 59 68.609 -14.112 -25.893 1.00 1.00 H new ATOM 893 N TYR A 60 65.947 -15.052 -19.760 1.00 1.00 N ATOM 894 CA TYR A 60 65.524 -16.449 -19.513 1.00 1.00 C ATOM 895 C TYR A 60 66.227 -17.111 -18.317 1.00 1.00 C ATOM 896 O TYR A 60 65.748 -18.122 -17.764 1.00 1.00 O ATOM 897 CB TYR A 60 65.738 -17.287 -20.816 1.00 1.00 C ATOM 898 CG TYR A 60 66.564 -18.532 -20.547 1.00 1.00 C ATOM 899 CD1 TYR A 60 65.941 -19.720 -20.140 1.00 1.00 C ATOM 900 CD2 TYR A 60 67.955 -18.485 -20.685 1.00 1.00 C ATOM 901 CE1 TYR A 60 66.713 -20.858 -19.875 1.00 1.00 C ATOM 902 CE2 TYR A 60 68.725 -19.620 -20.419 1.00 1.00 C ATOM 903 CZ TYR A 60 68.105 -20.808 -20.014 1.00 1.00 C ATOM 904 OH TYR A 60 68.867 -21.927 -19.749 1.00 1.00 O ATOM 0 H TYR A 60 66.748 -14.976 -20.387 1.00 1.00 H new ATOM 0 HA TYR A 60 64.467 -16.422 -19.246 1.00 1.00 H new ATOM 0 HB2 TYR A 60 64.771 -17.573 -21.229 1.00 1.00 H new ATOM 0 HB3 TYR A 60 66.236 -16.674 -21.567 1.00 1.00 H new ATOM 0 HD1 TYR A 60 64.867 -19.758 -20.031 1.00 1.00 H new ATOM 0 HD2 TYR A 60 68.435 -17.569 -20.998 1.00 1.00 H new ATOM 0 HE1 TYR A 60 66.234 -21.775 -19.563 1.00 1.00 H new ATOM 0 HE2 TYR A 60 69.799 -19.581 -20.526 1.00 1.00 H new ATOM 0 HH TYR A 60 69.814 -21.720 -19.896 1.00 1.00 H new ATOM 914 N GLU A 61 67.342 -16.556 -17.886 1.00 1.00 N ATOM 915 CA GLU A 61 68.073 -17.121 -16.773 1.00 1.00 C ATOM 916 C GLU A 61 67.479 -16.665 -15.454 1.00 1.00 C ATOM 917 O GLU A 61 67.834 -17.182 -14.402 1.00 1.00 O ATOM 918 CB GLU A 61 69.565 -16.732 -16.893 1.00 1.00 C ATOM 919 CG GLU A 61 70.462 -17.966 -16.696 1.00 1.00 C ATOM 920 CD GLU A 61 71.928 -17.582 -16.857 1.00 1.00 C ATOM 921 OE1 GLU A 61 72.391 -17.563 -17.985 1.00 1.00 O ATOM 922 OE2 GLU A 61 72.567 -17.321 -15.851 1.00 1.00 O ATOM 0 H GLU A 61 67.759 -15.717 -18.289 1.00 1.00 H new ATOM 0 HA GLU A 61 67.995 -18.208 -16.799 1.00 1.00 H new ATOM 0 HB2 GLU A 61 69.754 -16.290 -17.871 1.00 1.00 H new ATOM 0 HB3 GLU A 61 69.810 -15.974 -16.149 1.00 1.00 H new ATOM 0 HG2 GLU A 61 70.296 -18.391 -15.706 1.00 1.00 H new ATOM 0 HG3 GLU A 61 70.198 -18.736 -17.421 1.00 1.00 H new ATOM 929 N VAL A 62 66.628 -15.652 -15.489 1.00 1.00 N ATOM 930 CA VAL A 62 66.074 -15.117 -14.255 1.00 1.00 C ATOM 931 C VAL A 62 65.486 -16.207 -13.406 1.00 1.00 C ATOM 932 O VAL A 62 65.797 -16.274 -12.246 1.00 1.00 O ATOM 933 CB VAL A 62 65.009 -14.073 -14.575 1.00 1.00 C ATOM 934 CG1 VAL A 62 65.657 -12.979 -15.405 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.872 -14.710 -15.385 1.00 1.00 C ATOM 0 H VAL A 62 66.310 -15.191 -16.341 1.00 1.00 H new ATOM 0 HA VAL A 62 66.883 -14.650 -13.693 1.00 1.00 H new ATOM 0 HB VAL A 62 64.598 -13.668 -13.650 1.00 1.00 H new ATOM 0 HG11 VAL A 62 64.915 -12.218 -15.648 1.00 1.00 H new ATOM 0 HG12 VAL A 62 66.470 -12.525 -14.838 1.00 1.00 H new ATOM 0 HG13 VAL A 62 66.052 -13.407 -16.326 1.00 1.00 H new ATOM 0 HG21 VAL A 62 63.117 -13.956 -15.608 1.00 1.00 H new ATOM 0 HG22 VAL A 62 64.270 -15.112 -16.317 1.00 1.00 H new ATOM 0 HG23 VAL A 62 63.420 -15.516 -14.806 1.00 1.00 H new ATOM 945 N ALA A 63 64.578 -17.010 -13.917 1.00 1.00 N ATOM 946 CA ALA A 63 63.972 -18.029 -13.095 1.00 1.00 C ATOM 947 C ALA A 63 64.986 -19.112 -12.815 1.00 1.00 C ATOM 948 O ALA A 63 65.259 -19.429 -11.658 1.00 1.00 O ATOM 949 CB ALA A 63 62.766 -18.628 -13.821 1.00 1.00 C ATOM 0 H ALA A 63 64.249 -16.977 -14.882 1.00 1.00 H new ATOM 0 HA ALA A 63 63.640 -17.588 -12.155 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.311 -19.397 -13.197 1.00 1.00 H new ATOM 0 HB2 ALA A 63 62.036 -17.844 -14.021 1.00 1.00 H new ATOM 0 HB3 ALA A 63 63.091 -19.070 -14.763 1.00 1.00 H new ATOM 955 N HIS A 64 65.572 -19.648 -13.894 1.00 1.00 N ATOM 956 CA HIS A 64 66.584 -20.693 -13.737 1.00 1.00 C ATOM 957 C HIS A 64 67.545 -20.258 -12.621 1.00 1.00 C ATOM 958 O HIS A 64 67.768 -20.961 -11.647 1.00 1.00 O ATOM 959 CB HIS A 64 67.339 -20.903 -15.073 1.00 1.00 C ATOM 960 CG HIS A 64 67.376 -22.369 -15.438 1.00 1.00 C ATOM 961 ND1 HIS A 64 68.388 -23.217 -15.014 1.00 1.00 N ATOM 962 CD2 HIS A 64 66.522 -23.149 -16.180 1.00 1.00 C ATOM 963 CE1 HIS A 64 68.122 -24.444 -15.499 1.00 1.00 C ATOM 964 NE2 HIS A 64 66.994 -24.458 -16.215 1.00 1.00 N ATOM 0 H HIS A 64 65.369 -19.383 -14.858 1.00 1.00 H new ATOM 0 HA HIS A 64 66.120 -21.642 -13.469 1.00 1.00 H new ATOM 0 HB2 HIS A 64 66.850 -20.337 -15.866 1.00 1.00 H new ATOM 0 HB3 HIS A 64 68.355 -20.518 -14.987 1.00 1.00 H new ATOM 0 HD2 HIS A 64 65.621 -22.799 -16.663 1.00 1.00 H new ATOM 0 HE1 HIS A 64 68.744 -25.311 -15.330 1.00 1.00 H new ATOM 0 HE2 HIS A 64 66.570 -25.257 -16.686 1.00 1.00 H new ATOM 972 N ASP A 65 68.085 -19.074 -12.800 1.00 1.00 N ATOM 973 CA ASP A 65 69.011 -18.496 -11.832 1.00 1.00 C ATOM 974 C ASP A 65 68.270 -18.019 -10.571 1.00 1.00 C ATOM 975 O ASP A 65 68.596 -18.398 -9.434 1.00 1.00 O ATOM 976 CB ASP A 65 69.755 -17.327 -12.479 1.00 1.00 C ATOM 977 CG ASP A 65 71.002 -16.997 -11.673 1.00 1.00 C ATOM 978 OD1 ASP A 65 71.937 -17.778 -11.734 1.00 1.00 O ATOM 979 OD2 ASP A 65 71.003 -15.972 -11.010 1.00 1.00 O ATOM 0 H ASP A 65 67.902 -18.483 -13.611 1.00 1.00 H new ATOM 0 HA ASP A 65 69.724 -19.263 -11.530 1.00 1.00 H new ATOM 0 HB2 ASP A 65 70.030 -17.581 -13.503 1.00 1.00 H new ATOM 0 HB3 ASP A 65 69.104 -16.454 -12.531 1.00 1.00 H new ATOM 984 N GLY A 66 67.203 -17.270 -10.757 1.00 1.00 N ATOM 985 CA GLY A 66 66.384 -16.802 -9.647 1.00 1.00 C ATOM 986 C GLY A 66 65.536 -17.942 -9.115 1.00 1.00 C ATOM 987 O GLY A 66 64.522 -17.731 -8.453 1.00 1.00 O ATOM 0 H GLY A 66 66.876 -16.967 -11.675 1.00 1.00 H new ATOM 0 HA2 GLY A 66 67.021 -16.410 -8.854 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.744 -15.983 -9.976 1.00 1.00 H new ATOM 991 N ARG A 67 66.055 -19.144 -9.312 1.00 1.00 N ATOM 992 CA ARG A 67 65.474 -20.355 -8.765 1.00 1.00 C ATOM 993 C ARG A 67 65.748 -20.292 -7.288 1.00 1.00 C ATOM 994 O ARG A 67 65.564 -21.284 -6.584 1.00 1.00 O ATOM 995 CB ARG A 67 66.088 -21.658 -9.319 1.00 1.00 C ATOM 996 CG ARG A 67 65.233 -22.258 -10.442 1.00 1.00 C ATOM 997 CD ARG A 67 65.753 -23.665 -10.765 1.00 1.00 C ATOM 998 NE ARG A 67 64.764 -24.398 -11.550 1.00 1.00 N ATOM 999 CZ ARG A 67 64.862 -24.531 -12.870 1.00 1.00 C ATOM 1000 NH1 ARG A 67 65.873 -24.021 -13.520 1.00 1.00 N ATOM 1001 NH2 ARG A 67 63.943 -25.193 -13.516 1.00 1.00 N ATOM 0 H ARG A 67 66.899 -19.305 -9.861 1.00 1.00 H new ATOM 0 HA ARG A 67 64.417 -20.390 -9.030 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.091 -21.456 -9.694 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.190 -22.384 -8.512 1.00 1.00 H new ATOM 0 HG2 ARG A 67 64.188 -22.303 -10.137 1.00 1.00 H new ATOM 0 HG3 ARG A 67 65.279 -21.626 -11.329 1.00 1.00 H new ATOM 0 HD2 ARG A 67 66.690 -23.597 -11.318 1.00 1.00 H new ATOM 0 HD3 ARG A 67 65.967 -24.203 -9.841 1.00 1.00 H new ATOM 0 HE ARG A 67 63.971 -24.823 -11.070 1.00 1.00 H new ATOM 0 HH11 ARG A 67 66.600 -23.513 -13.016 1.00 1.00 H new ATOM 0 HH12 ARG A 67 65.936 -24.130 -14.532 1.00 1.00 H new ATOM 0 HH21 ARG A 67 63.158 -25.603 -13.009 1.00 1.00 H new ATOM 0 HH22 ARG A 67 64.009 -25.301 -14.528 1.00 1.00 H new ATOM 1015 N LEU A 68 66.263 -19.131 -6.838 1.00 1.00 N ATOM 1016 CA LEU A 68 66.636 -18.943 -5.436 1.00 1.00 C ATOM 1017 C LEU A 68 65.703 -19.759 -4.564 1.00 1.00 C ATOM 1018 O LEU A 68 66.093 -20.266 -3.509 1.00 1.00 O ATOM 1019 CB LEU A 68 66.525 -17.449 -5.044 1.00 1.00 C ATOM 1020 CG LEU A 68 65.102 -16.880 -5.371 1.00 1.00 C ATOM 1021 CD1 LEU A 68 64.258 -16.757 -4.091 1.00 1.00 C ATOM 1022 CD2 LEU A 68 65.222 -15.481 -5.996 1.00 1.00 C ATOM 0 H LEU A 68 66.427 -18.316 -7.429 1.00 1.00 H new ATOM 0 HA LEU A 68 67.666 -19.269 -5.294 1.00 1.00 H new ATOM 0 HB2 LEU A 68 66.730 -17.334 -3.980 1.00 1.00 H new ATOM 0 HB3 LEU A 68 67.281 -16.873 -5.578 1.00 1.00 H new ATOM 0 HG LEU A 68 64.622 -17.568 -6.067 1.00 1.00 H new ATOM 0 HD11 LEU A 68 63.274 -16.360 -4.341 1.00 1.00 H new ATOM 0 HD12 LEU A 68 64.147 -17.740 -3.632 1.00 1.00 H new ATOM 0 HD13 LEU A 68 64.754 -16.084 -3.392 1.00 1.00 H new ATOM 0 HD21 LEU A 68 64.227 -15.096 -6.219 1.00 1.00 H new ATOM 0 HD22 LEU A 68 65.722 -14.811 -5.296 1.00 1.00 H new ATOM 0 HD23 LEU A 68 65.802 -15.542 -6.917 1.00 1.00 H new ATOM 1034 N LEU A 69 64.486 -19.932 -5.049 1.00 1.00 N ATOM 1035 CA LEU A 69 63.536 -20.759 -4.307 1.00 1.00 C ATOM 1036 C LEU A 69 64.094 -22.190 -4.230 1.00 1.00 C ATOM 1037 O LEU A 69 64.456 -22.653 -3.147 1.00 1.00 O ATOM 1038 CB LEU A 69 62.172 -20.754 -5.008 1.00 1.00 C ATOM 1039 CG LEU A 69 61.143 -21.583 -4.181 1.00 1.00 C ATOM 1040 CD1 LEU A 69 59.855 -20.775 -3.952 1.00 1.00 C ATOM 1041 CD2 LEU A 69 60.789 -22.882 -4.923 1.00 1.00 C ATOM 0 H LEU A 69 64.136 -19.531 -5.919 1.00 1.00 H new ATOM 0 HA LEU A 69 63.400 -20.361 -3.301 1.00 1.00 H new ATOM 0 HB2 LEU A 69 61.817 -19.730 -5.123 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.267 -21.173 -6.010 1.00 1.00 H new ATOM 0 HG LEU A 69 61.597 -21.819 -3.219 1.00 1.00 H new ATOM 0 HD11 LEU A 69 59.150 -21.371 -3.373 1.00 1.00 H new ATOM 0 HD12 LEU A 69 60.091 -19.861 -3.407 1.00 1.00 H new ATOM 0 HD13 LEU A 69 59.410 -20.519 -4.914 1.00 1.00 H new ATOM 0 HD21 LEU A 69 60.070 -23.452 -4.335 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.355 -22.640 -5.893 1.00 1.00 H new ATOM 0 HD23 LEU A 69 61.691 -23.476 -5.068 1.00 1.00 H new ATOM 1053 N ALA A 70 64.235 -22.872 -5.380 1.00 1.00 N ATOM 1054 CA ALA A 70 64.846 -24.208 -5.336 1.00 1.00 C ATOM 1055 C ALA A 70 66.335 -23.936 -5.197 1.00 1.00 C ATOM 1056 O ALA A 70 66.922 -24.148 -4.137 1.00 1.00 O ATOM 1057 CB ALA A 70 64.542 -25.021 -6.619 1.00 1.00 C ATOM 0 H ALA A 70 63.951 -22.543 -6.303 1.00 1.00 H new ATOM 0 HA ALA A 70 64.453 -24.810 -4.517 1.00 1.00 H new ATOM 0 HB1 ALA A 70 65.011 -26.002 -6.548 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.464 -25.141 -6.727 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.937 -24.493 -7.487 1.00 1.00 H new ATOM 1063 N ALA A 71 66.936 -23.484 -6.284 1.00 1.00 N ATOM 1064 CA ALA A 71 68.352 -23.154 -6.373 1.00 1.00 C ATOM 1065 C ALA A 71 68.930 -22.426 -5.175 1.00 1.00 C ATOM 1066 O ALA A 71 70.090 -22.022 -5.263 1.00 1.00 O ATOM 1067 CB ALA A 71 68.632 -22.283 -7.596 1.00 1.00 C ATOM 0 H ALA A 71 66.436 -23.331 -7.160 1.00 1.00 H new ATOM 0 HA ALA A 71 68.835 -24.130 -6.433 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.696 -22.050 -7.641 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.340 -22.819 -8.499 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.061 -21.358 -7.522 1.00 1.00 H new ATOM 1073 N HIS A 72 68.172 -22.173 -4.100 1.00 1.00 N ATOM 1074 CA HIS A 72 68.708 -21.397 -2.973 1.00 1.00 C ATOM 1075 C HIS A 72 70.227 -21.554 -2.823 1.00 1.00 C ATOM 1076 O HIS A 72 70.967 -20.584 -3.014 1.00 1.00 O ATOM 1077 CB HIS A 72 68.009 -21.812 -1.659 1.00 1.00 C ATOM 1078 CG HIS A 72 67.693 -23.290 -1.647 1.00 1.00 C ATOM 1079 ND1 HIS A 72 66.408 -23.760 -1.855 1.00 1.00 N ATOM 1080 CD2 HIS A 72 68.459 -24.412 -1.399 1.00 1.00 C ATOM 1081 CE1 HIS A 72 66.433 -25.099 -1.731 1.00 1.00 C ATOM 1082 NE2 HIS A 72 67.658 -25.547 -1.455 1.00 1.00 N ATOM 0 H HIS A 72 67.208 -22.486 -3.986 1.00 1.00 H new ATOM 0 HA HIS A 72 68.506 -20.347 -3.185 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.649 -21.568 -0.811 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.089 -21.240 -1.538 1.00 1.00 H new ATOM 0 HD1 HIS A 72 65.587 -23.192 -2.065 1.00 1.00 H new ATOM 0 HD2 HIS A 72 69.519 -24.408 -1.193 1.00 1.00 H new ATOM 0 HE1 HIS A 72 65.566 -25.734 -1.842 1.00 1.00 H new ATOM 1090 N MET A 73 70.711 -22.753 -2.533 1.00 1.00 N ATOM 1091 CA MET A 73 72.150 -22.933 -2.435 1.00 1.00 C ATOM 1092 C MET A 73 72.781 -22.861 -3.834 1.00 1.00 C ATOM 1093 O MET A 73 73.804 -22.200 -4.008 1.00 1.00 O ATOM 1094 CB MET A 73 72.486 -24.260 -1.729 1.00 1.00 C ATOM 1095 CG MET A 73 72.607 -24.034 -0.211 1.00 1.00 C ATOM 1096 SD MET A 73 71.172 -23.104 0.403 1.00 1.00 S ATOM 1097 CE MET A 73 70.586 -24.305 1.628 1.00 1.00 C ATOM 0 H MET A 73 70.151 -23.589 -2.367 1.00 1.00 H new ATOM 0 HA MET A 73 72.570 -22.129 -1.830 1.00 1.00 H new ATOM 0 HB2 MET A 73 71.710 -24.997 -1.934 1.00 1.00 H new ATOM 0 HB3 MET A 73 73.420 -24.663 -2.120 1.00 1.00 H new ATOM 0 HG2 MET A 73 72.674 -24.993 0.302 1.00 1.00 H new ATOM 0 HG3 MET A 73 73.524 -23.489 0.011 1.00 1.00 H new ATOM 0 HE1 MET A 73 69.507 -24.208 1.745 1.00 1.00 H new ATOM 0 HE2 MET A 73 70.825 -25.314 1.292 1.00 1.00 H new ATOM 0 HE3 MET A 73 71.073 -24.116 2.585 1.00 1.00 H new ATOM 1107 N VAL A 74 72.235 -23.591 -4.818 1.00 1.00 N ATOM 1108 CA VAL A 74 72.859 -23.623 -6.145 1.00 1.00 C ATOM 1109 C VAL A 74 73.258 -22.224 -6.628 1.00 1.00 C ATOM 1110 O VAL A 74 74.358 -22.104 -7.173 1.00 1.00 O ATOM 1111 CB VAL A 74 71.951 -24.339 -7.146 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.620 -24.373 -8.520 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.726 -25.784 -6.668 1.00 1.00 C ATOM 0 H VAL A 74 71.388 -24.151 -4.724 1.00 1.00 H new ATOM 0 HA VAL A 74 73.785 -24.192 -6.066 1.00 1.00 H new ATOM 0 HB VAL A 74 71.001 -23.809 -7.217 1.00 1.00 H new ATOM 0 HG11 VAL A 74 71.969 -24.884 -9.229 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.800 -23.354 -8.862 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.569 -24.905 -8.450 1.00 1.00 H new ATOM 0 HG21 VAL A 74 71.079 -26.304 -7.375 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.684 -26.300 -6.605 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.255 -25.773 -5.685 1.00 1.00 H new ATOM 1123 N ASN A 75 72.432 -21.167 -6.473 1.00 1.00 N ATOM 1124 CA ASN A 75 72.800 -19.787 -6.902 1.00 1.00 C ATOM 1125 C ASN A 75 74.303 -19.483 -6.691 1.00 1.00 C ATOM 1126 O ASN A 75 74.855 -18.527 -7.227 1.00 1.00 O ATOM 1127 CB ASN A 75 71.935 -18.808 -6.071 1.00 1.00 C ATOM 1128 CG ASN A 75 71.572 -17.550 -6.870 1.00 1.00 C ATOM 1129 OD1 ASN A 75 71.255 -17.637 -8.054 1.00 1.00 O ATOM 1130 ND2 ASN A 75 71.574 -16.383 -6.270 1.00 1.00 N ATOM 0 H ASN A 75 71.504 -21.236 -6.055 1.00 1.00 H new ATOM 0 HA ASN A 75 72.616 -19.679 -7.971 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.023 -19.311 -5.751 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.475 -18.522 -5.168 1.00 1.00 H new ATOM 0 HD21 ASN A 75 71.312 -15.544 -6.787 1.00 1.00 H new ATOM 0 HD22 ASN A 75 71.838 -16.315 -5.287 1.00 1.00 H new ATOM 1137 N GLY A 76 74.932 -20.371 -5.954 1.00 1.00 N ATOM 1138 CA GLY A 76 76.364 -20.288 -5.707 1.00 1.00 C ATOM 1139 C GLY A 76 77.071 -20.000 -7.045 1.00 1.00 C ATOM 1140 O GLY A 76 78.150 -19.423 -7.083 1.00 1.00 O ATOM 0 H GLY A 76 74.475 -21.167 -5.510 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.580 -19.499 -4.986 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.730 -21.221 -5.278 1.00 1.00 H new ATOM 1144 N ILE A 77 76.413 -20.391 -8.141 1.00 1.00 N ATOM 1145 CA ILE A 77 76.951 -20.150 -9.478 1.00 1.00 C ATOM 1146 C ILE A 77 77.036 -18.631 -9.685 1.00 1.00 C ATOM 1147 O ILE A 77 78.059 -18.079 -10.053 1.00 1.00 O ATOM 1148 CB ILE A 77 76.035 -20.828 -10.529 1.00 1.00 C ATOM 1149 CG1 ILE A 77 74.572 -20.332 -10.399 1.00 1.00 C ATOM 1150 CG2 ILE A 77 76.082 -22.349 -10.328 1.00 1.00 C ATOM 1151 CD1 ILE A 77 73.633 -21.227 -11.219 1.00 1.00 C ATOM 0 H ILE A 77 75.514 -20.872 -8.127 1.00 1.00 H new ATOM 0 HA ILE A 77 77.948 -20.577 -9.591 1.00 1.00 H new ATOM 0 HB ILE A 77 76.394 -20.567 -11.525 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.270 -20.339 -9.352 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.498 -19.301 -10.745 1.00 1.00 H new ATOM 0 HG21 ILE A 77 75.440 -22.833 -11.064 1.00 1.00 H new ATOM 0 HG22 ILE A 77 77.106 -22.701 -10.452 1.00 1.00 H new ATOM 0 HG23 ILE A 77 75.733 -22.594 -9.325 1.00 1.00 H new ATOM 0 HD11 ILE A 77 72.609 -20.868 -11.119 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.927 -21.198 -12.268 1.00 1.00 H new ATOM 0 HD13 ILE A 77 73.695 -22.252 -10.853 1.00 1.00 H new ATOM 1163 N VAL A 78 75.881 -18.036 -9.478 1.00 1.00 N ATOM 1164 CA VAL A 78 75.718 -16.593 -9.681 1.00 1.00 C ATOM 1165 C VAL A 78 77.034 -15.925 -9.237 1.00 1.00 C ATOM 1166 O VAL A 78 77.468 -14.930 -9.823 1.00 1.00 O ATOM 1167 CB VAL A 78 74.534 -16.001 -8.918 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.582 -14.468 -9.012 1.00 1.00 C ATOM 1169 CG2 VAL A 78 73.245 -16.488 -9.571 1.00 1.00 C ATOM 0 H VAL A 78 75.037 -18.518 -9.170 1.00 1.00 H new ATOM 0 HA VAL A 78 75.502 -16.408 -10.733 1.00 1.00 H new ATOM 0 HB VAL A 78 74.575 -16.308 -7.873 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.738 -14.044 -8.468 1.00 1.00 H new ATOM 0 HG12 VAL A 78 75.513 -14.106 -8.577 1.00 1.00 H new ATOM 0 HG13 VAL A 78 74.529 -14.166 -10.058 1.00 1.00 H new ATOM 0 HG21 VAL A 78 72.389 -16.075 -9.038 1.00 1.00 H new ATOM 0 HG22 VAL A 78 73.218 -16.162 -10.611 1.00 1.00 H new ATOM 0 HG23 VAL A 78 73.206 -17.577 -9.531 1.00 1.00 H new ATOM 1179 N ILE A 79 77.679 -16.522 -8.218 1.00 1.00 N ATOM 1180 CA ILE A 79 78.971 -16.035 -7.708 1.00 1.00 C ATOM 1181 C ILE A 79 80.151 -16.855 -8.304 1.00 1.00 C ATOM 1182 O ILE A 79 81.244 -16.322 -8.518 1.00 1.00 O ATOM 1183 CB ILE A 79 78.966 -16.053 -6.134 1.00 1.00 C ATOM 1184 CG1 ILE A 79 79.822 -17.217 -5.550 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.515 -16.173 -5.634 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.385 -17.553 -4.113 1.00 1.00 C ATOM 0 H ILE A 79 77.324 -17.345 -7.731 1.00 1.00 H new ATOM 0 HA ILE A 79 79.116 -15.003 -8.029 1.00 1.00 H new ATOM 0 HB ILE A 79 79.413 -15.121 -5.790 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.721 -18.100 -6.181 1.00 1.00 H new ATOM 0 HG13 ILE A 79 80.876 -16.938 -5.558 1.00 1.00 H new ATOM 0 HG21 ILE A 79 77.506 -16.186 -4.544 1.00 1.00 H new ATOM 0 HG22 ILE A 79 76.935 -15.322 -5.992 1.00 1.00 H new ATOM 0 HG23 ILE A 79 77.075 -17.096 -6.012 1.00 1.00 H new ATOM 0 HD11 ILE A 79 79.997 -18.368 -3.728 1.00 1.00 H new ATOM 0 HD12 ILE A 79 79.510 -16.675 -3.480 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.337 -17.854 -4.112 1.00 1.00 H new ATOM 1198 N ALA A 80 79.910 -18.161 -8.547 1.00 1.00 N ATOM 1199 CA ALA A 80 80.933 -19.080 -9.094 1.00 1.00 C ATOM 1200 C ALA A 80 81.056 -19.072 -10.638 1.00 1.00 C ATOM 1201 O ALA A 80 82.054 -19.557 -11.177 1.00 1.00 O ATOM 1202 CB ALA A 80 80.697 -20.519 -8.596 1.00 1.00 C ATOM 0 H ALA A 80 79.009 -18.606 -8.372 1.00 1.00 H new ATOM 0 HA ALA A 80 81.882 -18.698 -8.717 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.461 -21.177 -9.011 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.751 -20.541 -7.508 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.712 -20.858 -8.917 1.00 1.00 H new ATOM 1208 N GLU A 81 80.093 -18.482 -11.349 1.00 1.00 N ATOM 1209 CA GLU A 81 80.174 -18.407 -12.797 1.00 1.00 C ATOM 1210 C GLU A 81 80.919 -17.159 -13.192 1.00 1.00 C ATOM 1211 O GLU A 81 82.023 -17.260 -13.724 1.00 1.00 O ATOM 1212 CB GLU A 81 78.774 -18.427 -13.429 1.00 1.00 C ATOM 1213 CG GLU A 81 78.285 -19.876 -13.529 1.00 1.00 C ATOM 1214 CD GLU A 81 76.822 -19.914 -13.956 1.00 1.00 C ATOM 1215 OE1 GLU A 81 76.051 -19.131 -13.428 1.00 1.00 O ATOM 1216 OE2 GLU A 81 76.495 -20.731 -14.800 1.00 1.00 O ATOM 0 H GLU A 81 79.259 -18.055 -10.945 1.00 1.00 H new ATOM 0 HA GLU A 81 80.713 -19.279 -13.166 1.00 1.00 H new ATOM 0 HB2 GLU A 81 78.082 -17.838 -12.827 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.803 -17.971 -14.419 1.00 1.00 H new ATOM 0 HG2 GLU A 81 78.895 -20.424 -14.248 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.403 -20.374 -12.566 1.00 1.00 H new ATOM 1223 N ASP A 82 80.362 -15.966 -12.951 1.00 1.00 N ATOM 1224 CA ASP A 82 81.045 -14.748 -13.310 1.00 1.00 C ATOM 1225 C ASP A 82 82.206 -14.459 -12.386 1.00 1.00 C ATOM 1226 O ASP A 82 83.042 -13.620 -12.733 1.00 1.00 O ATOM 1227 CB ASP A 82 80.065 -13.579 -13.263 1.00 1.00 C ATOM 1228 CG ASP A 82 80.754 -12.299 -13.720 1.00 1.00 C ATOM 1229 OD1 ASP A 82 81.479 -12.353 -14.699 1.00 1.00 O ATOM 1230 OD2 ASP A 82 80.548 -11.281 -13.081 1.00 1.00 O ATOM 0 H ASP A 82 79.450 -15.833 -12.513 1.00 1.00 H new ATOM 0 HA ASP A 82 81.439 -14.875 -14.318 1.00 1.00 H new ATOM 0 HB2 ASP A 82 79.207 -13.788 -13.902 1.00 1.00 H new ATOM 0 HB3 ASP A 82 79.684 -13.454 -12.249 1.00 1.00 H new ATOM 1235 N ALA A 83 82.293 -15.151 -11.226 1.00 1.00 N ATOM 1236 CA ALA A 83 83.419 -14.953 -10.289 1.00 1.00 C ATOM 1237 C ALA A 83 84.641 -14.322 -10.980 1.00 1.00 C ATOM 1238 O ALA A 83 85.241 -13.387 -10.445 1.00 1.00 O ATOM 1239 CB ALA A 83 83.799 -16.315 -9.651 1.00 1.00 C ATOM 0 H ALA A 83 81.607 -15.841 -10.921 1.00 1.00 H new ATOM 0 HA ALA A 83 83.099 -14.258 -9.513 1.00 1.00 H new ATOM 0 HB1 ALA A 83 84.629 -16.174 -8.959 1.00 1.00 H new ATOM 0 HB2 ALA A 83 82.941 -16.716 -9.111 1.00 1.00 H new ATOM 0 HB3 ALA A 83 84.094 -17.014 -10.434 1.00 1.00 H new ATOM 1245 N LEU A 84 85.030 -14.848 -12.154 1.00 1.00 N ATOM 1246 CA LEU A 84 86.211 -14.356 -12.894 1.00 1.00 C ATOM 1247 C LEU A 84 86.429 -12.850 -12.748 1.00 1.00 C ATOM 1248 O LEU A 84 87.571 -12.391 -12.656 1.00 1.00 O ATOM 1249 CB LEU A 84 85.977 -14.641 -14.405 1.00 1.00 C ATOM 1250 CG LEU A 84 86.490 -16.027 -14.838 1.00 1.00 C ATOM 1251 CD1 LEU A 84 88.023 -16.047 -14.896 1.00 1.00 C ATOM 1252 CD2 LEU A 84 85.984 -17.114 -13.882 1.00 1.00 C ATOM 0 H LEU A 84 84.543 -15.617 -12.615 1.00 1.00 H new ATOM 0 HA LEU A 84 87.085 -14.864 -12.487 1.00 1.00 H new ATOM 0 HB2 LEU A 84 84.911 -14.569 -14.623 1.00 1.00 H new ATOM 0 HB3 LEU A 84 86.476 -13.873 -14.996 1.00 1.00 H new ATOM 0 HG LEU A 84 86.103 -16.232 -15.836 1.00 1.00 H new ATOM 0 HD11 LEU A 84 88.363 -17.036 -15.204 1.00 1.00 H new ATOM 0 HD12 LEU A 84 88.370 -15.304 -15.614 1.00 1.00 H new ATOM 0 HD13 LEU A 84 88.427 -15.815 -13.911 1.00 1.00 H new ATOM 0 HD21 LEU A 84 86.358 -18.086 -14.205 1.00 1.00 H new ATOM 0 HD22 LEU A 84 86.340 -16.906 -12.873 1.00 1.00 H new ATOM 0 HD23 LEU A 84 84.894 -17.124 -13.887 1.00 1.00 H new ATOM 1264 N ILE A 85 85.349 -12.092 -12.688 1.00 1.00 N ATOM 1265 CA ILE A 85 85.452 -10.650 -12.503 1.00 1.00 C ATOM 1266 C ILE A 85 85.180 -10.329 -11.041 1.00 1.00 C ATOM 1267 O ILE A 85 85.788 -9.440 -10.451 1.00 1.00 O ATOM 1268 CB ILE A 85 84.475 -9.918 -13.428 1.00 1.00 C ATOM 1269 CG1 ILE A 85 84.809 -8.418 -13.446 1.00 1.00 C ATOM 1270 CG2 ILE A 85 83.044 -10.120 -12.928 1.00 1.00 C ATOM 1271 CD1 ILE A 85 86.172 -8.163 -14.121 1.00 1.00 C ATOM 0 H ILE A 85 84.395 -12.445 -12.764 1.00 1.00 H new ATOM 0 HA ILE A 85 86.455 -10.310 -12.763 1.00 1.00 H new ATOM 0 HB ILE A 85 84.563 -10.320 -14.437 1.00 1.00 H new ATOM 0 HG12 ILE A 85 84.028 -7.874 -13.978 1.00 1.00 H new ATOM 0 HG13 ILE A 85 84.827 -8.034 -12.426 1.00 1.00 H new ATOM 0 HG21 ILE A 85 82.351 -9.598 -13.588 1.00 1.00 H new ATOM 0 HG22 ILE A 85 82.808 -11.184 -12.922 1.00 1.00 H new ATOM 0 HG23 ILE A 85 82.952 -9.722 -11.917 1.00 1.00 H new ATOM 0 HD11 ILE A 85 86.384 -7.094 -14.120 1.00 1.00 H new ATOM 0 HD12 ILE A 85 86.954 -8.688 -13.572 1.00 1.00 H new ATOM 0 HD13 ILE A 85 86.143 -8.527 -15.148 1.00 1.00 H new ATOM 1283 N ALA A 86 84.247 -11.083 -10.479 1.00 1.00 N ATOM 1284 CA ALA A 86 83.887 -10.884 -9.084 1.00 1.00 C ATOM 1285 C ALA A 86 85.121 -11.139 -8.204 1.00 1.00 C ATOM 1286 O ALA A 86 85.531 -10.265 -7.447 1.00 1.00 O ATOM 1287 CB ALA A 86 82.698 -11.777 -8.681 1.00 1.00 C ATOM 0 H ALA A 86 83.734 -11.824 -10.957 1.00 1.00 H new ATOM 0 HA ALA A 86 83.562 -9.854 -8.938 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.453 -11.605 -7.633 1.00 1.00 H new ATOM 0 HB2 ALA A 86 81.834 -11.534 -9.300 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.964 -12.824 -8.824 1.00 1.00 H new ATOM 1293 N GLU A 87 85.705 -12.332 -8.263 1.00 1.00 N ATOM 1294 CA GLU A 87 86.867 -12.632 -7.429 1.00 1.00 C ATOM 1295 C GLU A 87 88.133 -11.887 -7.897 1.00 1.00 C ATOM 1296 O GLU A 87 89.249 -12.318 -7.619 1.00 1.00 O ATOM 1297 CB GLU A 87 87.125 -14.145 -7.463 1.00 1.00 C ATOM 1298 CG GLU A 87 88.042 -14.575 -6.288 1.00 1.00 C ATOM 1299 CD GLU A 87 89.049 -15.633 -6.750 1.00 1.00 C ATOM 1300 OE1 GLU A 87 89.800 -15.345 -7.670 1.00 1.00 O ATOM 1301 OE2 GLU A 87 89.050 -16.711 -6.181 1.00 1.00 O ATOM 0 H GLU A 87 85.401 -13.095 -8.867 1.00 1.00 H new ATOM 0 HA GLU A 87 86.648 -12.296 -6.416 1.00 1.00 H new ATOM 0 HB2 GLU A 87 86.178 -14.681 -7.406 1.00 1.00 H new ATOM 0 HB3 GLU A 87 87.589 -14.418 -8.411 1.00 1.00 H new ATOM 0 HG2 GLU A 87 88.572 -13.707 -5.897 1.00 1.00 H new ATOM 0 HG3 GLU A 87 87.436 -14.972 -5.473 1.00 1.00 H new ATOM 1308 N ALA A 88 87.963 -10.764 -8.598 1.00 1.00 N ATOM 1309 CA ALA A 88 89.111 -9.965 -9.077 1.00 1.00 C ATOM 1310 C ALA A 88 88.939 -8.521 -8.614 1.00 1.00 C ATOM 1311 O ALA A 88 89.877 -7.723 -8.590 1.00 1.00 O ATOM 1312 CB ALA A 88 89.187 -10.024 -10.603 1.00 1.00 C ATOM 0 H ALA A 88 87.051 -10.383 -8.849 1.00 1.00 H new ATOM 0 HA ALA A 88 90.037 -10.370 -8.668 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.035 -9.433 -10.948 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.312 -11.059 -10.921 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.268 -9.622 -11.029 1.00 1.00 H new ATOM 1318 N VAL A 89 87.704 -8.236 -8.226 1.00 1.00 N ATOM 1319 CA VAL A 89 87.324 -6.925 -7.712 1.00 1.00 C ATOM 1320 C VAL A 89 87.239 -6.991 -6.197 1.00 1.00 C ATOM 1321 O VAL A 89 86.421 -6.311 -5.591 1.00 1.00 O ATOM 1322 CB VAL A 89 86.022 -6.395 -8.325 1.00 1.00 C ATOM 1323 CG1 VAL A 89 86.167 -6.349 -9.847 1.00 1.00 C ATOM 1324 CG2 VAL A 89 84.848 -7.290 -7.958 1.00 1.00 C ATOM 0 H VAL A 89 86.936 -8.906 -8.258 1.00 1.00 H new ATOM 0 HA VAL A 89 88.094 -6.212 -8.005 1.00 1.00 H new ATOM 0 HB VAL A 89 85.832 -5.396 -7.934 1.00 1.00 H new ATOM 0 HG11 VAL A 89 85.244 -5.973 -10.289 1.00 1.00 H new ATOM 0 HG12 VAL A 89 86.993 -5.689 -10.114 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.367 -7.352 -10.224 1.00 1.00 H new ATOM 0 HG21 VAL A 89 83.935 -6.894 -8.404 1.00 1.00 H new ATOM 0 HG22 VAL A 89 85.028 -8.298 -8.333 1.00 1.00 H new ATOM 0 HG23 VAL A 89 84.739 -7.320 -6.874 1.00 1.00 H new ATOM 1334 N GLY A 90 88.105 -7.809 -5.573 1.00 1.00 N ATOM 1335 CA GLY A 90 88.119 -7.927 -4.125 1.00 1.00 C ATOM 1336 C GLY A 90 88.635 -6.643 -3.471 1.00 1.00 C ATOM 1337 O GLY A 90 88.133 -6.247 -2.420 1.00 1.00 O ATOM 0 H GLY A 90 88.794 -8.388 -6.053 1.00 1.00 H new ATOM 0 HA2 GLY A 90 87.113 -8.143 -3.765 1.00 1.00 H new ATOM 0 HA3 GLY A 90 88.749 -8.767 -3.832 1.00 1.00 H new ATOM 1341 N PRO A 91 89.593 -5.955 -4.076 1.00 1.00 N ATOM 1342 CA PRO A 91 90.116 -4.666 -3.521 1.00 1.00 C ATOM 1343 C PRO A 91 88.966 -3.734 -3.145 1.00 1.00 C ATOM 1344 O PRO A 91 89.162 -2.690 -2.529 1.00 1.00 O ATOM 1345 CB PRO A 91 90.968 -4.113 -4.665 1.00 1.00 C ATOM 1346 CG PRO A 91 91.458 -5.334 -5.366 1.00 1.00 C ATOM 1347 CD PRO A 91 90.290 -6.317 -5.326 1.00 1.00 C ATOM 0 HA PRO A 91 90.690 -4.783 -2.602 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.382 -3.478 -5.330 1.00 1.00 H new ATOM 0 HB3 PRO A 91 91.794 -3.507 -4.292 1.00 1.00 H new ATOM 0 HG2 PRO A 91 91.748 -5.109 -6.392 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.337 -5.747 -4.870 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.642 -6.209 -6.195 1.00 1.00 H new ATOM 0 HD3 PRO A 91 90.633 -7.351 -5.311 1.00 1.00 H new ATOM 1355 N HIS A 92 87.767 -4.154 -3.527 1.00 1.00 N ATOM 1356 CA HIS A 92 86.578 -3.389 -3.233 1.00 1.00 C ATOM 1357 C HIS A 92 86.504 -3.208 -1.728 1.00 1.00 C ATOM 1358 O HIS A 92 85.854 -2.301 -1.237 1.00 1.00 O ATOM 1359 CB HIS A 92 85.326 -4.139 -3.717 1.00 1.00 C ATOM 1360 CG HIS A 92 85.106 -5.396 -2.892 1.00 1.00 C ATOM 1361 ND1 HIS A 92 85.172 -5.391 -1.507 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.808 -6.696 -3.239 1.00 1.00 C ATOM 1363 CE1 HIS A 92 84.928 -6.636 -1.075 1.00 1.00 C ATOM 1364 NE2 HIS A 92 84.698 -7.475 -2.086 1.00 1.00 N ATOM 0 H HIS A 92 87.600 -5.020 -4.040 1.00 1.00 H new ATOM 0 HA HIS A 92 86.621 -2.425 -3.741 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.454 -3.490 -3.641 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.437 -4.402 -4.769 1.00 1.00 H new ATOM 0 HD2 HIS A 92 84.679 -7.057 -4.249 1.00 1.00 H new ATOM 0 HE1 HIS A 92 84.919 -6.925 -0.034 1.00 1.00 H new ATOM 0 HE2 HIS A 92 84.487 -8.471 -2.029 1.00 1.00 H new ATOM 1372 N LEU A 93 87.214 -4.070 -1.000 1.00 1.00 N ATOM 1373 CA LEU A 93 87.237 -3.963 0.447 1.00 1.00 C ATOM 1374 C LEU A 93 87.926 -2.660 0.824 1.00 1.00 C ATOM 1375 O LEU A 93 87.337 -1.806 1.489 1.00 1.00 O ATOM 1376 CB LEU A 93 87.947 -5.182 1.078 1.00 1.00 C ATOM 1377 CG LEU A 93 89.373 -5.386 0.480 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.461 -4.796 1.409 1.00 1.00 C ATOM 1379 CD2 LEU A 93 89.649 -6.890 0.284 1.00 1.00 C ATOM 0 H LEU A 93 87.769 -4.834 -1.385 1.00 1.00 H new ATOM 0 HA LEU A 93 86.218 -3.956 0.835 1.00 1.00 H new ATOM 0 HB2 LEU A 93 88.020 -5.044 2.157 1.00 1.00 H new ATOM 0 HB3 LEU A 93 87.350 -6.079 0.911 1.00 1.00 H new ATOM 0 HG LEU A 93 89.409 -4.868 -0.478 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.444 -4.954 0.965 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.289 -3.727 1.538 1.00 1.00 H new ATOM 0 HD13 LEU A 93 90.418 -5.290 2.379 1.00 1.00 H new ATOM 0 HD21 LEU A 93 90.647 -7.025 -0.134 1.00 1.00 H new ATOM 0 HD22 LEU A 93 89.586 -7.400 1.245 1.00 1.00 H new ATOM 0 HD23 LEU A 93 88.910 -7.310 -0.398 1.00 1.00 H new ATOM 1391 N ALA A 94 89.170 -2.499 0.382 1.00 1.00 N ATOM 1392 CA ALA A 94 89.901 -1.280 0.680 1.00 1.00 C ATOM 1393 C ALA A 94 89.085 -0.086 0.207 1.00 1.00 C ATOM 1394 O ALA A 94 88.805 0.831 0.978 1.00 1.00 O ATOM 1395 CB ALA A 94 91.278 -1.285 -0.007 1.00 1.00 C ATOM 0 H ALA A 94 89.682 -3.185 -0.173 1.00 1.00 H new ATOM 0 HA ALA A 94 90.063 -1.215 1.756 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.807 -0.362 0.231 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.858 -2.137 0.347 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.146 -1.359 -1.086 1.00 1.00 H new ATOM 1401 N ARG A 95 88.704 -0.105 -1.062 1.00 1.00 N ATOM 1402 CA ARG A 95 87.912 1.000 -1.573 1.00 1.00 C ATOM 1403 C ARG A 95 86.642 1.096 -0.748 1.00 1.00 C ATOM 1404 O ARG A 95 86.346 2.109 -0.093 1.00 1.00 O ATOM 1405 CB ARG A 95 87.546 0.833 -3.061 1.00 1.00 C ATOM 1406 CG ARG A 95 88.695 1.305 -3.963 1.00 1.00 C ATOM 1407 CD ARG A 95 88.160 1.584 -5.373 1.00 1.00 C ATOM 1408 NE ARG A 95 87.529 0.385 -5.928 1.00 1.00 N ATOM 1409 CZ ARG A 95 86.453 0.456 -6.715 1.00 1.00 C ATOM 1410 NH1 ARG A 95 85.931 1.612 -7.030 1.00 1.00 N ATOM 1411 NH2 ARG A 95 85.920 -0.638 -7.178 1.00 1.00 N ATOM 0 H ARG A 95 88.920 -0.842 -1.733 1.00 1.00 H new ATOM 0 HA ARG A 95 88.509 1.909 -1.494 1.00 1.00 H new ATOM 0 HB2 ARG A 95 87.321 -0.213 -3.269 1.00 1.00 H new ATOM 0 HB3 ARG A 95 86.645 1.404 -3.284 1.00 1.00 H new ATOM 0 HG2 ARG A 95 89.148 2.206 -3.550 1.00 1.00 H new ATOM 0 HG3 ARG A 95 89.475 0.545 -4.003 1.00 1.00 H new ATOM 0 HD2 ARG A 95 87.438 2.400 -5.340 1.00 1.00 H new ATOM 0 HD3 ARG A 95 88.975 1.906 -6.021 1.00 1.00 H new ATOM 0 HE ARG A 95 87.922 -0.530 -5.707 1.00 1.00 H new ATOM 0 HH11 ARG A 95 86.346 2.473 -6.674 1.00 1.00 H new ATOM 0 HH12 ARG A 95 85.109 1.653 -7.632 1.00 1.00 H new ATOM 0 HH21 ARG A 95 86.325 -1.543 -6.939 1.00 1.00 H new ATOM 0 HH22 ARG A 95 85.098 -0.590 -7.780 1.00 1.00 H new ATOM 1425 N ALA A 96 85.849 0.064 -0.706 1.00 1.00 N ATOM 1426 CA ALA A 96 84.647 0.170 0.050 1.00 1.00 C ATOM 1427 C ALA A 96 84.914 0.734 1.434 1.00 1.00 C ATOM 1428 O ALA A 96 83.966 0.899 2.177 1.00 1.00 O ATOM 1429 CB ALA A 96 83.884 -1.130 0.030 1.00 1.00 C ATOM 0 H ALA A 96 86.009 -0.830 -1.171 1.00 1.00 H new ATOM 0 HA ALA A 96 83.986 0.897 -0.422 1.00 1.00 H new ATOM 0 HB1 ALA A 96 82.970 -1.024 0.614 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.630 -1.387 -0.998 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.500 -1.920 0.460 1.00 1.00 H new ATOM 1435 N LEU A 97 86.214 0.769 1.856 1.00 1.00 N ATOM 1436 CA LEU A 97 86.623 1.039 3.258 1.00 1.00 C ATOM 1437 C LEU A 97 85.415 1.137 4.148 1.00 1.00 C ATOM 1438 O LEU A 97 85.393 0.404 5.106 1.00 1.00 O ATOM 1439 CB LEU A 97 87.394 2.397 3.225 1.00 1.00 C ATOM 1440 CG LEU A 97 87.385 3.185 4.574 1.00 1.00 C ATOM 1441 CD1 LEU A 97 88.516 2.682 5.480 1.00 1.00 C ATOM 1442 CD2 LEU A 97 87.619 4.676 4.285 1.00 1.00 C ATOM 0 H LEU A 97 87.003 0.610 1.229 1.00 1.00 H new ATOM 0 HA LEU A 97 87.246 0.238 3.655 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.428 2.205 2.939 1.00 1.00 H new ATOM 0 HB3 LEU A 97 86.960 3.027 2.449 1.00 1.00 H new ATOM 0 HG LEU A 97 86.425 3.037 5.068 1.00 1.00 H new ATOM 0 HD11 LEU A 97 88.504 3.236 6.419 1.00 1.00 H new ATOM 0 HD12 LEU A 97 88.375 1.620 5.683 1.00 1.00 H new ATOM 0 HD13 LEU A 97 89.474 2.832 4.983 1.00 1.00 H new ATOM 0 HD21 LEU A 97 87.614 5.233 5.222 1.00 1.00 H new ATOM 0 HD22 LEU A 97 88.582 4.804 3.792 1.00 1.00 H new ATOM 0 HD23 LEU A 97 86.827 5.050 3.636 1.00 1.00 H new ATOM 1454 N GLY A 98 84.398 1.913 3.909 1.00 1.00 N ATOM 1455 CA GLY A 98 83.254 1.821 4.788 1.00 1.00 C ATOM 1456 C GLY A 98 82.889 0.331 4.942 1.00 1.00 C ATOM 1457 O GLY A 98 82.304 -0.069 5.955 1.00 1.00 O ATOM 0 H GLY A 98 84.329 2.590 3.150 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.484 2.259 5.759 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.412 2.379 4.378 1.00 1.00 H new ATOM 1461 N GLN A 99 83.285 -0.510 3.944 1.00 1.00 N ATOM 1462 CA GLN A 99 83.010 -1.943 4.070 1.00 1.00 C ATOM 1463 C GLN A 99 83.875 -2.467 5.177 1.00 1.00 C ATOM 1464 O GLN A 99 83.597 -3.509 5.785 1.00 1.00 O ATOM 1465 CB GLN A 99 83.342 -2.688 2.793 1.00 1.00 C ATOM 1466 CG GLN A 99 83.142 -4.198 2.933 1.00 1.00 C ATOM 1467 CD GLN A 99 83.282 -4.824 1.547 1.00 1.00 C ATOM 1468 OE1 GLN A 99 83.534 -4.111 0.574 1.00 1.00 O ATOM 1469 NE2 GLN A 99 83.131 -6.104 1.394 1.00 1.00 N ATOM 0 H GLN A 99 83.769 -0.227 3.092 1.00 1.00 H new ATOM 0 HA GLN A 99 81.950 -2.091 4.275 1.00 1.00 H new ATOM 0 HB2 GLN A 99 82.715 -2.314 1.983 1.00 1.00 H new ATOM 0 HB3 GLN A 99 84.376 -2.485 2.515 1.00 1.00 H new ATOM 0 HG2 GLN A 99 83.879 -4.618 3.617 1.00 1.00 H new ATOM 0 HG3 GLN A 99 82.159 -4.415 3.351 1.00 1.00 H new ATOM 0 HE21 GLN A 99 82.922 -6.693 2.200 1.00 1.00 H new ATOM 0 HE22 GLN A 99 83.221 -6.521 0.467 1.00 1.00 H new ATOM 1478 N ILE A 100 84.912 -1.704 5.490 1.00 1.00 N ATOM 1479 CA ILE A 100 85.789 -2.073 6.588 1.00 1.00 C ATOM 1480 C ILE A 100 84.971 -1.990 7.858 1.00 1.00 C ATOM 1481 O ILE A 100 85.057 -2.870 8.711 1.00 1.00 O ATOM 1482 CB ILE A 100 87.041 -1.140 6.673 1.00 1.00 C ATOM 1483 CG1 ILE A 100 88.260 -1.934 7.214 1.00 1.00 C ATOM 1484 CG2 ILE A 100 86.796 0.076 7.603 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.949 -2.701 6.076 1.00 1.00 C ATOM 0 H ILE A 100 85.163 -0.841 5.008 1.00 1.00 H new ATOM 0 HA ILE A 100 86.172 -3.082 6.434 1.00 1.00 H new ATOM 0 HB ILE A 100 87.236 -0.775 5.665 1.00 1.00 H new ATOM 0 HG12 ILE A 100 88.969 -1.250 7.681 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.934 -2.631 7.986 1.00 1.00 H new ATOM 0 HG21 ILE A 100 87.691 0.697 7.633 1.00 1.00 H new ATOM 0 HG22 ILE A 100 85.960 0.662 7.222 1.00 1.00 H new ATOM 0 HG23 ILE A 100 86.565 -0.276 8.608 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.802 -3.252 6.473 1.00 1.00 H new ATOM 0 HD12 ILE A 100 88.242 -3.399 5.628 1.00 1.00 H new ATOM 0 HD13 ILE A 100 89.293 -1.997 5.319 1.00 1.00 H new ATOM 1497 N VAL A 101 84.158 -0.930 7.980 1.00 1.00 N ATOM 1498 CA VAL A 101 83.321 -0.800 9.162 1.00 1.00 C ATOM 1499 C VAL A 101 82.494 -2.072 9.261 1.00 1.00 C ATOM 1500 O VAL A 101 82.571 -2.804 10.235 1.00 1.00 O ATOM 1501 CB VAL A 101 82.391 0.421 9.052 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.528 0.529 10.314 1.00 1.00 C ATOM 1503 CG2 VAL A 101 83.220 1.695 8.910 1.00 1.00 C ATOM 0 H VAL A 101 84.069 -0.179 7.296 1.00 1.00 H new ATOM 0 HA VAL A 101 83.940 -0.657 10.048 1.00 1.00 H new ATOM 0 HB VAL A 101 81.753 0.299 8.177 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.871 1.395 10.232 1.00 1.00 H new ATOM 0 HG12 VAL A 101 80.927 -0.374 10.422 1.00 1.00 H new ATOM 0 HG13 VAL A 101 82.172 0.643 11.186 1.00 1.00 H new ATOM 0 HG21 VAL A 101 82.555 2.555 8.833 1.00 1.00 H new ATOM 0 HG22 VAL A 101 83.862 1.810 9.783 1.00 1.00 H new ATOM 0 HG23 VAL A 101 83.836 1.630 8.013 1.00 1.00 H new ATOM 1513 N CYS A 102 81.698 -2.336 8.242 1.00 1.00 N ATOM 1514 CA CYS A 102 80.860 -3.520 8.237 1.00 1.00 C ATOM 1515 C CYS A 102 81.646 -4.774 8.668 1.00 1.00 C ATOM 1516 O CYS A 102 81.061 -5.756 9.110 1.00 1.00 O ATOM 1517 CB CYS A 102 80.227 -3.695 6.835 1.00 1.00 C ATOM 1518 SG CYS A 102 81.123 -4.900 5.816 1.00 1.00 S ATOM 0 H CYS A 102 81.614 -1.750 7.411 1.00 1.00 H new ATOM 0 HA CYS A 102 80.062 -3.390 8.969 1.00 1.00 H new ATOM 0 HB2 CYS A 102 79.191 -4.015 6.945 1.00 1.00 H new ATOM 0 HB3 CYS A 102 80.211 -2.732 6.324 1.00 1.00 H new ATOM 0 HG CYS A 102 82.302 -4.434 5.528 1.00 1.00 H new ATOM 1523 N ARG A 103 82.970 -4.708 8.611 1.00 1.00 N ATOM 1524 CA ARG A 103 83.809 -5.836 9.067 1.00 1.00 C ATOM 1525 C ARG A 103 84.210 -5.666 10.546 1.00 1.00 C ATOM 1526 O ARG A 103 84.149 -6.599 11.350 1.00 1.00 O ATOM 1527 CB ARG A 103 85.068 -5.973 8.151 1.00 1.00 C ATOM 1528 CG ARG A 103 86.292 -6.615 8.909 1.00 1.00 C ATOM 1529 CD ARG A 103 86.985 -7.733 8.093 1.00 1.00 C ATOM 1530 NE ARG A 103 88.148 -7.212 7.364 1.00 1.00 N ATOM 1531 CZ ARG A 103 89.282 -7.918 7.249 1.00 1.00 C ATOM 1532 NH1 ARG A 103 89.382 -9.109 7.783 1.00 1.00 N ATOM 1533 NH2 ARG A 103 90.297 -7.425 6.595 1.00 1.00 N ATOM 0 H ARG A 103 83.491 -3.904 8.261 1.00 1.00 H new ATOM 0 HA ARG A 103 83.227 -6.755 8.991 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.819 -6.585 7.284 1.00 1.00 H new ATOM 0 HB3 ARG A 103 85.351 -4.989 7.776 1.00 1.00 H new ATOM 0 HG2 ARG A 103 87.019 -5.836 9.140 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.950 -7.024 9.860 1.00 1.00 H new ATOM 0 HD2 ARG A 103 87.300 -8.534 8.762 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.275 -8.167 7.389 1.00 1.00 H new ATOM 0 HE ARG A 103 88.092 -6.289 6.934 1.00 1.00 H new ATOM 0 HH11 ARG A 103 88.593 -9.508 8.292 1.00 1.00 H new ATOM 0 HH12 ARG A 103 90.249 -9.638 7.690 1.00 1.00 H new ATOM 0 HH21 ARG A 103 90.229 -6.500 6.170 1.00 1.00 H new ATOM 0 HH22 ARG A 103 91.159 -7.964 6.509 1.00 1.00 H new ATOM 1547 N TYR A 104 84.608 -4.448 10.852 1.00 1.00 N ATOM 1548 CA TYR A 104 85.038 -3.981 12.176 1.00 1.00 C ATOM 1549 C TYR A 104 83.972 -3.083 12.822 1.00 1.00 C ATOM 1550 O TYR A 104 84.286 -2.319 13.732 1.00 1.00 O ATOM 1551 CB TYR A 104 86.465 -3.362 12.116 1.00 1.00 C ATOM 1552 CG TYR A 104 86.490 -1.904 12.495 1.00 1.00 C ATOM 1553 CD1 TYR A 104 86.248 -0.949 11.522 1.00 1.00 C ATOM 1554 CD2 TYR A 104 86.766 -1.517 13.814 1.00 1.00 C ATOM 1555 CE1 TYR A 104 86.273 0.412 11.849 1.00 1.00 C ATOM 1556 CE2 TYR A 104 86.792 -0.161 14.149 1.00 1.00 C ATOM 1557 CZ TYR A 104 86.544 0.806 13.167 1.00 1.00 C ATOM 1558 OH TYR A 104 86.572 2.147 13.502 1.00 1.00 O ATOM 0 H TYR A 104 84.646 -3.708 10.151 1.00 1.00 H new ATOM 0 HA TYR A 104 85.128 -4.836 12.845 1.00 1.00 H new ATOM 0 HB2 TYR A 104 87.124 -3.917 12.784 1.00 1.00 H new ATOM 0 HB3 TYR A 104 86.863 -3.477 11.108 1.00 1.00 H new ATOM 0 HD1 TYR A 104 86.039 -1.255 10.508 1.00 1.00 H new ATOM 0 HD2 TYR A 104 86.958 -2.265 14.569 1.00 1.00 H new ATOM 0 HE1 TYR A 104 86.084 1.156 11.089 1.00 1.00 H new ATOM 0 HE2 TYR A 104 87.003 0.141 15.164 1.00 1.00 H new ATOM 0 HH TYR A 104 86.773 2.242 14.456 1.00 1.00 H new ATOM 1568 N GLY A 105 82.703 -3.178 12.404 1.00 1.00 N ATOM 1569 CA GLY A 105 81.699 -2.346 13.043 1.00 1.00 C ATOM 1570 C GLY A 105 80.272 -2.710 12.654 1.00 1.00 C ATOM 1571 O GLY A 105 79.347 -2.128 13.204 1.00 1.00 O ATOM 0 H GLY A 105 82.367 -3.793 11.663 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.805 -2.429 14.125 1.00 1.00 H new ATOM 0 HA3 GLY A 105 81.883 -1.304 12.783 1.00 1.00 H new ATOM 1575 N ALA A 106 80.100 -3.619 11.684 1.00 1.00 N ATOM 1576 CA ALA A 106 78.769 -4.003 11.202 1.00 1.00 C ATOM 1577 C ALA A 106 77.689 -3.939 12.270 1.00 1.00 C ATOM 1578 O ALA A 106 77.134 -4.961 12.661 1.00 1.00 O ATOM 1579 CB ALA A 106 78.818 -5.426 10.588 1.00 1.00 C ATOM 0 H ALA A 106 80.868 -4.102 11.218 1.00 1.00 H new ATOM 0 HA ALA A 106 78.496 -3.270 10.443 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.826 -5.703 10.233 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.519 -5.438 9.753 1.00 1.00 H new ATOM 0 HB3 ALA A 106 79.144 -6.138 11.346 1.00 1.00 H new ATOM 1585 N THR A 107 77.323 -2.748 12.711 1.00 1.00 N ATOM 1586 CA THR A 107 76.250 -2.635 13.658 1.00 1.00 C ATOM 1587 C THR A 107 75.001 -2.445 12.837 1.00 1.00 C ATOM 1588 O THR A 107 73.908 -2.274 13.376 1.00 1.00 O ATOM 1589 CB THR A 107 76.455 -1.429 14.591 1.00 1.00 C ATOM 1590 OG1 THR A 107 75.323 -1.292 15.437 1.00 1.00 O ATOM 1591 CG2 THR A 107 76.632 -0.142 13.777 1.00 1.00 C ATOM 0 H THR A 107 77.750 -1.865 12.429 1.00 1.00 H new ATOM 0 HA THR A 107 76.195 -3.519 14.294 1.00 1.00 H new ATOM 0 HB THR A 107 77.352 -1.596 15.187 1.00 1.00 H new ATOM 0 HG1 THR A 107 74.511 -1.515 14.936 1.00 1.00 H new ATOM 0 HG21 THR A 107 76.776 0.700 14.454 1.00 1.00 H new ATOM 0 HG22 THR A 107 77.503 -0.239 13.128 1.00 1.00 H new ATOM 0 HG23 THR A 107 75.744 0.029 13.169 1.00 1.00 H new ATOM 1599 N VAL A 108 75.161 -2.516 11.491 1.00 1.00 N ATOM 1600 CA VAL A 108 74.027 -2.385 10.597 1.00 1.00 C ATOM 1601 C VAL A 108 73.368 -3.746 10.359 1.00 1.00 C ATOM 1602 O VAL A 108 72.161 -3.878 10.577 1.00 1.00 O ATOM 1603 CB VAL A 108 74.414 -1.706 9.261 1.00 1.00 C ATOM 1604 CG1 VAL A 108 75.357 -2.593 8.440 1.00 1.00 C ATOM 1605 CG2 VAL A 108 73.138 -1.436 8.447 1.00 1.00 C ATOM 0 H VAL A 108 76.057 -2.661 11.026 1.00 1.00 H new ATOM 0 HA VAL A 108 73.301 -1.733 11.082 1.00 1.00 H new ATOM 0 HB VAL A 108 74.930 -0.772 9.485 1.00 1.00 H new ATOM 0 HG11 VAL A 108 75.611 -2.089 7.507 1.00 1.00 H new ATOM 0 HG12 VAL A 108 76.267 -2.782 9.010 1.00 1.00 H new ATOM 0 HG13 VAL A 108 74.865 -3.540 8.218 1.00 1.00 H new ATOM 0 HG21 VAL A 108 73.402 -0.958 7.504 1.00 1.00 H new ATOM 0 HG22 VAL A 108 72.629 -2.378 8.245 1.00 1.00 H new ATOM 0 HG23 VAL A 108 72.477 -0.780 9.014 1.00 1.00 H new ATOM 1615 N ILE A 109 74.101 -4.774 9.857 1.00 1.00 N ATOM 1616 CA ILE A 109 73.466 -6.063 9.561 1.00 1.00 C ATOM 1617 C ILE A 109 72.878 -6.782 10.790 1.00 1.00 C ATOM 1618 O ILE A 109 71.836 -7.414 10.664 1.00 1.00 O ATOM 1619 CB ILE A 109 74.465 -7.014 8.765 1.00 1.00 C ATOM 1620 CG1 ILE A 109 74.877 -8.276 9.579 1.00 1.00 C ATOM 1621 CG2 ILE A 109 75.731 -6.245 8.368 1.00 1.00 C ATOM 1622 CD1 ILE A 109 75.896 -9.116 8.791 1.00 1.00 C ATOM 0 H ILE A 109 75.100 -4.730 9.657 1.00 1.00 H new ATOM 0 HA ILE A 109 72.609 -5.829 8.930 1.00 1.00 H new ATOM 0 HB ILE A 109 73.927 -7.349 7.878 1.00 1.00 H new ATOM 0 HG12 ILE A 109 75.306 -7.975 10.535 1.00 1.00 H new ATOM 0 HG13 ILE A 109 73.995 -8.877 9.801 1.00 1.00 H new ATOM 0 HG21 ILE A 109 76.404 -6.908 7.825 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.460 -5.402 7.732 1.00 1.00 H new ATOM 0 HG23 ILE A 109 76.230 -5.877 9.265 1.00 1.00 H new ATOM 0 HD11 ILE A 109 76.173 -9.994 9.375 1.00 1.00 H new ATOM 0 HD12 ILE A 109 75.454 -9.433 7.847 1.00 1.00 H new ATOM 0 HD13 ILE A 109 76.785 -8.517 8.592 1.00 1.00 H new ATOM 1634 N PRO A 110 73.492 -6.753 11.955 1.00 1.00 N ATOM 1635 CA PRO A 110 72.955 -7.520 13.123 1.00 1.00 C ATOM 1636 C PRO A 110 71.457 -7.299 13.368 1.00 1.00 C ATOM 1637 O PRO A 110 70.735 -8.249 13.658 1.00 1.00 O ATOM 1638 CB PRO A 110 73.822 -7.053 14.300 1.00 1.00 C ATOM 1639 CG PRO A 110 75.103 -6.621 13.660 1.00 1.00 C ATOM 1640 CD PRO A 110 74.706 -5.999 12.320 1.00 1.00 C ATOM 0 HA PRO A 110 73.014 -8.596 12.959 1.00 1.00 H new ATOM 0 HB2 PRO A 110 73.351 -6.233 14.842 1.00 1.00 H new ATOM 0 HB3 PRO A 110 73.986 -7.857 15.018 1.00 1.00 H new ATOM 0 HG2 PRO A 110 75.630 -5.900 14.286 1.00 1.00 H new ATOM 0 HG3 PRO A 110 75.774 -7.468 13.515 1.00 1.00 H new ATOM 0 HD2 PRO A 110 74.506 -4.932 12.413 1.00 1.00 H new ATOM 0 HD3 PRO A 110 75.492 -6.112 11.573 1.00 1.00 H new ATOM 1648 N ASN A 111 70.981 -6.062 13.320 1.00 1.00 N ATOM 1649 CA ASN A 111 69.562 -5.843 13.601 1.00 1.00 C ATOM 1650 C ASN A 111 68.696 -6.449 12.489 1.00 1.00 C ATOM 1651 O ASN A 111 67.979 -7.431 12.711 1.00 1.00 O ATOM 1652 CB ASN A 111 69.290 -4.342 13.742 1.00 1.00 C ATOM 1653 CG ASN A 111 67.795 -4.079 13.851 1.00 1.00 C ATOM 1654 OD1 ASN A 111 67.219 -4.195 14.933 1.00 1.00 O ATOM 1655 ND2 ASN A 111 67.130 -3.725 12.789 1.00 1.00 N ATOM 0 H ASN A 111 71.524 -5.227 13.100 1.00 1.00 H new ATOM 0 HA ASN A 111 69.303 -6.337 14.538 1.00 1.00 H new ATOM 0 HB2 ASN A 111 69.798 -3.956 14.625 1.00 1.00 H new ATOM 0 HB3 ASN A 111 69.697 -3.810 12.882 1.00 1.00 H new ATOM 0 HD21 ASN A 111 66.128 -3.543 12.852 1.00 1.00 H new ATOM 0 HD22 ASN A 111 67.611 -3.630 11.894 1.00 1.00 H new ATOM 1662 N ILE A 112 68.770 -5.873 11.288 1.00 1.00 N ATOM 1663 CA ILE A 112 67.996 -6.380 10.155 1.00 1.00 C ATOM 1664 C ILE A 112 68.271 -7.873 10.001 1.00 1.00 C ATOM 1665 O ILE A 112 67.503 -8.607 9.413 1.00 1.00 O ATOM 1666 CB ILE A 112 68.429 -5.632 8.881 1.00 1.00 C ATOM 1667 CG1 ILE A 112 69.855 -6.056 8.513 1.00 1.00 C ATOM 1668 CG2 ILE A 112 68.409 -4.125 9.152 1.00 1.00 C ATOM 1669 CD1 ILE A 112 70.428 -5.129 7.435 1.00 1.00 C ATOM 0 H ILE A 112 69.352 -5.063 11.076 1.00 1.00 H new ATOM 0 HA ILE A 112 66.930 -6.223 10.321 1.00 1.00 H new ATOM 0 HB ILE A 112 67.748 -5.869 8.063 1.00 1.00 H new ATOM 0 HG12 ILE A 112 70.489 -6.029 9.399 1.00 1.00 H new ATOM 0 HG13 ILE A 112 69.854 -7.085 8.153 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.715 -3.590 8.253 1.00 1.00 H new ATOM 0 HG22 ILE A 112 67.401 -3.819 9.431 1.00 1.00 H new ATOM 0 HG23 ILE A 112 69.097 -3.892 9.965 1.00 1.00 H new ATOM 0 HD11 ILE A 112 71.441 -5.444 7.185 1.00 1.00 H new ATOM 0 HD12 ILE A 112 69.803 -5.178 6.543 1.00 1.00 H new ATOM 0 HD13 ILE A 112 70.448 -4.105 7.809 1.00 1.00 H new ATOM 1681 N ASN A 113 69.414 -8.257 10.524 1.00 1.00 N ATOM 1682 CA ASN A 113 69.825 -9.665 10.418 1.00 1.00 C ATOM 1683 C ASN A 113 68.774 -10.518 11.086 1.00 1.00 C ATOM 1684 O ASN A 113 68.283 -11.474 10.490 1.00 1.00 O ATOM 1685 CB ASN A 113 71.207 -9.991 10.993 1.00 1.00 C ATOM 1686 CG ASN A 113 71.426 -11.505 10.998 1.00 1.00 C ATOM 1687 OD1 ASN A 113 70.930 -12.210 10.117 1.00 1.00 O ATOM 1688 ND2 ASN A 113 72.145 -12.053 11.940 1.00 1.00 N ATOM 0 H ASN A 113 70.067 -7.647 11.015 1.00 1.00 H new ATOM 0 HA ASN A 113 69.913 -9.880 9.353 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.981 -9.505 10.399 1.00 1.00 H new ATOM 0 HB3 ASN A 113 71.290 -9.600 12.007 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.295 -13.062 11.945 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.557 -11.472 12.670 1.00 1.00 H new ATOM 1695 N ALA A 114 68.415 -10.187 12.321 1.00 1.00 N ATOM 1696 CA ALA A 114 67.414 -10.956 13.020 1.00 1.00 C ATOM 1697 C ALA A 114 66.101 -10.971 12.257 1.00 1.00 C ATOM 1698 O ALA A 114 65.367 -11.948 12.339 1.00 1.00 O ATOM 1699 CB ALA A 114 67.190 -10.375 14.419 1.00 1.00 C ATOM 0 H ALA A 114 68.800 -9.402 12.846 1.00 1.00 H new ATOM 0 HA ALA A 114 67.774 -11.981 13.103 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.433 -10.961 14.940 1.00 1.00 H new ATOM 0 HB2 ALA A 114 68.124 -10.408 14.980 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.854 -9.342 14.334 1.00 1.00 H new ATOM 1705 N ALA A 115 65.802 -9.928 11.478 1.00 1.00 N ATOM 1706 CA ALA A 115 64.572 -9.935 10.681 1.00 1.00 C ATOM 1707 C ALA A 115 64.802 -10.746 9.403 1.00 1.00 C ATOM 1708 O ALA A 115 64.050 -11.639 9.094 1.00 1.00 O ATOM 1709 CB ALA A 115 64.142 -8.505 10.329 1.00 1.00 C ATOM 0 H ALA A 115 66.376 -9.090 11.382 1.00 1.00 H new ATOM 0 HA ALA A 115 63.775 -10.393 11.266 1.00 1.00 H new ATOM 0 HB1 ALA A 115 63.227 -8.535 9.737 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.963 -7.943 11.246 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.930 -8.019 9.754 1.00 1.00 H new ATOM 1715 N ILE A 116 65.898 -10.406 8.718 1.00 1.00 N ATOM 1716 CA ILE A 116 66.275 -11.111 7.464 1.00 1.00 C ATOM 1717 C ILE A 116 66.042 -12.585 7.756 1.00 1.00 C ATOM 1718 O ILE A 116 65.395 -13.320 7.021 1.00 1.00 O ATOM 1719 CB ILE A 116 67.742 -10.874 7.058 1.00 1.00 C ATOM 1720 CG1 ILE A 116 67.870 -9.477 6.427 1.00 1.00 C ATOM 1721 CG2 ILE A 116 68.174 -11.943 6.042 1.00 1.00 C ATOM 1722 CD1 ILE A 116 69.348 -9.136 6.187 1.00 1.00 C ATOM 0 H ILE A 116 66.538 -9.661 8.995 1.00 1.00 H new ATOM 0 HA ILE A 116 65.683 -10.741 6.627 1.00 1.00 H new ATOM 0 HB ILE A 116 68.382 -10.938 7.938 1.00 1.00 H new ATOM 0 HG12 ILE A 116 67.324 -9.445 5.484 1.00 1.00 H new ATOM 0 HG13 ILE A 116 67.419 -8.732 7.082 1.00 1.00 H new ATOM 0 HG21 ILE A 116 69.212 -11.774 5.755 1.00 1.00 H new ATOM 0 HG22 ILE A 116 68.078 -12.932 6.491 1.00 1.00 H new ATOM 0 HG23 ILE A 116 67.539 -11.882 5.158 1.00 1.00 H new ATOM 0 HD11 ILE A 116 69.425 -8.145 5.740 1.00 1.00 H new ATOM 0 HD12 ILE A 116 69.883 -9.148 7.137 1.00 1.00 H new ATOM 0 HD13 ILE A 116 69.787 -9.872 5.514 1.00 1.00 H new ATOM 1734 N GLU A 117 66.583 -12.936 8.901 1.00 1.00 N ATOM 1735 CA GLU A 117 66.436 -14.297 9.395 1.00 1.00 C ATOM 1736 C GLU A 117 64.968 -14.655 9.231 1.00 1.00 C ATOM 1737 O GLU A 117 64.623 -15.563 8.500 1.00 1.00 O ATOM 1738 CB GLU A 117 66.870 -14.512 10.854 1.00 1.00 C ATOM 1739 CG GLU A 117 66.498 -15.957 11.245 1.00 1.00 C ATOM 1740 CD GLU A 117 67.270 -16.421 12.478 1.00 1.00 C ATOM 1741 OE1 GLU A 117 67.963 -15.610 13.067 1.00 1.00 O ATOM 1742 OE2 GLU A 117 67.161 -17.593 12.805 1.00 1.00 O ATOM 0 H GLU A 117 67.121 -12.313 9.503 1.00 1.00 H new ATOM 0 HA GLU A 117 67.104 -14.939 8.820 1.00 1.00 H new ATOM 0 HB2 GLU A 117 67.943 -14.351 10.962 1.00 1.00 H new ATOM 0 HB3 GLU A 117 66.373 -13.798 11.510 1.00 1.00 H new ATOM 0 HG2 GLU A 117 65.427 -16.018 11.441 1.00 1.00 H new ATOM 0 HG3 GLU A 117 66.708 -16.626 10.410 1.00 1.00 H new ATOM 1749 N VAL A 118 64.104 -13.875 9.851 1.00 1.00 N ATOM 1750 CA VAL A 118 62.662 -14.110 9.703 1.00 1.00 C ATOM 1751 C VAL A 118 62.227 -13.886 8.245 1.00 1.00 C ATOM 1752 O VAL A 118 61.634 -14.773 7.635 1.00 1.00 O ATOM 1753 CB VAL A 118 61.853 -13.192 10.623 1.00 1.00 C ATOM 1754 CG1 VAL A 118 60.394 -13.649 10.619 1.00 1.00 C ATOM 1755 CG2 VAL A 118 62.393 -13.276 12.052 1.00 1.00 C ATOM 0 H VAL A 118 64.356 -13.089 10.450 1.00 1.00 H new ATOM 0 HA VAL A 118 62.467 -15.145 9.985 1.00 1.00 H new ATOM 0 HB VAL A 118 61.932 -12.165 10.267 1.00 1.00 H new ATOM 0 HG11 VAL A 118 59.808 -13.002 11.272 1.00 1.00 H new ATOM 0 HG12 VAL A 118 59.999 -13.595 9.605 1.00 1.00 H new ATOM 0 HG13 VAL A 118 60.334 -14.676 10.978 1.00 1.00 H new ATOM 0 HG21 VAL A 118 61.812 -12.620 12.700 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.315 -14.302 12.411 1.00 1.00 H new ATOM 0 HG23 VAL A 118 63.438 -12.966 12.065 1.00 1.00 H new ATOM 1765 N LEU A 119 62.506 -12.691 7.708 1.00 1.00 N ATOM 1766 CA LEU A 119 62.142 -12.298 6.359 1.00 1.00 C ATOM 1767 C LEU A 119 62.578 -13.295 5.281 1.00 1.00 C ATOM 1768 O LEU A 119 61.944 -13.314 4.228 1.00 1.00 O ATOM 1769 CB LEU A 119 62.708 -10.878 6.089 1.00 1.00 C ATOM 1770 CG LEU A 119 61.582 -9.807 6.072 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.500 -10.152 5.018 1.00 1.00 C ATOM 1772 CD2 LEU A 119 60.948 -9.676 7.479 1.00 1.00 C ATOM 0 H LEU A 119 63.003 -11.961 8.219 1.00 1.00 H new ATOM 0 HA LEU A 119 61.054 -12.290 6.297 1.00 1.00 H new ATOM 0 HB2 LEU A 119 63.440 -10.625 6.856 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.233 -10.870 5.134 1.00 1.00 H new ATOM 0 HG LEU A 119 62.025 -8.850 5.795 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.725 -9.386 5.028 1.00 1.00 H new ATOM 0 HD12 LEU A 119 60.956 -10.194 4.029 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.057 -11.119 5.255 1.00 1.00 H new ATOM 0 HD21 LEU A 119 60.161 -8.923 7.455 1.00 1.00 H new ATOM 0 HD22 LEU A 119 60.524 -10.635 7.778 1.00 1.00 H new ATOM 0 HD23 LEU A 119 61.713 -9.378 8.196 1.00 1.00 H new ATOM 1784 N GLY A 120 63.565 -14.191 5.504 1.00 1.00 N ATOM 1785 CA GLY A 120 63.877 -15.224 4.503 1.00 1.00 C ATOM 1786 C GLY A 120 64.015 -16.556 5.291 1.00 1.00 C ATOM 1787 O GLY A 120 63.184 -17.459 5.201 1.00 1.00 O ATOM 0 H GLY A 120 64.142 -14.218 6.345 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.087 -15.293 3.755 1.00 1.00 H new ATOM 0 HA3 GLY A 120 64.799 -14.987 3.972 1.00 1.00 H new ATOM 1791 N THR A 121 65.091 -16.579 6.075 1.00 1.00 N ATOM 1792 CA THR A 121 65.455 -17.707 6.963 1.00 1.00 C ATOM 1793 C THR A 121 66.964 -17.781 7.207 1.00 1.00 C ATOM 1794 O THR A 121 67.394 -18.236 8.267 1.00 1.00 O ATOM 1795 CB THR A 121 64.920 -19.042 6.409 1.00 1.00 C ATOM 1796 OG1 THR A 121 63.538 -19.150 6.732 1.00 1.00 O ATOM 1797 CG2 THR A 121 65.663 -20.226 7.038 1.00 1.00 C ATOM 0 H THR A 121 65.754 -15.805 6.120 1.00 1.00 H new ATOM 0 HA THR A 121 64.981 -17.523 7.927 1.00 1.00 H new ATOM 0 HB THR A 121 65.071 -19.061 5.330 1.00 1.00 H new ATOM 0 HG1 THR A 121 63.013 -18.606 6.108 1.00 1.00 H new ATOM 0 HG21 THR A 121 65.270 -21.159 6.633 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.726 -20.151 6.810 1.00 1.00 H new ATOM 0 HG23 THR A 121 65.522 -20.211 8.119 1.00 1.00 H new ATOM 1805 N GLY A 122 67.770 -17.380 6.225 1.00 1.00 N ATOM 1806 CA GLY A 122 69.233 -17.459 6.359 1.00 1.00 C ATOM 1807 C GLY A 122 69.741 -18.643 5.539 1.00 1.00 C ATOM 1808 O GLY A 122 70.924 -18.742 5.222 1.00 1.00 O ATOM 0 H GLY A 122 67.445 -17.001 5.336 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.694 -16.534 6.012 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.510 -17.579 7.406 1.00 1.00 H new ATOM 1812 N THR A 123 68.789 -19.513 5.210 1.00 1.00 N ATOM 1813 CA THR A 123 69.127 -20.685 4.394 1.00 1.00 C ATOM 1814 C THR A 123 69.792 -20.126 3.124 1.00 1.00 C ATOM 1815 O THR A 123 69.153 -19.901 2.097 1.00 1.00 O ATOM 1816 CB THR A 123 67.920 -21.594 4.049 1.00 1.00 C ATOM 1817 OG1 THR A 123 68.201 -22.284 2.836 1.00 1.00 O ATOM 1818 CG2 THR A 123 66.612 -20.800 3.863 1.00 1.00 C ATOM 0 H THR A 123 67.809 -19.438 5.483 1.00 1.00 H new ATOM 0 HA THR A 123 69.788 -21.344 4.957 1.00 1.00 H new ATOM 0 HB THR A 123 67.778 -22.280 4.884 1.00 1.00 H new ATOM 0 HG1 THR A 123 68.297 -21.637 2.106 1.00 1.00 H new ATOM 0 HG21 THR A 123 65.800 -21.487 3.623 1.00 1.00 H new ATOM 0 HG22 THR A 123 66.376 -20.267 4.784 1.00 1.00 H new ATOM 0 HG23 THR A 123 66.734 -20.084 3.050 1.00 1.00 H new ATOM 1826 N ASP A 124 71.106 -19.896 3.267 1.00 1.00 N ATOM 1827 CA ASP A 124 71.949 -19.344 2.196 1.00 1.00 C ATOM 1828 C ASP A 124 73.439 -19.552 2.464 1.00 1.00 C ATOM 1829 O ASP A 124 73.839 -19.910 3.571 1.00 1.00 O ATOM 1830 CB ASP A 124 71.707 -17.839 2.049 1.00 1.00 C ATOM 1831 CG ASP A 124 70.269 -17.565 1.633 1.00 1.00 C ATOM 1832 OD1 ASP A 124 69.867 -18.074 0.602 1.00 1.00 O ATOM 1833 OD2 ASP A 124 69.592 -16.842 2.348 1.00 1.00 O ATOM 0 H ASP A 124 71.615 -20.088 4.130 1.00 1.00 H new ATOM 0 HA ASP A 124 71.674 -19.876 1.285 1.00 1.00 H new ATOM 0 HB2 ASP A 124 71.920 -17.337 2.993 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.391 -17.426 1.307 1.00 1.00 H new ATOM 1838 N TYR A 125 74.247 -19.248 1.447 1.00 1.00 N ATOM 1839 CA TYR A 125 75.704 -19.310 1.540 1.00 1.00 C ATOM 1840 C TYR A 125 76.271 -18.147 0.692 1.00 1.00 C ATOM 1841 O TYR A 125 75.794 -17.891 -0.410 1.00 1.00 O ATOM 1842 CB TYR A 125 76.209 -20.694 1.069 1.00 1.00 C ATOM 1843 CG TYR A 125 77.529 -20.574 0.339 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.737 -20.583 1.047 1.00 1.00 C ATOM 1845 CD2 TYR A 125 77.530 -20.439 -1.051 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.948 -20.455 0.357 1.00 1.00 C ATOM 1847 CE2 TYR A 125 78.738 -20.315 -1.739 1.00 1.00 C ATOM 1848 CZ TYR A 125 79.948 -20.321 -1.036 1.00 1.00 C ATOM 1849 OH TYR A 125 81.137 -20.188 -1.720 1.00 1.00 O ATOM 0 H TYR A 125 73.906 -18.951 0.533 1.00 1.00 H new ATOM 0 HA TYR A 125 76.045 -19.197 2.569 1.00 1.00 H new ATOM 0 HB2 TYR A 125 76.324 -21.354 1.929 1.00 1.00 H new ATOM 0 HB3 TYR A 125 75.468 -21.151 0.413 1.00 1.00 H new ATOM 0 HD1 TYR A 125 78.734 -20.688 2.122 1.00 1.00 H new ATOM 0 HD2 TYR A 125 76.596 -20.431 -1.593 1.00 1.00 H new ATOM 0 HE1 TYR A 125 80.882 -20.460 0.899 1.00 1.00 H new ATOM 0 HE2 TYR A 125 78.739 -20.214 -2.814 1.00 1.00 H new ATOM 0 HH TYR A 125 80.955 -20.107 -2.680 1.00 1.00 H new ATOM 1859 N ARG A 126 77.305 -17.474 1.204 1.00 1.00 N ATOM 1860 CA ARG A 126 77.951 -16.365 0.475 1.00 1.00 C ATOM 1861 C ARG A 126 79.433 -16.294 0.844 1.00 1.00 C ATOM 1862 O ARG A 126 79.823 -16.701 1.939 1.00 1.00 O ATOM 1863 CB ARG A 126 77.306 -14.994 0.795 1.00 1.00 C ATOM 1864 CG ARG A 126 75.774 -14.990 0.589 1.00 1.00 C ATOM 1865 CD ARG A 126 75.398 -15.030 -0.904 1.00 1.00 C ATOM 1866 NE ARG A 126 75.636 -13.740 -1.545 1.00 1.00 N ATOM 1867 CZ ARG A 126 75.495 -13.602 -2.860 1.00 1.00 C ATOM 1868 NH1 ARG A 126 75.212 -14.643 -3.595 1.00 1.00 N ATOM 1869 NH2 ARG A 126 75.642 -12.431 -3.418 1.00 1.00 N ATOM 0 H ARG A 126 77.716 -17.672 2.116 1.00 1.00 H new ATOM 0 HA ARG A 126 77.821 -16.569 -0.588 1.00 1.00 H new ATOM 0 HB2 ARG A 126 77.530 -14.724 1.827 1.00 1.00 H new ATOM 0 HB3 ARG A 126 77.755 -14.229 0.161 1.00 1.00 H new ATOM 0 HG2 ARG A 126 75.337 -15.849 1.097 1.00 1.00 H new ATOM 0 HG3 ARG A 126 75.348 -14.098 1.047 1.00 1.00 H new ATOM 0 HD2 ARG A 126 75.980 -15.802 -1.407 1.00 1.00 H new ATOM 0 HD3 ARG A 126 74.348 -15.303 -1.010 1.00 1.00 H new ATOM 0 HE ARG A 126 75.913 -12.938 -0.979 1.00 1.00 H new ATOM 0 HH11 ARG A 126 75.100 -15.559 -3.160 1.00 1.00 H new ATOM 0 HH12 ARG A 126 75.103 -14.541 -4.604 1.00 1.00 H new ATOM 0 HH21 ARG A 126 75.866 -11.617 -2.845 1.00 1.00 H new ATOM 0 HH22 ARG A 126 75.533 -12.330 -4.427 1.00 1.00 H new ATOM 1883 N PHE A 127 80.253 -15.755 -0.063 1.00 1.00 N ATOM 1884 CA PHE A 127 81.694 -15.613 0.195 1.00 1.00 C ATOM 1885 C PHE A 127 82.165 -14.207 -0.186 1.00 1.00 C ATOM 1886 O PHE A 127 83.130 -13.746 0.401 1.00 1.00 O ATOM 1887 CB PHE A 127 82.491 -16.694 -0.573 1.00 1.00 C ATOM 1888 CG PHE A 127 82.889 -16.222 -1.961 1.00 1.00 C ATOM 1889 CD1 PHE A 127 81.946 -15.603 -2.790 1.00 1.00 C ATOM 1890 CD2 PHE A 127 84.201 -16.419 -2.419 1.00 1.00 C ATOM 1891 CE1 PHE A 127 82.314 -15.177 -4.074 1.00 1.00 C ATOM 1892 CE2 PHE A 127 84.567 -15.997 -3.703 1.00 1.00 C ATOM 1893 CZ PHE A 127 83.624 -15.374 -4.529 1.00 1.00 C ATOM 1894 OXT PHE A 127 81.546 -13.613 -1.053 1.00 1.00 O ATOM 0 H PHE A 127 79.950 -15.412 -0.975 1.00 1.00 H new ATOM 0 HA PHE A 127 81.876 -15.755 1.260 1.00 1.00 H new ATOM 0 HB2 PHE A 127 83.385 -16.956 -0.008 1.00 1.00 H new ATOM 0 HB3 PHE A 127 81.889 -17.599 -0.656 1.00 1.00 H new ATOM 0 HD1 PHE A 127 80.935 -15.454 -2.440 1.00 1.00 H new ATOM 0 HD2 PHE A 127 84.929 -16.897 -1.780 1.00 1.00 H new ATOM 0 HE1 PHE A 127 81.587 -14.697 -4.712 1.00 1.00 H new ATOM 0 HE2 PHE A 127 85.576 -16.152 -4.056 1.00 1.00 H new ATOM 0 HZ PHE A 127 83.907 -15.045 -5.518 1.00 1.00 H new