USER MOD reduce.3.24.130724 H: found=0, std=0, add=927, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 925 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 40 GLN : amide:sc= -0.43 K(o=-1.2,f=-4.7!) USER MOD Set 1.2: A 48 ASN :FLIP amide:sc= -1.52 F(o=-6!,f=-1.2) USER MOD Set 1.3: A 50 TYR OH : rot -153:sc= 0.737 USER MOD Set 2.1: A 27 LYS NZ :NH3+ 169:sc= 0.481 (180deg=-0.00806) USER MOD Set 2.2: A 94 SER OG : rot -101:sc= 0.444 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 174:sc= 0.755 (180deg=0.705) USER MOD Single : A 4 LYS NZ :NH3+ 157:sc= 0.416 (180deg=0.00678) USER MOD Single : A 5 SER OG : rot -127:sc= 0.731 USER MOD Single : A 7 MET CE :methyl 177:sc= 0 (180deg=-0.0103) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -0.433 K(o=-0.43,f=-5!) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl -114:sc=-0.00823 (180deg=-0.581) USER MOD Single : A 72 THR OG1 : rot -128:sc= -1.31 USER MOD Single : A 103 THR OG1 : rot -112:sc= -0.287 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= 0.191 X(o=0.19,f=-0.04) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.191 0.830 -0.888 1.00 0.00 N ATOM 2 CA MET A 1 2.610 0.479 -0.656 1.00 0.00 C ATOM 3 C MET A 1 3.173 -0.363 -1.807 1.00 0.00 C ATOM 4 O MET A 1 4.127 0.056 -2.477 1.00 0.00 O ATOM 5 CB MET A 1 2.776 -0.251 0.710 1.00 0.00 C ATOM 6 CG MET A 1 2.538 0.631 1.944 1.00 0.00 C ATOM 7 SD MET A 1 2.805 -0.261 3.494 1.00 0.00 S ATOM 8 CE MET A 1 2.611 1.052 4.701 1.00 0.00 C ATOM 0 H1 MET A 1 0.811 1.311 -0.048 1.00 0.00 H new ATOM 0 H2 MET A 1 1.120 1.462 -1.711 1.00 0.00 H new ATOM 0 H3 MET A 1 0.644 -0.036 -1.068 1.00 0.00 H new ATOM 0 HA MET A 1 3.185 1.404 -0.620 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.084 -1.092 0.743 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.783 -0.665 0.765 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.205 1.493 1.905 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.518 1.015 1.921 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.749 0.648 5.704 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.354 1.828 4.517 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.612 1.479 4.617 1.00 0.00 H new ATOM 18 N ARG A 2 2.548 -1.527 -2.042 1.00 0.00 N ATOM 19 CA ARG A 2 3.018 -2.541 -2.999 1.00 0.00 C ATOM 20 C ARG A 2 4.397 -3.095 -2.586 1.00 0.00 C ATOM 21 O ARG A 2 5.450 -2.559 -2.960 1.00 0.00 O ATOM 22 CB ARG A 2 3.027 -2.032 -4.465 1.00 0.00 C ATOM 23 CG ARG A 2 1.638 -1.673 -5.030 1.00 0.00 C ATOM 24 CD ARG A 2 1.708 -1.154 -6.474 1.00 0.00 C ATOM 25 NE ARG A 2 2.491 0.093 -6.582 1.00 0.00 N ATOM 26 CZ ARG A 2 2.570 0.862 -7.679 1.00 0.00 C ATOM 27 NH1 ARG A 2 1.901 0.541 -8.785 1.00 0.00 N ATOM 28 NH2 ARG A 2 3.328 1.943 -7.664 1.00 0.00 N ATOM 0 H ARG A 2 1.687 -1.795 -1.564 1.00 0.00 H new ATOM 0 HA ARG A 2 2.297 -3.358 -2.966 1.00 0.00 H new ATOM 0 HB2 ARG A 2 3.668 -1.152 -4.526 1.00 0.00 H new ATOM 0 HB3 ARG A 2 3.475 -2.797 -5.098 1.00 0.00 H new ATOM 0 HG2 ARG A 2 0.996 -2.553 -4.994 1.00 0.00 H new ATOM 0 HG3 ARG A 2 1.176 -0.915 -4.397 1.00 0.00 H new ATOM 0 HD2 ARG A 2 2.154 -1.917 -7.111 1.00 0.00 H new ATOM 0 HD3 ARG A 2 0.698 -0.980 -6.845 1.00 0.00 H new ATOM 0 HE ARG A 2 3.013 0.393 -5.759 1.00 0.00 H new ATOM 0 HH11 ARG A 2 1.320 -0.297 -8.805 1.00 0.00 H new ATOM 0 HH12 ARG A 2 1.969 1.134 -9.612 1.00 0.00 H new ATOM 0 HH21 ARG A 2 3.849 2.189 -6.822 1.00 0.00 H new ATOM 0 HH22 ARG A 2 3.393 2.532 -8.494 1.00 0.00 H new ATOM 42 N LEU A 3 4.351 -4.147 -1.771 1.00 0.00 N ATOM 43 CA LEU A 3 5.525 -4.792 -1.168 1.00 0.00 C ATOM 44 C LEU A 3 5.268 -6.305 -1.027 1.00 0.00 C ATOM 45 O LEU A 3 4.154 -6.779 -1.296 1.00 0.00 O ATOM 46 CB LEU A 3 5.879 -4.111 0.207 1.00 0.00 C ATOM 47 CG LEU A 3 4.701 -3.441 1.008 1.00 0.00 C ATOM 48 CD1 LEU A 3 3.556 -4.418 1.308 1.00 0.00 C ATOM 49 CD2 LEU A 3 5.210 -2.766 2.307 1.00 0.00 C ATOM 0 H LEU A 3 3.473 -4.590 -1.502 1.00 0.00 H new ATOM 0 HA LEU A 3 6.392 -4.663 -1.816 1.00 0.00 H new ATOM 0 HB2 LEU A 3 6.337 -4.864 0.848 1.00 0.00 H new ATOM 0 HB3 LEU A 3 6.636 -3.349 0.021 1.00 0.00 H new ATOM 0 HG LEU A 3 4.292 -2.666 0.359 1.00 0.00 H new ATOM 0 HD11 LEU A 3 2.772 -3.901 1.862 1.00 0.00 H new ATOM 0 HD12 LEU A 3 3.148 -4.799 0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 3 3.933 -5.249 1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 3 4.371 -2.314 2.835 1.00 0.00 H new ATOM 0 HD22 LEU A 3 5.680 -3.514 2.946 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.938 -1.995 2.055 1.00 0.00 H new ATOM 61 N LYS A 4 6.308 -7.049 -0.614 1.00 0.00 N ATOM 62 CA LYS A 4 6.225 -8.511 -0.445 1.00 0.00 C ATOM 63 C LYS A 4 5.546 -8.860 0.900 1.00 0.00 C ATOM 64 O LYS A 4 5.295 -7.971 1.719 1.00 0.00 O ATOM 65 CB LYS A 4 7.645 -9.152 -0.554 1.00 0.00 C ATOM 66 CG LYS A 4 8.525 -9.072 0.711 1.00 0.00 C ATOM 67 CD LYS A 4 9.900 -9.769 0.531 1.00 0.00 C ATOM 68 CE LYS A 4 10.917 -8.919 -0.241 1.00 0.00 C ATOM 69 NZ LYS A 4 11.313 -7.709 0.530 1.00 0.00 N ATOM 0 H LYS A 4 7.223 -6.659 -0.389 1.00 0.00 H new ATOM 0 HA LYS A 4 5.611 -8.926 -1.244 1.00 0.00 H new ATOM 0 HB2 LYS A 4 7.528 -10.201 -0.825 1.00 0.00 H new ATOM 0 HB3 LYS A 4 8.177 -8.669 -1.373 1.00 0.00 H new ATOM 0 HG2 LYS A 4 8.684 -8.026 0.972 1.00 0.00 H new ATOM 0 HG3 LYS A 4 7.996 -9.532 1.546 1.00 0.00 H new ATOM 0 HD2 LYS A 4 10.309 -10.009 1.513 1.00 0.00 H new ATOM 0 HD3 LYS A 4 9.754 -10.713 0.007 1.00 0.00 H new ATOM 0 HE2 LYS A 4 11.801 -9.518 -0.460 1.00 0.00 H new ATOM 0 HE3 LYS A 4 10.490 -8.619 -1.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 12.240 -7.375 0.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 10.605 -6.961 0.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 11.371 -7.945 1.541 1.00 0.00 H new ATOM 83 N SER A 5 5.278 -10.160 1.112 1.00 0.00 N ATOM 84 CA SER A 5 4.611 -10.683 2.327 1.00 0.00 C ATOM 85 C SER A 5 5.396 -10.316 3.619 1.00 0.00 C ATOM 86 O SER A 5 4.816 -9.860 4.604 1.00 0.00 O ATOM 87 CB SER A 5 4.491 -12.217 2.191 1.00 0.00 C ATOM 88 OG SER A 5 3.949 -12.580 0.932 1.00 0.00 O ATOM 0 H SER A 5 5.519 -10.889 0.440 1.00 0.00 H new ATOM 0 HA SER A 5 3.624 -10.228 2.414 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.473 -12.673 2.312 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.858 -12.607 2.988 1.00 0.00 H new ATOM 0 HG SER A 5 3.182 -13.175 1.065 1.00 0.00 H new ATOM 94 N GLU A 6 6.725 -10.507 3.555 1.00 0.00 N ATOM 95 CA GLU A 6 7.681 -10.187 4.641 1.00 0.00 C ATOM 96 C GLU A 6 7.634 -8.703 5.000 1.00 0.00 C ATOM 97 O GLU A 6 7.500 -8.334 6.172 1.00 0.00 O ATOM 98 CB GLU A 6 9.117 -10.626 4.193 1.00 0.00 C ATOM 99 CG GLU A 6 10.327 -10.143 5.049 1.00 0.00 C ATOM 100 CD GLU A 6 10.906 -8.780 4.597 1.00 0.00 C ATOM 101 OE1 GLU A 6 11.378 -8.687 3.445 1.00 0.00 O ATOM 102 OE2 GLU A 6 10.882 -7.799 5.379 1.00 0.00 O ATOM 0 H GLU A 6 7.180 -10.897 2.729 1.00 0.00 H new ATOM 0 HA GLU A 6 7.404 -10.734 5.542 1.00 0.00 H new ATOM 0 HB2 GLU A 6 9.140 -11.715 4.165 1.00 0.00 H new ATOM 0 HB3 GLU A 6 9.270 -10.278 3.171 1.00 0.00 H new ATOM 0 HG2 GLU A 6 10.016 -10.068 6.091 1.00 0.00 H new ATOM 0 HG3 GLU A 6 11.115 -10.895 5.005 1.00 0.00 H new ATOM 109 N MET A 7 7.729 -7.876 3.957 1.00 0.00 N ATOM 110 CA MET A 7 7.831 -6.419 4.089 1.00 0.00 C ATOM 111 C MET A 7 6.470 -5.807 4.484 1.00 0.00 C ATOM 112 O MET A 7 6.418 -4.717 5.072 1.00 0.00 O ATOM 113 CB MET A 7 8.383 -5.805 2.776 1.00 0.00 C ATOM 114 CG MET A 7 8.548 -4.285 2.830 1.00 0.00 C ATOM 115 SD MET A 7 9.443 -3.744 4.304 1.00 0.00 S ATOM 116 CE MET A 7 8.850 -2.063 4.501 1.00 0.00 C ATOM 0 H MET A 7 7.737 -8.200 2.990 1.00 0.00 H new ATOM 0 HA MET A 7 8.531 -6.182 4.890 1.00 0.00 H new ATOM 0 HB2 MET A 7 9.348 -6.259 2.551 1.00 0.00 H new ATOM 0 HB3 MET A 7 7.712 -6.060 1.956 1.00 0.00 H new ATOM 0 HG2 MET A 7 9.080 -3.948 1.940 1.00 0.00 H new ATOM 0 HG3 MET A 7 7.565 -3.814 2.811 1.00 0.00 H new ATOM 0 HE1 MET A 7 9.280 -1.629 5.403 1.00 0.00 H new ATOM 0 HE2 MET A 7 9.146 -1.469 3.636 1.00 0.00 H new ATOM 0 HE3 MET A 7 7.763 -2.068 4.583 1.00 0.00 H new ATOM 126 N PHE A 8 5.370 -6.525 4.167 1.00 0.00 N ATOM 127 CA PHE A 8 4.014 -6.125 4.587 1.00 0.00 C ATOM 128 C PHE A 8 3.907 -6.218 6.112 1.00 0.00 C ATOM 129 O PHE A 8 3.408 -5.296 6.763 1.00 0.00 O ATOM 130 CB PHE A 8 2.909 -6.997 3.907 1.00 0.00 C ATOM 131 CG PHE A 8 1.479 -6.512 4.201 1.00 0.00 C ATOM 132 CD1 PHE A 8 0.879 -5.527 3.410 1.00 0.00 C ATOM 133 CD2 PHE A 8 0.748 -7.009 5.284 1.00 0.00 C ATOM 134 CE1 PHE A 8 -0.392 -5.057 3.691 1.00 0.00 C ATOM 135 CE2 PHE A 8 -0.524 -6.537 5.556 1.00 0.00 C ATOM 136 CZ PHE A 8 -1.090 -5.560 4.761 1.00 0.00 C ATOM 0 H PHE A 8 5.398 -7.386 3.620 1.00 0.00 H new ATOM 0 HA PHE A 8 3.849 -5.096 4.268 1.00 0.00 H new ATOM 0 HB2 PHE A 8 3.070 -6.998 2.829 1.00 0.00 H new ATOM 0 HB3 PHE A 8 3.011 -8.028 4.245 1.00 0.00 H new ATOM 0 HD1 PHE A 8 1.417 -5.126 2.564 1.00 0.00 H new ATOM 0 HD2 PHE A 8 1.181 -7.770 5.916 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -0.835 -4.294 3.068 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -1.077 -6.935 6.394 1.00 0.00 H new ATOM 0 HZ PHE A 8 -2.081 -5.192 4.981 1.00 0.00 H new ATOM 146 N VAL A 9 4.400 -7.342 6.663 1.00 0.00 N ATOM 147 CA VAL A 9 4.408 -7.585 8.113 1.00 0.00 C ATOM 148 C VAL A 9 5.371 -6.612 8.820 1.00 0.00 C ATOM 149 O VAL A 9 5.036 -6.057 9.867 1.00 0.00 O ATOM 150 CB VAL A 9 4.784 -9.069 8.462 1.00 0.00 C ATOM 151 CG1 VAL A 9 4.719 -9.314 9.974 1.00 0.00 C ATOM 152 CG2 VAL A 9 3.876 -10.058 7.707 1.00 0.00 C ATOM 0 H VAL A 9 4.802 -8.103 6.116 1.00 0.00 H new ATOM 0 HA VAL A 9 3.394 -7.410 8.473 1.00 0.00 H new ATOM 0 HB VAL A 9 5.811 -9.238 8.139 1.00 0.00 H new ATOM 0 HG11 VAL A 9 4.984 -10.350 10.186 1.00 0.00 H new ATOM 0 HG12 VAL A 9 5.418 -8.649 10.481 1.00 0.00 H new ATOM 0 HG13 VAL A 9 3.708 -9.118 10.331 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.156 -11.079 7.965 1.00 0.00 H new ATOM 0 HG22 VAL A 9 2.837 -9.885 7.987 1.00 0.00 H new ATOM 0 HG23 VAL A 9 3.991 -9.911 6.633 1.00 0.00 H new ATOM 162 N SER A 10 6.542 -6.374 8.197 1.00 0.00 N ATOM 163 CA SER A 10 7.564 -5.446 8.724 1.00 0.00 C ATOM 164 C SER A 10 6.967 -4.035 8.883 1.00 0.00 C ATOM 165 O SER A 10 7.188 -3.364 9.893 1.00 0.00 O ATOM 166 CB SER A 10 8.800 -5.411 7.792 1.00 0.00 C ATOM 167 OG SER A 10 9.857 -4.628 8.337 1.00 0.00 O ATOM 0 H SER A 10 6.806 -6.818 7.317 1.00 0.00 H new ATOM 0 HA SER A 10 7.886 -5.801 9.703 1.00 0.00 H new ATOM 0 HB2 SER A 10 9.153 -6.428 7.620 1.00 0.00 H new ATOM 0 HB3 SER A 10 8.511 -5.006 6.822 1.00 0.00 H new ATOM 0 HG SER A 10 10.619 -4.632 7.720 1.00 0.00 H new ATOM 173 N ALA A 11 6.164 -3.629 7.884 1.00 0.00 N ATOM 174 CA ALA A 11 5.441 -2.347 7.898 1.00 0.00 C ATOM 175 C ALA A 11 4.264 -2.387 8.904 1.00 0.00 C ATOM 176 O ALA A 11 3.984 -1.387 9.563 1.00 0.00 O ATOM 177 CB ALA A 11 4.939 -2.006 6.484 1.00 0.00 C ATOM 0 H ALA A 11 5.998 -4.182 7.043 1.00 0.00 H new ATOM 0 HA ALA A 11 6.129 -1.566 8.221 1.00 0.00 H new ATOM 0 HB1 ALA A 11 4.406 -1.056 6.507 1.00 0.00 H new ATOM 0 HB2 ALA A 11 5.788 -1.929 5.805 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.267 -2.791 6.137 1.00 0.00 H new ATOM 183 N LEU A 12 3.613 -3.569 9.024 1.00 0.00 N ATOM 184 CA LEU A 12 2.377 -3.766 9.834 1.00 0.00 C ATOM 185 C LEU A 12 2.650 -3.520 11.332 1.00 0.00 C ATOM 186 O LEU A 12 1.846 -2.873 12.020 1.00 0.00 O ATOM 187 CB LEU A 12 1.805 -5.201 9.594 1.00 0.00 C ATOM 188 CG LEU A 12 0.254 -5.408 9.740 1.00 0.00 C ATOM 189 CD1 LEU A 12 -0.153 -6.809 9.238 1.00 0.00 C ATOM 190 CD2 LEU A 12 -0.261 -5.176 11.184 1.00 0.00 C ATOM 0 H LEU A 12 3.929 -4.421 8.560 1.00 0.00 H new ATOM 0 HA LEU A 12 1.632 -3.037 9.515 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.091 -5.511 8.589 1.00 0.00 H new ATOM 0 HB3 LEU A 12 2.300 -5.879 10.289 1.00 0.00 H new ATOM 0 HG LEU A 12 -0.220 -4.648 9.118 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.230 -6.936 9.346 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.121 -6.913 8.188 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.362 -7.570 9.824 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.339 -5.335 11.216 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.229 -5.875 11.862 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.036 -4.155 11.491 1.00 0.00 H new ATOM 202 N ILE A 13 3.795 -4.046 11.820 1.00 0.00 N ATOM 203 CA ILE A 13 4.257 -3.831 13.213 1.00 0.00 C ATOM 204 C ILE A 13 4.353 -2.308 13.490 1.00 0.00 C ATOM 205 O ILE A 13 3.800 -1.803 14.470 1.00 0.00 O ATOM 206 CB ILE A 13 5.641 -4.587 13.516 1.00 0.00 C ATOM 207 CG1 ILE A 13 5.438 -6.114 13.836 1.00 0.00 C ATOM 208 CG2 ILE A 13 6.425 -3.943 14.691 1.00 0.00 C ATOM 209 CD1 ILE A 13 4.704 -6.934 12.805 1.00 0.00 C ATOM 0 H ILE A 13 4.423 -4.628 11.265 1.00 0.00 H new ATOM 0 HA ILE A 13 3.527 -4.268 13.895 1.00 0.00 H new ATOM 0 HB ILE A 13 6.219 -4.486 12.598 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.420 -6.562 13.990 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.899 -6.194 14.780 1.00 0.00 H new ATOM 0 HG21 ILE A 13 7.352 -4.492 14.854 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.656 -2.905 14.449 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.818 -3.978 15.596 1.00 0.00 H new ATOM 0 HD11 ILE A 13 4.631 -7.967 13.146 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.703 -6.528 12.663 1.00 0.00 H new ATOM 0 HD13 ILE A 13 5.247 -6.901 11.860 1.00 0.00 H new ATOM 221 N ARG A 14 4.964 -1.583 12.542 1.00 0.00 N ATOM 222 CA ARG A 14 5.161 -0.122 12.636 1.00 0.00 C ATOM 223 C ARG A 14 3.812 0.639 12.499 1.00 0.00 C ATOM 224 O ARG A 14 3.662 1.717 13.083 1.00 0.00 O ATOM 225 CB ARG A 14 6.202 0.369 11.580 1.00 0.00 C ATOM 226 CG ARG A 14 7.695 0.146 11.954 1.00 0.00 C ATOM 227 CD ARG A 14 8.075 -1.328 12.172 1.00 0.00 C ATOM 228 NE ARG A 14 9.530 -1.512 12.380 1.00 0.00 N ATOM 229 CZ ARG A 14 10.115 -2.057 13.458 1.00 0.00 C ATOM 230 NH1 ARG A 14 9.416 -2.362 14.547 1.00 0.00 N ATOM 231 NH2 ARG A 14 11.421 -2.257 13.454 1.00 0.00 N ATOM 0 H ARG A 14 5.338 -1.991 11.685 1.00 0.00 H new ATOM 0 HA ARG A 14 5.561 0.099 13.626 1.00 0.00 H new ATOM 0 HB2 ARG A 14 6.003 -0.139 10.636 1.00 0.00 H new ATOM 0 HB3 ARG A 14 6.044 1.434 11.408 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.322 0.558 11.163 1.00 0.00 H new ATOM 0 HG3 ARG A 14 7.918 0.706 12.862 1.00 0.00 H new ATOM 0 HD2 ARG A 14 7.535 -1.715 13.036 1.00 0.00 H new ATOM 0 HD3 ARG A 14 7.757 -1.914 11.309 1.00 0.00 H new ATOM 0 HE ARG A 14 10.146 -1.194 11.632 1.00 0.00 H new ATOM 0 HH11 ARG A 14 8.412 -2.182 14.576 1.00 0.00 H new ATOM 0 HH12 ARG A 14 9.883 -2.776 15.354 1.00 0.00 H new ATOM 0 HH21 ARG A 14 11.974 -1.998 12.637 1.00 0.00 H new ATOM 0 HH22 ARG A 14 11.876 -2.670 14.268 1.00 0.00 H new ATOM 245 N ARG A 15 2.839 0.061 11.746 1.00 0.00 N ATOM 246 CA ARG A 15 1.490 0.656 11.565 1.00 0.00 C ATOM 247 C ARG A 15 0.763 0.773 12.921 1.00 0.00 C ATOM 248 O ARG A 15 0.213 1.834 13.256 1.00 0.00 O ATOM 249 CB ARG A 15 0.606 -0.187 10.590 1.00 0.00 C ATOM 250 CG ARG A 15 1.051 -0.205 9.108 1.00 0.00 C ATOM 251 CD ARG A 15 0.065 -0.991 8.213 1.00 0.00 C ATOM 252 NE ARG A 15 0.472 -1.029 6.791 1.00 0.00 N ATOM 253 CZ ARG A 15 -0.371 -1.113 5.743 1.00 0.00 C ATOM 254 NH1 ARG A 15 -1.693 -1.048 5.912 1.00 0.00 N ATOM 255 NH2 ARG A 15 0.117 -1.228 4.517 1.00 0.00 N ATOM 0 H ARG A 15 2.967 -0.822 11.252 1.00 0.00 H new ATOM 0 HA ARG A 15 1.637 1.646 11.133 1.00 0.00 H new ATOM 0 HB2 ARG A 15 0.580 -1.215 10.953 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -0.414 0.193 10.637 1.00 0.00 H new ATOM 0 HG2 ARG A 15 1.134 0.819 8.743 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.042 -0.652 9.033 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -0.021 -2.011 8.587 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -0.924 -0.539 8.289 1.00 0.00 H new ATOM 0 HE ARG A 15 1.471 -0.988 6.588 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -2.082 -0.933 6.848 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -2.314 -1.114 5.106 1.00 0.00 H new ATOM 0 HH21 ARG A 15 1.126 -1.253 4.370 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -0.516 -1.292 3.720 1.00 0.00 H new ATOM 269 N VAL A 16 0.776 -0.331 13.690 1.00 0.00 N ATOM 270 CA VAL A 16 0.035 -0.412 14.960 1.00 0.00 C ATOM 271 C VAL A 16 0.720 0.433 16.058 1.00 0.00 C ATOM 272 O VAL A 16 0.040 1.064 16.860 1.00 0.00 O ATOM 273 CB VAL A 16 -0.173 -1.896 15.454 1.00 0.00 C ATOM 274 CG1 VAL A 16 -0.695 -2.808 14.318 1.00 0.00 C ATOM 275 CG2 VAL A 16 1.099 -2.477 16.080 1.00 0.00 C ATOM 0 H VAL A 16 1.292 -1.179 13.453 1.00 0.00 H new ATOM 0 HA VAL A 16 -0.955 -0.000 14.764 1.00 0.00 H new ATOM 0 HB VAL A 16 -0.935 -1.862 16.233 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.826 -3.822 14.696 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -1.651 -2.429 13.957 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.024 -2.817 13.499 1.00 0.00 H new ATOM 0 HG21 VAL A 16 0.910 -3.500 16.406 1.00 0.00 H new ATOM 0 HG22 VAL A 16 1.902 -2.474 15.343 1.00 0.00 H new ATOM 0 HG23 VAL A 16 1.392 -1.871 16.938 1.00 0.00 H new ATOM 285 N PHE A 17 2.074 0.448 16.069 1.00 0.00 N ATOM 286 CA PHE A 17 2.857 1.247 17.037 1.00 0.00 C ATOM 287 C PHE A 17 2.686 2.753 16.764 1.00 0.00 C ATOM 288 O PHE A 17 2.738 3.566 17.694 1.00 0.00 O ATOM 289 CB PHE A 17 4.361 0.832 17.032 1.00 0.00 C ATOM 290 CG PHE A 17 4.679 -0.417 17.865 1.00 0.00 C ATOM 291 CD1 PHE A 17 4.675 -0.358 19.260 1.00 0.00 C ATOM 292 CD2 PHE A 17 4.976 -1.638 17.268 1.00 0.00 C ATOM 293 CE1 PHE A 17 4.963 -1.478 20.018 1.00 0.00 C ATOM 294 CE2 PHE A 17 5.264 -2.756 18.028 1.00 0.00 C ATOM 295 CZ PHE A 17 5.257 -2.674 19.400 1.00 0.00 C ATOM 0 H PHE A 17 2.647 -0.086 15.416 1.00 0.00 H new ATOM 0 HA PHE A 17 2.470 1.042 18.035 1.00 0.00 H new ATOM 0 HB2 PHE A 17 4.673 0.656 16.003 1.00 0.00 H new ATOM 0 HB3 PHE A 17 4.956 1.665 17.407 1.00 0.00 H new ATOM 0 HD1 PHE A 17 4.444 0.575 19.753 1.00 0.00 H new ATOM 0 HD2 PHE A 17 4.982 -1.714 16.191 1.00 0.00 H new ATOM 0 HE1 PHE A 17 4.958 -1.415 21.096 1.00 0.00 H new ATOM 0 HE2 PHE A 17 5.494 -3.694 17.544 1.00 0.00 H new ATOM 0 HZ PHE A 17 5.482 -3.547 19.994 1.00 0.00 H new ATOM 305 N ALA A 18 2.460 3.113 15.482 1.00 0.00 N ATOM 306 CA ALA A 18 2.115 4.495 15.084 1.00 0.00 C ATOM 307 C ALA A 18 0.735 4.890 15.660 1.00 0.00 C ATOM 308 O ALA A 18 0.503 6.050 16.019 1.00 0.00 O ATOM 309 CB ALA A 18 2.132 4.633 13.549 1.00 0.00 C ATOM 0 H ALA A 18 2.511 2.460 14.700 1.00 0.00 H new ATOM 0 HA ALA A 18 2.862 5.175 15.493 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.876 5.656 13.273 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.127 4.394 13.173 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.405 3.947 13.114 1.00 0.00 H new ATOM 315 N ALA A 19 -0.165 3.892 15.754 1.00 0.00 N ATOM 316 CA ALA A 19 -1.517 4.047 16.333 1.00 0.00 C ATOM 317 C ALA A 19 -1.510 3.906 17.878 1.00 0.00 C ATOM 318 O ALA A 19 -2.506 4.233 18.541 1.00 0.00 O ATOM 319 CB ALA A 19 -2.458 3.016 15.702 1.00 0.00 C ATOM 0 H ALA A 19 0.027 2.945 15.427 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.870 5.054 16.110 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -3.456 3.127 16.126 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -2.502 3.175 14.625 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -2.087 2.012 15.906 1.00 0.00 H new ATOM 325 N GLY A 20 -0.388 3.404 18.438 1.00 0.00 N ATOM 326 CA GLY A 20 -0.214 3.262 19.897 1.00 0.00 C ATOM 327 C GLY A 20 -0.345 1.821 20.394 1.00 0.00 C ATOM 328 O GLY A 20 -0.064 1.545 21.568 1.00 0.00 O ATOM 0 H GLY A 20 0.416 3.089 17.895 1.00 0.00 H new ATOM 0 HA2 GLY A 20 0.767 3.646 20.176 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -0.954 3.881 20.404 1.00 0.00 H new ATOM 332 N GLY A 21 -0.775 0.910 19.497 1.00 0.00 N ATOM 333 CA GLY A 21 -0.894 -0.517 19.815 1.00 0.00 C ATOM 334 C GLY A 21 0.452 -1.261 19.789 1.00 0.00 C ATOM 335 O GLY A 21 1.512 -0.649 19.618 1.00 0.00 O ATOM 0 H GLY A 21 -1.046 1.145 18.542 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -1.342 -0.626 20.803 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.574 -0.985 19.103 1.00 0.00 H new ATOM 339 N PHE A 22 0.389 -2.596 19.929 1.00 0.00 N ATOM 340 CA PHE A 22 1.573 -3.493 19.977 1.00 0.00 C ATOM 341 C PHE A 22 1.487 -4.494 18.815 1.00 0.00 C ATOM 342 O PHE A 22 0.404 -4.721 18.284 1.00 0.00 O ATOM 343 CB PHE A 22 1.630 -4.238 21.351 1.00 0.00 C ATOM 344 CG PHE A 22 2.773 -5.260 21.491 1.00 0.00 C ATOM 345 CD1 PHE A 22 4.061 -4.851 21.829 1.00 0.00 C ATOM 346 CD2 PHE A 22 2.560 -6.627 21.254 1.00 0.00 C ATOM 347 CE1 PHE A 22 5.095 -5.765 21.935 1.00 0.00 C ATOM 348 CE2 PHE A 22 3.596 -7.540 21.362 1.00 0.00 C ATOM 349 CZ PHE A 22 4.864 -7.107 21.698 1.00 0.00 C ATOM 0 H PHE A 22 -0.495 -3.097 20.014 1.00 0.00 H new ATOM 0 HA PHE A 22 2.486 -2.906 19.877 1.00 0.00 H new ATOM 0 HB2 PHE A 22 1.726 -3.497 22.145 1.00 0.00 H new ATOM 0 HB3 PHE A 22 0.682 -4.752 21.508 1.00 0.00 H new ATOM 0 HD1 PHE A 22 4.256 -3.804 22.011 1.00 0.00 H new ATOM 0 HD2 PHE A 22 1.573 -6.972 20.983 1.00 0.00 H new ATOM 0 HE1 PHE A 22 6.085 -5.429 22.204 1.00 0.00 H new ATOM 0 HE2 PHE A 22 3.413 -8.589 21.184 1.00 0.00 H new ATOM 0 HZ PHE A 22 5.674 -7.817 21.775 1.00 0.00 H new ATOM 359 N ALA A 23 2.638 -5.062 18.405 1.00 0.00 N ATOM 360 CA ALA A 23 2.691 -6.141 17.394 1.00 0.00 C ATOM 361 C ALA A 23 3.975 -6.952 17.525 1.00 0.00 C ATOM 362 O ALA A 23 4.976 -6.461 18.065 1.00 0.00 O ATOM 363 CB ALA A 23 2.573 -5.589 15.977 1.00 0.00 C ATOM 0 H ALA A 23 3.554 -4.789 18.762 1.00 0.00 H new ATOM 0 HA ALA A 23 1.839 -6.794 17.581 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.616 -6.410 15.262 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.624 -5.063 15.869 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.394 -4.898 15.786 1.00 0.00 H new ATOM 369 N ALA A 24 3.929 -8.189 16.993 1.00 0.00 N ATOM 370 CA ALA A 24 5.069 -9.109 16.981 1.00 0.00 C ATOM 371 C ALA A 24 4.791 -10.269 16.018 1.00 0.00 C ATOM 372 O ALA A 24 3.690 -10.841 16.016 1.00 0.00 O ATOM 373 CB ALA A 24 5.378 -9.635 18.393 1.00 0.00 C ATOM 0 H ALA A 24 3.091 -8.575 16.558 1.00 0.00 H new ATOM 0 HA ALA A 24 5.948 -8.564 16.636 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.229 -10.315 18.350 1.00 0.00 H new ATOM 0 HB2 ALA A 24 5.616 -8.798 19.049 1.00 0.00 H new ATOM 0 HB3 ALA A 24 4.509 -10.166 18.782 1.00 0.00 H new ATOM 379 N VAL A 25 5.799 -10.587 15.190 1.00 0.00 N ATOM 380 CA VAL A 25 5.729 -11.684 14.212 1.00 0.00 C ATOM 381 C VAL A 25 5.963 -13.020 14.940 1.00 0.00 C ATOM 382 O VAL A 25 7.110 -13.368 15.265 1.00 0.00 O ATOM 383 CB VAL A 25 6.782 -11.505 13.044 1.00 0.00 C ATOM 384 CG1 VAL A 25 6.473 -12.453 11.858 1.00 0.00 C ATOM 385 CG2 VAL A 25 6.879 -10.024 12.597 1.00 0.00 C ATOM 0 H VAL A 25 6.689 -10.088 15.180 1.00 0.00 H new ATOM 0 HA VAL A 25 4.740 -11.673 13.755 1.00 0.00 H new ATOM 0 HB VAL A 25 7.762 -11.787 13.430 1.00 0.00 H new ATOM 0 HG11 VAL A 25 7.214 -12.306 11.072 1.00 0.00 H new ATOM 0 HG12 VAL A 25 6.508 -13.487 12.200 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.480 -12.234 11.466 1.00 0.00 H new ATOM 0 HG21 VAL A 25 7.610 -9.934 11.794 1.00 0.00 H new ATOM 0 HG22 VAL A 25 5.905 -9.687 12.241 1.00 0.00 H new ATOM 0 HG23 VAL A 25 7.190 -9.409 13.441 1.00 0.00 H new ATOM 395 N GLU A 26 4.864 -13.721 15.251 1.00 0.00 N ATOM 396 CA GLU A 26 4.900 -15.013 15.952 1.00 0.00 C ATOM 397 C GLU A 26 5.474 -16.107 15.035 1.00 0.00 C ATOM 398 O GLU A 26 6.505 -16.712 15.343 1.00 0.00 O ATOM 399 CB GLU A 26 3.475 -15.390 16.453 1.00 0.00 C ATOM 400 CG GLU A 26 2.821 -14.321 17.357 1.00 0.00 C ATOM 401 CD GLU A 26 3.651 -14.005 18.619 1.00 0.00 C ATOM 402 OE1 GLU A 26 3.640 -14.821 19.565 1.00 0.00 O ATOM 403 OE2 GLU A 26 4.322 -12.949 18.669 1.00 0.00 O ATOM 0 H GLU A 26 3.921 -13.407 15.023 1.00 0.00 H new ATOM 0 HA GLU A 26 5.555 -14.927 16.819 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.832 -15.563 15.590 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.531 -16.330 17.002 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.681 -13.405 16.783 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.831 -14.664 17.657 1.00 0.00 H new ATOM 410 N LYS A 27 4.805 -16.326 13.891 1.00 0.00 N ATOM 411 CA LYS A 27 5.225 -17.311 12.877 1.00 0.00 C ATOM 412 C LYS A 27 5.685 -16.580 11.612 1.00 0.00 C ATOM 413 O LYS A 27 5.140 -15.529 11.257 1.00 0.00 O ATOM 414 CB LYS A 27 4.053 -18.277 12.549 1.00 0.00 C ATOM 415 CG LYS A 27 4.371 -19.364 11.493 1.00 0.00 C ATOM 416 CD LYS A 27 3.200 -20.349 11.266 1.00 0.00 C ATOM 417 CE LYS A 27 3.489 -21.376 10.154 1.00 0.00 C ATOM 418 NZ LYS A 27 4.682 -22.211 10.429 1.00 0.00 N ATOM 0 H LYS A 27 3.953 -15.823 13.641 1.00 0.00 H new ATOM 0 HA LYS A 27 6.055 -17.899 13.269 1.00 0.00 H new ATOM 0 HB2 LYS A 27 3.740 -18.768 13.470 1.00 0.00 H new ATOM 0 HB3 LYS A 27 3.206 -17.688 12.198 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.621 -18.882 10.548 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.252 -19.923 11.809 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.990 -20.877 12.196 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.302 -19.786 11.010 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.621 -22.023 10.031 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.631 -20.850 9.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 4.719 -22.998 9.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 5.540 -21.632 10.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.625 -22.591 11.396 1.00 0.00 H new ATOM 432 N LYS A 28 6.685 -17.160 10.943 1.00 0.00 N ATOM 433 CA LYS A 28 7.239 -16.661 9.681 1.00 0.00 C ATOM 434 C LYS A 28 7.065 -17.740 8.599 1.00 0.00 C ATOM 435 O LYS A 28 7.245 -18.929 8.876 1.00 0.00 O ATOM 436 CB LYS A 28 8.741 -16.292 9.862 1.00 0.00 C ATOM 437 CG LYS A 28 9.443 -15.857 8.556 1.00 0.00 C ATOM 438 CD LYS A 28 10.900 -15.388 8.753 1.00 0.00 C ATOM 439 CE LYS A 28 11.553 -14.977 7.420 1.00 0.00 C ATOM 440 NZ LYS A 28 12.939 -14.495 7.604 1.00 0.00 N ATOM 0 H LYS A 28 7.143 -18.010 11.272 1.00 0.00 H new ATOM 0 HA LYS A 28 6.709 -15.759 9.375 1.00 0.00 H new ATOM 0 HB2 LYS A 28 8.821 -15.486 10.591 1.00 0.00 H new ATOM 0 HB3 LYS A 28 9.268 -17.151 10.277 1.00 0.00 H new ATOM 0 HG2 LYS A 28 9.432 -16.691 7.855 1.00 0.00 H new ATOM 0 HG3 LYS A 28 8.871 -15.049 8.100 1.00 0.00 H new ATOM 0 HD2 LYS A 28 10.920 -14.545 9.443 1.00 0.00 H new ATOM 0 HD3 LYS A 28 11.481 -16.189 9.211 1.00 0.00 H new ATOM 0 HE2 LYS A 28 11.553 -15.828 6.739 1.00 0.00 H new ATOM 0 HE3 LYS A 28 10.957 -14.194 6.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 13.339 -14.229 6.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 12.938 -13.666 8.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 13.516 -15.250 8.027 1.00 0.00 H new ATOM 454 N GLY A 29 6.697 -17.315 7.384 1.00 0.00 N ATOM 455 CA GLY A 29 6.573 -18.214 6.231 1.00 0.00 C ATOM 456 C GLY A 29 7.329 -17.692 5.014 1.00 0.00 C ATOM 457 O GLY A 29 8.452 -17.194 5.155 1.00 0.00 O ATOM 0 H GLY A 29 6.478 -16.341 7.173 1.00 0.00 H new ATOM 0 HA2 GLY A 29 6.953 -19.200 6.498 1.00 0.00 H new ATOM 0 HA3 GLY A 29 5.520 -18.336 5.978 1.00 0.00 H new ATOM 461 N ALA A 30 6.704 -17.789 3.821 1.00 0.00 N ATOM 462 CA ALA A 30 7.323 -17.379 2.547 1.00 0.00 C ATOM 463 C ALA A 30 7.344 -15.846 2.440 1.00 0.00 C ATOM 464 O ALA A 30 6.320 -15.191 2.639 1.00 0.00 O ATOM 465 CB ALA A 30 6.578 -18.014 1.361 1.00 0.00 C ATOM 0 H ALA A 30 5.757 -18.154 3.716 1.00 0.00 H new ATOM 0 HA ALA A 30 8.353 -17.734 2.520 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.047 -17.702 0.428 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.621 -19.100 1.443 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.537 -17.691 1.370 1.00 0.00 H new ATOM 471 N GLU A 31 8.516 -15.286 2.125 1.00 0.00 N ATOM 472 CA GLU A 31 8.753 -13.843 2.200 1.00 0.00 C ATOM 473 C GLU A 31 8.102 -13.090 1.024 1.00 0.00 C ATOM 474 O GLU A 31 7.532 -12.027 1.218 1.00 0.00 O ATOM 475 CB GLU A 31 10.274 -13.564 2.276 1.00 0.00 C ATOM 476 CG GLU A 31 10.968 -14.238 3.482 1.00 0.00 C ATOM 477 CD GLU A 31 12.446 -13.838 3.635 1.00 0.00 C ATOM 478 OE1 GLU A 31 13.303 -14.388 2.911 1.00 0.00 O ATOM 479 OE2 GLU A 31 12.754 -12.948 4.458 1.00 0.00 O ATOM 0 H GLU A 31 9.326 -15.821 1.811 1.00 0.00 H new ATOM 0 HA GLU A 31 8.281 -13.468 3.108 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.745 -13.911 1.356 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.435 -12.487 2.330 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.432 -13.976 4.394 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.901 -15.320 3.373 1.00 0.00 H new ATOM 486 N ALA A 32 8.186 -13.650 -0.187 1.00 0.00 N ATOM 487 CA ALA A 32 7.650 -13.005 -1.408 1.00 0.00 C ATOM 488 C ALA A 32 6.139 -13.287 -1.593 1.00 0.00 C ATOM 489 O ALA A 32 5.350 -12.355 -1.787 1.00 0.00 O ATOM 490 CB ALA A 32 8.444 -13.457 -2.651 1.00 0.00 C ATOM 0 H ALA A 32 8.622 -14.556 -0.357 1.00 0.00 H new ATOM 0 HA ALA A 32 7.768 -11.928 -1.289 1.00 0.00 H new ATOM 0 HB1 ALA A 32 8.036 -12.973 -3.539 1.00 0.00 H new ATOM 0 HB2 ALA A 32 9.491 -13.179 -2.535 1.00 0.00 H new ATOM 0 HB3 ALA A 32 8.366 -14.539 -2.759 1.00 0.00 H new ATOM 496 N ALA A 33 5.752 -14.579 -1.510 1.00 0.00 N ATOM 497 CA ALA A 33 4.394 -15.055 -1.896 1.00 0.00 C ATOM 498 C ALA A 33 3.612 -15.688 -0.726 1.00 0.00 C ATOM 499 O ALA A 33 2.575 -16.337 -0.952 1.00 0.00 O ATOM 500 CB ALA A 33 4.526 -16.066 -3.055 1.00 0.00 C ATOM 0 H ALA A 33 6.365 -15.323 -1.176 1.00 0.00 H new ATOM 0 HA ALA A 33 3.820 -14.182 -2.208 1.00 0.00 H new ATOM 0 HB1 ALA A 33 3.536 -16.420 -3.344 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.002 -15.582 -3.908 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.134 -16.912 -2.733 1.00 0.00 H new ATOM 506 N GLY A 34 4.079 -15.478 0.513 1.00 0.00 N ATOM 507 CA GLY A 34 3.476 -16.116 1.690 1.00 0.00 C ATOM 508 C GLY A 34 2.131 -15.528 2.086 1.00 0.00 C ATOM 509 O GLY A 34 1.864 -14.341 1.851 1.00 0.00 O ATOM 0 H GLY A 34 4.871 -14.872 0.725 1.00 0.00 H new ATOM 0 HA2 GLY A 34 3.352 -17.180 1.491 1.00 0.00 H new ATOM 0 HA3 GLY A 34 4.163 -16.027 2.532 1.00 0.00 H new ATOM 513 N ALA A 35 1.280 -16.371 2.690 1.00 0.00 N ATOM 514 CA ALA A 35 0.015 -15.931 3.293 1.00 0.00 C ATOM 515 C ALA A 35 0.327 -15.153 4.585 1.00 0.00 C ATOM 516 O ALA A 35 1.407 -15.312 5.154 1.00 0.00 O ATOM 517 CB ALA A 35 -0.892 -17.148 3.569 1.00 0.00 C ATOM 0 H ALA A 35 1.449 -17.373 2.774 1.00 0.00 H new ATOM 0 HA ALA A 35 -0.521 -15.274 2.609 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -1.827 -16.811 4.016 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -1.103 -17.664 2.633 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -0.388 -17.830 4.254 1.00 0.00 H new ATOM 523 N ILE A 36 -0.599 -14.297 5.033 1.00 0.00 N ATOM 524 CA ILE A 36 -0.414 -13.470 6.242 1.00 0.00 C ATOM 525 C ILE A 36 -1.719 -13.508 7.044 1.00 0.00 C ATOM 526 O ILE A 36 -2.717 -12.908 6.624 1.00 0.00 O ATOM 527 CB ILE A 36 -0.071 -11.956 5.928 1.00 0.00 C ATOM 528 CG1 ILE A 36 1.044 -11.774 4.845 1.00 0.00 C ATOM 529 CG2 ILE A 36 0.296 -11.196 7.230 1.00 0.00 C ATOM 530 CD1 ILE A 36 2.417 -12.247 5.257 1.00 0.00 C ATOM 0 H ILE A 36 -1.498 -14.155 4.572 1.00 0.00 H new ATOM 0 HA ILE A 36 0.432 -13.883 6.791 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.976 -11.524 5.501 1.00 0.00 H new ATOM 0 HG12 ILE A 36 0.746 -12.311 3.945 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.104 -10.718 4.581 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.528 -10.158 6.992 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -0.546 -11.230 7.921 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.164 -11.665 7.693 1.00 0.00 H new ATOM 0 HD11 ILE A 36 3.120 -12.079 4.441 1.00 0.00 H new ATOM 0 HD12 ILE A 36 2.744 -11.693 6.137 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.380 -13.311 5.491 1.00 0.00 H new ATOM 542 N PHE A 37 -1.732 -14.238 8.164 1.00 0.00 N ATOM 543 CA PHE A 37 -2.885 -14.291 9.065 1.00 0.00 C ATOM 544 C PHE A 37 -2.558 -13.544 10.360 1.00 0.00 C ATOM 545 O PHE A 37 -1.713 -13.967 11.155 1.00 0.00 O ATOM 546 CB PHE A 37 -3.322 -15.758 9.295 1.00 0.00 C ATOM 547 CG PHE A 37 -4.032 -16.343 8.069 1.00 0.00 C ATOM 548 CD1 PHE A 37 -3.313 -16.887 7.005 1.00 0.00 C ATOM 549 CD2 PHE A 37 -5.423 -16.295 7.961 1.00 0.00 C ATOM 550 CE1 PHE A 37 -3.958 -17.368 5.882 1.00 0.00 C ATOM 551 CE2 PHE A 37 -6.066 -16.782 6.839 1.00 0.00 C ATOM 552 CZ PHE A 37 -5.335 -17.315 5.799 1.00 0.00 C ATOM 0 H PHE A 37 -0.943 -14.808 8.470 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.740 -13.787 8.614 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.448 -16.364 9.531 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -3.987 -15.808 10.157 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.235 -16.933 7.060 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -6.005 -15.871 8.766 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.384 -17.786 5.068 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -7.144 -16.745 6.777 1.00 0.00 H new ATOM 0 HZ PHE A 37 -5.839 -17.691 4.921 1.00 0.00 H new ATOM 562 N VAL A 38 -3.256 -12.417 10.548 1.00 0.00 N ATOM 563 CA VAL A 38 -3.020 -11.463 11.629 1.00 0.00 C ATOM 564 C VAL A 38 -4.154 -11.582 12.644 1.00 0.00 C ATOM 565 O VAL A 38 -5.328 -11.491 12.289 1.00 0.00 O ATOM 566 CB VAL A 38 -2.949 -9.987 11.076 1.00 0.00 C ATOM 567 CG1 VAL A 38 -2.665 -8.969 12.204 1.00 0.00 C ATOM 568 CG2 VAL A 38 -1.893 -9.866 9.956 1.00 0.00 C ATOM 0 H VAL A 38 -4.021 -12.140 9.933 1.00 0.00 H new ATOM 0 HA VAL A 38 -2.065 -11.690 12.102 1.00 0.00 H new ATOM 0 HB VAL A 38 -3.926 -9.751 10.654 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.623 -7.964 11.785 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -3.460 -9.019 12.948 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -1.711 -9.205 12.676 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.864 -8.839 9.592 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.914 -10.140 10.348 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.155 -10.534 9.136 1.00 0.00 H new ATOM 578 N ARG A 39 -3.787 -11.787 13.899 1.00 0.00 N ATOM 579 CA ARG A 39 -4.723 -11.962 15.004 1.00 0.00 C ATOM 580 C ARG A 39 -4.692 -10.700 15.882 1.00 0.00 C ATOM 581 O ARG A 39 -3.699 -10.414 16.558 1.00 0.00 O ATOM 582 CB ARG A 39 -4.348 -13.254 15.796 1.00 0.00 C ATOM 583 CG ARG A 39 -2.860 -13.361 16.218 1.00 0.00 C ATOM 584 CD ARG A 39 -2.506 -14.680 16.925 1.00 0.00 C ATOM 585 NE ARG A 39 -3.279 -14.859 18.168 1.00 0.00 N ATOM 586 CZ ARG A 39 -2.803 -15.312 19.331 1.00 0.00 C ATOM 587 NH1 ARG A 39 -1.512 -15.594 19.484 1.00 0.00 N ATOM 588 NH2 ARG A 39 -3.622 -15.443 20.355 1.00 0.00 N ATOM 0 H ARG A 39 -2.810 -11.838 14.187 1.00 0.00 H new ATOM 0 HA ARG A 39 -5.743 -12.090 14.641 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -4.968 -13.305 16.691 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -4.599 -14.121 15.185 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -2.233 -13.255 15.333 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -2.620 -12.529 16.880 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -2.699 -15.516 16.253 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -1.440 -14.695 17.154 1.00 0.00 H new ATOM 0 HE ARG A 39 -4.269 -14.614 18.137 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -0.866 -15.465 18.705 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -1.168 -15.939 20.380 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -4.607 -15.200 20.254 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -3.271 -15.788 21.248 1.00 0.00 H new ATOM 602 N GLN A 40 -5.774 -9.913 15.809 1.00 0.00 N ATOM 603 CA GLN A 40 -5.913 -8.678 16.587 1.00 0.00 C ATOM 604 C GLN A 40 -6.406 -8.987 17.994 1.00 0.00 C ATOM 605 O GLN A 40 -7.554 -9.371 18.176 1.00 0.00 O ATOM 606 CB GLN A 40 -6.887 -7.681 15.919 1.00 0.00 C ATOM 607 CG GLN A 40 -7.023 -6.355 16.692 1.00 0.00 C ATOM 608 CD GLN A 40 -8.129 -5.440 16.192 1.00 0.00 C ATOM 609 OE1 GLN A 40 -8.490 -5.448 15.026 1.00 0.00 O ATOM 610 NE2 GLN A 40 -8.654 -4.630 17.088 1.00 0.00 N ATOM 0 H GLN A 40 -6.575 -10.115 15.210 1.00 0.00 H new ATOM 0 HA GLN A 40 -4.926 -8.218 16.631 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -6.543 -7.470 14.906 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -7.869 -8.146 15.832 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -7.203 -6.580 17.743 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -6.075 -5.820 16.638 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -8.324 -4.654 18.053 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -9.390 -3.978 16.817 1.00 0.00 H new ATOM 619 N ARG A 41 -5.531 -8.809 18.972 1.00 0.00 N ATOM 620 CA ARG A 41 -5.885 -8.861 20.381 1.00 0.00 C ATOM 621 C ARG A 41 -6.594 -7.550 20.782 1.00 0.00 C ATOM 622 O ARG A 41 -5.946 -6.509 20.912 1.00 0.00 O ATOM 623 CB ARG A 41 -4.611 -9.089 21.215 1.00 0.00 C ATOM 624 CG ARG A 41 -4.862 -9.369 22.714 1.00 0.00 C ATOM 625 CD ARG A 41 -3.590 -9.861 23.425 1.00 0.00 C ATOM 626 NE ARG A 41 -3.132 -11.152 22.864 1.00 0.00 N ATOM 627 CZ ARG A 41 -1.922 -11.401 22.330 1.00 0.00 C ATOM 628 NH1 ARG A 41 -0.988 -10.454 22.307 1.00 0.00 N ATOM 629 NH2 ARG A 41 -1.649 -12.606 21.851 1.00 0.00 N ATOM 0 H ARG A 41 -4.542 -8.622 18.806 1.00 0.00 H new ATOM 0 HA ARG A 41 -6.571 -9.687 20.569 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.060 -9.928 20.790 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.972 -8.210 21.125 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.221 -8.461 23.198 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.648 -10.117 22.817 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.801 -9.116 23.323 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.786 -9.973 24.491 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.796 -11.926 22.884 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -1.187 -9.532 22.696 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -0.073 -10.650 21.901 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.355 -13.341 21.888 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -0.733 -12.798 21.446 1.00 0.00 H new ATOM 643 N LEU A 42 -7.931 -7.615 20.904 1.00 0.00 N ATOM 644 CA LEU A 42 -8.761 -6.491 21.384 1.00 0.00 C ATOM 645 C LEU A 42 -8.437 -6.198 22.856 1.00 0.00 C ATOM 646 O LEU A 42 -8.187 -7.127 23.642 1.00 0.00 O ATOM 647 CB LEU A 42 -10.288 -6.814 21.240 1.00 0.00 C ATOM 648 CG LEU A 42 -10.919 -6.732 19.810 1.00 0.00 C ATOM 649 CD1 LEU A 42 -10.910 -5.293 19.268 1.00 0.00 C ATOM 650 CD2 LEU A 42 -10.248 -7.706 18.831 1.00 0.00 C ATOM 0 H LEU A 42 -8.470 -8.449 20.673 1.00 0.00 H new ATOM 0 HA LEU A 42 -8.534 -5.617 20.774 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.455 -7.821 21.623 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.837 -6.131 21.888 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.961 -7.039 19.904 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -11.356 -5.276 18.274 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -11.485 -4.650 19.934 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.883 -4.932 19.211 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.716 -7.617 17.851 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.188 -7.467 18.750 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.363 -8.726 19.196 1.00 0.00 H new ATOM 662 N ARG A 43 -8.481 -4.909 23.222 1.00 0.00 N ATOM 663 CA ARG A 43 -8.293 -4.460 24.613 1.00 0.00 C ATOM 664 C ARG A 43 -9.444 -4.954 25.521 1.00 0.00 C ATOM 665 O ARG A 43 -9.320 -4.950 26.743 1.00 0.00 O ATOM 666 CB ARG A 43 -8.184 -2.912 24.672 1.00 0.00 C ATOM 667 CG ARG A 43 -9.444 -2.163 24.193 1.00 0.00 C ATOM 668 CD ARG A 43 -9.370 -0.644 24.413 1.00 0.00 C ATOM 669 NE ARG A 43 -10.599 0.028 23.947 1.00 0.00 N ATOM 670 CZ ARG A 43 -10.930 1.300 24.201 1.00 0.00 C ATOM 671 NH1 ARG A 43 -10.149 2.076 24.947 1.00 0.00 N ATOM 672 NH2 ARG A 43 -12.050 1.791 23.707 1.00 0.00 N ATOM 0 H ARG A 43 -8.648 -4.147 22.564 1.00 0.00 H new ATOM 0 HA ARG A 43 -7.363 -4.892 24.983 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -7.968 -2.615 25.698 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -7.336 -2.597 24.064 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.595 -2.362 23.132 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -10.314 -2.557 24.718 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.218 -0.435 25.472 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -8.508 -0.239 23.882 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.249 -0.522 23.386 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -9.282 1.704 25.336 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.417 3.043 25.130 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.657 1.203 23.136 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -12.309 2.759 23.896 1.00 0.00 H new ATOM 686 N ASP A 44 -10.568 -5.368 24.894 1.00 0.00 N ATOM 687 CA ASP A 44 -11.741 -5.928 25.600 1.00 0.00 C ATOM 688 C ASP A 44 -11.484 -7.384 26.077 1.00 0.00 C ATOM 689 O ASP A 44 -12.234 -7.917 26.906 1.00 0.00 O ATOM 690 CB ASP A 44 -12.980 -5.871 24.667 1.00 0.00 C ATOM 691 CG ASP A 44 -14.303 -6.270 25.356 1.00 0.00 C ATOM 692 OD1 ASP A 44 -14.788 -5.509 26.225 1.00 0.00 O ATOM 693 OD2 ASP A 44 -14.884 -7.325 25.017 1.00 0.00 O ATOM 0 H ASP A 44 -10.687 -5.323 23.882 1.00 0.00 H new ATOM 0 HA ASP A 44 -11.926 -5.326 26.490 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.078 -4.860 24.272 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -12.812 -6.531 23.816 1.00 0.00 H new ATOM 698 N GLY A 45 -10.407 -8.006 25.556 1.00 0.00 N ATOM 699 CA GLY A 45 -10.071 -9.406 25.859 1.00 0.00 C ATOM 700 C GLY A 45 -10.591 -10.361 24.794 1.00 0.00 C ATOM 701 O GLY A 45 -10.641 -11.574 25.002 1.00 0.00 O ATOM 0 H GLY A 45 -9.752 -7.553 24.918 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -8.989 -9.509 25.941 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -10.492 -9.678 26.827 1.00 0.00 H new ATOM 705 N ARG A 46 -10.988 -9.792 23.644 1.00 0.00 N ATOM 706 CA ARG A 46 -11.442 -10.559 22.471 1.00 0.00 C ATOM 707 C ARG A 46 -10.305 -10.627 21.443 1.00 0.00 C ATOM 708 O ARG A 46 -9.225 -10.058 21.665 1.00 0.00 O ATOM 709 CB ARG A 46 -12.703 -9.892 21.841 1.00 0.00 C ATOM 710 CG ARG A 46 -13.832 -9.561 22.844 1.00 0.00 C ATOM 711 CD ARG A 46 -14.326 -10.787 23.633 1.00 0.00 C ATOM 712 NE ARG A 46 -15.298 -10.411 24.683 1.00 0.00 N ATOM 713 CZ ARG A 46 -15.908 -11.266 25.518 1.00 0.00 C ATOM 714 NH1 ARG A 46 -15.707 -12.575 25.427 1.00 0.00 N ATOM 715 NH2 ARG A 46 -16.740 -10.806 26.435 1.00 0.00 N ATOM 0 H ARG A 46 -11.003 -8.782 23.501 1.00 0.00 H new ATOM 0 HA ARG A 46 -11.711 -11.569 22.781 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.399 -8.972 21.342 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -13.102 -10.555 21.073 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.476 -8.806 23.545 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -14.671 -9.123 22.304 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -14.788 -11.498 22.948 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -13.475 -11.292 24.090 1.00 0.00 H new ATOM 0 HE ARG A 46 -15.523 -9.421 24.780 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -15.080 -12.946 24.713 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -16.180 -13.210 26.071 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -16.917 -9.804 26.507 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.206 -11.453 27.072 1.00 0.00 H new ATOM 729 N GLU A 47 -10.565 -11.306 20.317 1.00 0.00 N ATOM 730 CA GLU A 47 -9.626 -11.394 19.198 1.00 0.00 C ATOM 731 C GLU A 47 -10.370 -11.443 17.861 1.00 0.00 C ATOM 732 O GLU A 47 -11.473 -11.969 17.762 1.00 0.00 O ATOM 733 CB GLU A 47 -8.644 -12.595 19.323 1.00 0.00 C ATOM 734 CG GLU A 47 -7.444 -12.351 20.253 1.00 0.00 C ATOM 735 CD GLU A 47 -6.366 -13.430 20.113 1.00 0.00 C ATOM 736 OE1 GLU A 47 -5.661 -13.449 19.082 1.00 0.00 O ATOM 737 OE2 GLU A 47 -6.227 -14.269 21.023 1.00 0.00 O ATOM 0 H GLU A 47 -11.437 -11.811 20.160 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.021 -10.488 19.233 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.196 -13.462 19.685 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -8.271 -12.847 18.330 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -7.009 -11.376 20.032 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -7.790 -12.319 21.286 1.00 0.00 H new ATOM 744 N ASN A 48 -9.764 -10.808 16.855 1.00 0.00 N ATOM 745 CA ASN A 48 -10.172 -10.898 15.444 1.00 0.00 C ATOM 746 C ASN A 48 -9.060 -11.628 14.677 1.00 0.00 C ATOM 747 O ASN A 48 -7.929 -11.732 15.162 1.00 0.00 O ATOM 748 CB ASN A 48 -10.418 -9.480 14.823 1.00 0.00 C ATOM 749 CG ASN A 48 -11.697 -8.749 15.279 1.00 0.00 C ATOM 750 OD1 ASN A 48 -12.073 -8.876 16.538 1.00 0.00 O flip ATOM 751 ND2 ASN A 48 -12.336 -8.047 14.492 1.00 0.00 N flip ATOM 0 H ASN A 48 -8.956 -10.202 16.998 1.00 0.00 H new ATOM 0 HA ASN A 48 -11.113 -11.444 15.374 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -9.561 -8.849 15.059 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -10.450 -9.582 13.738 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -12.031 -7.960 13.523 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -13.170 -7.553 14.810 1.00 0.00 H new ATOM 758 N LEU A 49 -9.386 -12.147 13.490 1.00 0.00 N ATOM 759 CA LEU A 49 -8.409 -12.786 12.591 1.00 0.00 C ATOM 760 C LEU A 49 -8.575 -12.161 11.211 1.00 0.00 C ATOM 761 O LEU A 49 -9.688 -11.837 10.808 1.00 0.00 O ATOM 762 CB LEU A 49 -8.592 -14.338 12.554 1.00 0.00 C ATOM 763 CG LEU A 49 -7.279 -15.184 12.629 1.00 0.00 C ATOM 764 CD1 LEU A 49 -7.578 -16.681 12.830 1.00 0.00 C ATOM 765 CD2 LEU A 49 -6.378 -14.963 11.392 1.00 0.00 C ATOM 0 H LEU A 49 -10.337 -12.138 13.120 1.00 0.00 H new ATOM 0 HA LEU A 49 -7.396 -12.616 12.955 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -9.236 -14.628 13.384 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -9.118 -14.600 11.636 1.00 0.00 H new ATOM 0 HG LEU A 49 -6.730 -14.833 13.503 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -6.641 -17.236 12.877 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -8.130 -16.820 13.760 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -8.175 -17.048 11.995 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -5.477 -15.569 11.485 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -6.919 -15.253 10.491 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -6.102 -13.911 11.326 1.00 0.00 H new ATOM 777 N TYR A 50 -7.455 -11.950 10.523 1.00 0.00 N ATOM 778 CA TYR A 50 -7.391 -11.314 9.206 1.00 0.00 C ATOM 779 C TYR A 50 -6.532 -12.175 8.287 1.00 0.00 C ATOM 780 O TYR A 50 -5.597 -12.817 8.755 1.00 0.00 O ATOM 781 CB TYR A 50 -6.811 -9.883 9.342 1.00 0.00 C ATOM 782 CG TYR A 50 -7.620 -9.030 10.323 1.00 0.00 C ATOM 783 CD1 TYR A 50 -8.867 -8.538 9.959 1.00 0.00 C ATOM 784 CD2 TYR A 50 -7.178 -8.780 11.623 1.00 0.00 C ATOM 785 CE1 TYR A 50 -9.633 -7.815 10.836 1.00 0.00 C ATOM 786 CE2 TYR A 50 -7.950 -8.048 12.498 1.00 0.00 C ATOM 787 CZ TYR A 50 -9.183 -7.577 12.096 1.00 0.00 C ATOM 788 OH TYR A 50 -9.960 -6.847 12.960 1.00 0.00 O ATOM 0 H TYR A 50 -6.538 -12.225 10.876 1.00 0.00 H new ATOM 0 HA TYR A 50 -8.389 -11.229 8.777 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -5.776 -9.941 9.679 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -6.801 -9.401 8.364 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -9.241 -8.729 8.964 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -6.222 -9.164 11.946 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -10.595 -7.434 10.525 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -7.591 -7.843 13.496 1.00 0.00 H new ATOM 0 HH TYR A 50 -9.387 -6.403 13.620 1.00 0.00 H new ATOM 798 N GLY A 51 -6.869 -12.200 6.995 1.00 0.00 N ATOM 799 CA GLY A 51 -6.152 -13.014 6.012 1.00 0.00 C ATOM 800 C GLY A 51 -6.053 -12.312 4.668 1.00 0.00 C ATOM 801 O GLY A 51 -6.773 -11.330 4.443 1.00 0.00 O ATOM 0 H GLY A 51 -7.641 -11.660 6.604 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -5.151 -13.234 6.382 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.663 -13.969 5.887 1.00 0.00 H new ATOM 805 N PRO A 52 -5.165 -12.784 3.738 1.00 0.00 N ATOM 806 CA PRO A 52 -5.009 -12.170 2.405 1.00 0.00 C ATOM 807 C PRO A 52 -6.258 -12.418 1.524 1.00 0.00 C ATOM 808 O PRO A 52 -6.533 -13.553 1.112 1.00 0.00 O ATOM 809 CB PRO A 52 -3.729 -12.853 1.849 1.00 0.00 C ATOM 810 CG PRO A 52 -3.682 -14.185 2.538 1.00 0.00 C ATOM 811 CD PRO A 52 -4.249 -13.950 3.922 1.00 0.00 C ATOM 0 HA PRO A 52 -4.914 -11.084 2.430 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -3.779 -12.968 0.766 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -2.839 -12.263 2.066 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -4.268 -14.927 1.996 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -2.661 -14.562 2.592 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -4.785 -14.826 4.289 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -3.463 -13.731 4.645 1.00 0.00 H new ATOM 819 N ALA A 53 -7.032 -11.339 1.292 1.00 0.00 N ATOM 820 CA ALA A 53 -8.259 -11.375 0.470 1.00 0.00 C ATOM 821 C ALA A 53 -7.929 -11.712 -1.001 1.00 0.00 C ATOM 822 O ALA A 53 -6.791 -11.473 -1.451 1.00 0.00 O ATOM 823 CB ALA A 53 -9.013 -10.025 0.567 1.00 0.00 C ATOM 0 H ALA A 53 -6.823 -10.415 1.670 1.00 0.00 H new ATOM 0 HA ALA A 53 -8.906 -12.162 0.857 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -9.915 -10.067 -0.044 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -9.286 -9.835 1.605 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -8.369 -9.222 0.208 1.00 0.00 H new ATOM 829 N PRO A 54 -8.903 -12.304 -1.774 1.00 0.00 N ATOM 830 CA PRO A 54 -8.739 -12.522 -3.226 1.00 0.00 C ATOM 831 C PRO A 54 -8.618 -11.173 -3.954 1.00 0.00 C ATOM 832 O PRO A 54 -9.545 -10.354 -3.913 1.00 0.00 O ATOM 833 CB PRO A 54 -10.020 -13.319 -3.632 1.00 0.00 C ATOM 834 CG PRO A 54 -11.020 -12.995 -2.566 1.00 0.00 C ATOM 835 CD PRO A 54 -10.218 -12.820 -1.292 1.00 0.00 C ATOM 0 HA PRO A 54 -7.834 -13.069 -3.491 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -10.379 -13.018 -4.616 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -9.823 -14.390 -3.678 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -11.572 -12.087 -2.809 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.753 -13.795 -2.461 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -10.698 -12.119 -0.609 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -10.107 -13.762 -0.755 1.00 0.00 H new ATOM 843 N GLN A 55 -7.434 -10.924 -4.549 1.00 0.00 N ATOM 844 CA GLN A 55 -7.154 -9.666 -5.261 1.00 0.00 C ATOM 845 C GLN A 55 -8.079 -9.540 -6.486 1.00 0.00 C ATOM 846 O GLN A 55 -8.284 -10.514 -7.218 1.00 0.00 O ATOM 847 CB GLN A 55 -5.657 -9.594 -5.692 1.00 0.00 C ATOM 848 CG GLN A 55 -5.217 -8.291 -6.426 1.00 0.00 C ATOM 849 CD GLN A 55 -5.255 -7.000 -5.574 1.00 0.00 C ATOM 850 OE1 GLN A 55 -6.057 -6.848 -4.652 1.00 0.00 O ATOM 851 NE2 GLN A 55 -4.369 -6.059 -5.874 1.00 0.00 N ATOM 0 H GLN A 55 -6.655 -11.582 -4.549 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.348 -8.832 -4.586 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -5.038 -9.713 -4.803 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -5.446 -10.442 -6.343 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -4.202 -8.430 -6.798 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -5.859 -8.150 -7.296 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -3.712 -6.203 -6.641 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -4.344 -5.192 -5.337 1.00 0.00 H new ATOM 860 N SER A 56 -8.672 -8.356 -6.661 1.00 0.00 N ATOM 861 CA SER A 56 -9.463 -8.034 -7.849 1.00 0.00 C ATOM 862 C SER A 56 -8.492 -7.704 -8.993 1.00 0.00 C ATOM 863 O SER A 56 -8.012 -6.571 -9.089 1.00 0.00 O ATOM 864 CB SER A 56 -10.403 -6.842 -7.553 1.00 0.00 C ATOM 865 OG SER A 56 -11.226 -7.102 -6.425 1.00 0.00 O ATOM 0 H SER A 56 -8.617 -7.596 -5.984 1.00 0.00 H new ATOM 0 HA SER A 56 -10.088 -8.880 -8.135 1.00 0.00 H new ATOM 0 HB2 SER A 56 -9.811 -5.945 -7.375 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.028 -6.644 -8.424 1.00 0.00 H new ATOM 0 HG SER A 56 -11.808 -6.331 -6.260 1.00 0.00 H new ATOM 871 N PHE A 57 -8.139 -8.727 -9.801 1.00 0.00 N ATOM 872 CA PHE A 57 -7.193 -8.572 -10.925 1.00 0.00 C ATOM 873 C PHE A 57 -7.841 -8.931 -12.267 1.00 0.00 C ATOM 874 O PHE A 57 -8.709 -9.804 -12.338 1.00 0.00 O ATOM 875 CB PHE A 57 -5.891 -9.398 -10.691 1.00 0.00 C ATOM 876 CG PHE A 57 -6.066 -10.907 -10.486 1.00 0.00 C ATOM 877 CD1 PHE A 57 -6.132 -11.791 -11.564 1.00 0.00 C ATOM 878 CD2 PHE A 57 -6.127 -11.443 -9.203 1.00 0.00 C ATOM 879 CE1 PHE A 57 -6.258 -13.153 -11.361 1.00 0.00 C ATOM 880 CE2 PHE A 57 -6.255 -12.802 -9.000 1.00 0.00 C ATOM 881 CZ PHE A 57 -6.319 -13.657 -10.078 1.00 0.00 C ATOM 0 H PHE A 57 -8.499 -9.675 -9.693 1.00 0.00 H new ATOM 0 HA PHE A 57 -6.916 -7.519 -10.968 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -5.231 -9.244 -11.545 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -5.382 -8.992 -9.817 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -6.084 -11.406 -12.572 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -6.073 -10.783 -8.350 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -6.309 -13.822 -12.207 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -6.305 -13.195 -7.995 1.00 0.00 H new ATOM 0 HZ PHE A 57 -6.417 -14.721 -9.919 1.00 0.00 H new ATOM 891 N ALA A 58 -7.410 -8.222 -13.318 1.00 0.00 N ATOM 892 CA ALA A 58 -7.759 -8.522 -14.710 1.00 0.00 C ATOM 893 C ALA A 58 -6.505 -9.054 -15.423 1.00 0.00 C ATOM 894 O ALA A 58 -5.602 -8.283 -15.767 1.00 0.00 O ATOM 895 CB ALA A 58 -8.318 -7.273 -15.404 1.00 0.00 C ATOM 0 H ALA A 58 -6.799 -7.411 -13.222 1.00 0.00 H new ATOM 0 HA ALA A 58 -8.539 -9.283 -14.748 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -8.572 -7.513 -16.436 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.212 -6.935 -14.880 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.568 -6.482 -15.390 1.00 0.00 H new ATOM 901 N ASP A 59 -6.446 -10.392 -15.568 1.00 0.00 N ATOM 902 CA ASP A 59 -5.345 -11.125 -16.239 1.00 0.00 C ATOM 903 C ASP A 59 -3.991 -10.893 -15.512 1.00 0.00 C ATOM 904 O ASP A 59 -2.933 -10.731 -16.141 1.00 0.00 O ATOM 905 CB ASP A 59 -5.289 -10.767 -17.761 1.00 0.00 C ATOM 906 CG ASP A 59 -4.642 -11.877 -18.615 1.00 0.00 C ATOM 907 OD1 ASP A 59 -5.331 -12.871 -18.926 1.00 0.00 O ATOM 908 OD2 ASP A 59 -3.451 -11.761 -18.987 1.00 0.00 O ATOM 0 H ASP A 59 -7.177 -11.011 -15.216 1.00 0.00 H new ATOM 0 HA ASP A 59 -5.547 -12.194 -16.174 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -6.300 -10.580 -18.123 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -4.728 -9.842 -17.891 1.00 0.00 H new ATOM 913 N ASP A 60 -4.079 -10.858 -14.166 1.00 0.00 N ATOM 914 CA ASP A 60 -2.934 -10.762 -13.223 1.00 0.00 C ATOM 915 C ASP A 60 -2.225 -9.396 -13.241 1.00 0.00 C ATOM 916 O ASP A 60 -1.180 -9.243 -12.599 1.00 0.00 O ATOM 917 CB ASP A 60 -1.904 -11.911 -13.431 1.00 0.00 C ATOM 918 CG ASP A 60 -2.486 -13.305 -13.169 1.00 0.00 C ATOM 919 OD1 ASP A 60 -2.880 -13.584 -12.015 1.00 0.00 O ATOM 920 OD2 ASP A 60 -2.537 -14.138 -14.101 1.00 0.00 O ATOM 0 H ASP A 60 -4.977 -10.897 -13.685 1.00 0.00 H new ATOM 0 HA ASP A 60 -3.380 -10.870 -12.234 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -1.526 -11.869 -14.452 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -1.053 -11.750 -12.769 1.00 0.00 H new ATOM 925 N GLU A 61 -2.807 -8.401 -13.928 1.00 0.00 N ATOM 926 CA GLU A 61 -2.236 -7.042 -13.994 1.00 0.00 C ATOM 927 C GLU A 61 -2.248 -6.367 -12.609 1.00 0.00 C ATOM 928 O GLU A 61 -1.207 -5.887 -12.135 1.00 0.00 O ATOM 929 CB GLU A 61 -3.013 -6.188 -15.022 1.00 0.00 C ATOM 930 CG GLU A 61 -2.855 -6.651 -16.484 1.00 0.00 C ATOM 931 CD GLU A 61 -1.401 -6.592 -16.994 1.00 0.00 C ATOM 932 OE1 GLU A 61 -0.987 -5.544 -17.532 1.00 0.00 O ATOM 933 OE2 GLU A 61 -0.668 -7.600 -16.867 1.00 0.00 O ATOM 0 H GLU A 61 -3.677 -8.511 -14.449 1.00 0.00 H new ATOM 0 HA GLU A 61 -1.198 -7.122 -14.316 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.071 -6.202 -14.762 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -2.679 -5.153 -14.943 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -3.222 -7.673 -16.575 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -3.482 -6.029 -17.123 1.00 0.00 H new ATOM 940 N ASP A 62 -3.424 -6.380 -11.949 1.00 0.00 N ATOM 941 CA ASP A 62 -3.653 -5.676 -10.655 1.00 0.00 C ATOM 942 C ASP A 62 -2.859 -6.288 -9.489 1.00 0.00 C ATOM 943 O ASP A 62 -2.831 -5.708 -8.406 1.00 0.00 O ATOM 944 CB ASP A 62 -5.155 -5.638 -10.300 1.00 0.00 C ATOM 945 CG ASP A 62 -6.014 -4.963 -11.379 1.00 0.00 C ATOM 946 OD1 ASP A 62 -6.152 -5.537 -12.486 1.00 0.00 O ATOM 947 OD2 ASP A 62 -6.548 -3.854 -11.137 1.00 0.00 O ATOM 0 H ASP A 62 -4.246 -6.877 -12.292 1.00 0.00 H new ATOM 0 HA ASP A 62 -3.289 -4.659 -10.800 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -5.511 -6.657 -10.146 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -5.286 -5.108 -9.356 1.00 0.00 H new ATOM 952 N ILE A 63 -2.232 -7.464 -9.718 1.00 0.00 N ATOM 953 CA ILE A 63 -1.273 -8.075 -8.760 1.00 0.00 C ATOM 954 C ILE A 63 -0.075 -7.122 -8.539 1.00 0.00 C ATOM 955 O ILE A 63 0.476 -7.018 -7.437 1.00 0.00 O ATOM 956 CB ILE A 63 -0.744 -9.487 -9.271 1.00 0.00 C ATOM 957 CG1 ILE A 63 -1.932 -10.459 -9.560 1.00 0.00 C ATOM 958 CG2 ILE A 63 0.268 -10.131 -8.280 1.00 0.00 C ATOM 959 CD1 ILE A 63 -2.840 -10.710 -8.375 1.00 0.00 C ATOM 0 H ILE A 63 -2.373 -8.015 -10.565 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.801 -8.235 -7.820 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.210 -9.307 -10.204 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -2.527 -10.052 -10.378 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.530 -11.413 -9.902 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.600 -11.092 -8.672 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.128 -9.472 -8.159 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.214 -10.280 -7.314 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.636 -11.395 -8.665 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.263 -11.148 -7.561 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.276 -9.767 -8.044 1.00 0.00 H new ATOM 971 N MET A 64 0.294 -6.420 -9.614 1.00 0.00 N ATOM 972 CA MET A 64 1.432 -5.489 -9.651 1.00 0.00 C ATOM 973 C MET A 64 0.963 -4.026 -9.576 1.00 0.00 C ATOM 974 O MET A 64 1.718 -3.160 -9.116 1.00 0.00 O ATOM 975 CB MET A 64 2.241 -5.769 -10.948 1.00 0.00 C ATOM 976 CG MET A 64 2.881 -7.175 -10.972 1.00 0.00 C ATOM 977 SD MET A 64 3.292 -7.753 -12.630 1.00 0.00 S ATOM 978 CE MET A 64 1.663 -8.076 -13.306 1.00 0.00 C ATOM 0 H MET A 64 -0.200 -6.483 -10.504 1.00 0.00 H new ATOM 0 HA MET A 64 2.070 -5.647 -8.781 1.00 0.00 H new ATOM 0 HB2 MET A 64 1.583 -5.661 -11.810 1.00 0.00 H new ATOM 0 HB3 MET A 64 3.024 -5.018 -11.050 1.00 0.00 H new ATOM 0 HG2 MET A 64 3.787 -7.163 -10.366 1.00 0.00 H new ATOM 0 HG3 MET A 64 2.196 -7.885 -10.508 1.00 0.00 H new ATOM 0 HE1 MET A 64 1.549 -9.145 -13.485 1.00 0.00 H new ATOM 0 HE2 MET A 64 0.903 -7.743 -12.599 1.00 0.00 H new ATOM 0 HE3 MET A 64 1.545 -7.536 -14.246 1.00 0.00 H new ATOM 988 N ARG A 65 -0.279 -3.745 -10.023 1.00 0.00 N ATOM 989 CA ARG A 65 -0.828 -2.361 -10.010 1.00 0.00 C ATOM 990 C ARG A 65 -1.214 -1.941 -8.576 1.00 0.00 C ATOM 991 O ARG A 65 -1.191 -0.748 -8.242 1.00 0.00 O ATOM 992 CB ARG A 65 -2.044 -2.197 -10.970 1.00 0.00 C ATOM 993 CG ARG A 65 -1.844 -2.764 -12.397 1.00 0.00 C ATOM 994 CD ARG A 65 -0.501 -2.376 -13.043 1.00 0.00 C ATOM 995 NE ARG A 65 -0.294 -3.038 -14.353 1.00 0.00 N ATOM 996 CZ ARG A 65 0.898 -3.399 -14.856 1.00 0.00 C ATOM 997 NH1 ARG A 65 2.020 -3.156 -14.185 1.00 0.00 N ATOM 998 NH2 ARG A 65 0.962 -4.013 -16.023 1.00 0.00 N ATOM 0 H ARG A 65 -0.920 -4.446 -10.395 1.00 0.00 H new ATOM 0 HA ARG A 65 -0.039 -1.703 -10.373 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -2.909 -2.686 -10.521 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -2.283 -1.136 -11.049 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -1.916 -3.851 -12.358 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -2.656 -2.413 -13.033 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -0.463 -1.295 -13.175 1.00 0.00 H new ATOM 0 HD3 ARG A 65 0.314 -2.644 -12.370 1.00 0.00 H new ATOM 0 HE ARG A 65 -1.121 -3.235 -14.916 1.00 0.00 H new ATOM 0 HH11 ARG A 65 1.981 -2.691 -13.278 1.00 0.00 H new ATOM 0 HH12 ARG A 65 2.919 -3.435 -14.577 1.00 0.00 H new ATOM 0 HH21 ARG A 65 0.107 -4.213 -16.542 1.00 0.00 H new ATOM 0 HH22 ARG A 65 1.867 -4.288 -16.406 1.00 0.00 H new ATOM 1012 N ALA A 66 -1.549 -2.941 -7.742 1.00 0.00 N ATOM 1013 CA ALA A 66 -1.849 -2.761 -6.312 1.00 0.00 C ATOM 1014 C ALA A 66 -1.462 -4.041 -5.549 1.00 0.00 C ATOM 1015 O ALA A 66 -1.429 -5.136 -6.133 1.00 0.00 O ATOM 1016 CB ALA A 66 -3.339 -2.425 -6.102 1.00 0.00 C ATOM 0 H ALA A 66 -1.620 -3.911 -8.048 1.00 0.00 H new ATOM 0 HA ALA A 66 -1.267 -1.924 -5.926 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -3.537 -2.297 -5.038 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -3.582 -1.503 -6.630 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -3.953 -3.238 -6.490 1.00 0.00 H new ATOM 1022 N GLU A 67 -1.131 -3.889 -4.254 1.00 0.00 N ATOM 1023 CA GLU A 67 -0.885 -5.039 -3.359 1.00 0.00 C ATOM 1024 C GLU A 67 -2.230 -5.716 -3.029 1.00 0.00 C ATOM 1025 O GLU A 67 -3.279 -5.047 -3.013 1.00 0.00 O ATOM 1026 CB GLU A 67 -0.130 -4.629 -2.049 1.00 0.00 C ATOM 1027 CG GLU A 67 -0.915 -3.763 -1.032 1.00 0.00 C ATOM 1028 CD GLU A 67 -1.293 -2.367 -1.560 1.00 0.00 C ATOM 1029 OE1 GLU A 67 -0.387 -1.516 -1.708 1.00 0.00 O ATOM 1030 OE2 GLU A 67 -2.476 -2.127 -1.872 1.00 0.00 O ATOM 0 H GLU A 67 -1.027 -2.981 -3.802 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.234 -5.741 -3.879 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.191 -5.539 -1.543 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.772 -4.086 -2.332 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.825 -4.291 -0.746 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.316 -3.649 -0.129 1.00 0.00 H new ATOM 1037 N ARG A 68 -2.209 -7.043 -2.806 1.00 0.00 N ATOM 1038 CA ARG A 68 -3.429 -7.799 -2.469 1.00 0.00 C ATOM 1039 C ARG A 68 -3.928 -7.393 -1.071 1.00 0.00 C ATOM 1040 O ARG A 68 -3.191 -7.477 -0.077 1.00 0.00 O ATOM 1041 CB ARG A 68 -3.211 -9.334 -2.585 1.00 0.00 C ATOM 1042 CG ARG A 68 -2.140 -9.941 -1.648 1.00 0.00 C ATOM 1043 CD ARG A 68 -2.033 -11.465 -1.809 1.00 0.00 C ATOM 1044 NE ARG A 68 -3.348 -12.121 -1.627 1.00 0.00 N ATOM 1045 CZ ARG A 68 -3.695 -13.320 -2.109 1.00 0.00 C ATOM 1046 NH1 ARG A 68 -2.832 -14.046 -2.817 1.00 0.00 N ATOM 1047 NH2 ARG A 68 -4.917 -13.780 -1.887 1.00 0.00 N ATOM 0 H ARG A 68 -1.364 -7.612 -2.853 1.00 0.00 H new ATOM 0 HA ARG A 68 -4.201 -7.546 -3.195 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -4.161 -9.831 -2.388 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.937 -9.565 -3.614 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.173 -9.485 -1.859 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.386 -9.702 -0.613 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.641 -11.701 -2.798 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -1.324 -11.860 -1.082 1.00 0.00 H new ATOM 0 HE ARG A 68 -4.050 -11.615 -1.087 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -1.894 -13.690 -2.998 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -3.109 -14.959 -3.179 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -5.583 -13.222 -1.353 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -5.192 -14.693 -2.250 1.00 0.00 H new ATOM 1061 N ARG A 69 -5.172 -6.905 -1.035 1.00 0.00 N ATOM 1062 CA ARG A 69 -5.809 -6.392 0.176 1.00 0.00 C ATOM 1063 C ARG A 69 -6.167 -7.550 1.123 1.00 0.00 C ATOM 1064 O ARG A 69 -6.091 -8.724 0.743 1.00 0.00 O ATOM 1065 CB ARG A 69 -7.056 -5.566 -0.235 1.00 0.00 C ATOM 1066 CG ARG A 69 -7.464 -4.444 0.764 1.00 0.00 C ATOM 1067 CD ARG A 69 -7.713 -3.105 0.054 1.00 0.00 C ATOM 1068 NE ARG A 69 -6.492 -2.648 -0.644 1.00 0.00 N ATOM 1069 CZ ARG A 69 -6.447 -1.810 -1.686 1.00 0.00 C ATOM 1070 NH1 ARG A 69 -7.554 -1.300 -2.202 1.00 0.00 N ATOM 1071 NH2 ARG A 69 -5.279 -1.506 -2.228 1.00 0.00 N ATOM 0 H ARG A 69 -5.771 -6.856 -1.859 1.00 0.00 H new ATOM 0 HA ARG A 69 -5.125 -5.741 0.720 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -6.868 -5.113 -1.209 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -7.899 -6.246 -0.357 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.365 -4.744 1.298 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -6.679 -4.319 1.509 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -8.528 -3.213 -0.662 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -8.025 -2.355 0.781 1.00 0.00 H new ATOM 0 HE ARG A 69 -5.601 -3.005 -0.299 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.461 -1.544 -1.805 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -7.500 -0.663 -2.997 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -4.421 -1.910 -1.851 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -5.236 -0.868 -3.023 1.00 0.00 H new ATOM 1085 N PHE A 70 -6.511 -7.213 2.368 1.00 0.00 N ATOM 1086 CA PHE A 70 -6.854 -8.200 3.403 1.00 0.00 C ATOM 1087 C PHE A 70 -8.357 -8.217 3.660 1.00 0.00 C ATOM 1088 O PHE A 70 -9.102 -7.422 3.094 1.00 0.00 O ATOM 1089 CB PHE A 70 -6.037 -7.918 4.697 1.00 0.00 C ATOM 1090 CG PHE A 70 -4.613 -8.453 4.640 1.00 0.00 C ATOM 1091 CD1 PHE A 70 -3.783 -8.160 3.559 1.00 0.00 C ATOM 1092 CD2 PHE A 70 -4.119 -9.280 5.643 1.00 0.00 C ATOM 1093 CE1 PHE A 70 -2.513 -8.674 3.477 1.00 0.00 C ATOM 1094 CE2 PHE A 70 -2.846 -9.784 5.563 1.00 0.00 C ATOM 1095 CZ PHE A 70 -2.046 -9.485 4.477 1.00 0.00 C ATOM 0 H PHE A 70 -6.561 -6.247 2.691 1.00 0.00 H new ATOM 0 HA PHE A 70 -6.585 -9.196 3.052 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.007 -6.843 4.872 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.552 -8.365 5.548 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.146 -7.517 2.771 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -4.742 -9.527 6.490 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -1.886 -8.440 2.629 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -2.467 -10.417 6.352 1.00 0.00 H new ATOM 0 HZ PHE A 70 -1.048 -9.893 4.416 1.00 0.00 H new ATOM 1105 N GLU A 71 -8.779 -9.169 4.491 1.00 0.00 N ATOM 1106 CA GLU A 71 -10.185 -9.391 4.846 1.00 0.00 C ATOM 1107 C GLU A 71 -10.278 -9.845 6.307 1.00 0.00 C ATOM 1108 O GLU A 71 -9.295 -10.332 6.875 1.00 0.00 O ATOM 1109 CB GLU A 71 -10.803 -10.460 3.918 1.00 0.00 C ATOM 1110 CG GLU A 71 -10.124 -11.848 3.992 1.00 0.00 C ATOM 1111 CD GLU A 71 -10.896 -12.929 3.225 1.00 0.00 C ATOM 1112 OE1 GLU A 71 -12.048 -13.215 3.613 1.00 0.00 O ATOM 1113 OE2 GLU A 71 -10.372 -13.486 2.241 1.00 0.00 O ATOM 0 H GLU A 71 -8.142 -9.822 4.947 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.739 -8.460 4.723 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -11.858 -10.573 4.168 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -10.755 -10.101 2.890 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -9.114 -11.775 3.590 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.031 -12.146 5.036 1.00 0.00 H new ATOM 1120 N THR A 72 -11.464 -9.695 6.901 1.00 0.00 N ATOM 1121 CA THR A 72 -11.718 -10.076 8.294 1.00 0.00 C ATOM 1122 C THR A 72 -12.253 -11.528 8.344 1.00 0.00 C ATOM 1123 O THR A 72 -13.393 -11.786 7.944 1.00 0.00 O ATOM 1124 CB THR A 72 -12.728 -9.078 8.945 1.00 0.00 C ATOM 1125 OG1 THR A 72 -12.263 -7.733 8.726 1.00 0.00 O ATOM 1126 CG2 THR A 72 -12.902 -9.316 10.458 1.00 0.00 C ATOM 0 H THR A 72 -12.279 -9.304 6.428 1.00 0.00 H new ATOM 0 HA THR A 72 -10.789 -10.032 8.862 1.00 0.00 H new ATOM 0 HB THR A 72 -13.699 -9.238 8.477 1.00 0.00 H new ATOM 0 HG1 THR A 72 -12.236 -7.253 9.580 1.00 0.00 H new ATOM 0 HG21 THR A 72 -13.614 -8.596 10.860 1.00 0.00 H new ATOM 0 HG22 THR A 72 -13.274 -10.327 10.627 1.00 0.00 H new ATOM 0 HG23 THR A 72 -11.941 -9.194 10.958 1.00 0.00 H new ATOM 1134 N ARG A 73 -11.392 -12.473 8.775 1.00 0.00 N ATOM 1135 CA ARG A 73 -11.731 -13.904 8.866 1.00 0.00 C ATOM 1136 C ARG A 73 -12.650 -14.149 10.083 1.00 0.00 C ATOM 1137 O ARG A 73 -13.811 -14.555 9.932 1.00 0.00 O ATOM 1138 CB ARG A 73 -10.434 -14.769 8.966 1.00 0.00 C ATOM 1139 CG ARG A 73 -9.398 -14.514 7.839 1.00 0.00 C ATOM 1140 CD ARG A 73 -9.955 -14.785 6.423 1.00 0.00 C ATOM 1141 NE ARG A 73 -10.296 -16.205 6.214 1.00 0.00 N ATOM 1142 CZ ARG A 73 -11.206 -16.672 5.346 1.00 0.00 C ATOM 1143 NH1 ARG A 73 -11.957 -15.851 4.626 1.00 0.00 N ATOM 1144 NH2 ARG A 73 -11.387 -17.975 5.227 1.00 0.00 N ATOM 0 H ARG A 73 -10.439 -12.262 9.070 1.00 0.00 H new ATOM 0 HA ARG A 73 -12.263 -14.200 7.962 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.959 -14.578 9.928 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.714 -15.822 8.953 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.057 -13.480 7.896 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.527 -15.147 8.006 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -10.843 -14.174 6.262 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.218 -14.478 5.681 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.796 -16.892 6.779 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -11.849 -14.842 4.726 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -12.643 -16.229 3.972 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -10.836 -18.620 5.793 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -12.077 -18.336 4.569 1.00 0.00 H new ATOM 1158 N LEU A 74 -12.118 -13.885 11.288 1.00 0.00 N ATOM 1159 CA LEU A 74 -12.877 -13.988 12.555 1.00 0.00 C ATOM 1160 C LEU A 74 -13.024 -12.593 13.179 1.00 0.00 C ATOM 1161 O LEU A 74 -12.254 -11.687 12.854 1.00 0.00 O ATOM 1162 CB LEU A 74 -12.147 -14.950 13.533 1.00 0.00 C ATOM 1163 CG LEU A 74 -12.001 -16.429 13.040 1.00 0.00 C ATOM 1164 CD1 LEU A 74 -11.075 -17.238 13.967 1.00 0.00 C ATOM 1165 CD2 LEU A 74 -13.384 -17.116 12.892 1.00 0.00 C ATOM 0 H LEU A 74 -11.149 -13.594 11.416 1.00 0.00 H new ATOM 0 HA LEU A 74 -13.870 -14.390 12.353 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -11.152 -14.552 13.732 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -12.685 -14.953 14.481 1.00 0.00 H new ATOM 0 HG LEU A 74 -11.540 -16.401 12.053 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -10.994 -18.260 13.598 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -10.086 -16.779 13.984 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -11.488 -17.248 14.976 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -13.246 -18.141 12.548 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -13.892 -17.122 13.856 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -13.987 -16.568 12.167 1.00 0.00 H new ATOM 1177 N ALA A 75 -14.006 -12.431 14.086 1.00 0.00 N ATOM 1178 CA ALA A 75 -14.272 -11.146 14.744 1.00 0.00 C ATOM 1179 C ALA A 75 -14.903 -11.347 16.134 1.00 0.00 C ATOM 1180 O ALA A 75 -15.958 -11.983 16.259 1.00 0.00 O ATOM 1181 CB ALA A 75 -15.172 -10.263 13.858 1.00 0.00 C ATOM 0 H ALA A 75 -14.630 -13.183 14.379 1.00 0.00 H new ATOM 0 HA ALA A 75 -13.318 -10.638 14.885 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -15.359 -9.314 14.361 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -14.675 -10.077 12.906 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -16.119 -10.772 13.680 1.00 0.00 H new ATOM 1187 N GLY A 76 -14.220 -10.818 17.172 1.00 0.00 N ATOM 1188 CA GLY A 76 -14.750 -10.767 18.543 1.00 0.00 C ATOM 1189 C GLY A 76 -14.796 -12.131 19.231 1.00 0.00 C ATOM 1190 O GLY A 76 -15.602 -12.351 20.137 1.00 0.00 O ATOM 0 H GLY A 76 -13.287 -10.416 17.079 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -14.135 -10.090 19.137 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -15.755 -10.347 18.520 1.00 0.00 H new ATOM 1194 N VAL A 77 -13.906 -13.028 18.798 1.00 0.00 N ATOM 1195 CA VAL A 77 -13.813 -14.412 19.289 1.00 0.00 C ATOM 1196 C VAL A 77 -12.681 -14.532 20.334 1.00 0.00 C ATOM 1197 O VAL A 77 -12.187 -13.518 20.829 1.00 0.00 O ATOM 1198 CB VAL A 77 -13.581 -15.400 18.081 1.00 0.00 C ATOM 1199 CG1 VAL A 77 -14.764 -15.335 17.087 1.00 0.00 C ATOM 1200 CG2 VAL A 77 -12.231 -15.129 17.359 1.00 0.00 C ATOM 0 H VAL A 77 -13.214 -12.811 18.081 1.00 0.00 H new ATOM 0 HA VAL A 77 -14.750 -14.684 19.775 1.00 0.00 H new ATOM 0 HB VAL A 77 -13.529 -16.409 18.490 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -14.584 -16.024 16.262 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -15.685 -15.615 17.599 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -14.858 -14.321 16.699 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -12.112 -15.832 16.534 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -12.224 -14.110 16.972 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -11.410 -15.255 18.064 1.00 0.00 H new ATOM 1210 N GLU A 78 -12.305 -15.771 20.697 1.00 0.00 N ATOM 1211 CA GLU A 78 -11.189 -16.037 21.632 1.00 0.00 C ATOM 1212 C GLU A 78 -9.971 -16.607 20.884 1.00 0.00 C ATOM 1213 O GLU A 78 -10.072 -16.980 19.710 1.00 0.00 O ATOM 1214 CB GLU A 78 -11.668 -17.012 22.740 1.00 0.00 C ATOM 1215 CG GLU A 78 -12.194 -18.361 22.218 1.00 0.00 C ATOM 1216 CD GLU A 78 -12.830 -19.220 23.318 1.00 0.00 C ATOM 1217 OE1 GLU A 78 -14.036 -19.047 23.592 1.00 0.00 O ATOM 1218 OE2 GLU A 78 -12.126 -20.048 23.933 1.00 0.00 O ATOM 0 H GLU A 78 -12.762 -16.616 20.354 1.00 0.00 H new ATOM 0 HA GLU A 78 -10.879 -15.100 22.094 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -10.841 -17.199 23.424 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -12.456 -16.528 23.317 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -12.930 -18.180 21.435 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -11.373 -18.914 21.762 1.00 0.00 H new ATOM 1225 N GLY A 79 -8.833 -16.701 21.603 1.00 0.00 N ATOM 1226 CA GLY A 79 -7.575 -17.226 21.053 1.00 0.00 C ATOM 1227 C GLY A 79 -7.637 -18.699 20.660 1.00 0.00 C ATOM 1228 O GLY A 79 -6.786 -19.182 19.912 1.00 0.00 O ATOM 0 H GLY A 79 -8.765 -16.414 22.580 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.300 -16.638 20.177 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.783 -17.090 21.790 1.00 0.00 H new ATOM 1232 N GLU A 80 -8.641 -19.410 21.194 1.00 0.00 N ATOM 1233 CA GLU A 80 -8.923 -20.811 20.845 1.00 0.00 C ATOM 1234 C GLU A 80 -9.458 -20.906 19.403 1.00 0.00 C ATOM 1235 O GLU A 80 -9.066 -21.795 18.644 1.00 0.00 O ATOM 1236 CB GLU A 80 -9.957 -21.391 21.841 1.00 0.00 C ATOM 1237 CG GLU A 80 -10.211 -22.903 21.728 1.00 0.00 C ATOM 1238 CD GLU A 80 -8.995 -23.749 22.125 1.00 0.00 C ATOM 1239 OE1 GLU A 80 -8.694 -23.837 23.335 1.00 0.00 O ATOM 1240 OE2 GLU A 80 -8.323 -24.319 21.241 1.00 0.00 O ATOM 0 H GLU A 80 -9.285 -19.026 21.886 1.00 0.00 H new ATOM 0 HA GLU A 80 -8.001 -21.389 20.907 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -9.621 -21.172 22.855 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -10.904 -20.870 21.699 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -11.056 -23.172 22.362 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -10.493 -23.142 20.703 1.00 0.00 H new ATOM 1247 N GLU A 81 -10.355 -19.962 19.045 1.00 0.00 N ATOM 1248 CA GLU A 81 -10.945 -19.865 17.695 1.00 0.00 C ATOM 1249 C GLU A 81 -9.900 -19.390 16.679 1.00 0.00 C ATOM 1250 O GLU A 81 -9.884 -19.837 15.519 1.00 0.00 O ATOM 1251 CB GLU A 81 -12.157 -18.899 17.715 1.00 0.00 C ATOM 1252 CG GLU A 81 -13.320 -19.354 18.618 1.00 0.00 C ATOM 1253 CD GLU A 81 -13.881 -20.733 18.230 1.00 0.00 C ATOM 1254 OE1 GLU A 81 -14.750 -20.809 17.337 1.00 0.00 O ATOM 1255 OE2 GLU A 81 -13.449 -21.755 18.810 1.00 0.00 O ATOM 0 H GLU A 81 -10.690 -19.244 19.687 1.00 0.00 H new ATOM 0 HA GLU A 81 -11.287 -20.855 17.393 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -11.818 -17.918 18.047 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -12.528 -18.781 16.697 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -12.978 -19.385 19.653 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -14.120 -18.616 18.569 1.00 0.00 H new ATOM 1262 N ILE A 82 -9.033 -18.476 17.137 1.00 0.00 N ATOM 1263 CA ILE A 82 -7.917 -17.961 16.342 1.00 0.00 C ATOM 1264 C ILE A 82 -6.963 -19.118 15.973 1.00 0.00 C ATOM 1265 O ILE A 82 -6.744 -19.398 14.791 1.00 0.00 O ATOM 1266 CB ILE A 82 -7.146 -16.833 17.121 1.00 0.00 C ATOM 1267 CG1 ILE A 82 -8.096 -15.638 17.467 1.00 0.00 C ATOM 1268 CG2 ILE A 82 -5.905 -16.357 16.338 1.00 0.00 C ATOM 1269 CD1 ILE A 82 -8.718 -14.931 16.276 1.00 0.00 C ATOM 0 H ILE A 82 -9.089 -18.074 18.073 1.00 0.00 H new ATOM 0 HA ILE A 82 -8.313 -17.521 15.426 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.794 -17.259 18.061 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -8.897 -16.007 18.107 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.534 -14.907 18.049 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.395 -15.577 16.904 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.227 -17.197 16.185 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.215 -15.960 15.371 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -9.357 -14.121 16.627 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -7.930 -14.523 15.643 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -9.314 -15.641 15.702 1.00 0.00 H new ATOM 1281 N ALA A 83 -6.475 -19.821 17.009 1.00 0.00 N ATOM 1282 CA ALA A 83 -5.544 -20.961 16.864 1.00 0.00 C ATOM 1283 C ALA A 83 -6.196 -22.122 16.093 1.00 0.00 C ATOM 1284 O ALA A 83 -5.502 -22.896 15.414 1.00 0.00 O ATOM 1285 CB ALA A 83 -5.068 -21.435 18.243 1.00 0.00 C ATOM 0 H ALA A 83 -6.715 -19.615 17.979 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.683 -20.622 16.289 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.383 -22.275 18.123 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.555 -20.618 18.751 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.927 -21.749 18.836 1.00 0.00 H new ATOM 1291 N ALA A 84 -7.540 -22.220 16.210 1.00 0.00 N ATOM 1292 CA ALA A 84 -8.341 -23.221 15.484 1.00 0.00 C ATOM 1293 C ALA A 84 -8.167 -23.064 13.973 1.00 0.00 C ATOM 1294 O ALA A 84 -7.981 -24.052 13.276 1.00 0.00 O ATOM 1295 CB ALA A 84 -9.830 -23.129 15.853 1.00 0.00 C ATOM 0 H ALA A 84 -8.094 -21.608 16.809 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.977 -24.204 15.782 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.390 -23.882 15.298 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.951 -23.301 16.922 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.207 -22.138 15.600 1.00 0.00 H new ATOM 1301 N LEU A 85 -8.217 -21.809 13.479 1.00 0.00 N ATOM 1302 CA LEU A 85 -8.044 -21.528 12.043 1.00 0.00 C ATOM 1303 C LEU A 85 -6.559 -21.567 11.642 1.00 0.00 C ATOM 1304 O LEU A 85 -6.224 -22.075 10.571 1.00 0.00 O ATOM 1305 CB LEU A 85 -8.620 -20.155 11.629 1.00 0.00 C ATOM 1306 CG LEU A 85 -8.533 -19.873 10.077 1.00 0.00 C ATOM 1307 CD1 LEU A 85 -9.902 -19.909 9.403 1.00 0.00 C ATOM 1308 CD2 LEU A 85 -7.719 -18.600 9.752 1.00 0.00 C ATOM 0 H LEU A 85 -8.375 -20.980 14.052 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.597 -22.311 11.524 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.663 -20.099 11.942 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.084 -19.370 12.163 1.00 0.00 H new ATOM 0 HG LEU A 85 -7.969 -20.697 9.639 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.788 -19.709 8.337 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -10.350 -20.893 9.542 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.546 -19.151 9.848 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -7.690 -18.452 8.672 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -8.189 -17.737 10.224 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -6.703 -18.712 10.130 1.00 0.00 H new ATOM 1320 N LEU A 86 -5.683 -21.001 12.498 1.00 0.00 N ATOM 1321 CA LEU A 86 -4.222 -20.918 12.231 1.00 0.00 C ATOM 1322 C LEU A 86 -3.629 -22.312 11.953 1.00 0.00 C ATOM 1323 O LEU A 86 -2.720 -22.453 11.131 1.00 0.00 O ATOM 1324 CB LEU A 86 -3.466 -20.250 13.415 1.00 0.00 C ATOM 1325 CG LEU A 86 -3.816 -18.759 13.714 1.00 0.00 C ATOM 1326 CD1 LEU A 86 -3.038 -18.250 14.948 1.00 0.00 C ATOM 1327 CD2 LEU A 86 -3.583 -17.863 12.472 1.00 0.00 C ATOM 0 H LEU A 86 -5.960 -20.590 13.389 1.00 0.00 H new ATOM 0 HA LEU A 86 -4.092 -20.298 11.344 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.660 -20.833 14.315 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.396 -20.316 13.217 1.00 0.00 H new ATOM 0 HG LEU A 86 -4.879 -18.701 13.950 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.298 -17.209 15.138 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.300 -18.853 15.817 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.967 -18.329 14.761 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.837 -16.831 12.715 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.536 -17.919 12.174 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.212 -18.208 11.652 1.00 0.00 H new ATOM 1339 N GLU A 87 -4.186 -23.341 12.628 1.00 0.00 N ATOM 1340 CA GLU A 87 -3.736 -24.739 12.472 1.00 0.00 C ATOM 1341 C GLU A 87 -4.275 -25.330 11.153 1.00 0.00 C ATOM 1342 O GLU A 87 -3.629 -26.199 10.546 1.00 0.00 O ATOM 1343 CB GLU A 87 -4.131 -25.606 13.717 1.00 0.00 C ATOM 1344 CG GLU A 87 -5.595 -26.127 13.765 1.00 0.00 C ATOM 1345 CD GLU A 87 -5.773 -27.559 13.201 1.00 0.00 C ATOM 1346 OE1 GLU A 87 -5.247 -28.516 13.811 1.00 0.00 O ATOM 1347 OE2 GLU A 87 -6.427 -27.734 12.150 1.00 0.00 O ATOM 0 H GLU A 87 -4.953 -23.227 13.290 1.00 0.00 H new ATOM 0 HA GLU A 87 -2.647 -24.752 12.418 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.462 -26.465 13.760 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -3.950 -25.015 14.615 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.943 -26.109 14.798 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -6.231 -25.444 13.202 1.00 0.00 H new ATOM 1354 N ARG A 88 -5.468 -24.858 10.724 1.00 0.00 N ATOM 1355 CA ARG A 88 -6.117 -25.333 9.491 1.00 0.00 C ATOM 1356 C ARG A 88 -5.398 -24.753 8.255 1.00 0.00 C ATOM 1357 O ARG A 88 -5.219 -25.438 7.244 1.00 0.00 O ATOM 1358 CB ARG A 88 -7.621 -24.937 9.478 1.00 0.00 C ATOM 1359 CG ARG A 88 -8.433 -25.538 10.640 1.00 0.00 C ATOM 1360 CD ARG A 88 -9.874 -25.001 10.739 1.00 0.00 C ATOM 1361 NE ARG A 88 -10.728 -25.487 9.638 1.00 0.00 N ATOM 1362 CZ ARG A 88 -11.873 -26.171 9.793 1.00 0.00 C ATOM 1363 NH1 ARG A 88 -12.337 -26.456 11.008 1.00 0.00 N ATOM 1364 NH2 ARG A 88 -12.537 -26.583 8.728 1.00 0.00 N ATOM 0 H ARG A 88 -6.000 -24.144 11.221 1.00 0.00 H new ATOM 0 HA ARG A 88 -6.048 -26.420 9.459 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -7.701 -23.851 9.515 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -8.063 -25.257 8.535 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -8.467 -26.621 10.524 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -7.914 -25.333 11.577 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -10.307 -25.303 11.693 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -9.855 -23.911 10.728 1.00 0.00 H new ATOM 0 HE ARG A 88 -10.425 -25.288 8.685 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -11.821 -26.154 11.835 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -13.208 -26.976 11.112 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -12.179 -26.381 7.794 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -13.407 -27.103 8.839 1.00 0.00 H new ATOM 1378 N GLU A 89 -4.996 -23.476 8.361 1.00 0.00 N ATOM 1379 CA GLU A 89 -4.325 -22.742 7.278 1.00 0.00 C ATOM 1380 C GLU A 89 -2.875 -23.187 7.134 1.00 0.00 C ATOM 1381 O GLU A 89 -2.376 -23.288 6.023 1.00 0.00 O ATOM 1382 CB GLU A 89 -4.396 -21.212 7.513 1.00 0.00 C ATOM 1383 CG GLU A 89 -5.822 -20.660 7.534 1.00 0.00 C ATOM 1384 CD GLU A 89 -6.636 -21.017 6.275 1.00 0.00 C ATOM 1385 OE1 GLU A 89 -6.292 -20.535 5.173 1.00 0.00 O ATOM 1386 OE2 GLU A 89 -7.646 -21.754 6.387 1.00 0.00 O ATOM 0 H GLU A 89 -5.129 -22.921 9.207 1.00 0.00 H new ATOM 0 HA GLU A 89 -4.850 -22.971 6.351 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -3.910 -20.976 8.460 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -3.831 -20.706 6.730 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.339 -21.044 8.413 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -5.782 -19.576 7.636 1.00 0.00 H new ATOM 1393 N ARG A 90 -2.203 -23.439 8.273 1.00 0.00 N ATOM 1394 CA ARG A 90 -0.811 -23.961 8.271 1.00 0.00 C ATOM 1395 C ARG A 90 -0.744 -25.383 7.677 1.00 0.00 C ATOM 1396 O ARG A 90 0.287 -25.784 7.119 1.00 0.00 O ATOM 1397 CB ARG A 90 -0.155 -23.912 9.682 1.00 0.00 C ATOM 1398 CG ARG A 90 -0.532 -25.056 10.645 1.00 0.00 C ATOM 1399 CD ARG A 90 0.081 -24.880 12.043 1.00 0.00 C ATOM 1400 NE ARG A 90 -0.121 -26.081 12.883 1.00 0.00 N ATOM 1401 CZ ARG A 90 0.862 -26.869 13.345 1.00 0.00 C ATOM 1402 NH1 ARG A 90 2.132 -26.626 13.031 1.00 0.00 N ATOM 1403 NH2 ARG A 90 0.573 -27.901 14.116 1.00 0.00 N ATOM 0 H ARG A 90 -2.593 -23.293 9.204 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.231 -23.298 7.629 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.928 -23.911 9.557 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.422 -22.966 10.152 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -1.617 -25.109 10.733 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.199 -26.005 10.224 1.00 0.00 H new ATOM 0 HD2 ARG A 90 1.148 -24.676 11.950 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.368 -24.015 12.531 1.00 0.00 H new ATOM 0 HE ARG A 90 -1.079 -26.329 13.129 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.367 -25.834 12.433 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.871 -27.232 13.388 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.397 -28.099 14.360 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.320 -28.500 14.467 1.00 0.00 H new ATOM 1417 N ARG A 91 -1.852 -26.134 7.822 1.00 0.00 N ATOM 1418 CA ARG A 91 -1.995 -27.504 7.289 1.00 0.00 C ATOM 1419 C ARG A 91 -1.840 -27.520 5.752 1.00 0.00 C ATOM 1420 O ARG A 91 -1.159 -28.390 5.190 1.00 0.00 O ATOM 1421 CB ARG A 91 -3.373 -28.092 7.712 1.00 0.00 C ATOM 1422 CG ARG A 91 -3.649 -29.539 7.246 1.00 0.00 C ATOM 1423 CD ARG A 91 -2.649 -30.557 7.818 1.00 0.00 C ATOM 1424 NE ARG A 91 -2.883 -31.920 7.296 1.00 0.00 N ATOM 1425 CZ ARG A 91 -2.357 -33.053 7.794 1.00 0.00 C ATOM 1426 NH1 ARG A 91 -1.571 -33.035 8.868 1.00 0.00 N ATOM 1427 NH2 ARG A 91 -2.606 -34.209 7.191 1.00 0.00 N ATOM 0 H ARG A 91 -2.681 -25.805 8.317 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.203 -28.125 7.706 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.444 -28.059 8.799 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.160 -27.446 7.321 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -4.658 -29.824 7.543 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -3.614 -29.577 6.157 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -1.634 -30.245 7.573 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -2.725 -30.568 8.905 1.00 0.00 H new ATOM 0 HE ARG A 91 -3.498 -32.009 6.487 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -1.358 -32.151 9.329 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -1.182 -33.906 9.230 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -3.192 -34.233 6.357 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -2.211 -35.073 7.562 1.00 0.00 H new ATOM 1441 N PHE A 92 -2.466 -26.539 5.092 1.00 0.00 N ATOM 1442 CA PHE A 92 -2.380 -26.369 3.634 1.00 0.00 C ATOM 1443 C PHE A 92 -1.088 -25.617 3.262 1.00 0.00 C ATOM 1444 O PHE A 92 -0.280 -26.099 2.459 1.00 0.00 O ATOM 1445 CB PHE A 92 -3.642 -25.627 3.111 1.00 0.00 C ATOM 1446 CG PHE A 92 -4.901 -26.494 3.105 1.00 0.00 C ATOM 1447 CD1 PHE A 92 -5.663 -26.665 4.258 1.00 0.00 C ATOM 1448 CD2 PHE A 92 -5.307 -27.159 1.946 1.00 0.00 C ATOM 1449 CE1 PHE A 92 -6.791 -27.469 4.254 1.00 0.00 C ATOM 1450 CE2 PHE A 92 -6.431 -27.965 1.944 1.00 0.00 C ATOM 1451 CZ PHE A 92 -7.175 -28.118 3.097 1.00 0.00 C ATOM 0 H PHE A 92 -3.048 -25.839 5.553 1.00 0.00 H new ATOM 0 HA PHE A 92 -2.344 -27.349 3.157 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.819 -24.748 3.730 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -3.451 -25.271 2.099 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.370 -26.163 5.169 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.735 -27.042 1.038 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -7.371 -27.589 5.157 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.727 -28.475 1.039 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.055 -28.744 3.094 1.00 0.00 H new ATOM 1461 N ASP A 93 -0.899 -24.446 3.877 1.00 0.00 N ATOM 1462 CA ASP A 93 0.255 -23.561 3.630 1.00 0.00 C ATOM 1463 C ASP A 93 0.856 -23.117 4.961 1.00 0.00 C ATOM 1464 O ASP A 93 0.336 -22.209 5.611 1.00 0.00 O ATOM 1465 CB ASP A 93 -0.152 -22.315 2.793 1.00 0.00 C ATOM 1466 CG ASP A 93 -0.614 -22.674 1.374 1.00 0.00 C ATOM 1467 OD1 ASP A 93 0.245 -22.795 0.470 1.00 0.00 O ATOM 1468 OD2 ASP A 93 -1.833 -22.862 1.163 1.00 0.00 O ATOM 0 H ASP A 93 -1.549 -24.076 4.571 1.00 0.00 H new ATOM 0 HA ASP A 93 0.995 -24.121 3.059 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -0.953 -21.784 3.307 1.00 0.00 H new ATOM 0 HB3 ASP A 93 0.695 -21.632 2.732 1.00 0.00 H new ATOM 1473 N SER A 94 1.961 -23.764 5.362 1.00 0.00 N ATOM 1474 CA SER A 94 2.765 -23.352 6.531 1.00 0.00 C ATOM 1475 C SER A 94 3.593 -22.081 6.199 1.00 0.00 C ATOM 1476 O SER A 94 4.303 -21.535 7.048 1.00 0.00 O ATOM 1477 CB SER A 94 3.671 -24.522 6.982 1.00 0.00 C ATOM 1478 OG SER A 94 4.287 -24.265 8.240 1.00 0.00 O ATOM 0 H SER A 94 2.326 -24.589 4.886 1.00 0.00 H new ATOM 0 HA SER A 94 2.100 -23.101 7.357 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.079 -25.435 7.048 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.441 -24.695 6.230 1.00 0.00 H new ATOM 0 HG SER A 94 5.214 -23.981 8.098 1.00 0.00 H new ATOM 1484 N ASP A 95 3.469 -21.623 4.939 1.00 0.00 N ATOM 1485 CA ASP A 95 4.054 -20.379 4.424 1.00 0.00 C ATOM 1486 C ASP A 95 3.310 -19.120 4.934 1.00 0.00 C ATOM 1487 O ASP A 95 3.636 -18.005 4.501 1.00 0.00 O ATOM 1488 CB ASP A 95 4.012 -20.405 2.870 1.00 0.00 C ATOM 1489 CG ASP A 95 4.762 -21.601 2.250 1.00 0.00 C ATOM 1490 OD1 ASP A 95 4.267 -22.749 2.360 1.00 0.00 O ATOM 1491 OD2 ASP A 95 5.847 -21.408 1.659 1.00 0.00 O ATOM 0 H ASP A 95 2.939 -22.130 4.230 1.00 0.00 H new ATOM 0 HA ASP A 95 5.081 -20.321 4.786 1.00 0.00 H new ATOM 0 HB2 ASP A 95 2.972 -20.431 2.544 1.00 0.00 H new ATOM 0 HB3 ASP A 95 4.443 -19.480 2.488 1.00 0.00 H new ATOM 1496 N LEU A 96 2.307 -19.287 5.835 1.00 0.00 N ATOM 1497 CA LEU A 96 1.602 -18.137 6.433 1.00 0.00 C ATOM 1498 C LEU A 96 2.449 -17.512 7.552 1.00 0.00 C ATOM 1499 O LEU A 96 3.248 -18.198 8.210 1.00 0.00 O ATOM 1500 CB LEU A 96 0.177 -18.483 6.982 1.00 0.00 C ATOM 1501 CG LEU A 96 0.093 -19.189 8.377 1.00 0.00 C ATOM 1502 CD1 LEU A 96 -1.336 -19.145 8.951 1.00 0.00 C ATOM 1503 CD2 LEU A 96 0.603 -20.630 8.309 1.00 0.00 C ATOM 0 H LEU A 96 1.976 -20.197 6.156 1.00 0.00 H new ATOM 0 HA LEU A 96 1.459 -17.423 5.622 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.396 -17.557 7.038 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.319 -19.121 6.251 1.00 0.00 H new ATOM 0 HG LEU A 96 0.743 -18.633 9.053 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.355 -19.645 9.920 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.648 -18.108 9.072 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.018 -19.652 8.268 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.530 -21.089 9.295 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.000 -21.196 7.600 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.643 -20.633 7.984 1.00 0.00 H new ATOM 1515 N TRP A 97 2.264 -16.205 7.740 1.00 0.00 N ATOM 1516 CA TRP A 97 2.872 -15.445 8.827 1.00 0.00 C ATOM 1517 C TRP A 97 1.780 -15.148 9.851 1.00 0.00 C ATOM 1518 O TRP A 97 0.744 -14.582 9.495 1.00 0.00 O ATOM 1519 CB TRP A 97 3.460 -14.116 8.290 1.00 0.00 C ATOM 1520 CG TRP A 97 4.578 -14.278 7.284 1.00 0.00 C ATOM 1521 CD1 TRP A 97 4.549 -14.988 6.119 1.00 0.00 C ATOM 1522 CD2 TRP A 97 5.865 -13.668 7.346 1.00 0.00 C ATOM 1523 NE1 TRP A 97 5.753 -14.890 5.482 1.00 0.00 N ATOM 1524 CE2 TRP A 97 6.574 -14.083 6.211 1.00 0.00 C ATOM 1525 CE3 TRP A 97 6.485 -12.832 8.265 1.00 0.00 C ATOM 1526 CZ2 TRP A 97 7.877 -13.678 5.964 1.00 0.00 C ATOM 1527 CZ3 TRP A 97 7.778 -12.423 8.025 1.00 0.00 C ATOM 1528 CH2 TRP A 97 8.462 -12.848 6.878 1.00 0.00 C ATOM 0 H TRP A 97 1.677 -15.637 7.129 1.00 0.00 H new ATOM 0 HA TRP A 97 3.682 -16.017 9.280 1.00 0.00 H new ATOM 0 HB2 TRP A 97 2.657 -13.539 7.830 1.00 0.00 H new ATOM 0 HB3 TRP A 97 3.830 -13.532 9.133 1.00 0.00 H new ATOM 0 HD1 TRP A 97 3.699 -15.545 5.754 1.00 0.00 H new ATOM 0 HE1 TRP A 97 5.998 -15.347 4.603 1.00 0.00 H new ATOM 0 HE3 TRP A 97 5.962 -12.508 9.153 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 8.409 -14.006 5.083 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 8.270 -11.768 8.728 1.00 0.00 H new ATOM 0 HH2 TRP A 97 9.475 -12.512 6.713 1.00 0.00 H new ATOM 1539 N VAL A 98 2.013 -15.508 11.113 1.00 0.00 N ATOM 1540 CA VAL A 98 1.056 -15.247 12.193 1.00 0.00 C ATOM 1541 C VAL A 98 1.579 -14.068 13.000 1.00 0.00 C ATOM 1542 O VAL A 98 2.684 -14.126 13.537 1.00 0.00 O ATOM 1543 CB VAL A 98 0.826 -16.498 13.111 1.00 0.00 C ATOM 1544 CG1 VAL A 98 -0.150 -16.164 14.262 1.00 0.00 C ATOM 1545 CG2 VAL A 98 0.324 -17.709 12.277 1.00 0.00 C ATOM 0 H VAL A 98 2.862 -15.985 11.416 1.00 0.00 H new ATOM 0 HA VAL A 98 0.083 -15.017 11.759 1.00 0.00 H new ATOM 0 HB VAL A 98 1.781 -16.775 13.557 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -0.294 -17.047 14.885 1.00 0.00 H new ATOM 0 HG12 VAL A 98 0.263 -15.357 14.867 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.109 -15.853 13.847 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.171 -18.565 12.934 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -0.618 -17.451 11.792 1.00 0.00 H new ATOM 0 HG23 VAL A 98 1.066 -17.961 11.519 1.00 0.00 H new ATOM 1555 N VAL A 99 0.804 -12.980 13.027 1.00 0.00 N ATOM 1556 CA VAL A 99 1.209 -11.726 13.690 1.00 0.00 C ATOM 1557 C VAL A 99 0.155 -11.340 14.727 1.00 0.00 C ATOM 1558 O VAL A 99 -0.996 -11.099 14.358 1.00 0.00 O ATOM 1559 CB VAL A 99 1.363 -10.535 12.658 1.00 0.00 C ATOM 1560 CG1 VAL A 99 2.156 -9.354 13.263 1.00 0.00 C ATOM 1561 CG2 VAL A 99 1.976 -11.022 11.319 1.00 0.00 C ATOM 0 H VAL A 99 -0.118 -12.938 12.594 1.00 0.00 H new ATOM 0 HA VAL A 99 2.176 -11.899 14.162 1.00 0.00 H new ATOM 0 HB VAL A 99 0.363 -10.162 12.436 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.241 -8.556 12.525 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.635 -8.979 14.144 1.00 0.00 H new ATOM 0 HG13 VAL A 99 3.152 -9.692 13.547 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.068 -10.180 10.633 1.00 0.00 H new ATOM 0 HG22 VAL A 99 2.962 -11.449 11.504 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.330 -11.780 10.877 1.00 0.00 H new ATOM 1571 N GLU A 100 0.525 -11.290 16.017 1.00 0.00 N ATOM 1572 CA GLU A 100 -0.385 -10.790 17.059 1.00 0.00 C ATOM 1573 C GLU A 100 -0.233 -9.272 17.155 1.00 0.00 C ATOM 1574 O GLU A 100 0.879 -8.764 17.308 1.00 0.00 O ATOM 1575 CB GLU A 100 -0.141 -11.477 18.432 1.00 0.00 C ATOM 1576 CG GLU A 100 1.257 -11.267 19.054 1.00 0.00 C ATOM 1577 CD GLU A 100 1.386 -11.869 20.463 1.00 0.00 C ATOM 1578 OE1 GLU A 100 1.021 -13.055 20.646 1.00 0.00 O ATOM 1579 OE2 GLU A 100 1.808 -11.160 21.402 1.00 0.00 O ATOM 0 H GLU A 100 1.438 -11.587 16.361 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.409 -11.037 16.781 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -0.889 -11.113 19.136 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.308 -12.548 18.315 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.009 -11.715 18.404 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.471 -10.199 19.100 1.00 0.00 H new ATOM 1586 N ILE A 101 -1.347 -8.545 16.976 1.00 0.00 N ATOM 1587 CA ILE A 101 -1.380 -7.089 17.133 1.00 0.00 C ATOM 1588 C ILE A 101 -2.366 -6.730 18.264 1.00 0.00 C ATOM 1589 O ILE A 101 -3.545 -7.061 18.203 1.00 0.00 O ATOM 1590 CB ILE A 101 -1.741 -6.357 15.771 1.00 0.00 C ATOM 1591 CG1 ILE A 101 -3.132 -6.788 15.214 1.00 0.00 C ATOM 1592 CG2 ILE A 101 -0.644 -6.610 14.698 1.00 0.00 C ATOM 1593 CD1 ILE A 101 -3.627 -5.959 14.051 1.00 0.00 C ATOM 0 H ILE A 101 -2.246 -8.952 16.719 1.00 0.00 H new ATOM 0 HA ILE A 101 -0.386 -6.735 17.406 1.00 0.00 H new ATOM 0 HB ILE A 101 -1.789 -5.291 15.995 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -3.077 -7.831 14.903 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.864 -6.734 16.020 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -0.914 -6.098 13.774 1.00 0.00 H new ATOM 0 HG22 ILE A 101 0.312 -6.229 15.058 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -0.560 -7.680 14.509 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -4.600 -6.329 13.729 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -3.719 -4.918 14.359 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -2.919 -6.032 13.225 1.00 0.00 H new ATOM 1605 N GLU A 102 -1.873 -6.052 19.305 1.00 0.00 N ATOM 1606 CA GLU A 102 -2.677 -5.708 20.483 1.00 0.00 C ATOM 1607 C GLU A 102 -3.197 -4.285 20.278 1.00 0.00 C ATOM 1608 O GLU A 102 -2.453 -3.315 20.462 1.00 0.00 O ATOM 1609 CB GLU A 102 -1.838 -5.844 21.794 1.00 0.00 C ATOM 1610 CG GLU A 102 -2.652 -5.963 23.110 1.00 0.00 C ATOM 1611 CD GLU A 102 -3.510 -4.724 23.465 1.00 0.00 C ATOM 1612 OE1 GLU A 102 -2.942 -3.716 23.940 1.00 0.00 O ATOM 1613 OE2 GLU A 102 -4.748 -4.752 23.276 1.00 0.00 O ATOM 0 H GLU A 102 -0.908 -5.727 19.355 1.00 0.00 H new ATOM 0 HA GLU A 102 -3.516 -6.395 20.593 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.199 -6.722 21.704 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -1.180 -4.978 21.873 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -3.308 -6.831 23.036 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.961 -6.154 23.931 1.00 0.00 H new ATOM 1620 N THR A 103 -4.466 -4.177 19.886 1.00 0.00 N ATOM 1621 CA THR A 103 -5.099 -2.892 19.577 1.00 0.00 C ATOM 1622 C THR A 103 -6.629 -2.983 19.707 1.00 0.00 C ATOM 1623 O THR A 103 -7.220 -4.065 19.635 1.00 0.00 O ATOM 1624 CB THR A 103 -4.688 -2.382 18.148 1.00 0.00 C ATOM 1625 OG1 THR A 103 -5.487 -1.243 17.758 1.00 0.00 O ATOM 1626 CG2 THR A 103 -4.797 -3.488 17.085 1.00 0.00 C ATOM 0 H THR A 103 -5.087 -4.979 19.773 1.00 0.00 H new ATOM 0 HA THR A 103 -4.741 -2.165 20.306 1.00 0.00 H new ATOM 0 HB THR A 103 -3.642 -2.080 18.209 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.076 -1.495 17.017 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.503 -3.090 16.114 1.00 0.00 H new ATOM 0 HG22 THR A 103 -4.139 -4.315 17.352 1.00 0.00 H new ATOM 0 HG23 THR A 103 -5.826 -3.844 17.035 1.00 0.00 H new ATOM 1634 N ASP A 104 -7.246 -1.812 19.903 1.00 0.00 N ATOM 1635 CA ASP A 104 -8.698 -1.646 20.077 1.00 0.00 C ATOM 1636 C ASP A 104 -9.441 -1.681 18.726 1.00 0.00 C ATOM 1637 O ASP A 104 -10.609 -2.076 18.654 1.00 0.00 O ATOM 1638 CB ASP A 104 -8.967 -0.298 20.796 1.00 0.00 C ATOM 1639 CG ASP A 104 -8.504 0.931 19.984 1.00 0.00 C ATOM 1640 OD1 ASP A 104 -7.281 1.182 19.912 1.00 0.00 O ATOM 1641 OD2 ASP A 104 -9.358 1.647 19.418 1.00 0.00 O ATOM 0 H ASP A 104 -6.738 -0.929 19.947 1.00 0.00 H new ATOM 0 HA ASP A 104 -9.073 -2.475 20.677 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -10.034 -0.209 20.999 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.458 -0.301 21.760 1.00 0.00 H new ATOM 1646 N GLU A 105 -8.746 -1.252 17.664 1.00 0.00 N ATOM 1647 CA GLU A 105 -9.315 -1.139 16.309 1.00 0.00 C ATOM 1648 C GLU A 105 -8.381 -1.785 15.277 1.00 0.00 C ATOM 1649 O GLU A 105 -7.334 -2.336 15.629 1.00 0.00 O ATOM 1650 CB GLU A 105 -9.528 0.350 15.948 1.00 0.00 C ATOM 1651 CG GLU A 105 -8.221 1.161 15.847 1.00 0.00 C ATOM 1652 CD GLU A 105 -8.398 2.441 15.036 1.00 0.00 C ATOM 1653 OE1 GLU A 105 -8.593 2.342 13.796 1.00 0.00 O ATOM 1654 OE2 GLU A 105 -8.356 3.539 15.620 1.00 0.00 O ATOM 0 H GLU A 105 -7.767 -0.971 17.718 1.00 0.00 H new ATOM 0 HA GLU A 105 -10.273 -1.659 16.294 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.056 0.411 14.997 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.171 0.808 16.700 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.873 1.413 16.849 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.448 0.545 15.387 1.00 0.00 H new ATOM 1661 N ILE A 106 -8.749 -1.666 13.987 1.00 0.00 N ATOM 1662 CA ILE A 106 -7.983 -2.255 12.883 1.00 0.00 C ATOM 1663 C ILE A 106 -7.764 -1.239 11.732 1.00 0.00 C ATOM 1664 O ILE A 106 -6.780 -1.338 10.991 1.00 0.00 O ATOM 1665 CB ILE A 106 -8.713 -3.546 12.353 1.00 0.00 C ATOM 1666 CG1 ILE A 106 -7.773 -4.375 11.426 1.00 0.00 C ATOM 1667 CG2 ILE A 106 -10.063 -3.211 11.661 1.00 0.00 C ATOM 1668 CD1 ILE A 106 -6.539 -4.929 12.124 1.00 0.00 C ATOM 0 H ILE A 106 -9.582 -1.160 13.687 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.999 -2.531 13.263 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.956 -4.164 13.217 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -8.339 -5.204 11.001 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.455 -3.746 10.594 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.531 -4.131 11.311 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.724 -2.716 12.373 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.883 -2.551 10.813 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.939 -5.492 11.409 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.948 -4.106 12.525 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -6.846 -5.586 12.938 1.00 0.00 H new ATOM 1680 N GLY A 107 -8.643 -0.221 11.656 1.00 0.00 N ATOM 1681 CA GLY A 107 -8.808 0.586 10.442 1.00 0.00 C ATOM 1682 C GLY A 107 -7.606 1.461 10.093 1.00 0.00 C ATOM 1683 O GLY A 107 -7.311 1.670 8.913 1.00 0.00 O ATOM 0 H GLY A 107 -9.250 0.059 12.427 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -9.012 -0.080 9.604 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -9.683 1.225 10.562 1.00 0.00 H new ATOM 1687 N THR A 108 -6.914 1.971 11.118 1.00 0.00 N ATOM 1688 CA THR A 108 -5.743 2.853 10.937 1.00 0.00 C ATOM 1689 C THR A 108 -4.437 2.056 10.705 1.00 0.00 C ATOM 1690 O THR A 108 -3.449 2.608 10.203 1.00 0.00 O ATOM 1691 CB THR A 108 -5.574 3.790 12.181 1.00 0.00 C ATOM 1692 OG1 THR A 108 -4.539 4.761 11.956 1.00 0.00 O ATOM 1693 CG2 THR A 108 -5.261 3.008 13.466 1.00 0.00 C ATOM 0 H THR A 108 -7.144 1.788 12.095 1.00 0.00 H new ATOM 0 HA THR A 108 -5.928 3.451 10.045 1.00 0.00 H new ATOM 0 HB THR A 108 -6.530 4.295 12.315 1.00 0.00 H new ATOM 0 HG1 THR A 108 -4.452 5.336 12.745 1.00 0.00 H new ATOM 0 HG21 THR A 108 -5.153 3.704 14.298 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.074 2.313 13.676 1.00 0.00 H new ATOM 0 HG23 THR A 108 -4.333 2.451 13.336 1.00 0.00 H new ATOM 1701 N LEU A 109 -4.442 0.746 11.042 1.00 0.00 N ATOM 1702 CA LEU A 109 -3.200 -0.054 11.157 1.00 0.00 C ATOM 1703 C LEU A 109 -3.226 -1.362 10.325 1.00 0.00 C ATOM 1704 O LEU A 109 -2.275 -2.153 10.389 1.00 0.00 O ATOM 1705 CB LEU A 109 -2.914 -0.293 12.670 1.00 0.00 C ATOM 1706 CG LEU A 109 -4.116 -0.809 13.550 1.00 0.00 C ATOM 1707 CD1 LEU A 109 -4.291 -2.339 13.485 1.00 0.00 C ATOM 1708 CD2 LEU A 109 -3.987 -0.333 15.013 1.00 0.00 C ATOM 0 H LEU A 109 -5.293 0.220 11.239 1.00 0.00 H new ATOM 0 HA LEU A 109 -2.375 0.508 10.719 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -2.100 -1.013 12.752 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.556 0.643 13.100 1.00 0.00 H new ATOM 0 HG LEU A 109 -5.017 -0.370 13.123 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -5.133 -2.636 14.110 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -4.480 -2.640 12.455 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -3.384 -2.825 13.844 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -4.831 -0.706 15.593 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -3.058 -0.713 15.439 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.980 0.757 15.042 1.00 0.00 H new ATOM 1720 N LEU A 110 -4.303 -1.556 9.543 1.00 0.00 N ATOM 1721 CA LEU A 110 -4.426 -2.656 8.561 1.00 0.00 C ATOM 1722 C LEU A 110 -5.630 -2.379 7.641 1.00 0.00 C ATOM 1723 O LEU A 110 -6.726 -2.055 8.119 1.00 0.00 O ATOM 1724 CB LEU A 110 -4.588 -4.035 9.266 1.00 0.00 C ATOM 1725 CG LEU A 110 -4.673 -5.297 8.341 1.00 0.00 C ATOM 1726 CD1 LEU A 110 -3.433 -5.416 7.437 1.00 0.00 C ATOM 1727 CD2 LEU A 110 -4.886 -6.590 9.169 1.00 0.00 C ATOM 0 H LEU A 110 -5.122 -0.949 9.573 1.00 0.00 H new ATOM 0 HA LEU A 110 -3.511 -2.699 7.969 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -3.747 -4.169 9.947 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -5.490 -4.000 9.877 1.00 0.00 H new ATOM 0 HG LEU A 110 -5.542 -5.169 7.695 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -3.525 -6.302 6.809 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -3.356 -4.530 6.806 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -2.539 -5.500 8.055 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -4.941 -7.447 8.498 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -4.052 -6.722 9.859 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -5.815 -6.512 9.734 1.00 0.00 H new ATOM 1739 N THR A 111 -5.406 -2.508 6.321 1.00 0.00 N ATOM 1740 CA THR A 111 -6.428 -2.249 5.296 1.00 0.00 C ATOM 1741 C THR A 111 -7.182 -3.551 4.948 1.00 0.00 C ATOM 1742 O THR A 111 -6.559 -4.584 4.671 1.00 0.00 O ATOM 1743 CB THR A 111 -5.795 -1.658 3.992 1.00 0.00 C ATOM 1744 OG1 THR A 111 -4.963 -0.530 4.313 1.00 0.00 O ATOM 1745 CG2 THR A 111 -6.885 -1.229 2.996 1.00 0.00 C ATOM 0 H THR A 111 -4.507 -2.796 5.936 1.00 0.00 H new ATOM 0 HA THR A 111 -7.124 -1.518 5.708 1.00 0.00 H new ATOM 0 HB THR A 111 -5.188 -2.436 3.529 1.00 0.00 H new ATOM 0 HG1 THR A 111 -4.570 -0.169 3.491 1.00 0.00 H new ATOM 0 HG21 THR A 111 -6.418 -0.822 2.099 1.00 0.00 H new ATOM 0 HG22 THR A 111 -7.494 -2.093 2.728 1.00 0.00 H new ATOM 0 HG23 THR A 111 -7.517 -0.468 3.454 1.00 0.00 H new ATOM 1753 N LEU A 112 -8.528 -3.472 4.946 1.00 0.00 N ATOM 1754 CA LEU A 112 -9.423 -4.620 4.684 1.00 0.00 C ATOM 1755 C LEU A 112 -10.448 -4.265 3.598 1.00 0.00 C ATOM 1756 O LEU A 112 -10.709 -3.086 3.339 1.00 0.00 O ATOM 1757 CB LEU A 112 -10.162 -5.029 5.988 1.00 0.00 C ATOM 1758 CG LEU A 112 -9.236 -5.297 7.216 1.00 0.00 C ATOM 1759 CD1 LEU A 112 -10.020 -5.244 8.521 1.00 0.00 C ATOM 1760 CD2 LEU A 112 -8.466 -6.626 7.067 1.00 0.00 C ATOM 0 H LEU A 112 -9.030 -2.603 5.128 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.818 -5.457 4.337 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -10.868 -4.241 6.250 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.746 -5.928 5.790 1.00 0.00 H new ATOM 0 HG LEU A 112 -8.494 -4.499 7.248 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.348 -5.435 9.357 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.471 -4.258 8.635 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.804 -6.001 8.506 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.832 -6.779 7.940 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.175 -7.450 6.984 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.847 -6.589 6.171 1.00 0.00 H new ATOM 1772 N VAL A 113 -11.005 -5.305 2.964 1.00 0.00 N ATOM 1773 CA VAL A 113 -12.126 -5.191 2.018 1.00 0.00 C ATOM 1774 C VAL A 113 -13.463 -5.343 2.773 1.00 0.00 C ATOM 1775 O VAL A 113 -14.491 -4.805 2.347 1.00 0.00 O ATOM 1776 CB VAL A 113 -12.028 -6.272 0.868 1.00 0.00 C ATOM 1777 CG1 VAL A 113 -10.753 -6.055 0.020 1.00 0.00 C ATOM 1778 CG2 VAL A 113 -12.086 -7.726 1.426 1.00 0.00 C ATOM 0 H VAL A 113 -10.685 -6.265 3.095 1.00 0.00 H new ATOM 0 HA VAL A 113 -12.077 -4.206 1.554 1.00 0.00 H new ATOM 0 HB VAL A 113 -12.898 -6.141 0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -10.705 -6.810 -0.765 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -10.780 -5.063 -0.431 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -9.873 -6.139 0.658 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -12.015 -8.435 0.601 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -11.255 -7.885 2.114 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -13.028 -7.876 1.954 1.00 0.00 H new ATOM 1788 N ASP A 114 -13.418 -6.081 3.908 1.00 0.00 N ATOM 1789 CA ASP A 114 -14.599 -6.396 4.730 1.00 0.00 C ATOM 1790 C ASP A 114 -15.027 -5.168 5.551 1.00 0.00 C ATOM 1791 O ASP A 114 -16.099 -4.598 5.317 1.00 0.00 O ATOM 1792 CB ASP A 114 -14.294 -7.595 5.668 1.00 0.00 C ATOM 1793 CG ASP A 114 -15.478 -7.962 6.588 1.00 0.00 C ATOM 1794 OD1 ASP A 114 -16.415 -8.648 6.125 1.00 0.00 O ATOM 1795 OD2 ASP A 114 -15.485 -7.555 7.769 1.00 0.00 O ATOM 0 H ASP A 114 -12.552 -6.475 4.277 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.421 -6.670 4.068 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -14.029 -8.463 5.064 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -13.425 -7.356 6.282 1.00 0.00 H new ATOM 1800 N GLN A 115 -14.169 -4.780 6.514 1.00 0.00 N ATOM 1801 CA GLN A 115 -14.412 -3.622 7.391 1.00 0.00 C ATOM 1802 C GLN A 115 -14.420 -2.307 6.576 1.00 0.00 C ATOM 1803 O GLN A 115 -13.637 -2.180 5.619 1.00 0.00 O ATOM 1804 CB GLN A 115 -13.345 -3.569 8.521 1.00 0.00 C ATOM 1805 CG GLN A 115 -13.438 -4.722 9.544 1.00 0.00 C ATOM 1806 CD GLN A 115 -14.727 -4.695 10.365 1.00 0.00 C ATOM 1807 OE1 GLN A 115 -14.787 -4.064 11.417 1.00 0.00 O ATOM 1808 NE2 GLN A 115 -15.769 -5.362 9.890 1.00 0.00 N ATOM 0 H GLN A 115 -13.290 -5.261 6.704 1.00 0.00 H new ATOM 0 HA GLN A 115 -15.394 -3.736 7.850 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -12.354 -3.581 8.068 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -13.442 -2.621 9.051 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -13.370 -5.674 9.017 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -12.584 -4.670 10.219 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -15.688 -5.877 9.013 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -16.652 -5.360 10.401 1.00 0.00 H new ATOM 1817 N PRO A 116 -15.304 -1.311 6.939 1.00 0.00 N ATOM 1818 CA PRO A 116 -15.444 -0.040 6.182 1.00 0.00 C ATOM 1819 C PRO A 116 -14.138 0.790 6.161 1.00 0.00 C ATOM 1820 O PRO A 116 -13.260 0.626 7.022 1.00 0.00 O ATOM 1821 CB PRO A 116 -16.583 0.709 6.938 1.00 0.00 C ATOM 1822 CG PRO A 116 -16.583 0.113 8.312 1.00 0.00 C ATOM 1823 CD PRO A 116 -16.224 -1.341 8.116 1.00 0.00 C ATOM 0 HA PRO A 116 -15.667 -0.213 5.129 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -16.397 1.782 6.972 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -17.545 0.568 6.445 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -15.861 0.613 8.957 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -17.559 0.217 8.786 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -15.736 -1.758 8.997 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -17.106 -1.951 7.922 1.00 0.00 H new ATOM 1831 N GLN A 117 -14.021 1.666 5.147 1.00 0.00 N ATOM 1832 CA GLN A 117 -12.921 2.646 5.043 1.00 0.00 C ATOM 1833 C GLN A 117 -13.114 3.775 6.081 1.00 0.00 C ATOM 1834 O GLN A 117 -12.172 4.504 6.408 1.00 0.00 O ATOM 1835 CB GLN A 117 -12.853 3.224 3.604 1.00 0.00 C ATOM 1836 CG GLN A 117 -12.564 2.163 2.510 1.00 0.00 C ATOM 1837 CD GLN A 117 -12.369 2.769 1.118 1.00 0.00 C ATOM 1838 OE1 GLN A 117 -11.247 3.084 0.715 1.00 0.00 O ATOM 1839 NE2 GLN A 117 -13.453 2.936 0.376 1.00 0.00 N ATOM 0 H GLN A 117 -14.686 1.716 4.375 1.00 0.00 H new ATOM 0 HA GLN A 117 -11.977 2.144 5.255 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -13.798 3.717 3.377 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -12.078 3.989 3.567 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -11.670 1.603 2.784 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -13.389 1.451 2.477 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -14.367 2.665 0.740 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -13.374 3.336 -0.559 1.00 0.00 H new ATOM 1848 N ALA A 118 -14.360 3.906 6.570 1.00 0.00 N ATOM 1849 CA ALA A 118 -14.715 4.799 7.672 1.00 0.00 C ATOM 1850 C ALA A 118 -14.296 4.144 9.011 1.00 0.00 C ATOM 1851 O ALA A 118 -13.436 4.704 9.720 1.00 0.00 O ATOM 1852 CB ALA A 118 -16.229 5.100 7.638 1.00 0.00 C ATOM 1853 OXT ALA A 118 -14.795 3.039 9.316 1.00 0.00 O ATOM 0 H ALA A 118 -15.155 3.384 6.201 1.00 0.00 H new ATOM 0 HA ALA A 118 -14.187 5.747 7.571 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -16.486 5.766 8.462 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -16.484 5.578 6.692 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -16.787 4.169 7.736 1.00 0.00 H new TER 1859 ALA A 118