USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 753 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -110:sc= -0.845 (180deg=-3.84!) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot -57:sc= 0.557 USER MOD Single : A -4 SER OG : rot 180:sc=-0.00256 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ -118:sc= 0.0981 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HD1:sc= -4! C(o=-4!,f=-5.6!) USER MOD Single : A 33 THR OG1 : rot 90:sc= -0.166 USER MOD Single : A 36 GLN : amide:sc= -0.563 X(o=-0.56,f=-0.33) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.457) USER MOD Single : A 46 HIS : no HD1:sc= -5.55! C(o=-5.6!,f=-13!) USER MOD Single : A 66 ASN : amide:sc= 1.13 K(o=1.1,f=-0.21) USER MOD Single : A 67 MET CE :methyl -120:sc= -1.2 (180deg=-5.14!) USER MOD Single : A 68 ASN : amide:sc= -0.0569 X(o=-0.057,f=-0.41) USER MOD Single : A 70 SER OG : rot 65:sc= 0.753 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.376 X(o=-0.38,f=-0.38) USER MOD Single : A 83 LYS NZ :NH3+ -145:sc=-0.00978 (180deg=-0.542) USER MOD Single : A 85 MET CE :methyl -172:sc= 0 (180deg=-0.0468) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 19:sc= 0.315! USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 -20.015 -23.052 5.735 1.00 0.00 N ATOM 2 CA GLY A -6 -19.578 -21.862 6.442 1.00 0.00 C ATOM 3 C GLY A -6 -20.541 -21.453 7.539 1.00 0.00 C ATOM 4 O GLY A -6 -21.484 -22.181 7.850 1.00 0.00 O ATOM 0 H1 GLY A -6 -19.313 -23.809 5.862 1.00 0.00 H new ATOM 0 H2 GLY A -6 -20.932 -23.363 6.113 1.00 0.00 H new ATOM 0 H3 GLY A -6 -20.113 -22.838 4.722 1.00 0.00 H new ATOM 0 HA2 GLY A -6 -18.594 -22.041 6.875 1.00 0.00 H new ATOM 0 HA3 GLY A -6 -19.470 -21.041 5.733 1.00 0.00 H new ATOM 8 N SER A -5 -20.303 -20.286 8.128 1.00 0.00 N ATOM 9 CA SER A -5 -21.154 -19.783 9.201 1.00 0.00 C ATOM 10 C SER A -5 -21.475 -18.306 8.992 1.00 0.00 C ATOM 11 O SER A -5 -20.863 -17.638 8.160 1.00 0.00 O ATOM 12 CB SER A -5 -20.473 -19.982 10.556 1.00 0.00 C ATOM 13 OG SER A -5 -20.197 -21.352 10.792 1.00 0.00 O ATOM 0 H SER A -5 -19.528 -19.671 7.881 1.00 0.00 H new ATOM 0 HA SER A -5 -22.087 -20.346 9.186 1.00 0.00 H new ATOM 0 HB2 SER A -5 -19.546 -19.410 10.588 1.00 0.00 H new ATOM 0 HB3 SER A -5 -21.113 -19.595 11.349 1.00 0.00 H new ATOM 0 HG SER A -5 -19.760 -21.452 11.664 1.00 0.00 H new ATOM 19 N SER A -4 -22.441 -17.804 9.755 1.00 0.00 N ATOM 20 CA SER A -4 -22.848 -16.408 9.652 1.00 0.00 C ATOM 21 C SER A -4 -22.188 -15.568 10.741 1.00 0.00 C ATOM 22 O SER A -4 -21.540 -16.098 11.643 1.00 0.00 O ATOM 23 CB SER A -4 -24.370 -16.290 9.754 1.00 0.00 C ATOM 24 OG SER A -4 -24.818 -15.036 9.267 1.00 0.00 O ATOM 0 H SER A -4 -22.956 -18.343 10.451 1.00 0.00 H new ATOM 0 HA SER A -4 -22.525 -16.032 8.681 1.00 0.00 H new ATOM 0 HB2 SER A -4 -24.839 -17.093 9.186 1.00 0.00 H new ATOM 0 HB3 SER A -4 -24.679 -16.412 10.792 1.00 0.00 H new ATOM 0 HG SER A -4 -25.794 -14.986 9.341 1.00 0.00 H new ATOM 30 N GLY A -3 -22.358 -14.252 10.650 1.00 0.00 N ATOM 31 CA GLY A -3 -21.772 -13.359 11.633 1.00 0.00 C ATOM 32 C GLY A -3 -22.820 -12.622 12.443 1.00 0.00 C ATOM 33 O GLY A -3 -23.171 -13.042 13.546 1.00 0.00 O ATOM 0 H GLY A -3 -22.891 -13.789 9.914 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -21.134 -13.932 12.306 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -21.133 -12.635 11.127 1.00 0.00 H new ATOM 37 N SER A -2 -23.320 -11.518 11.897 1.00 0.00 N ATOM 38 CA SER A -2 -24.330 -10.718 12.579 1.00 0.00 C ATOM 39 C SER A -2 -23.760 -10.090 13.847 1.00 0.00 C ATOM 40 O SER A -2 -24.416 -10.064 14.889 1.00 0.00 O ATOM 41 CB SER A -2 -25.546 -11.579 12.924 1.00 0.00 C ATOM 42 OG SER A -2 -26.593 -10.791 13.463 1.00 0.00 O ATOM 0 H SER A -2 -23.042 -11.157 10.984 1.00 0.00 H new ATOM 0 HA SER A -2 -24.640 -9.918 11.906 1.00 0.00 H new ATOM 0 HB2 SER A -2 -25.897 -12.093 12.029 1.00 0.00 H new ATOM 0 HB3 SER A -2 -25.259 -12.348 13.641 1.00 0.00 H new ATOM 0 HG SER A -2 -26.267 -10.308 14.251 1.00 0.00 H new ATOM 48 N SER A -1 -22.534 -9.586 13.751 1.00 0.00 N ATOM 49 CA SER A -1 -21.873 -8.962 14.891 1.00 0.00 C ATOM 50 C SER A -1 -22.861 -8.131 15.705 1.00 0.00 C ATOM 51 O SER A -1 -22.898 -8.215 16.931 1.00 0.00 O ATOM 52 CB SER A -1 -20.717 -8.079 14.417 1.00 0.00 C ATOM 53 OG SER A -1 -19.976 -7.575 15.515 1.00 0.00 O ATOM 0 H SER A -1 -21.978 -9.598 12.896 1.00 0.00 H new ATOM 0 HA SER A -1 -21.479 -9.754 15.528 1.00 0.00 H new ATOM 0 HB2 SER A -1 -20.060 -8.654 13.764 1.00 0.00 H new ATOM 0 HB3 SER A -1 -21.107 -7.250 13.826 1.00 0.00 H new ATOM 0 HG SER A -1 -19.242 -7.015 15.185 1.00 0.00 H new ATOM 59 N GLY A 0 -23.662 -7.328 15.010 1.00 0.00 N ATOM 60 CA GLY A 0 -24.639 -6.493 15.683 1.00 0.00 C ATOM 61 C GLY A 0 -24.620 -5.061 15.185 1.00 0.00 C ATOM 62 O GLY A 0 -24.960 -4.794 14.032 1.00 0.00 O ATOM 0 H GLY A 0 -23.651 -7.241 13.994 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -25.634 -6.913 15.535 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -24.444 -6.504 16.755 1.00 0.00 H new ATOM 66 N MET A 1 -24.223 -4.139 16.055 1.00 0.00 N ATOM 67 CA MET A 1 -24.162 -2.726 15.696 1.00 0.00 C ATOM 68 C MET A 1 -23.169 -2.497 14.561 1.00 0.00 C ATOM 69 O MET A 1 -21.965 -2.387 14.789 1.00 0.00 O ATOM 70 CB MET A 1 -23.767 -1.886 16.912 1.00 0.00 C ATOM 71 CG MET A 1 -23.605 -0.407 16.602 1.00 0.00 C ATOM 72 SD MET A 1 -25.174 0.482 16.616 1.00 0.00 S ATOM 73 CE MET A 1 -25.531 0.566 14.863 1.00 0.00 C ATOM 0 H MET A 1 -23.939 -4.344 17.013 1.00 0.00 H new ATOM 0 HA MET A 1 -25.152 -2.419 15.357 1.00 0.00 H new ATOM 0 HB2 MET A 1 -24.524 -2.006 17.687 1.00 0.00 H new ATOM 0 HB3 MET A 1 -22.831 -2.268 17.319 1.00 0.00 H new ATOM 0 HG2 MET A 1 -22.931 0.042 17.332 1.00 0.00 H new ATOM 0 HG3 MET A 1 -23.137 -0.294 15.624 1.00 0.00 H new ATOM 0 HE1 MET A 1 -25.427 1.595 14.519 1.00 0.00 H new ATOM 0 HE2 MET A 1 -24.834 -0.071 14.319 1.00 0.00 H new ATOM 0 HE3 MET A 1 -26.550 0.225 14.683 1.00 0.00 H new ATOM 83 N ALA A 2 -23.683 -2.425 13.337 1.00 0.00 N ATOM 84 CA ALA A 2 -22.842 -2.206 12.167 1.00 0.00 C ATOM 85 C ALA A 2 -23.200 -0.898 11.470 1.00 0.00 C ATOM 86 O ALA A 2 -24.366 -0.641 11.169 1.00 0.00 O ATOM 87 CB ALA A 2 -22.970 -3.374 11.200 1.00 0.00 C ATOM 0 H ALA A 2 -24.678 -2.515 13.130 1.00 0.00 H new ATOM 0 HA ALA A 2 -21.807 -2.137 12.502 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -22.337 -3.198 10.331 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -22.658 -4.293 11.696 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -24.008 -3.469 10.880 1.00 0.00 H new ATOM 93 N THR A 3 -22.189 -0.072 11.217 1.00 0.00 N ATOM 94 CA THR A 3 -22.397 1.211 10.557 1.00 0.00 C ATOM 95 C THR A 3 -21.232 1.551 9.635 1.00 0.00 C ATOM 96 O THR A 3 -20.067 1.395 10.005 1.00 0.00 O ATOM 97 CB THR A 3 -22.575 2.347 11.582 1.00 0.00 C ATOM 98 OG1 THR A 3 -21.461 2.373 12.482 1.00 0.00 O ATOM 99 CG2 THR A 3 -23.865 2.169 12.369 1.00 0.00 C ATOM 0 H THR A 3 -21.218 -0.269 11.459 1.00 0.00 H new ATOM 0 HA THR A 3 -23.308 1.118 9.966 1.00 0.00 H new ATOM 0 HB THR A 3 -22.626 3.291 11.040 1.00 0.00 H new ATOM 0 HG1 THR A 3 -21.580 3.099 13.130 1.00 0.00 H new ATOM 0 HG21 THR A 3 -23.969 2.983 13.086 1.00 0.00 H new ATOM 0 HG22 THR A 3 -24.713 2.178 11.684 1.00 0.00 H new ATOM 0 HG23 THR A 3 -23.838 1.218 12.901 1.00 0.00 H new ATOM 107 N THR A 4 -21.551 2.017 8.432 1.00 0.00 N ATOM 108 CA THR A 4 -20.530 2.379 7.457 1.00 0.00 C ATOM 109 C THR A 4 -19.784 1.147 6.959 1.00 0.00 C ATOM 110 O THR A 4 -18.553 1.114 6.950 1.00 0.00 O ATOM 111 CB THR A 4 -19.515 3.375 8.049 1.00 0.00 C ATOM 112 OG1 THR A 4 -20.203 4.419 8.747 1.00 0.00 O ATOM 113 CG2 THR A 4 -18.645 3.976 6.956 1.00 0.00 C ATOM 0 H THR A 4 -22.509 2.153 8.109 1.00 0.00 H new ATOM 0 HA THR A 4 -21.046 2.851 6.621 1.00 0.00 H new ATOM 0 HB THR A 4 -18.873 2.835 8.745 1.00 0.00 H new ATOM 0 HG1 THR A 4 -19.551 5.047 9.122 1.00 0.00 H new ATOM 0 HG21 THR A 4 -17.936 4.676 7.399 1.00 0.00 H new ATOM 0 HG22 THR A 4 -18.100 3.181 6.447 1.00 0.00 H new ATOM 0 HG23 THR A 4 -19.274 4.502 6.238 1.00 0.00 H new ATOM 121 N LYS A 5 -20.536 0.133 6.544 1.00 0.00 N ATOM 122 CA LYS A 5 -19.947 -1.102 6.041 1.00 0.00 C ATOM 123 C LYS A 5 -19.572 -0.967 4.569 1.00 0.00 C ATOM 124 O LYS A 5 -19.940 -1.804 3.745 1.00 0.00 O ATOM 125 CB LYS A 5 -20.921 -2.268 6.225 1.00 0.00 C ATOM 126 CG LYS A 5 -20.893 -2.871 7.619 1.00 0.00 C ATOM 127 CD LYS A 5 -19.869 -3.988 7.723 1.00 0.00 C ATOM 128 CE LYS A 5 -20.205 -4.949 8.853 1.00 0.00 C ATOM 129 NZ LYS A 5 -21.111 -6.041 8.401 1.00 0.00 N ATOM 0 H LYS A 5 -21.556 0.143 6.546 1.00 0.00 H new ATOM 0 HA LYS A 5 -19.040 -1.300 6.612 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -21.932 -1.923 6.008 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -20.686 -3.045 5.498 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -20.661 -2.094 8.348 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -21.881 -3.258 7.869 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -19.827 -4.534 6.780 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -18.880 -3.562 7.889 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -19.285 -5.380 9.248 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -20.676 -4.400 9.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -21.316 -6.675 9.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -21.999 -5.631 8.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -20.651 -6.581 7.640 1.00 0.00 H new ATOM 143 N ARG A 6 -18.836 0.091 4.246 1.00 0.00 N ATOM 144 CA ARG A 6 -18.411 0.336 2.873 1.00 0.00 C ATOM 145 C ARG A 6 -16.899 0.533 2.799 1.00 0.00 C ATOM 146 O ARG A 6 -16.223 -0.077 1.970 1.00 0.00 O ATOM 147 CB ARG A 6 -19.125 1.564 2.306 1.00 0.00 C ATOM 148 CG ARG A 6 -20.605 1.341 2.042 1.00 0.00 C ATOM 149 CD ARG A 6 -21.316 2.645 1.717 1.00 0.00 C ATOM 150 NE ARG A 6 -22.751 2.565 1.974 1.00 0.00 N ATOM 151 CZ ARG A 6 -23.549 3.625 2.029 1.00 0.00 C ATOM 152 NH1 ARG A 6 -23.053 4.842 1.845 1.00 0.00 N ATOM 153 NH2 ARG A 6 -24.845 3.471 2.267 1.00 0.00 N ATOM 0 H ARG A 6 -18.521 0.792 4.916 1.00 0.00 H new ATOM 0 HA ARG A 6 -18.676 -0.537 2.276 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -19.010 2.394 3.003 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -18.639 1.859 1.376 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -20.727 0.643 1.214 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -21.066 0.882 2.916 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -20.886 3.451 2.312 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -21.149 2.898 0.670 1.00 0.00 H new ATOM 0 HE ARG A 6 -23.164 1.644 2.119 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -22.057 4.964 1.661 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -23.668 5.655 1.888 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -25.230 2.537 2.408 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -25.456 4.286 2.309 1.00 0.00 H new ATOM 167 N VAL A 7 -16.376 1.389 3.670 1.00 0.00 N ATOM 168 CA VAL A 7 -14.945 1.667 3.704 1.00 0.00 C ATOM 169 C VAL A 7 -14.200 0.612 4.514 1.00 0.00 C ATOM 170 O VAL A 7 -14.215 0.634 5.746 1.00 0.00 O ATOM 171 CB VAL A 7 -14.657 3.056 4.303 1.00 0.00 C ATOM 172 CG1 VAL A 7 -13.159 3.308 4.372 1.00 0.00 C ATOM 173 CG2 VAL A 7 -15.351 4.140 3.491 1.00 0.00 C ATOM 0 H VAL A 7 -16.922 1.902 4.362 1.00 0.00 H new ATOM 0 HA VAL A 7 -14.593 1.645 2.672 1.00 0.00 H new ATOM 0 HB VAL A 7 -15.053 3.084 5.318 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -12.975 4.294 4.798 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -12.691 2.549 4.999 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.736 3.261 3.369 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -15.137 5.115 3.928 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -14.987 4.115 2.464 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -16.427 3.967 3.498 1.00 0.00 H new ATOM 183 N LEU A 8 -13.548 -0.311 3.816 1.00 0.00 N ATOM 184 CA LEU A 8 -12.795 -1.375 4.470 1.00 0.00 C ATOM 185 C LEU A 8 -11.359 -0.938 4.742 1.00 0.00 C ATOM 186 O LEU A 8 -10.745 -0.245 3.930 1.00 0.00 O ATOM 187 CB LEU A 8 -12.801 -2.637 3.605 1.00 0.00 C ATOM 188 CG LEU A 8 -14.139 -3.003 2.962 1.00 0.00 C ATOM 189 CD1 LEU A 8 -13.999 -4.261 2.119 1.00 0.00 C ATOM 190 CD2 LEU A 8 -15.209 -3.189 4.027 1.00 0.00 C ATOM 0 H LEU A 8 -13.526 -0.344 2.797 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.276 -1.593 5.424 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -12.062 -2.514 2.813 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.474 -3.476 4.219 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.443 -2.185 2.309 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.961 -4.506 1.669 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.263 -4.092 1.333 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -13.672 -5.087 2.750 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -16.155 -3.449 3.551 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -14.912 -3.989 4.705 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.328 -2.263 4.589 1.00 0.00 H new ATOM 202 N TYR A 9 -10.828 -1.349 5.888 1.00 0.00 N ATOM 203 CA TYR A 9 -9.465 -1.000 6.268 1.00 0.00 C ATOM 204 C TYR A 9 -8.539 -2.207 6.144 1.00 0.00 C ATOM 205 O TYR A 9 -8.861 -3.302 6.606 1.00 0.00 O ATOM 206 CB TYR A 9 -9.433 -0.464 7.700 1.00 0.00 C ATOM 207 CG TYR A 9 -8.094 -0.636 8.382 1.00 0.00 C ATOM 208 CD1 TYR A 9 -7.669 -1.886 8.816 1.00 0.00 C ATOM 209 CD2 TYR A 9 -7.254 0.451 8.591 1.00 0.00 C ATOM 210 CE1 TYR A 9 -6.447 -2.047 9.440 1.00 0.00 C ATOM 211 CE2 TYR A 9 -6.030 0.298 9.213 1.00 0.00 C ATOM 212 CZ TYR A 9 -5.631 -0.953 9.636 1.00 0.00 C ATOM 213 OH TYR A 9 -4.413 -1.110 10.255 1.00 0.00 O ATOM 0 H TYR A 9 -11.321 -1.925 6.570 1.00 0.00 H new ATOM 0 HA TYR A 9 -9.113 -0.223 5.589 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -9.692 0.595 7.688 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -10.198 -0.973 8.287 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -8.305 -2.746 8.663 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -7.563 1.432 8.262 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -6.132 -3.025 9.773 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -5.389 1.153 9.367 1.00 0.00 H new ATOM 0 HH TYR A 9 -3.962 -0.242 10.314 1.00 0.00 H new ATOM 223 N VAL A 10 -7.386 -1.998 5.517 1.00 0.00 N ATOM 224 CA VAL A 10 -6.411 -3.066 5.333 1.00 0.00 C ATOM 225 C VAL A 10 -5.117 -2.765 6.081 1.00 0.00 C ATOM 226 O VAL A 10 -4.662 -1.623 6.120 1.00 0.00 O ATOM 227 CB VAL A 10 -6.090 -3.283 3.842 1.00 0.00 C ATOM 228 CG1 VAL A 10 -5.267 -4.548 3.651 1.00 0.00 C ATOM 229 CG2 VAL A 10 -7.372 -3.342 3.025 1.00 0.00 C ATOM 0 H VAL A 10 -7.104 -1.098 5.128 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.858 -3.974 5.737 1.00 0.00 H new ATOM 0 HB VAL A 10 -5.499 -2.438 3.488 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -5.050 -4.684 2.592 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.332 -4.461 4.204 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.828 -5.406 4.020 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.127 -3.496 1.974 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.991 -4.167 3.378 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -7.918 -2.405 3.137 1.00 0.00 H new ATOM 239 N GLY A 11 -4.528 -3.799 6.675 1.00 0.00 N ATOM 240 CA GLY A 11 -3.292 -3.624 7.414 1.00 0.00 C ATOM 241 C GLY A 11 -2.270 -4.697 7.096 1.00 0.00 C ATOM 242 O GLY A 11 -2.562 -5.648 6.372 1.00 0.00 O ATOM 0 H GLY A 11 -4.885 -4.754 6.657 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -2.870 -2.645 7.184 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -3.506 -3.636 8.483 1.00 0.00 H new ATOM 246 N GLY A 12 -1.065 -4.545 7.637 1.00 0.00 N ATOM 247 CA GLY A 12 -0.014 -5.515 7.394 1.00 0.00 C ATOM 248 C GLY A 12 0.401 -5.568 5.937 1.00 0.00 C ATOM 249 O GLY A 12 1.048 -6.521 5.502 1.00 0.00 O ATOM 0 H GLY A 12 -0.798 -3.767 8.240 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.853 -5.268 8.007 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.355 -6.502 7.708 1.00 0.00 H new ATOM 253 N LEU A 13 0.026 -4.543 5.179 1.00 0.00 N ATOM 254 CA LEU A 13 0.361 -4.476 3.761 1.00 0.00 C ATOM 255 C LEU A 13 1.866 -4.603 3.551 1.00 0.00 C ATOM 256 O LEU A 13 2.624 -4.771 4.506 1.00 0.00 O ATOM 257 CB LEU A 13 -0.140 -3.162 3.159 1.00 0.00 C ATOM 258 CG LEU A 13 -1.657 -3.020 3.026 1.00 0.00 C ATOM 259 CD1 LEU A 13 -2.022 -1.628 2.535 1.00 0.00 C ATOM 260 CD2 LEU A 13 -2.211 -4.082 2.087 1.00 0.00 C ATOM 0 H LEU A 13 -0.510 -3.747 5.523 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.130 -5.309 3.258 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.229 -2.340 3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.304 -3.046 2.170 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.104 -3.164 4.010 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.105 -1.546 2.446 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.658 -0.885 3.245 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.564 -1.454 1.561 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.292 -3.966 2.004 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.757 -3.970 1.102 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.981 -5.072 2.481 1.00 0.00 H new ATOM 272 N ALA A 14 2.292 -4.520 2.295 1.00 0.00 N ATOM 273 CA ALA A 14 3.707 -4.622 1.960 1.00 0.00 C ATOM 274 C ALA A 14 4.300 -3.249 1.659 1.00 0.00 C ATOM 275 O ALA A 14 3.581 -2.252 1.603 1.00 0.00 O ATOM 276 CB ALA A 14 3.903 -5.555 0.774 1.00 0.00 C ATOM 0 H ALA A 14 1.677 -4.382 1.493 1.00 0.00 H new ATOM 0 HA ALA A 14 4.230 -5.034 2.823 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.964 -5.622 0.535 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.525 -6.546 1.024 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.361 -5.167 -0.088 1.00 0.00 H new ATOM 282 N GLU A 15 5.615 -3.207 1.466 1.00 0.00 N ATOM 283 CA GLU A 15 6.303 -1.955 1.172 1.00 0.00 C ATOM 284 C GLU A 15 6.121 -1.565 -0.292 1.00 0.00 C ATOM 285 O GLU A 15 6.355 -0.419 -0.673 1.00 0.00 O ATOM 286 CB GLU A 15 7.793 -2.078 1.497 1.00 0.00 C ATOM 287 CG GLU A 15 8.564 -2.930 0.503 1.00 0.00 C ATOM 288 CD GLU A 15 10.062 -2.712 0.587 1.00 0.00 C ATOM 289 OE1 GLU A 15 10.672 -3.162 1.580 1.00 0.00 O ATOM 290 OE2 GLU A 15 10.625 -2.092 -0.339 1.00 0.00 O ATOM 0 H GLU A 15 6.224 -4.024 1.508 1.00 0.00 H new ATOM 0 HA GLU A 15 5.866 -1.175 1.795 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.233 -1.081 1.527 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.905 -2.506 2.493 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.343 -3.982 0.684 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.223 -2.701 -0.507 1.00 0.00 H new ATOM 297 N GLU A 16 5.701 -2.528 -1.107 1.00 0.00 N ATOM 298 CA GLU A 16 5.489 -2.285 -2.530 1.00 0.00 C ATOM 299 C GLU A 16 4.003 -2.325 -2.873 1.00 0.00 C ATOM 300 O GLU A 16 3.627 -2.477 -4.035 1.00 0.00 O ATOM 301 CB GLU A 16 6.245 -3.321 -3.365 1.00 0.00 C ATOM 302 CG GLU A 16 6.440 -2.909 -4.814 1.00 0.00 C ATOM 303 CD GLU A 16 7.527 -1.866 -4.983 1.00 0.00 C ATOM 304 OE1 GLU A 16 8.649 -2.093 -4.486 1.00 0.00 O ATOM 305 OE2 GLU A 16 7.255 -0.822 -5.612 1.00 0.00 O ATOM 0 H GLU A 16 5.501 -3.482 -0.807 1.00 0.00 H new ATOM 0 HA GLU A 16 5.871 -1.291 -2.764 1.00 0.00 H new ATOM 0 HB2 GLU A 16 7.220 -3.499 -2.912 1.00 0.00 H new ATOM 0 HB3 GLU A 16 5.703 -4.266 -3.334 1.00 0.00 H new ATOM 0 HG2 GLU A 16 6.690 -3.788 -5.407 1.00 0.00 H new ATOM 0 HG3 GLU A 16 5.501 -2.517 -5.206 1.00 0.00 H new ATOM 312 N VAL A 17 3.162 -2.189 -1.852 1.00 0.00 N ATOM 313 CA VAL A 17 1.717 -2.209 -2.044 1.00 0.00 C ATOM 314 C VAL A 17 1.127 -0.809 -1.920 1.00 0.00 C ATOM 315 O VAL A 17 1.492 -0.048 -1.024 1.00 0.00 O ATOM 316 CB VAL A 17 1.028 -3.137 -1.026 1.00 0.00 C ATOM 317 CG1 VAL A 17 -0.484 -3.058 -1.169 1.00 0.00 C ATOM 318 CG2 VAL A 17 1.514 -4.569 -1.198 1.00 0.00 C ATOM 0 H VAL A 17 3.457 -2.064 -0.884 1.00 0.00 H new ATOM 0 HA VAL A 17 1.537 -2.588 -3.050 1.00 0.00 H new ATOM 0 HB VAL A 17 1.291 -2.806 -0.022 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.953 -3.720 -0.442 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -0.813 -2.034 -0.993 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.771 -3.363 -2.175 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.017 -5.212 -0.471 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.281 -4.914 -2.206 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.592 -4.609 -1.041 1.00 0.00 H new ATOM 328 N ASP A 18 0.212 -0.477 -2.824 1.00 0.00 N ATOM 329 CA ASP A 18 -0.432 0.832 -2.815 1.00 0.00 C ATOM 330 C ASP A 18 -1.857 0.741 -3.351 1.00 0.00 C ATOM 331 O ASP A 18 -2.302 -0.323 -3.782 1.00 0.00 O ATOM 332 CB ASP A 18 0.377 1.827 -3.648 1.00 0.00 C ATOM 333 CG ASP A 18 1.872 1.670 -3.448 1.00 0.00 C ATOM 334 OD1 ASP A 18 2.457 0.750 -4.056 1.00 0.00 O ATOM 335 OD2 ASP A 18 2.456 2.465 -2.683 1.00 0.00 O ATOM 0 H ASP A 18 -0.101 -1.096 -3.572 1.00 0.00 H new ATOM 0 HA ASP A 18 -0.473 1.182 -1.784 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.138 1.692 -4.703 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.083 2.842 -3.382 1.00 0.00 H new ATOM 340 N ASP A 19 -2.568 1.862 -3.320 1.00 0.00 N ATOM 341 CA ASP A 19 -3.943 1.909 -3.803 1.00 0.00 C ATOM 342 C ASP A 19 -4.085 1.145 -5.116 1.00 0.00 C ATOM 343 O ASP A 19 -5.107 0.507 -5.369 1.00 0.00 O ATOM 344 CB ASP A 19 -4.391 3.359 -3.992 1.00 0.00 C ATOM 345 CG ASP A 19 -3.670 4.043 -5.138 1.00 0.00 C ATOM 346 OD1 ASP A 19 -2.429 3.926 -5.213 1.00 0.00 O ATOM 347 OD2 ASP A 19 -4.348 4.694 -5.960 1.00 0.00 O ATOM 0 H ASP A 19 -2.215 2.751 -2.965 1.00 0.00 H new ATOM 0 HA ASP A 19 -4.580 1.434 -3.056 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -5.465 3.383 -4.176 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -4.213 3.914 -3.071 1.00 0.00 H new ATOM 352 N LYS A 20 -3.052 1.214 -5.949 1.00 0.00 N ATOM 353 CA LYS A 20 -3.059 0.529 -7.236 1.00 0.00 C ATOM 354 C LYS A 20 -3.058 -0.984 -7.047 1.00 0.00 C ATOM 355 O LYS A 20 -3.933 -1.685 -7.556 1.00 0.00 O ATOM 356 CB LYS A 20 -1.846 0.951 -8.068 1.00 0.00 C ATOM 357 CG LYS A 20 -1.930 2.376 -8.588 1.00 0.00 C ATOM 358 CD LYS A 20 -0.550 2.975 -8.799 1.00 0.00 C ATOM 359 CE LYS A 20 -0.608 4.208 -9.688 1.00 0.00 C ATOM 360 NZ LYS A 20 -0.699 3.848 -11.130 1.00 0.00 N ATOM 0 H LYS A 20 -2.199 1.738 -5.755 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.970 0.811 -7.764 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -0.946 0.847 -7.462 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.741 0.271 -8.913 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.481 2.389 -9.528 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.490 2.989 -7.882 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.116 3.240 -7.835 1.00 0.00 H new ATOM 0 HD3 LYS A 20 0.106 2.230 -9.250 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -1.469 4.816 -9.410 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.280 4.818 -9.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -0.736 4.715 -11.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 0.135 3.289 -11.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.559 3.287 -11.294 1.00 0.00 H new ATOM 374 N VAL A 21 -2.070 -1.483 -6.311 1.00 0.00 N ATOM 375 CA VAL A 21 -1.957 -2.914 -6.052 1.00 0.00 C ATOM 376 C VAL A 21 -3.241 -3.466 -5.444 1.00 0.00 C ATOM 377 O VAL A 21 -3.767 -4.485 -5.894 1.00 0.00 O ATOM 378 CB VAL A 21 -0.780 -3.222 -5.107 1.00 0.00 C ATOM 379 CG1 VAL A 21 -0.743 -4.704 -4.765 1.00 0.00 C ATOM 380 CG2 VAL A 21 0.534 -2.778 -5.731 1.00 0.00 C ATOM 0 H VAL A 21 -1.336 -0.918 -5.884 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.778 -3.396 -7.013 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.924 -2.664 -4.182 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.095 -4.902 -4.097 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.674 -4.987 -4.274 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.624 -5.285 -5.679 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.355 -3.003 -5.050 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.687 -3.307 -6.671 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.503 -1.705 -5.920 1.00 0.00 H new ATOM 390 N LEU A 22 -3.742 -2.787 -4.417 1.00 0.00 N ATOM 391 CA LEU A 22 -4.967 -3.209 -3.746 1.00 0.00 C ATOM 392 C LEU A 22 -6.176 -3.037 -4.660 1.00 0.00 C ATOM 393 O LEU A 22 -7.070 -3.884 -4.690 1.00 0.00 O ATOM 394 CB LEU A 22 -5.168 -2.407 -2.459 1.00 0.00 C ATOM 395 CG LEU A 22 -4.333 -2.848 -1.256 1.00 0.00 C ATOM 396 CD1 LEU A 22 -4.397 -1.805 -0.151 1.00 0.00 C ATOM 397 CD2 LEU A 22 -4.807 -4.200 -0.744 1.00 0.00 C ATOM 0 H LEU A 22 -3.319 -1.943 -4.031 1.00 0.00 H new ATOM 0 HA LEU A 22 -4.871 -4.266 -3.498 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.944 -1.361 -2.668 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.221 -2.458 -2.183 1.00 0.00 H new ATOM 0 HG LEU A 22 -3.295 -2.947 -1.575 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.797 -2.136 0.697 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -4.008 -0.857 -0.523 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.432 -1.674 0.166 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -4.201 -4.498 0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.852 -4.129 -0.442 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -4.708 -4.944 -1.535 1.00 0.00 H new ATOM 409 N HIS A 23 -6.196 -1.937 -5.406 1.00 0.00 N ATOM 410 CA HIS A 23 -7.294 -1.656 -6.324 1.00 0.00 C ATOM 411 C HIS A 23 -7.535 -2.836 -7.260 1.00 0.00 C ATOM 412 O HIS A 23 -8.678 -3.221 -7.506 1.00 0.00 O ATOM 413 CB HIS A 23 -6.996 -0.396 -7.138 1.00 0.00 C ATOM 414 CG HIS A 23 -7.809 -0.287 -8.391 1.00 0.00 C ATOM 415 ND1 HIS A 23 -7.767 -1.226 -9.400 1.00 0.00 N ATOM 416 CD2 HIS A 23 -8.691 0.658 -8.794 1.00 0.00 C ATOM 417 CE1 HIS A 23 -8.586 -0.863 -10.371 1.00 0.00 C ATOM 418 NE2 HIS A 23 -9.159 0.277 -10.028 1.00 0.00 N ATOM 0 H HIS A 23 -5.465 -1.226 -5.393 1.00 0.00 H new ATOM 0 HA HIS A 23 -8.196 -1.493 -5.734 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -7.181 0.480 -6.517 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.938 -0.384 -7.399 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -8.974 1.546 -8.247 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -8.758 -1.406 -11.289 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -9.839 0.791 -10.589 1.00 0.00 H new ATOM 426 N ALA A 24 -6.452 -3.405 -7.779 1.00 0.00 N ATOM 427 CA ALA A 24 -6.547 -4.541 -8.687 1.00 0.00 C ATOM 428 C ALA A 24 -6.770 -5.840 -7.919 1.00 0.00 C ATOM 429 O ALA A 24 -7.332 -6.797 -8.451 1.00 0.00 O ATOM 430 CB ALA A 24 -5.292 -4.640 -9.542 1.00 0.00 C ATOM 0 H ALA A 24 -5.499 -3.098 -7.586 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.406 -4.383 -9.339 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.377 -5.493 -10.215 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.177 -3.727 -10.126 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.422 -4.771 -8.898 1.00 0.00 H new ATOM 436 N ALA A 25 -6.327 -5.865 -6.667 1.00 0.00 N ATOM 437 CA ALA A 25 -6.479 -7.046 -5.826 1.00 0.00 C ATOM 438 C ALA A 25 -7.867 -7.094 -5.195 1.00 0.00 C ATOM 439 O ALA A 25 -8.288 -8.129 -4.677 1.00 0.00 O ATOM 440 CB ALA A 25 -5.406 -7.069 -4.748 1.00 0.00 C ATOM 0 H ALA A 25 -5.860 -5.081 -6.212 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.363 -7.928 -6.456 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.532 -7.956 -4.128 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -4.421 -7.090 -5.215 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.494 -6.177 -4.128 1.00 0.00 H new ATOM 446 N PHE A 26 -8.572 -5.969 -5.241 1.00 0.00 N ATOM 447 CA PHE A 26 -9.912 -5.883 -4.672 1.00 0.00 C ATOM 448 C PHE A 26 -10.941 -5.552 -5.749 1.00 0.00 C ATOM 449 O PHE A 26 -12.133 -5.431 -5.468 1.00 0.00 O ATOM 450 CB PHE A 26 -9.954 -4.824 -3.568 1.00 0.00 C ATOM 451 CG PHE A 26 -9.260 -5.247 -2.305 1.00 0.00 C ATOM 452 CD1 PHE A 26 -7.959 -5.723 -2.340 1.00 0.00 C ATOM 453 CD2 PHE A 26 -9.908 -5.170 -1.083 1.00 0.00 C ATOM 454 CE1 PHE A 26 -7.317 -6.113 -1.179 1.00 0.00 C ATOM 455 CE2 PHE A 26 -9.271 -5.557 0.081 1.00 0.00 C ATOM 456 CZ PHE A 26 -7.974 -6.031 0.032 1.00 0.00 C ATOM 0 H PHE A 26 -8.238 -5.104 -5.666 1.00 0.00 H new ATOM 0 HA PHE A 26 -10.160 -6.854 -4.244 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.493 -3.908 -3.937 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -10.994 -4.589 -3.341 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.440 -5.790 -3.285 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -10.923 -4.803 -1.039 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.303 -6.481 -1.220 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -9.786 -5.489 1.028 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.475 -6.337 0.940 1.00 0.00 H new ATOM 466 N ILE A 27 -10.470 -5.406 -6.983 1.00 0.00 N ATOM 467 CA ILE A 27 -11.347 -5.089 -8.103 1.00 0.00 C ATOM 468 C ILE A 27 -12.411 -6.166 -8.290 1.00 0.00 C ATOM 469 O ILE A 27 -13.534 -5.897 -8.715 1.00 0.00 O ATOM 470 CB ILE A 27 -10.554 -4.933 -9.414 1.00 0.00 C ATOM 471 CG1 ILE A 27 -11.365 -4.133 -10.434 1.00 0.00 C ATOM 472 CG2 ILE A 27 -10.186 -6.299 -9.975 1.00 0.00 C ATOM 473 CD1 ILE A 27 -11.615 -2.700 -10.017 1.00 0.00 C ATOM 0 H ILE A 27 -9.486 -5.502 -7.232 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.830 -4.141 -7.866 1.00 0.00 H new ATOM 0 HB ILE A 27 -9.634 -4.388 -9.203 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -10.839 -4.139 -11.389 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.322 -4.629 -10.594 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -9.626 -6.173 -10.902 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -9.574 -6.837 -9.251 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.095 -6.867 -10.175 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -12.196 -2.193 -10.788 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.168 -2.686 -9.078 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.662 -2.188 -9.885 1.00 0.00 H new ATOM 485 N PRO A 28 -12.050 -7.416 -7.963 1.00 0.00 N ATOM 486 CA PRO A 28 -12.960 -8.559 -8.084 1.00 0.00 C ATOM 487 C PRO A 28 -14.213 -8.396 -7.230 1.00 0.00 C ATOM 488 O PRO A 28 -15.329 -8.356 -7.749 1.00 0.00 O ATOM 489 CB PRO A 28 -12.120 -9.736 -7.581 1.00 0.00 C ATOM 490 CG PRO A 28 -10.708 -9.286 -7.734 1.00 0.00 C ATOM 491 CD PRO A 28 -10.728 -7.809 -7.449 1.00 0.00 C ATOM 0 HA PRO A 28 -13.325 -8.683 -9.104 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -12.350 -9.971 -6.542 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.313 -10.638 -8.162 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -10.051 -9.811 -7.041 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.338 -9.487 -8.739 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.625 -7.597 -6.385 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -9.920 -7.284 -7.958 1.00 0.00 H new ATOM 499 N PHE A 29 -14.022 -8.301 -5.919 1.00 0.00 N ATOM 500 CA PHE A 29 -15.137 -8.142 -4.993 1.00 0.00 C ATOM 501 C PHE A 29 -16.236 -7.281 -5.608 1.00 0.00 C ATOM 502 O PHE A 29 -17.320 -7.770 -5.925 1.00 0.00 O ATOM 503 CB PHE A 29 -14.655 -7.515 -3.683 1.00 0.00 C ATOM 504 CG PHE A 29 -13.746 -8.409 -2.890 1.00 0.00 C ATOM 505 CD1 PHE A 29 -14.150 -9.683 -2.524 1.00 0.00 C ATOM 506 CD2 PHE A 29 -12.486 -7.975 -2.509 1.00 0.00 C ATOM 507 CE1 PHE A 29 -13.315 -10.508 -1.795 1.00 0.00 C ATOM 508 CE2 PHE A 29 -11.647 -8.796 -1.780 1.00 0.00 C ATOM 509 CZ PHE A 29 -12.062 -10.064 -1.421 1.00 0.00 C ATOM 0 H PHE A 29 -13.105 -8.331 -5.473 1.00 0.00 H new ATOM 0 HA PHE A 29 -15.547 -9.130 -4.785 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -14.133 -6.584 -3.905 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -15.521 -7.257 -3.073 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.129 -10.035 -2.812 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -12.156 -6.984 -2.785 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -13.642 -11.499 -1.518 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -10.667 -8.447 -1.491 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.408 -10.706 -0.849 1.00 0.00 H new ATOM 519 N GLY A 30 -15.948 -5.993 -5.773 1.00 0.00 N ATOM 520 CA GLY A 30 -16.921 -5.083 -6.349 1.00 0.00 C ATOM 521 C GLY A 30 -16.279 -4.021 -7.219 1.00 0.00 C ATOM 522 O GLY A 30 -15.261 -4.271 -7.865 1.00 0.00 O ATOM 0 H GLY A 30 -15.058 -5.564 -5.518 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -17.637 -5.651 -6.943 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -17.482 -4.602 -5.548 1.00 0.00 H new ATOM 526 N ASP A 31 -16.874 -2.834 -7.237 1.00 0.00 N ATOM 527 CA ASP A 31 -16.353 -1.730 -8.035 1.00 0.00 C ATOM 528 C ASP A 31 -15.837 -0.608 -7.139 1.00 0.00 C ATOM 529 O ASP A 31 -16.548 0.361 -6.869 1.00 0.00 O ATOM 530 CB ASP A 31 -17.437 -1.194 -8.971 1.00 0.00 C ATOM 531 CG ASP A 31 -17.978 -2.261 -9.902 1.00 0.00 C ATOM 532 OD1 ASP A 31 -18.731 -3.136 -9.427 1.00 0.00 O ATOM 533 OD2 ASP A 31 -17.647 -2.223 -11.106 1.00 0.00 O ATOM 0 H ASP A 31 -17.717 -2.611 -6.708 1.00 0.00 H new ATOM 0 HA ASP A 31 -15.522 -2.106 -8.632 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -18.255 -0.785 -8.378 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -17.030 -0.373 -9.562 1.00 0.00 H new ATOM 538 N ILE A 32 -14.598 -0.746 -6.681 1.00 0.00 N ATOM 539 CA ILE A 32 -13.988 0.256 -5.816 1.00 0.00 C ATOM 540 C ILE A 32 -14.358 1.666 -6.262 1.00 0.00 C ATOM 541 O ILE A 32 -14.072 2.068 -7.390 1.00 0.00 O ATOM 542 CB ILE A 32 -12.453 0.122 -5.794 1.00 0.00 C ATOM 543 CG1 ILE A 32 -12.047 -1.261 -5.281 1.00 0.00 C ATOM 544 CG2 ILE A 32 -11.838 1.215 -4.933 1.00 0.00 C ATOM 545 CD1 ILE A 32 -10.605 -1.613 -5.568 1.00 0.00 C ATOM 0 H ILE A 32 -13.997 -1.542 -6.894 1.00 0.00 H new ATOM 0 HA ILE A 32 -14.374 0.083 -4.811 1.00 0.00 H new ATOM 0 HB ILE A 32 -12.079 0.235 -6.811 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -12.216 -1.304 -4.205 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -12.693 -2.012 -5.735 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -10.753 1.107 -4.927 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -12.103 2.191 -5.340 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -12.216 1.132 -3.914 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.388 -2.607 -5.176 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.435 -1.603 -6.645 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -9.950 -0.884 -5.090 1.00 0.00 H new ATOM 557 N THR A 33 -14.994 2.416 -5.367 1.00 0.00 N ATOM 558 CA THR A 33 -15.403 3.782 -5.668 1.00 0.00 C ATOM 559 C THR A 33 -14.254 4.760 -5.451 1.00 0.00 C ATOM 560 O THR A 33 -14.112 5.739 -6.185 1.00 0.00 O ATOM 561 CB THR A 33 -16.600 4.214 -4.800 1.00 0.00 C ATOM 562 OG1 THR A 33 -16.256 4.130 -3.413 1.00 0.00 O ATOM 563 CG2 THR A 33 -17.814 3.342 -5.080 1.00 0.00 C ATOM 0 H THR A 33 -15.237 2.100 -4.428 1.00 0.00 H new ATOM 0 HA THR A 33 -15.699 3.800 -6.717 1.00 0.00 H new ATOM 0 HB THR A 33 -16.848 5.246 -5.050 1.00 0.00 H new ATOM 0 HG1 THR A 33 -15.870 4.982 -3.119 1.00 0.00 H new ATOM 0 HG21 THR A 33 -18.647 3.666 -4.455 1.00 0.00 H new ATOM 0 HG22 THR A 33 -18.092 3.432 -6.130 1.00 0.00 H new ATOM 0 HG23 THR A 33 -17.575 2.303 -4.855 1.00 0.00 H new ATOM 571 N ASP A 34 -13.436 4.490 -4.440 1.00 0.00 N ATOM 572 CA ASP A 34 -12.297 5.346 -4.128 1.00 0.00 C ATOM 573 C ASP A 34 -11.403 4.698 -3.075 1.00 0.00 C ATOM 574 O ASP A 34 -11.860 3.877 -2.279 1.00 0.00 O ATOM 575 CB ASP A 34 -12.778 6.711 -3.636 1.00 0.00 C ATOM 576 CG ASP A 34 -13.852 6.598 -2.572 1.00 0.00 C ATOM 577 OD1 ASP A 34 -13.497 6.416 -1.388 1.00 0.00 O ATOM 578 OD2 ASP A 34 -15.046 6.693 -2.922 1.00 0.00 O ATOM 0 H ASP A 34 -13.540 3.685 -3.822 1.00 0.00 H new ATOM 0 HA ASP A 34 -11.715 5.481 -5.040 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -11.931 7.268 -3.236 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -13.165 7.282 -4.480 1.00 0.00 H new ATOM 583 N ILE A 35 -10.128 5.071 -3.079 1.00 0.00 N ATOM 584 CA ILE A 35 -9.170 4.527 -2.124 1.00 0.00 C ATOM 585 C ILE A 35 -8.395 5.640 -1.427 1.00 0.00 C ATOM 586 O ILE A 35 -8.043 6.644 -2.045 1.00 0.00 O ATOM 587 CB ILE A 35 -8.173 3.573 -2.808 1.00 0.00 C ATOM 588 CG1 ILE A 35 -8.917 2.409 -3.466 1.00 0.00 C ATOM 589 CG2 ILE A 35 -7.156 3.058 -1.801 1.00 0.00 C ATOM 590 CD1 ILE A 35 -8.033 1.540 -4.333 1.00 0.00 C ATOM 0 H ILE A 35 -9.734 5.748 -3.733 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.745 3.970 -1.384 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.640 4.123 -3.583 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.370 1.792 -2.690 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -9.731 2.805 -4.073 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.459 2.385 -2.300 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -6.608 3.898 -1.375 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -7.672 2.521 -1.005 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.627 0.736 -4.767 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.601 2.143 -5.131 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -7.234 1.114 -3.726 1.00 0.00 H new ATOM 602 N GLN A 36 -8.132 5.453 -0.138 1.00 0.00 N ATOM 603 CA GLN A 36 -7.397 6.441 0.643 1.00 0.00 C ATOM 604 C GLN A 36 -6.060 5.879 1.112 1.00 0.00 C ATOM 605 O GLN A 36 -5.985 4.748 1.595 1.00 0.00 O ATOM 606 CB GLN A 36 -8.226 6.889 1.848 1.00 0.00 C ATOM 607 CG GLN A 36 -9.366 7.828 1.487 1.00 0.00 C ATOM 608 CD GLN A 36 -10.536 7.108 0.848 1.00 0.00 C ATOM 609 OE1 GLN A 36 -11.270 6.377 1.516 1.00 0.00 O ATOM 610 NE2 GLN A 36 -10.719 7.309 -0.451 1.00 0.00 N ATOM 0 H GLN A 36 -8.417 4.627 0.388 1.00 0.00 H new ATOM 0 HA GLN A 36 -7.204 7.302 0.003 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -8.635 6.009 2.345 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.571 7.385 2.565 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -9.707 8.341 2.386 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -8.998 8.593 0.804 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -10.087 7.922 -0.966 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -11.491 6.850 -0.934 1.00 0.00 H new ATOM 619 N ILE A 37 -5.005 6.674 0.967 1.00 0.00 N ATOM 620 CA ILE A 37 -3.671 6.256 1.376 1.00 0.00 C ATOM 621 C ILE A 37 -2.965 7.358 2.158 1.00 0.00 C ATOM 622 O ILE A 37 -2.417 8.303 1.590 1.00 0.00 O ATOM 623 CB ILE A 37 -2.805 5.868 0.163 1.00 0.00 C ATOM 624 CG1 ILE A 37 -3.537 4.844 -0.707 1.00 0.00 C ATOM 625 CG2 ILE A 37 -1.464 5.317 0.623 1.00 0.00 C ATOM 626 CD1 ILE A 37 -3.540 3.448 -0.123 1.00 0.00 C ATOM 0 H ILE A 37 -5.049 7.612 0.569 1.00 0.00 H new ATOM 0 HA ILE A 37 -3.797 5.383 2.016 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.623 6.761 -0.435 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -4.567 5.171 -0.851 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.071 4.816 -1.692 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.864 5.048 -0.246 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.940 6.075 1.205 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.626 4.433 1.240 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -4.076 2.775 -0.792 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.514 3.101 -0.005 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -4.033 3.461 0.849 1.00 0.00 H new ATOM 638 N PRO A 38 -2.975 7.235 3.494 1.00 0.00 N ATOM 639 CA PRO A 38 -2.337 8.211 4.383 1.00 0.00 C ATOM 640 C PRO A 38 -0.816 8.170 4.293 1.00 0.00 C ATOM 641 O PRO A 38 -0.194 7.144 4.571 1.00 0.00 O ATOM 642 CB PRO A 38 -2.802 7.777 5.776 1.00 0.00 C ATOM 643 CG PRO A 38 -3.100 6.324 5.641 1.00 0.00 C ATOM 644 CD PRO A 38 -3.608 6.134 4.239 1.00 0.00 C ATOM 0 HA PRO A 38 -2.609 9.235 4.127 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -2.030 7.955 6.524 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -3.684 8.334 6.090 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -2.207 5.724 5.817 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -3.845 6.009 6.372 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -3.324 5.161 3.837 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -4.696 6.192 4.194 1.00 0.00 H new ATOM 652 N LEU A 39 -0.221 9.292 3.904 1.00 0.00 N ATOM 653 CA LEU A 39 1.229 9.386 3.777 1.00 0.00 C ATOM 654 C LEU A 39 1.750 10.670 4.414 1.00 0.00 C ATOM 655 O LEU A 39 0.982 11.588 4.702 1.00 0.00 O ATOM 656 CB LEU A 39 1.637 9.332 2.304 1.00 0.00 C ATOM 657 CG LEU A 39 1.211 8.081 1.535 1.00 0.00 C ATOM 658 CD1 LEU A 39 1.516 8.236 0.053 1.00 0.00 C ATOM 659 CD2 LEU A 39 1.901 6.847 2.097 1.00 0.00 C ATOM 0 H LEU A 39 -0.721 10.150 3.671 1.00 0.00 H new ATOM 0 HA LEU A 39 1.670 8.538 4.301 1.00 0.00 H new ATOM 0 HB2 LEU A 39 1.220 10.204 1.800 1.00 0.00 H new ATOM 0 HB3 LEU A 39 2.722 9.419 2.245 1.00 0.00 H new ATOM 0 HG LEU A 39 0.135 7.955 1.653 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.206 7.336 -0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.974 9.095 -0.342 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.587 8.388 -0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 39 1.585 5.967 1.537 1.00 0.00 H new ATOM 0 HD22 LEU A 39 2.981 6.963 2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 39 1.631 6.725 3.146 1.00 0.00 H new ATOM 671 N ASP A 40 3.060 10.728 4.630 1.00 0.00 N ATOM 672 CA ASP A 40 3.684 11.902 5.230 1.00 0.00 C ATOM 673 C ASP A 40 4.035 12.935 4.164 1.00 0.00 C ATOM 674 O ASP A 40 3.709 12.765 2.989 1.00 0.00 O ATOM 675 CB ASP A 40 4.942 11.498 6.000 1.00 0.00 C ATOM 676 CG ASP A 40 5.248 12.444 7.145 1.00 0.00 C ATOM 677 OD1 ASP A 40 4.297 12.872 7.831 1.00 0.00 O ATOM 678 OD2 ASP A 40 6.439 12.757 7.354 1.00 0.00 O ATOM 0 H ASP A 40 3.710 9.976 4.399 1.00 0.00 H new ATOM 0 HA ASP A 40 2.971 12.349 5.922 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.817 10.488 6.390 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.791 11.473 5.316 1.00 0.00 H new ATOM 683 N TYR A 41 4.698 14.007 4.583 1.00 0.00 N ATOM 684 CA TYR A 41 5.090 15.070 3.665 1.00 0.00 C ATOM 685 C TYR A 41 6.580 14.995 3.348 1.00 0.00 C ATOM 686 O TYR A 41 7.019 15.409 2.276 1.00 0.00 O ATOM 687 CB TYR A 41 4.752 16.438 4.261 1.00 0.00 C ATOM 688 CG TYR A 41 5.684 17.541 3.814 1.00 0.00 C ATOM 689 CD1 TYR A 41 7.024 17.535 4.182 1.00 0.00 C ATOM 690 CD2 TYR A 41 5.226 18.588 3.025 1.00 0.00 C ATOM 691 CE1 TYR A 41 7.880 18.541 3.776 1.00 0.00 C ATOM 692 CE2 TYR A 41 6.074 19.597 2.614 1.00 0.00 C ATOM 693 CZ TYR A 41 7.400 19.570 2.992 1.00 0.00 C ATOM 694 OH TYR A 41 8.249 20.574 2.585 1.00 0.00 O ATOM 0 H TYR A 41 4.975 14.163 5.552 1.00 0.00 H new ATOM 0 HA TYR A 41 4.533 14.937 2.737 1.00 0.00 H new ATOM 0 HB2 TYR A 41 3.731 16.703 3.985 1.00 0.00 H new ATOM 0 HB3 TYR A 41 4.781 16.368 5.348 1.00 0.00 H new ATOM 0 HD1 TYR A 41 7.403 16.731 4.795 1.00 0.00 H new ATOM 0 HD2 TYR A 41 4.188 18.613 2.728 1.00 0.00 H new ATOM 0 HE1 TYR A 41 8.919 18.522 4.071 1.00 0.00 H new ATOM 0 HE2 TYR A 41 5.701 20.403 2.000 1.00 0.00 H new ATOM 0 HH TYR A 41 7.754 21.220 2.039 1.00 0.00 H new ATOM 704 N GLU A 42 7.353 14.464 4.291 1.00 0.00 N ATOM 705 CA GLU A 42 8.794 14.335 4.113 1.00 0.00 C ATOM 706 C GLU A 42 9.145 13.000 3.462 1.00 0.00 C ATOM 707 O GLU A 42 10.017 12.928 2.595 1.00 0.00 O ATOM 708 CB GLU A 42 9.510 14.462 5.459 1.00 0.00 C ATOM 709 CG GLU A 42 9.738 15.899 5.895 1.00 0.00 C ATOM 710 CD GLU A 42 10.968 16.056 6.768 1.00 0.00 C ATOM 711 OE1 GLU A 42 11.031 15.396 7.827 1.00 0.00 O ATOM 712 OE2 GLU A 42 11.866 16.839 6.394 1.00 0.00 O ATOM 0 H GLU A 42 7.005 14.117 5.185 1.00 0.00 H new ATOM 0 HA GLU A 42 9.126 15.139 3.456 1.00 0.00 H new ATOM 0 HB2 GLU A 42 8.925 13.948 6.222 1.00 0.00 H new ATOM 0 HB3 GLU A 42 10.472 13.953 5.399 1.00 0.00 H new ATOM 0 HG2 GLU A 42 9.841 16.530 5.013 1.00 0.00 H new ATOM 0 HG3 GLU A 42 8.863 16.253 6.440 1.00 0.00 H new ATOM 719 N THR A 43 8.458 11.943 3.886 1.00 0.00 N ATOM 720 CA THR A 43 8.697 10.610 3.347 1.00 0.00 C ATOM 721 C THR A 43 7.504 10.126 2.530 1.00 0.00 C ATOM 722 O THR A 43 7.637 9.239 1.688 1.00 0.00 O ATOM 723 CB THR A 43 8.984 9.594 4.468 1.00 0.00 C ATOM 724 OG1 THR A 43 7.855 9.496 5.342 1.00 0.00 O ATOM 725 CG2 THR A 43 10.215 10.001 5.265 1.00 0.00 C ATOM 0 H THR A 43 7.732 11.985 4.601 1.00 0.00 H new ATOM 0 HA THR A 43 9.572 10.682 2.700 1.00 0.00 H new ATOM 0 HB THR A 43 9.172 8.624 4.009 1.00 0.00 H new ATOM 0 HG1 THR A 43 8.045 8.847 6.051 1.00 0.00 H new ATOM 0 HG21 THR A 43 10.398 9.268 6.051 1.00 0.00 H new ATOM 0 HG22 THR A 43 11.079 10.046 4.602 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.051 10.981 5.713 1.00 0.00 H new ATOM 733 N GLU A 44 6.340 10.714 2.786 1.00 0.00 N ATOM 734 CA GLU A 44 5.124 10.341 2.073 1.00 0.00 C ATOM 735 C GLU A 44 5.044 8.829 1.888 1.00 0.00 C ATOM 736 O GLU A 44 4.507 8.341 0.893 1.00 0.00 O ATOM 737 CB GLU A 44 5.070 11.037 0.712 1.00 0.00 C ATOM 738 CG GLU A 44 6.171 10.600 -0.239 1.00 0.00 C ATOM 739 CD GLU A 44 6.031 11.216 -1.617 1.00 0.00 C ATOM 740 OE1 GLU A 44 6.216 12.446 -1.738 1.00 0.00 O ATOM 741 OE2 GLU A 44 5.737 10.471 -2.575 1.00 0.00 O ATOM 0 H GLU A 44 6.213 11.450 3.481 1.00 0.00 H new ATOM 0 HA GLU A 44 4.270 10.662 2.670 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.103 10.839 0.250 1.00 0.00 H new ATOM 0 HB3 GLU A 44 5.137 12.115 0.861 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.139 10.875 0.181 1.00 0.00 H new ATOM 0 HG3 GLU A 44 6.159 9.514 -0.328 1.00 0.00 H new ATOM 748 N LYS A 45 5.585 8.091 2.852 1.00 0.00 N ATOM 749 CA LYS A 45 5.576 6.634 2.797 1.00 0.00 C ATOM 750 C LYS A 45 4.519 6.061 3.736 1.00 0.00 C ATOM 751 O LYS A 45 4.365 6.520 4.868 1.00 0.00 O ATOM 752 CB LYS A 45 6.954 6.081 3.166 1.00 0.00 C ATOM 753 CG LYS A 45 7.999 6.281 2.081 1.00 0.00 C ATOM 754 CD LYS A 45 9.063 5.197 2.126 1.00 0.00 C ATOM 755 CE LYS A 45 10.181 5.553 3.095 1.00 0.00 C ATOM 756 NZ LYS A 45 9.805 5.262 4.506 1.00 0.00 N ATOM 0 H LYS A 45 6.035 8.479 3.681 1.00 0.00 H new ATOM 0 HA LYS A 45 5.332 6.335 1.778 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.296 6.563 4.082 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.864 5.016 3.380 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.516 6.278 1.104 1.00 0.00 H new ATOM 0 HG3 LYS A 45 8.468 7.258 2.201 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.609 4.252 2.424 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.477 5.051 1.129 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.079 4.992 2.835 1.00 0.00 H new ATOM 0 HE3 LYS A 45 10.425 6.611 2.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.666 5.155 5.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.233 6.045 4.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.253 4.382 4.544 1.00 0.00 H new ATOM 770 N HIS A 46 3.794 5.053 3.259 1.00 0.00 N ATOM 771 CA HIS A 46 2.753 4.416 4.058 1.00 0.00 C ATOM 772 C HIS A 46 3.360 3.452 5.072 1.00 0.00 C ATOM 773 O HIS A 46 4.336 2.760 4.779 1.00 0.00 O ATOM 774 CB HIS A 46 1.772 3.671 3.153 1.00 0.00 C ATOM 775 CG HIS A 46 2.241 2.304 2.757 1.00 0.00 C ATOM 776 ND1 HIS A 46 2.537 1.316 3.672 1.00 0.00 N ATOM 777 CD2 HIS A 46 2.463 1.764 1.536 1.00 0.00 C ATOM 778 CE1 HIS A 46 2.923 0.227 3.031 1.00 0.00 C ATOM 779 NE2 HIS A 46 2.886 0.473 1.733 1.00 0.00 N ATOM 0 H HIS A 46 3.908 4.661 2.324 1.00 0.00 H new ATOM 0 HA HIS A 46 2.217 5.195 4.600 1.00 0.00 H new ATOM 0 HB2 HIS A 46 0.814 3.583 3.665 1.00 0.00 H new ATOM 0 HB3 HIS A 46 1.600 4.262 2.253 1.00 0.00 H new ATOM 0 HD2 HIS A 46 2.332 2.257 0.584 1.00 0.00 H new ATOM 0 HE1 HIS A 46 3.218 -0.705 3.490 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.132 -0.189 0.997 1.00 0.00 H new ATOM 787 N ARG A 47 2.778 3.413 6.266 1.00 0.00 N ATOM 788 CA ARG A 47 3.263 2.535 7.325 1.00 0.00 C ATOM 789 C ARG A 47 2.921 1.079 7.023 1.00 0.00 C ATOM 790 O ARG A 47 3.677 0.170 7.362 1.00 0.00 O ATOM 791 CB ARG A 47 2.661 2.943 8.670 1.00 0.00 C ATOM 792 CG ARG A 47 3.378 2.339 9.867 1.00 0.00 C ATOM 793 CD ARG A 47 2.591 2.547 11.151 1.00 0.00 C ATOM 794 NE ARG A 47 2.945 3.799 11.814 1.00 0.00 N ATOM 795 CZ ARG A 47 2.230 4.339 12.794 1.00 0.00 C ATOM 796 NH1 ARG A 47 1.129 3.739 13.225 1.00 0.00 N ATOM 797 NH2 ARG A 47 2.616 5.482 13.347 1.00 0.00 N ATOM 0 H ARG A 47 1.970 3.979 6.525 1.00 0.00 H new ATOM 0 HA ARG A 47 4.347 2.633 7.376 1.00 0.00 H new ATOM 0 HB2 ARG A 47 2.684 4.030 8.754 1.00 0.00 H new ATOM 0 HB3 ARG A 47 1.613 2.643 8.695 1.00 0.00 H new ATOM 0 HG2 ARG A 47 3.530 1.273 9.701 1.00 0.00 H new ATOM 0 HG3 ARG A 47 4.365 2.790 9.967 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.524 2.545 10.927 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.776 1.713 11.828 1.00 0.00 H new ATOM 0 HE ARG A 47 3.788 4.285 11.508 1.00 0.00 H new ATOM 0 HH11 ARG A 47 0.829 2.860 12.804 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.582 4.156 13.978 1.00 0.00 H new ATOM 0 HH21 ARG A 47 3.463 5.947 13.019 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.066 5.896 14.100 1.00 0.00 H new ATOM 811 N GLY A 48 1.775 0.865 6.384 1.00 0.00 N ATOM 812 CA GLY A 48 1.352 -0.482 6.048 1.00 0.00 C ATOM 813 C GLY A 48 -0.140 -0.682 6.221 1.00 0.00 C ATOM 814 O GLY A 48 -0.575 -1.617 6.894 1.00 0.00 O ATOM 0 H GLY A 48 1.132 1.601 6.093 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.627 -0.699 5.016 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.886 -1.195 6.677 1.00 0.00 H new ATOM 818 N PHE A 49 -0.928 0.200 5.614 1.00 0.00 N ATOM 819 CA PHE A 49 -2.381 0.117 5.707 1.00 0.00 C ATOM 820 C PHE A 49 -3.044 1.102 4.748 1.00 0.00 C ATOM 821 O PHE A 49 -2.379 1.950 4.155 1.00 0.00 O ATOM 822 CB PHE A 49 -2.839 0.396 7.140 1.00 0.00 C ATOM 823 CG PHE A 49 -2.572 1.804 7.591 1.00 0.00 C ATOM 824 CD1 PHE A 49 -1.276 2.238 7.821 1.00 0.00 C ATOM 825 CD2 PHE A 49 -3.616 2.694 7.784 1.00 0.00 C ATOM 826 CE1 PHE A 49 -1.028 3.533 8.236 1.00 0.00 C ATOM 827 CE2 PHE A 49 -3.375 3.990 8.199 1.00 0.00 C ATOM 828 CZ PHE A 49 -2.078 4.410 8.424 1.00 0.00 C ATOM 0 H PHE A 49 -0.585 0.980 5.053 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.681 -0.893 5.428 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.907 0.195 7.217 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -2.335 -0.295 7.815 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.451 1.557 7.674 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.631 2.371 7.608 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -0.014 3.859 8.413 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.198 4.673 8.347 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.886 5.423 8.746 1.00 0.00 H new ATOM 838 N ALA A 50 -4.360 0.982 4.602 1.00 0.00 N ATOM 839 CA ALA A 50 -5.113 1.861 3.717 1.00 0.00 C ATOM 840 C ALA A 50 -6.614 1.706 3.938 1.00 0.00 C ATOM 841 O ALA A 50 -7.049 0.964 4.818 1.00 0.00 O ATOM 842 CB ALA A 50 -4.759 1.579 2.265 1.00 0.00 C ATOM 0 H ALA A 50 -4.926 0.285 5.085 1.00 0.00 H new ATOM 0 HA ALA A 50 -4.842 2.890 3.951 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.329 2.243 1.616 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.693 1.748 2.111 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -5.000 0.543 2.026 1.00 0.00 H new ATOM 848 N PHE A 51 -7.402 2.411 3.132 1.00 0.00 N ATOM 849 CA PHE A 51 -8.855 2.353 3.241 1.00 0.00 C ATOM 850 C PHE A 51 -9.502 2.309 1.859 1.00 0.00 C ATOM 851 O PHE A 51 -9.341 3.228 1.056 1.00 0.00 O ATOM 852 CB PHE A 51 -9.378 3.559 4.023 1.00 0.00 C ATOM 853 CG PHE A 51 -8.841 3.644 5.423 1.00 0.00 C ATOM 854 CD1 PHE A 51 -7.572 4.143 5.664 1.00 0.00 C ATOM 855 CD2 PHE A 51 -9.607 3.224 6.499 1.00 0.00 C ATOM 856 CE1 PHE A 51 -7.075 4.223 6.951 1.00 0.00 C ATOM 857 CE2 PHE A 51 -9.116 3.302 7.789 1.00 0.00 C ATOM 858 CZ PHE A 51 -7.848 3.800 8.015 1.00 0.00 C ATOM 0 H PHE A 51 -7.059 3.029 2.397 1.00 0.00 H new ATOM 0 HA PHE A 51 -9.118 1.441 3.776 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.117 4.471 3.486 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.466 3.513 4.062 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -6.963 4.474 4.836 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -10.598 2.831 6.328 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -6.084 4.616 7.125 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.724 2.974 8.619 1.00 0.00 H new ATOM 0 HZ PHE A 51 -7.461 3.859 9.022 1.00 0.00 H new ATOM 868 N VAL A 52 -10.235 1.233 1.589 1.00 0.00 N ATOM 869 CA VAL A 52 -10.907 1.068 0.306 1.00 0.00 C ATOM 870 C VAL A 52 -12.407 1.304 0.437 1.00 0.00 C ATOM 871 O VAL A 52 -13.046 0.799 1.360 1.00 0.00 O ATOM 872 CB VAL A 52 -10.668 -0.337 -0.276 1.00 0.00 C ATOM 873 CG1 VAL A 52 -11.319 -0.467 -1.645 1.00 0.00 C ATOM 874 CG2 VAL A 52 -9.178 -0.635 -0.355 1.00 0.00 C ATOM 0 H VAL A 52 -10.378 0.463 2.242 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.483 1.810 -0.371 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.127 -1.069 0.389 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -11.139 -1.467 -2.040 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -12.392 -0.300 -1.555 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -10.893 0.273 -2.322 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -9.028 -1.632 -0.769 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -8.693 0.101 -0.997 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.744 -0.587 0.644 1.00 0.00 H new ATOM 884 N GLU A 53 -12.963 2.075 -0.492 1.00 0.00 N ATOM 885 CA GLU A 53 -14.390 2.377 -0.480 1.00 0.00 C ATOM 886 C GLU A 53 -15.136 1.522 -1.499 1.00 0.00 C ATOM 887 O GLU A 53 -14.957 1.678 -2.707 1.00 0.00 O ATOM 888 CB GLU A 53 -14.622 3.861 -0.774 1.00 0.00 C ATOM 889 CG GLU A 53 -16.000 4.354 -0.368 1.00 0.00 C ATOM 890 CD GLU A 53 -16.036 5.850 -0.123 1.00 0.00 C ATOM 891 OE1 GLU A 53 -15.507 6.292 0.918 1.00 0.00 O ATOM 892 OE2 GLU A 53 -16.593 6.577 -0.971 1.00 0.00 O ATOM 0 H GLU A 53 -12.448 2.502 -1.262 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.776 2.146 0.513 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -13.867 4.448 -0.252 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.482 4.038 -1.840 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -16.717 4.100 -1.149 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -16.316 3.834 0.536 1.00 0.00 H new ATOM 899 N PHE A 54 -15.975 0.618 -1.004 1.00 0.00 N ATOM 900 CA PHE A 54 -16.748 -0.264 -1.871 1.00 0.00 C ATOM 901 C PHE A 54 -18.062 0.394 -2.282 1.00 0.00 C ATOM 902 O PHE A 54 -18.659 1.145 -1.511 1.00 0.00 O ATOM 903 CB PHE A 54 -17.027 -1.592 -1.165 1.00 0.00 C ATOM 904 CG PHE A 54 -15.870 -2.548 -1.206 1.00 0.00 C ATOM 905 CD1 PHE A 54 -14.574 -2.097 -1.014 1.00 0.00 C ATOM 906 CD2 PHE A 54 -16.078 -3.898 -1.438 1.00 0.00 C ATOM 907 CE1 PHE A 54 -13.507 -2.974 -1.051 1.00 0.00 C ATOM 908 CE2 PHE A 54 -15.014 -4.780 -1.476 1.00 0.00 C ATOM 909 CZ PHE A 54 -13.727 -4.318 -1.283 1.00 0.00 C ATOM 0 H PHE A 54 -16.137 0.477 -0.007 1.00 0.00 H new ATOM 0 HA PHE A 54 -16.161 -0.456 -2.770 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -17.287 -1.394 -0.125 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -17.894 -2.064 -1.626 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -14.396 -1.047 -0.833 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -17.082 -4.265 -1.591 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -12.502 -2.609 -0.899 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -15.189 -5.830 -1.657 1.00 0.00 H new ATOM 0 HZ PHE A 54 -12.895 -5.006 -1.313 1.00 0.00 H new ATOM 919 N GLU A 55 -18.506 0.105 -3.501 1.00 0.00 N ATOM 920 CA GLU A 55 -19.749 0.669 -4.014 1.00 0.00 C ATOM 921 C GLU A 55 -20.911 0.375 -3.070 1.00 0.00 C ATOM 922 O GLU A 55 -21.657 1.276 -2.686 1.00 0.00 O ATOM 923 CB GLU A 55 -20.053 0.108 -5.405 1.00 0.00 C ATOM 924 CG GLU A 55 -20.902 1.032 -6.262 1.00 0.00 C ATOM 925 CD GLU A 55 -20.068 1.995 -7.084 1.00 0.00 C ATOM 926 OE1 GLU A 55 -19.180 1.527 -7.826 1.00 0.00 O ATOM 927 OE2 GLU A 55 -20.305 3.218 -6.985 1.00 0.00 O ATOM 0 H GLU A 55 -18.024 -0.516 -4.151 1.00 0.00 H new ATOM 0 HA GLU A 55 -19.626 1.750 -4.084 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -19.113 -0.091 -5.921 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -20.566 -0.848 -5.298 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -21.523 0.434 -6.929 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -21.577 1.598 -5.620 1.00 0.00 H new ATOM 934 N LEU A 56 -21.058 -0.893 -2.700 1.00 0.00 N ATOM 935 CA LEU A 56 -22.130 -1.308 -1.801 1.00 0.00 C ATOM 936 C LEU A 56 -21.563 -1.841 -0.489 1.00 0.00 C ATOM 937 O LEU A 56 -20.350 -1.858 -0.286 1.00 0.00 O ATOM 938 CB LEU A 56 -22.997 -2.377 -2.468 1.00 0.00 C ATOM 939 CG LEU A 56 -23.583 -2.010 -3.831 1.00 0.00 C ATOM 940 CD1 LEU A 56 -24.270 -3.214 -4.458 1.00 0.00 C ATOM 941 CD2 LEU A 56 -24.557 -0.848 -3.699 1.00 0.00 C ATOM 0 H LEU A 56 -20.449 -1.651 -3.008 1.00 0.00 H new ATOM 0 HA LEU A 56 -22.746 -0.436 -1.582 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -22.399 -3.281 -2.583 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -23.819 -2.622 -1.795 1.00 0.00 H new ATOM 0 HG LEU A 56 -22.767 -1.701 -4.484 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -24.681 -2.934 -5.428 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -23.546 -4.018 -4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -25.075 -3.553 -3.807 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -24.964 -0.601 -4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -25.370 -1.129 -3.029 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -24.036 0.019 -3.294 1.00 0.00 H new ATOM 953 N ALA A 57 -22.451 -2.279 0.398 1.00 0.00 N ATOM 954 CA ALA A 57 -22.039 -2.817 1.689 1.00 0.00 C ATOM 955 C ALA A 57 -21.840 -4.327 1.615 1.00 0.00 C ATOM 956 O ALA A 57 -20.816 -4.849 2.056 1.00 0.00 O ATOM 957 CB ALA A 57 -23.066 -2.470 2.757 1.00 0.00 C ATOM 0 H ALA A 57 -23.460 -2.272 0.246 1.00 0.00 H new ATOM 0 HA ALA A 57 -21.085 -2.363 1.957 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -22.746 -2.878 3.716 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -23.157 -1.387 2.836 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -24.032 -2.897 2.486 1.00 0.00 H new ATOM 963 N GLU A 58 -22.825 -5.023 1.056 1.00 0.00 N ATOM 964 CA GLU A 58 -22.756 -6.474 0.927 1.00 0.00 C ATOM 965 C GLU A 58 -21.381 -6.912 0.433 1.00 0.00 C ATOM 966 O GLU A 58 -20.630 -7.567 1.156 1.00 0.00 O ATOM 967 CB GLU A 58 -23.838 -6.974 -0.033 1.00 0.00 C ATOM 968 CG GLU A 58 -25.233 -6.483 0.313 1.00 0.00 C ATOM 969 CD GLU A 58 -26.317 -7.453 -0.119 1.00 0.00 C ATOM 970 OE1 GLU A 58 -26.155 -8.090 -1.181 1.00 0.00 O ATOM 971 OE2 GLU A 58 -27.327 -7.574 0.605 1.00 0.00 O ATOM 0 H GLU A 58 -23.679 -4.606 0.686 1.00 0.00 H new ATOM 0 HA GLU A 58 -22.924 -6.909 1.912 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -23.590 -6.654 -1.045 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -23.835 -8.064 -0.034 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -25.301 -6.323 1.389 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -25.403 -5.518 -0.164 1.00 0.00 H new ATOM 978 N ASP A 59 -21.058 -6.546 -0.803 1.00 0.00 N ATOM 979 CA ASP A 59 -19.773 -6.900 -1.394 1.00 0.00 C ATOM 980 C ASP A 59 -18.632 -6.623 -0.420 1.00 0.00 C ATOM 981 O ASP A 59 -17.726 -7.440 -0.262 1.00 0.00 O ATOM 982 CB ASP A 59 -19.553 -6.121 -2.692 1.00 0.00 C ATOM 983 CG ASP A 59 -19.356 -4.637 -2.450 1.00 0.00 C ATOM 984 OD1 ASP A 59 -19.986 -4.099 -1.516 1.00 0.00 O ATOM 985 OD2 ASP A 59 -18.571 -4.014 -3.195 1.00 0.00 O ATOM 0 H ASP A 59 -21.669 -6.004 -1.415 1.00 0.00 H new ATOM 0 HA ASP A 59 -19.785 -7.967 -1.617 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -18.681 -6.521 -3.209 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -20.409 -6.268 -3.350 1.00 0.00 H new ATOM 990 N ALA A 60 -18.682 -5.464 0.229 1.00 0.00 N ATOM 991 CA ALA A 60 -17.654 -5.080 1.187 1.00 0.00 C ATOM 992 C ALA A 60 -17.506 -6.129 2.284 1.00 0.00 C ATOM 993 O ALA A 60 -16.408 -6.618 2.544 1.00 0.00 O ATOM 994 CB ALA A 60 -17.978 -3.722 1.793 1.00 0.00 C ATOM 0 H ALA A 60 -19.424 -4.775 0.108 1.00 0.00 H new ATOM 0 HA ALA A 60 -16.705 -5.012 0.656 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -17.202 -3.448 2.507 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -18.025 -2.973 1.003 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -18.940 -3.772 2.304 1.00 0.00 H new ATOM 1000 N ALA A 61 -18.620 -6.469 2.925 1.00 0.00 N ATOM 1001 CA ALA A 61 -18.614 -7.461 3.993 1.00 0.00 C ATOM 1002 C ALA A 61 -17.937 -8.750 3.541 1.00 0.00 C ATOM 1003 O ALA A 61 -17.129 -9.326 4.269 1.00 0.00 O ATOM 1004 CB ALA A 61 -20.035 -7.743 4.459 1.00 0.00 C ATOM 0 H ALA A 61 -19.538 -6.072 2.723 1.00 0.00 H new ATOM 0 HA ALA A 61 -18.043 -7.056 4.829 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -20.016 -8.486 5.257 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -20.485 -6.823 4.831 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -20.623 -8.123 3.624 1.00 0.00 H new ATOM 1010 N ALA A 62 -18.273 -9.198 2.336 1.00 0.00 N ATOM 1011 CA ALA A 62 -17.696 -10.419 1.787 1.00 0.00 C ATOM 1012 C ALA A 62 -16.185 -10.290 1.629 1.00 0.00 C ATOM 1013 O ALA A 62 -15.441 -11.236 1.885 1.00 0.00 O ATOM 1014 CB ALA A 62 -18.341 -10.753 0.450 1.00 0.00 C ATOM 0 H ALA A 62 -18.942 -8.734 1.721 1.00 0.00 H new ATOM 0 HA ALA A 62 -17.894 -11.231 2.487 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -17.900 -11.667 0.052 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.412 -10.897 0.589 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.173 -9.934 -0.250 1.00 0.00 H new ATOM 1020 N ALA A 63 -15.737 -9.112 1.206 1.00 0.00 N ATOM 1021 CA ALA A 63 -14.314 -8.859 1.016 1.00 0.00 C ATOM 1022 C ALA A 63 -13.546 -9.035 2.321 1.00 0.00 C ATOM 1023 O ALA A 63 -12.448 -9.592 2.336 1.00 0.00 O ATOM 1024 CB ALA A 63 -14.097 -7.461 0.457 1.00 0.00 C ATOM 0 H ALA A 63 -16.339 -8.318 0.988 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.933 -9.587 0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -13.030 -7.285 0.320 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -14.606 -7.370 -0.503 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -14.500 -6.725 1.152 1.00 0.00 H new ATOM 1030 N ILE A 64 -14.130 -8.556 3.415 1.00 0.00 N ATOM 1031 CA ILE A 64 -13.499 -8.661 4.725 1.00 0.00 C ATOM 1032 C ILE A 64 -13.415 -10.114 5.179 1.00 0.00 C ATOM 1033 O ILE A 64 -12.330 -10.626 5.455 1.00 0.00 O ATOM 1034 CB ILE A 64 -14.265 -7.847 5.785 1.00 0.00 C ATOM 1035 CG1 ILE A 64 -14.351 -6.377 5.368 1.00 0.00 C ATOM 1036 CG2 ILE A 64 -13.592 -7.980 7.143 1.00 0.00 C ATOM 1037 CD1 ILE A 64 -15.204 -5.536 6.291 1.00 0.00 C ATOM 0 H ILE A 64 -15.038 -8.092 3.420 1.00 0.00 H new ATOM 0 HA ILE A 64 -12.492 -8.255 4.625 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.278 -8.242 5.863 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.345 -5.958 5.334 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -14.756 -6.317 4.358 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -14.145 -7.399 7.881 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -13.579 -9.028 7.441 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -12.569 -7.608 7.080 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.220 -4.506 5.934 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -16.220 -5.930 6.307 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -14.788 -5.565 7.298 1.00 0.00 H new ATOM 1049 N ASP A 65 -14.565 -10.773 5.253 1.00 0.00 N ATOM 1050 CA ASP A 65 -14.622 -12.169 5.670 1.00 0.00 C ATOM 1051 C ASP A 65 -13.546 -12.991 4.967 1.00 0.00 C ATOM 1052 O ASP A 65 -13.094 -14.012 5.483 1.00 0.00 O ATOM 1053 CB ASP A 65 -16.003 -12.756 5.377 1.00 0.00 C ATOM 1054 CG ASP A 65 -16.966 -12.576 6.534 1.00 0.00 C ATOM 1055 OD1 ASP A 65 -16.891 -11.530 7.212 1.00 0.00 O ATOM 1056 OD2 ASP A 65 -17.795 -13.482 6.762 1.00 0.00 O ATOM 0 H ASP A 65 -15.472 -10.363 5.029 1.00 0.00 H new ATOM 0 HA ASP A 65 -14.440 -12.209 6.744 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -16.416 -12.280 4.487 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -15.903 -13.818 5.153 1.00 0.00 H new ATOM 1061 N ASN A 66 -13.142 -12.538 3.784 1.00 0.00 N ATOM 1062 CA ASN A 66 -12.121 -13.232 3.008 1.00 0.00 C ATOM 1063 C ASN A 66 -10.738 -12.647 3.282 1.00 0.00 C ATOM 1064 O ASN A 66 -9.928 -13.247 3.987 1.00 0.00 O ATOM 1065 CB ASN A 66 -12.438 -13.144 1.514 1.00 0.00 C ATOM 1066 CG ASN A 66 -13.540 -14.099 1.100 1.00 0.00 C ATOM 1067 OD1 ASN A 66 -13.286 -15.117 0.457 1.00 0.00 O ATOM 1068 ND2 ASN A 66 -14.774 -13.773 1.468 1.00 0.00 N ATOM 0 H ASN A 66 -13.506 -11.694 3.342 1.00 0.00 H new ATOM 0 HA ASN A 66 -12.119 -14.279 3.311 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -12.733 -12.124 1.267 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -11.537 -13.363 0.941 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -15.557 -14.377 1.218 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -14.938 -12.919 2.001 1.00 0.00 H new ATOM 1075 N MET A 67 -10.477 -11.472 2.718 1.00 0.00 N ATOM 1076 CA MET A 67 -9.194 -10.805 2.902 1.00 0.00 C ATOM 1077 C MET A 67 -8.734 -10.903 4.353 1.00 0.00 C ATOM 1078 O MET A 67 -7.541 -10.816 4.643 1.00 0.00 O ATOM 1079 CB MET A 67 -9.293 -9.336 2.485 1.00 0.00 C ATOM 1080 CG MET A 67 -9.673 -9.144 1.026 1.00 0.00 C ATOM 1081 SD MET A 67 -8.702 -10.178 -0.087 1.00 0.00 S ATOM 1082 CE MET A 67 -7.061 -9.509 0.174 1.00 0.00 C ATOM 0 H MET A 67 -11.137 -10.963 2.130 1.00 0.00 H new ATOM 0 HA MET A 67 -8.459 -11.305 2.271 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.031 -8.837 3.113 1.00 0.00 H new ATOM 0 HB3 MET A 67 -8.336 -8.849 2.670 1.00 0.00 H new ATOM 0 HG2 MET A 67 -10.731 -9.372 0.897 1.00 0.00 H new ATOM 0 HG3 MET A 67 -9.537 -8.097 0.754 1.00 0.00 H new ATOM 0 HE1 MET A 67 -6.670 -9.126 -0.769 1.00 0.00 H new ATOM 0 HE2 MET A 67 -7.110 -8.699 0.902 1.00 0.00 H new ATOM 0 HE3 MET A 67 -6.403 -10.294 0.548 1.00 0.00 H new ATOM 1092 N ASN A 68 -9.687 -11.084 5.261 1.00 0.00 N ATOM 1093 CA ASN A 68 -9.379 -11.193 6.682 1.00 0.00 C ATOM 1094 C ASN A 68 -8.333 -12.276 6.931 1.00 0.00 C ATOM 1095 O ASN A 68 -8.579 -13.457 6.688 1.00 0.00 O ATOM 1096 CB ASN A 68 -10.649 -11.503 7.479 1.00 0.00 C ATOM 1097 CG ASN A 68 -10.350 -11.900 8.911 1.00 0.00 C ATOM 1098 OD1 ASN A 68 -10.061 -13.063 9.197 1.00 0.00 O ATOM 1099 ND2 ASN A 68 -10.419 -10.934 9.820 1.00 0.00 N ATOM 0 H ASN A 68 -10.680 -11.158 5.038 1.00 0.00 H new ATOM 0 HA ASN A 68 -8.973 -10.237 7.014 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -11.299 -10.628 7.476 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.195 -12.308 6.988 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -10.229 -11.142 10.800 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -10.662 -9.984 9.538 1.00 0.00 H new ATOM 1106 N GLU A 69 -7.166 -11.864 7.416 1.00 0.00 N ATOM 1107 CA GLU A 69 -6.083 -12.799 7.697 1.00 0.00 C ATOM 1108 C GLU A 69 -5.762 -13.645 6.468 1.00 0.00 C ATOM 1109 O GLU A 69 -5.550 -14.853 6.571 1.00 0.00 O ATOM 1110 CB GLU A 69 -6.455 -13.706 8.871 1.00 0.00 C ATOM 1111 CG GLU A 69 -6.778 -12.948 10.148 1.00 0.00 C ATOM 1112 CD GLU A 69 -7.258 -13.858 11.261 1.00 0.00 C ATOM 1113 OE1 GLU A 69 -8.113 -14.728 10.991 1.00 0.00 O ATOM 1114 OE2 GLU A 69 -6.779 -13.700 12.404 1.00 0.00 O ATOM 0 H GLU A 69 -6.946 -10.890 7.622 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.197 -12.221 7.960 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.316 -14.313 8.591 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.630 -14.392 9.065 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.890 -12.410 10.481 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.544 -12.201 9.939 1.00 0.00 H new ATOM 1121 N SER A 70 -5.730 -13.001 5.306 1.00 0.00 N ATOM 1122 CA SER A 70 -5.440 -13.693 4.056 1.00 0.00 C ATOM 1123 C SER A 70 -3.954 -13.608 3.719 1.00 0.00 C ATOM 1124 O SER A 70 -3.183 -12.963 4.429 1.00 0.00 O ATOM 1125 CB SER A 70 -6.267 -13.099 2.915 1.00 0.00 C ATOM 1126 OG SER A 70 -7.579 -13.636 2.902 1.00 0.00 O ATOM 0 H SER A 70 -5.901 -12.001 5.204 1.00 0.00 H new ATOM 0 HA SER A 70 -5.707 -14.742 4.181 1.00 0.00 H new ATOM 0 HB2 SER A 70 -6.315 -12.015 3.023 1.00 0.00 H new ATOM 0 HB3 SER A 70 -5.778 -13.303 1.963 1.00 0.00 H new ATOM 0 HG SER A 70 -8.050 -13.369 3.719 1.00 0.00 H new ATOM 1132 N GLU A 71 -3.561 -14.264 2.632 1.00 0.00 N ATOM 1133 CA GLU A 71 -2.168 -14.263 2.202 1.00 0.00 C ATOM 1134 C GLU A 71 -1.987 -13.417 0.944 1.00 0.00 C ATOM 1135 O GLU A 71 -2.465 -13.776 -0.133 1.00 0.00 O ATOM 1136 CB GLU A 71 -1.690 -15.693 1.941 1.00 0.00 C ATOM 1137 CG GLU A 71 -0.244 -15.778 1.482 1.00 0.00 C ATOM 1138 CD GLU A 71 0.364 -17.146 1.720 1.00 0.00 C ATOM 1139 OE1 GLU A 71 0.511 -17.533 2.898 1.00 0.00 O ATOM 1140 OE2 GLU A 71 0.693 -17.830 0.728 1.00 0.00 O ATOM 0 H GLU A 71 -4.187 -14.803 2.033 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.569 -13.828 3.001 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.808 -16.278 2.853 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.330 -16.148 1.185 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.189 -15.540 0.420 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.345 -15.026 2.008 1.00 0.00 H new ATOM 1147 N LEU A 72 -1.294 -12.293 1.089 1.00 0.00 N ATOM 1148 CA LEU A 72 -1.050 -11.395 -0.035 1.00 0.00 C ATOM 1149 C LEU A 72 0.387 -10.884 -0.021 1.00 0.00 C ATOM 1150 O LEU A 72 0.893 -10.453 1.015 1.00 0.00 O ATOM 1151 CB LEU A 72 -2.024 -10.216 0.009 1.00 0.00 C ATOM 1152 CG LEU A 72 -1.749 -9.082 -0.980 1.00 0.00 C ATOM 1153 CD1 LEU A 72 -2.230 -9.461 -2.373 1.00 0.00 C ATOM 1154 CD2 LEU A 72 -2.416 -7.796 -0.515 1.00 0.00 C ATOM 0 H LEU A 72 -0.891 -11.982 1.973 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.208 -11.954 -0.957 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -3.030 -10.594 -0.173 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.017 -9.802 1.017 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.673 -8.915 -1.022 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.026 -8.643 -3.063 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.707 -10.357 -2.707 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.302 -9.656 -2.347 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.210 -7.000 -1.230 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.493 -7.950 -0.444 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -2.024 -7.516 0.463 1.00 0.00 H new ATOM 1166 N PHE A 73 1.038 -10.933 -1.178 1.00 0.00 N ATOM 1167 CA PHE A 73 2.417 -10.473 -1.299 1.00 0.00 C ATOM 1168 C PHE A 73 3.356 -11.349 -0.476 1.00 0.00 C ATOM 1169 O PHE A 73 4.430 -10.912 -0.065 1.00 0.00 O ATOM 1170 CB PHE A 73 2.533 -9.016 -0.847 1.00 0.00 C ATOM 1171 CG PHE A 73 2.424 -8.029 -1.974 1.00 0.00 C ATOM 1172 CD1 PHE A 73 1.308 -8.015 -2.795 1.00 0.00 C ATOM 1173 CD2 PHE A 73 3.437 -7.115 -2.212 1.00 0.00 C ATOM 1174 CE1 PHE A 73 1.204 -7.107 -3.832 1.00 0.00 C ATOM 1175 CE2 PHE A 73 3.339 -6.204 -3.247 1.00 0.00 C ATOM 1176 CZ PHE A 73 2.221 -6.201 -4.059 1.00 0.00 C ATOM 0 H PHE A 73 0.633 -11.286 -2.045 1.00 0.00 H new ATOM 0 HA PHE A 73 2.707 -10.545 -2.347 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.753 -8.808 -0.115 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.489 -8.875 -0.342 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.510 -8.722 -2.623 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.314 -7.114 -1.581 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.328 -7.106 -4.464 1.00 0.00 H new ATOM 0 HE2 PHE A 73 4.135 -5.495 -3.421 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.143 -5.492 -4.870 1.00 0.00 H new ATOM 1186 N GLY A 74 2.943 -12.591 -0.238 1.00 0.00 N ATOM 1187 CA GLY A 74 3.758 -13.509 0.535 1.00 0.00 C ATOM 1188 C GLY A 74 3.712 -13.214 2.021 1.00 0.00 C ATOM 1189 O GLY A 74 4.604 -13.616 2.768 1.00 0.00 O ATOM 0 H GLY A 74 2.058 -12.977 -0.567 1.00 0.00 H new ATOM 0 HA2 GLY A 74 3.417 -14.529 0.359 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.790 -13.454 0.188 1.00 0.00 H new ATOM 1193 N ARG A 75 2.672 -12.508 2.451 1.00 0.00 N ATOM 1194 CA ARG A 75 2.515 -12.156 3.857 1.00 0.00 C ATOM 1195 C ARG A 75 1.039 -12.084 4.239 1.00 0.00 C ATOM 1196 O ARG A 75 0.163 -12.075 3.374 1.00 0.00 O ATOM 1197 CB ARG A 75 3.195 -10.817 4.149 1.00 0.00 C ATOM 1198 CG ARG A 75 2.531 -9.635 3.463 1.00 0.00 C ATOM 1199 CD ARG A 75 3.208 -9.303 2.143 1.00 0.00 C ATOM 1200 NE ARG A 75 4.655 -9.170 2.289 1.00 0.00 N ATOM 1201 CZ ARG A 75 5.239 -8.169 2.938 1.00 0.00 C ATOM 1202 NH1 ARG A 75 4.504 -7.218 3.497 1.00 0.00 N ATOM 1203 NH2 ARG A 75 6.562 -8.117 3.028 1.00 0.00 N ATOM 0 H ARG A 75 1.925 -12.168 1.845 1.00 0.00 H new ATOM 0 HA ARG A 75 2.989 -12.934 4.455 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.197 -10.647 5.226 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.237 -10.872 3.833 1.00 0.00 H new ATOM 0 HG2 ARG A 75 1.479 -9.859 3.287 1.00 0.00 H new ATOM 0 HG3 ARG A 75 2.566 -8.766 4.120 1.00 0.00 H new ATOM 0 HD2 ARG A 75 2.987 -10.084 1.416 1.00 0.00 H new ATOM 0 HD3 ARG A 75 2.796 -8.374 1.748 1.00 0.00 H new ATOM 0 HE ARG A 75 5.250 -9.885 1.870 1.00 0.00 H new ATOM 0 HH11 ARG A 75 3.487 -7.254 3.429 1.00 0.00 H new ATOM 0 HH12 ARG A 75 4.956 -6.451 3.995 1.00 0.00 H new ATOM 0 HH21 ARG A 75 7.131 -8.846 2.599 1.00 0.00 H new ATOM 0 HH22 ARG A 75 7.009 -7.348 3.527 1.00 0.00 H new ATOM 1217 N THR A 76 0.771 -12.031 5.540 1.00 0.00 N ATOM 1218 CA THR A 76 -0.597 -11.961 6.036 1.00 0.00 C ATOM 1219 C THR A 76 -1.051 -10.515 6.195 1.00 0.00 C ATOM 1220 O THR A 76 -0.263 -9.645 6.568 1.00 0.00 O ATOM 1221 CB THR A 76 -0.742 -12.684 7.388 1.00 0.00 C ATOM 1222 OG1 THR A 76 -0.300 -14.041 7.269 1.00 0.00 O ATOM 1223 CG2 THR A 76 -2.186 -12.656 7.865 1.00 0.00 C ATOM 0 H THR A 76 1.484 -12.035 6.269 1.00 0.00 H new ATOM 0 HA THR A 76 -1.226 -12.457 5.297 1.00 0.00 H new ATOM 0 HB THR A 76 -0.124 -12.164 8.120 1.00 0.00 H new ATOM 0 HG1 THR A 76 -0.394 -14.493 8.134 1.00 0.00 H new ATOM 0 HG21 THR A 76 -2.263 -13.173 8.822 1.00 0.00 H new ATOM 0 HG22 THR A 76 -2.510 -11.622 7.984 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.821 -13.153 7.132 1.00 0.00 H new ATOM 1231 N ILE A 77 -2.324 -10.264 5.909 1.00 0.00 N ATOM 1232 CA ILE A 77 -2.882 -8.923 6.023 1.00 0.00 C ATOM 1233 C ILE A 77 -4.158 -8.927 6.858 1.00 0.00 C ATOM 1234 O ILE A 77 -4.896 -9.912 6.878 1.00 0.00 O ATOM 1235 CB ILE A 77 -3.190 -8.322 4.638 1.00 0.00 C ATOM 1236 CG1 ILE A 77 -4.091 -9.265 3.838 1.00 0.00 C ATOM 1237 CG2 ILE A 77 -1.900 -8.046 3.882 1.00 0.00 C ATOM 1238 CD1 ILE A 77 -4.812 -8.587 2.695 1.00 0.00 C ATOM 0 H ILE A 77 -2.988 -10.972 5.597 1.00 0.00 H new ATOM 0 HA ILE A 77 -2.129 -8.309 6.518 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.716 -7.378 4.777 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.488 -10.082 3.443 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.827 -9.708 4.509 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.134 -7.622 2.906 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.291 -7.341 4.447 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.349 -8.977 3.750 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.432 -9.316 2.173 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.442 -7.788 3.085 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.082 -8.168 2.002 1.00 0.00 H new ATOM 1250 N ARG A 78 -4.413 -7.818 7.545 1.00 0.00 N ATOM 1251 CA ARG A 78 -5.600 -7.693 8.381 1.00 0.00 C ATOM 1252 C ARG A 78 -6.638 -6.789 7.721 1.00 0.00 C ATOM 1253 O ARG A 78 -6.328 -5.675 7.301 1.00 0.00 O ATOM 1254 CB ARG A 78 -5.225 -7.137 9.756 1.00 0.00 C ATOM 1255 CG ARG A 78 -4.352 -8.074 10.575 1.00 0.00 C ATOM 1256 CD ARG A 78 -4.539 -7.849 12.067 1.00 0.00 C ATOM 1257 NE ARG A 78 -3.948 -6.588 12.508 1.00 0.00 N ATOM 1258 CZ ARG A 78 -4.031 -6.133 13.753 1.00 0.00 C ATOM 1259 NH1 ARG A 78 -4.676 -6.833 14.676 1.00 0.00 N ATOM 1260 NH2 ARG A 78 -3.468 -4.977 14.078 1.00 0.00 N ATOM 0 H ARG A 78 -3.813 -6.993 7.539 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.033 -8.686 8.503 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -4.703 -6.189 9.625 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -6.137 -6.924 10.313 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.595 -9.108 10.329 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -3.305 -7.921 10.311 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -5.603 -7.853 12.304 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -4.087 -8.674 12.618 1.00 0.00 H new ATOM 0 HE ARG A 78 -3.444 -6.026 11.822 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -5.110 -7.723 14.431 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -4.738 -6.482 15.632 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -2.970 -4.436 13.371 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -3.533 -4.629 15.035 1.00 0.00 H new ATOM 1274 N VAL A 79 -7.870 -7.278 7.634 1.00 0.00 N ATOM 1275 CA VAL A 79 -8.954 -6.516 7.026 1.00 0.00 C ATOM 1276 C VAL A 79 -10.125 -6.360 7.990 1.00 0.00 C ATOM 1277 O VAL A 79 -10.525 -7.314 8.655 1.00 0.00 O ATOM 1278 CB VAL A 79 -9.455 -7.185 5.732 1.00 0.00 C ATOM 1279 CG1 VAL A 79 -10.622 -6.407 5.145 1.00 0.00 C ATOM 1280 CG2 VAL A 79 -8.323 -7.306 4.723 1.00 0.00 C ATOM 0 H VAL A 79 -8.143 -8.199 7.977 1.00 0.00 H new ATOM 0 HA VAL A 79 -8.551 -5.532 6.785 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.805 -8.189 5.974 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -10.962 -6.895 4.232 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.439 -6.377 5.866 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.303 -5.390 4.916 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.694 -7.781 3.815 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -7.941 -6.313 4.484 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.521 -7.911 5.147 1.00 0.00 H new ATOM 1290 N ASN A 80 -10.670 -5.150 8.060 1.00 0.00 N ATOM 1291 CA ASN A 80 -11.795 -4.868 8.943 1.00 0.00 C ATOM 1292 C ASN A 80 -12.323 -3.454 8.718 1.00 0.00 C ATOM 1293 O ASN A 80 -11.647 -2.615 8.121 1.00 0.00 O ATOM 1294 CB ASN A 80 -11.379 -5.042 10.405 1.00 0.00 C ATOM 1295 CG ASN A 80 -12.571 -5.174 11.333 1.00 0.00 C ATOM 1296 OD1 ASN A 80 -13.300 -6.165 11.288 1.00 0.00 O ATOM 1297 ND2 ASN A 80 -12.774 -4.173 12.181 1.00 0.00 N ATOM 0 H ASN A 80 -10.350 -4.349 7.515 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.592 -5.575 8.712 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.750 -5.927 10.498 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.775 -4.188 10.712 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -13.560 -4.206 12.830 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -12.144 -3.371 12.183 1.00 0.00 H new ATOM 1304 N LEU A 81 -13.534 -3.197 9.200 1.00 0.00 N ATOM 1305 CA LEU A 81 -14.153 -1.885 9.052 1.00 0.00 C ATOM 1306 C LEU A 81 -13.212 -0.782 9.527 1.00 0.00 C ATOM 1307 O LEU A 81 -12.485 -0.951 10.505 1.00 0.00 O ATOM 1308 CB LEU A 81 -15.464 -1.826 9.839 1.00 0.00 C ATOM 1309 CG LEU A 81 -16.680 -2.463 9.165 1.00 0.00 C ATOM 1310 CD1 LEU A 81 -17.846 -2.546 10.138 1.00 0.00 C ATOM 1311 CD2 LEU A 81 -17.074 -1.677 7.923 1.00 0.00 C ATOM 0 H LEU A 81 -14.106 -3.880 9.696 1.00 0.00 H new ATOM 0 HA LEU A 81 -14.364 -1.727 7.994 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.309 -2.314 10.801 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -15.694 -0.781 10.045 1.00 0.00 H new ATOM 0 HG LEU A 81 -16.414 -3.475 8.860 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -18.703 -3.002 9.641 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -17.560 -3.152 10.998 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -18.112 -1.544 10.473 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -17.941 -2.145 7.456 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -17.321 -0.653 8.204 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -16.243 -1.669 7.218 1.00 0.00 H new ATOM 1323 N ALA A 82 -13.234 0.348 8.828 1.00 0.00 N ATOM 1324 CA ALA A 82 -12.386 1.480 9.181 1.00 0.00 C ATOM 1325 C ALA A 82 -12.683 1.970 10.594 1.00 0.00 C ATOM 1326 O ALA A 82 -13.838 2.001 11.021 1.00 0.00 O ATOM 1327 CB ALA A 82 -12.570 2.610 8.179 1.00 0.00 C ATOM 0 H ALA A 82 -13.829 0.504 8.015 1.00 0.00 H new ATOM 0 HA ALA A 82 -11.348 1.148 9.151 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -11.931 3.449 8.455 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.300 2.260 7.183 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.611 2.932 8.181 1.00 0.00 H new ATOM 1333 N LYS A 83 -11.635 2.351 11.316 1.00 0.00 N ATOM 1334 CA LYS A 83 -11.783 2.841 12.682 1.00 0.00 C ATOM 1335 C LYS A 83 -12.351 4.256 12.694 1.00 0.00 C ATOM 1336 O LYS A 83 -12.178 5.028 11.751 1.00 0.00 O ATOM 1337 CB LYS A 83 -10.434 2.814 13.404 1.00 0.00 C ATOM 1338 CG LYS A 83 -9.496 3.931 12.980 1.00 0.00 C ATOM 1339 CD LYS A 83 -8.486 4.254 14.068 1.00 0.00 C ATOM 1340 CE LYS A 83 -7.367 3.225 14.113 1.00 0.00 C ATOM 1341 NZ LYS A 83 -7.722 2.056 14.965 1.00 0.00 N ATOM 0 H LYS A 83 -10.673 2.330 10.978 1.00 0.00 H new ATOM 0 HA LYS A 83 -12.480 2.185 13.204 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.605 2.882 14.478 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -9.951 1.855 13.218 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -8.971 3.641 12.070 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.075 4.824 12.743 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -8.065 5.244 13.892 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -8.989 4.288 15.034 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -7.147 2.884 13.102 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -6.460 3.692 14.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -6.871 1.710 15.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -8.432 2.342 15.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -8.112 1.298 14.369 1.00 0.00 H new ATOM 1355 N PRO A 84 -13.044 4.607 13.787 1.00 0.00 N ATOM 1356 CA PRO A 84 -13.650 5.933 13.949 1.00 0.00 C ATOM 1357 C PRO A 84 -12.605 7.027 14.140 1.00 0.00 C ATOM 1358 O PRO A 84 -12.053 7.188 15.227 1.00 0.00 O ATOM 1359 CB PRO A 84 -14.502 5.781 15.211 1.00 0.00 C ATOM 1360 CG PRO A 84 -13.854 4.680 15.977 1.00 0.00 C ATOM 1361 CD PRO A 84 -13.290 3.738 14.950 1.00 0.00 C ATOM 0 HA PRO A 84 -14.218 6.233 13.068 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -14.523 6.705 15.788 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -15.535 5.536 14.964 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -13.068 5.066 16.626 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -14.576 4.173 16.617 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -12.372 3.265 15.300 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -13.990 2.937 14.712 1.00 0.00 H new ATOM 1369 N MET A 85 -12.341 7.778 13.075 1.00 0.00 N ATOM 1370 CA MET A 85 -11.364 8.859 13.127 1.00 0.00 C ATOM 1371 C MET A 85 -11.787 9.927 14.132 1.00 0.00 C ATOM 1372 O MET A 85 -12.969 10.059 14.449 1.00 0.00 O ATOM 1373 CB MET A 85 -11.190 9.486 11.742 1.00 0.00 C ATOM 1374 CG MET A 85 -12.505 9.833 11.063 1.00 0.00 C ATOM 1375 SD MET A 85 -12.337 11.173 9.869 1.00 0.00 S ATOM 1376 CE MET A 85 -12.271 12.592 10.959 1.00 0.00 C ATOM 0 H MET A 85 -12.790 7.658 12.167 1.00 0.00 H new ATOM 0 HA MET A 85 -10.412 8.438 13.450 1.00 0.00 H new ATOM 0 HB2 MET A 85 -10.588 10.390 11.834 1.00 0.00 H new ATOM 0 HB3 MET A 85 -10.634 8.796 11.107 1.00 0.00 H new ATOM 0 HG2 MET A 85 -12.893 8.948 10.558 1.00 0.00 H new ATOM 0 HG3 MET A 85 -13.237 10.115 11.820 1.00 0.00 H new ATOM 0 HE1 MET A 85 -12.311 13.507 10.368 1.00 0.00 H new ATOM 0 HE2 MET A 85 -13.119 12.565 11.643 1.00 0.00 H new ATOM 0 HE3 MET A 85 -11.343 12.569 11.530 1.00 0.00 H new ATOM 1386 N ARG A 86 -10.814 10.685 14.627 1.00 0.00 N ATOM 1387 CA ARG A 86 -11.087 11.740 15.597 1.00 0.00 C ATOM 1388 C ARG A 86 -10.555 13.082 15.103 1.00 0.00 C ATOM 1389 O ARG A 86 -9.602 13.135 14.325 1.00 0.00 O ATOM 1390 CB ARG A 86 -10.457 11.395 16.947 1.00 0.00 C ATOM 1391 CG ARG A 86 -11.316 10.477 17.803 1.00 0.00 C ATOM 1392 CD ARG A 86 -12.397 11.253 18.539 1.00 0.00 C ATOM 1393 NE ARG A 86 -11.905 11.828 19.788 1.00 0.00 N ATOM 1394 CZ ARG A 86 -12.697 12.219 20.780 1.00 0.00 C ATOM 1395 NH1 ARG A 86 -14.013 12.096 20.669 1.00 0.00 N ATOM 1396 NH2 ARG A 86 -12.174 12.733 21.885 1.00 0.00 N ATOM 0 H ARG A 86 -9.831 10.589 14.373 1.00 0.00 H new ATOM 0 HA ARG A 86 -12.167 11.819 15.718 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -9.491 10.920 16.777 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -10.267 12.317 17.496 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.777 9.716 17.173 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -10.686 9.955 18.524 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.772 12.050 17.897 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.237 10.592 18.751 1.00 0.00 H new ATOM 0 HE ARG A 86 -10.897 11.935 19.905 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -14.419 11.701 19.821 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -14.619 12.397 21.432 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -11.162 12.828 21.974 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.783 13.033 22.646 1.00 0.00 H new ATOM 1410 N ILE A 87 -11.177 14.163 15.560 1.00 0.00 N ATOM 1411 CA ILE A 87 -10.766 15.505 15.166 1.00 0.00 C ATOM 1412 C ILE A 87 -10.378 16.340 16.381 1.00 0.00 C ATOM 1413 O ILE A 87 -10.934 16.174 17.467 1.00 0.00 O ATOM 1414 CB ILE A 87 -11.882 16.231 14.393 1.00 0.00 C ATOM 1415 CG1 ILE A 87 -13.130 16.373 15.268 1.00 0.00 C ATOM 1416 CG2 ILE A 87 -12.211 15.484 13.109 1.00 0.00 C ATOM 1417 CD1 ILE A 87 -14.039 17.505 14.845 1.00 0.00 C ATOM 0 H ILE A 87 -11.968 14.136 16.204 1.00 0.00 H new ATOM 0 HA ILE A 87 -9.899 15.391 14.515 1.00 0.00 H new ATOM 0 HB ILE A 87 -11.530 17.229 14.129 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -13.691 15.439 15.242 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -12.823 16.531 16.302 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -13.002 16.010 12.574 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -11.322 15.431 12.481 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -12.546 14.475 13.351 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -14.902 17.546 15.509 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -13.495 18.448 14.898 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -14.376 17.338 13.822 1.00 0.00 H new ATOM 1429 N LYS A 88 -9.420 17.242 16.191 1.00 0.00 N ATOM 1430 CA LYS A 88 -8.958 18.107 17.270 1.00 0.00 C ATOM 1431 C LYS A 88 -9.358 19.557 17.014 1.00 0.00 C ATOM 1432 O LYS A 88 -9.404 20.369 17.937 1.00 0.00 O ATOM 1433 CB LYS A 88 -7.439 18.005 17.418 1.00 0.00 C ATOM 1434 CG LYS A 88 -6.878 18.858 18.543 1.00 0.00 C ATOM 1435 CD LYS A 88 -7.126 18.222 19.901 1.00 0.00 C ATOM 1436 CE LYS A 88 -7.004 19.241 21.024 1.00 0.00 C ATOM 1437 NZ LYS A 88 -7.233 18.625 22.360 1.00 0.00 N ATOM 0 H LYS A 88 -8.949 17.393 15.299 1.00 0.00 H new ATOM 0 HA LYS A 88 -9.430 17.776 18.195 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -7.169 16.964 17.594 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -6.970 18.302 16.480 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -5.807 18.998 18.396 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -7.336 19.847 18.514 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -8.121 17.776 19.919 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -6.412 17.414 20.062 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -6.013 19.693 20.998 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -7.725 20.043 20.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -7.141 19.352 23.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -8.188 18.216 22.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -6.530 17.876 22.522 1.00 0.00 H new ATOM 1451 N GLU A 89 -9.648 19.872 15.755 1.00 0.00 N ATOM 1452 CA GLU A 89 -10.045 21.224 15.380 1.00 0.00 C ATOM 1453 C GLU A 89 -11.557 21.316 15.194 1.00 0.00 C ATOM 1454 O GLU A 89 -12.174 20.434 14.596 1.00 0.00 O ATOM 1455 CB GLU A 89 -9.335 21.649 14.092 1.00 0.00 C ATOM 1456 CG GLU A 89 -7.885 22.051 14.301 1.00 0.00 C ATOM 1457 CD GLU A 89 -7.025 21.784 13.081 1.00 0.00 C ATOM 1458 OE1 GLU A 89 -7.117 22.560 12.107 1.00 0.00 O ATOM 1459 OE2 GLU A 89 -6.258 20.798 13.101 1.00 0.00 O ATOM 0 H GLU A 89 -9.615 19.211 14.979 1.00 0.00 H new ATOM 0 HA GLU A 89 -9.754 21.897 16.186 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -9.376 20.828 13.376 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.875 22.486 13.648 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.838 23.111 14.549 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.480 21.506 15.153 1.00 0.00 H new ATOM 1466 N SER A 90 -12.147 22.389 15.711 1.00 0.00 N ATOM 1467 CA SER A 90 -13.586 22.594 15.607 1.00 0.00 C ATOM 1468 C SER A 90 -13.898 23.920 14.919 1.00 0.00 C ATOM 1469 O SER A 90 -14.638 23.964 13.938 1.00 0.00 O ATOM 1470 CB SER A 90 -14.229 22.564 16.995 1.00 0.00 C ATOM 1471 OG SER A 90 -15.636 22.419 16.903 1.00 0.00 O ATOM 0 H SER A 90 -11.650 23.130 16.206 1.00 0.00 H new ATOM 0 HA SER A 90 -14.000 21.785 15.005 1.00 0.00 H new ATOM 0 HB2 SER A 90 -13.813 21.740 17.574 1.00 0.00 H new ATOM 0 HB3 SER A 90 -13.989 23.483 17.530 1.00 0.00 H new ATOM 0 HG SER A 90 -16.023 22.401 17.803 1.00 0.00 H new ATOM 1477 N GLY A 91 -13.325 25.000 15.442 1.00 0.00 N ATOM 1478 CA GLY A 91 -13.552 26.313 14.867 1.00 0.00 C ATOM 1479 C GLY A 91 -14.847 26.939 15.346 1.00 0.00 C ATOM 1480 O GLY A 91 -15.941 26.524 14.965 1.00 0.00 O ATOM 0 H GLY A 91 -12.708 24.989 16.254 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -12.719 26.968 15.123 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -13.571 26.232 13.780 1.00 0.00 H new ATOM 1484 N PRO A 92 -14.731 27.964 16.204 1.00 0.00 N ATOM 1485 CA PRO A 92 -15.891 28.670 16.755 1.00 0.00 C ATOM 1486 C PRO A 92 -16.615 29.504 15.704 1.00 0.00 C ATOM 1487 O PRO A 92 -16.044 29.849 14.670 1.00 0.00 O ATOM 1488 CB PRO A 92 -15.279 29.575 17.828 1.00 0.00 C ATOM 1489 CG PRO A 92 -13.871 29.785 17.388 1.00 0.00 C ATOM 1490 CD PRO A 92 -13.458 28.512 16.701 1.00 0.00 C ATOM 0 HA PRO A 92 -16.643 27.981 17.138 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -15.816 30.521 17.902 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -15.321 29.107 18.812 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -13.796 30.636 16.711 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -13.224 29.997 18.239 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -12.758 28.703 15.888 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -12.966 27.825 17.390 1.00 0.00 H new ATOM 1498 N SER A 93 -17.876 29.826 15.976 1.00 0.00 N ATOM 1499 CA SER A 93 -18.679 30.617 15.052 1.00 0.00 C ATOM 1500 C SER A 93 -19.382 31.758 15.782 1.00 0.00 C ATOM 1501 O SER A 93 -20.082 31.539 16.770 1.00 0.00 O ATOM 1502 CB SER A 93 -19.712 29.731 14.353 1.00 0.00 C ATOM 1503 OG SER A 93 -20.760 29.374 15.238 1.00 0.00 O ATOM 0 H SER A 93 -18.363 29.551 16.829 1.00 0.00 H new ATOM 0 HA SER A 93 -18.011 31.044 14.304 1.00 0.00 H new ATOM 0 HB2 SER A 93 -20.123 30.257 13.491 1.00 0.00 H new ATOM 0 HB3 SER A 93 -19.228 28.830 13.976 1.00 0.00 H new ATOM 0 HG SER A 93 -20.774 29.995 15.996 1.00 0.00 H new ATOM 1509 N SER A 94 -19.188 32.977 15.288 1.00 0.00 N ATOM 1510 CA SER A 94 -19.799 34.154 15.895 1.00 0.00 C ATOM 1511 C SER A 94 -20.808 34.793 14.945 1.00 0.00 C ATOM 1512 O SER A 94 -21.994 34.890 15.255 1.00 0.00 O ATOM 1513 CB SER A 94 -18.724 35.173 16.276 1.00 0.00 C ATOM 1514 OG SER A 94 -17.872 34.661 17.286 1.00 0.00 O ATOM 0 H SER A 94 -18.613 33.175 14.469 1.00 0.00 H new ATOM 0 HA SER A 94 -20.325 33.837 16.796 1.00 0.00 H new ATOM 0 HB2 SER A 94 -18.135 35.432 15.396 1.00 0.00 H new ATOM 0 HB3 SER A 94 -19.196 36.091 16.625 1.00 0.00 H new ATOM 0 HG SER A 94 -17.192 35.330 17.511 1.00 0.00 H new ATOM 1520 N GLY A 95 -20.326 35.228 13.785 1.00 0.00 N ATOM 1521 CA GLY A 95 -21.197 35.853 12.807 1.00 0.00 C ATOM 1522 C GLY A 95 -20.652 37.176 12.306 1.00 0.00 C ATOM 1523 O GLY A 95 -21.238 38.229 12.555 1.00 0.00 O ATOM 0 H GLY A 95 -19.348 35.159 13.505 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -21.334 35.177 11.963 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -22.180 36.013 13.250 1.00 0.00 H new TER 1527 GLY A 95