USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 933 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: C 13 ASN : amide:sc= 1.03 K(o=1,f=-1.1) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc=-0.00925 USER MOD Set 2.1: A 13 ASN : amide:sc= -0.104 K(o=-0.11,f=0.4) USER MOD Set 2.2: A 19 THR OG1 : rot 180:sc= -0.0016 USER MOD Set 3.1: A 11 SER OG : rot 180:sc= 0.39 USER MOD Set 3.2: A 21 THR OG1 : rot -71:sc= 0.427 USER MOD Single : A 1 MET CE :methyl 172:sc= -0.041 (180deg=-0.146) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 173:sc= 0.893 (180deg=0.69) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 29 GLN : amide:sc= -0.0105 X(o=-0.011,f=0) USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.886 X(o=-0.89,f=-0.5) USER MOD Single : A 48 TYR OH : rot 168:sc= 0.256 USER MOD Single : A 49 GLN : amide:sc= 0.686 K(o=0.69,f=0) USER MOD Single : A 52 GLN : amide:sc= -3.02! K(o=-3!,f=-1.5) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl -177:sc= -0.827 (180deg=-0.847) USER MOD Single : C 1 MET N :NH3+ 139:sc= 0.00772 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 SER OG : rot 180:sc= -0.218 USER MOD Single : C 21 THR OG1 : rot 180:sc= -0.0061 USER MOD Single : C 26 SER OG : rot 9:sc= 0.163 USER MOD Single : C 28 GLN : amide:sc= -0.319 X(o=-0.32,f=0) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 35 ASN : amide:sc= -0.0469 K(o=-0.047,f=-1.9!) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HD1:sc= -1.15 X(o=-1.1,f=-1) USER MOD Single : C 48 TYR OH : rot 25:sc= 0.451 USER MOD Single : C 49 GLN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : C 52 GLN : amide:sc= -3.8! K(o=-3.8!,f=-1.6) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.787 -7.876 -10.813 1.00 0.00 N ATOM 2 CA MET A 1 4.216 -6.935 -9.829 1.00 0.00 C ATOM 3 C MET A 1 2.898 -7.476 -9.288 1.00 0.00 C ATOM 4 O MET A 1 2.059 -7.923 -10.066 1.00 0.00 O ATOM 5 CB MET A 1 4.004 -5.565 -10.475 1.00 0.00 C ATOM 6 CG MET A 1 3.867 -4.489 -9.398 1.00 0.00 C ATOM 7 SD MET A 1 3.808 -2.789 -10.026 1.00 0.00 S ATOM 8 CE MET A 1 2.242 -2.858 -10.922 1.00 0.00 C ATOM 0 H1 MET A 1 5.685 -7.497 -11.175 1.00 0.00 H new ATOM 0 H2 MET A 1 4.958 -8.795 -10.356 1.00 0.00 H new ATOM 0 H3 MET A 1 4.121 -8.000 -11.602 1.00 0.00 H new ATOM 0 HA MET A 1 4.914 -6.826 -8.999 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.843 -5.330 -11.130 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.109 -5.583 -11.097 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.960 -4.682 -8.825 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.705 -4.577 -8.707 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.970 -1.857 -11.258 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.346 -3.515 -11.786 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.463 -3.244 -10.264 1.00 0.00 H new ATOM 20 N LEU A 2 2.713 -7.442 -7.966 1.00 0.00 N ATOM 21 CA LEU A 2 1.495 -7.930 -7.330 1.00 0.00 C ATOM 22 C LEU A 2 0.443 -6.816 -7.336 1.00 0.00 C ATOM 23 O LEU A 2 0.761 -5.677 -7.001 1.00 0.00 O ATOM 24 CB LEU A 2 1.850 -8.342 -5.892 1.00 0.00 C ATOM 25 CG LEU A 2 0.947 -9.414 -5.257 1.00 0.00 C ATOM 26 CD1 LEU A 2 1.051 -9.317 -3.738 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.520 -9.328 -5.646 1.00 0.00 C ATOM 0 H LEU A 2 3.404 -7.076 -7.311 1.00 0.00 H new ATOM 0 HA LEU A 2 1.085 -8.787 -7.865 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.877 -8.708 -5.883 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.823 -7.452 -5.263 1.00 0.00 H new ATOM 0 HG LEU A 2 1.309 -10.368 -5.639 1.00 0.00 H new ATOM 0 HD11 LEU A 2 0.414 -10.074 -3.281 1.00 0.00 H new ATOM 0 HD12 LEU A 2 2.085 -9.480 -3.433 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.729 -8.327 -3.414 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.075 -10.124 -5.149 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -0.921 -8.361 -5.342 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.617 -9.437 -6.726 1.00 0.00 H new ATOM 39 N ILE A 3 -0.802 -7.126 -7.709 1.00 0.00 N ATOM 40 CA ILE A 3 -1.907 -6.177 -7.678 1.00 0.00 C ATOM 41 C ILE A 3 -2.993 -6.724 -6.765 1.00 0.00 C ATOM 42 O ILE A 3 -3.165 -7.934 -6.652 1.00 0.00 O ATOM 43 CB ILE A 3 -2.473 -5.919 -9.089 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.575 -4.993 -9.909 1.00 0.00 C ATOM 45 CG2 ILE A 3 -3.832 -5.217 -9.022 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.365 -5.696 -10.499 1.00 0.00 C ATOM 0 H ILE A 3 -1.069 -8.052 -8.043 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.542 -5.223 -7.298 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.546 -6.903 -9.552 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.160 -4.553 -10.716 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.237 -4.172 -9.276 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.205 -5.049 -10.032 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.538 -5.842 -8.474 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.722 -4.260 -8.512 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.229 -4.981 -11.069 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.241 -6.113 -9.695 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.696 -6.499 -11.158 1.00 0.00 H new ATOM 58 N LEU A 4 -3.727 -5.819 -6.116 1.00 0.00 N ATOM 59 CA LEU A 4 -4.846 -6.160 -5.263 1.00 0.00 C ATOM 60 C LEU A 4 -5.937 -5.115 -5.456 1.00 0.00 C ATOM 61 O LEU A 4 -5.705 -4.055 -6.040 1.00 0.00 O ATOM 62 CB LEU A 4 -4.397 -6.205 -3.796 1.00 0.00 C ATOM 63 CG LEU A 4 -3.398 -7.331 -3.500 1.00 0.00 C ATOM 64 CD1 LEU A 4 -2.932 -7.239 -2.050 1.00 0.00 C ATOM 65 CD2 LEU A 4 -4.029 -8.712 -3.677 1.00 0.00 C ATOM 0 H LEU A 4 -3.551 -4.816 -6.175 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.231 -7.145 -5.528 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.944 -5.249 -3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.273 -6.329 -3.159 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.571 -7.212 -4.200 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.223 -8.041 -1.844 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.450 -6.276 -1.883 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.790 -7.335 -1.385 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.288 -9.481 -3.458 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.873 -8.816 -2.995 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.376 -8.825 -4.704 1.00 0.00 H new ATOM 77 N THR A 5 -7.134 -5.417 -4.956 1.00 0.00 N ATOM 78 CA THR A 5 -8.260 -4.501 -5.006 1.00 0.00 C ATOM 79 C THR A 5 -8.740 -4.311 -3.580 1.00 0.00 C ATOM 80 O THR A 5 -8.789 -5.263 -2.799 1.00 0.00 O ATOM 81 CB THR A 5 -9.350 -5.054 -5.926 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.838 -5.139 -7.236 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.585 -4.158 -5.960 1.00 0.00 C ATOM 0 H THR A 5 -7.345 -6.307 -4.505 1.00 0.00 H new ATOM 0 HA THR A 5 -7.977 -3.534 -5.422 1.00 0.00 H new ATOM 0 HB THR A 5 -9.643 -6.031 -5.541 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.528 -5.494 -7.834 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.331 -4.592 -6.626 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.001 -4.073 -4.956 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.307 -3.168 -6.322 1.00 0.00 H new ATOM 91 N ARG A 6 -9.094 -3.071 -3.239 1.00 0.00 N ATOM 92 CA ARG A 6 -9.401 -2.693 -1.871 1.00 0.00 C ATOM 93 C ARG A 6 -10.539 -1.678 -1.872 1.00 0.00 C ATOM 94 O ARG A 6 -10.909 -1.174 -2.931 1.00 0.00 O ATOM 95 CB ARG A 6 -8.115 -2.103 -1.278 1.00 0.00 C ATOM 96 CG ARG A 6 -8.060 -2.037 0.250 1.00 0.00 C ATOM 97 CD ARG A 6 -7.856 -3.414 0.889 1.00 0.00 C ATOM 98 NE ARG A 6 -9.073 -4.228 0.844 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.129 -5.537 0.591 1.00 0.00 C ATOM 100 NH1 ARG A 6 -8.025 -6.242 0.354 1.00 0.00 N ATOM 101 NH2 ARG A 6 -10.310 -6.141 0.574 1.00 0.00 N ATOM 0 H ARG A 6 -9.174 -2.305 -3.908 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.728 -3.543 -1.272 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -7.270 -2.695 -1.629 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -7.984 -1.095 -1.672 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.248 -1.375 0.553 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -8.985 -1.599 0.625 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -7.051 -3.937 0.373 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -7.542 -3.289 1.925 1.00 0.00 H new ATOM 0 HE ARG A 6 -9.957 -3.751 1.022 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -7.114 -5.782 0.364 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -8.090 -7.242 0.163 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.159 -5.605 0.753 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -10.369 -7.141 0.382 1.00 0.00 H new ATOM 115 N LYS A 7 -11.094 -1.369 -0.699 1.00 0.00 N ATOM 116 CA LYS A 7 -12.148 -0.374 -0.574 1.00 0.00 C ATOM 117 C LYS A 7 -11.870 0.526 0.620 1.00 0.00 C ATOM 118 O LYS A 7 -11.157 0.134 1.542 1.00 0.00 O ATOM 119 CB LYS A 7 -13.522 -1.041 -0.451 1.00 0.00 C ATOM 120 CG LYS A 7 -13.862 -1.868 -1.692 1.00 0.00 C ATOM 121 CD LYS A 7 -13.385 -3.322 -1.651 1.00 0.00 C ATOM 122 CE LYS A 7 -14.502 -4.271 -1.209 1.00 0.00 C ATOM 123 NZ LYS A 7 -14.970 -3.992 0.161 1.00 0.00 N ATOM 0 H LYS A 7 -10.824 -1.802 0.184 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.160 0.237 -1.477 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.537 -1.683 0.430 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.285 -0.277 -0.302 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.943 -1.860 -1.831 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.425 -1.382 -2.565 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -13.027 -3.616 -2.638 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -12.541 -3.409 -0.967 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -15.341 -4.187 -1.900 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -14.144 -5.299 -1.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.802 -4.580 0.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -14.212 -4.212 0.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -15.226 -2.987 0.242 1.00 0.00 H new ATOM 137 N VAL A 8 -12.439 1.729 0.598 1.00 0.00 N ATOM 138 CA VAL A 8 -12.226 2.738 1.630 1.00 0.00 C ATOM 139 C VAL A 8 -12.415 2.142 3.026 1.00 0.00 C ATOM 140 O VAL A 8 -13.491 1.647 3.356 1.00 0.00 O ATOM 141 CB VAL A 8 -13.182 3.909 1.405 1.00 0.00 C ATOM 142 CG1 VAL A 8 -13.027 4.944 2.518 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.880 4.579 0.063 1.00 0.00 C ATOM 0 H VAL A 8 -13.068 2.033 -0.146 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.200 3.099 1.563 1.00 0.00 H new ATOM 0 HB VAL A 8 -14.202 3.524 1.406 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.714 5.772 2.343 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.252 4.481 3.479 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.003 5.318 2.527 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.566 5.413 -0.090 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.854 4.948 0.063 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -13.005 3.854 -0.742 1.00 0.00 H new ATOM 153 N GLY A 9 -11.355 2.197 3.839 1.00 0.00 N ATOM 154 CA GLY A 9 -11.382 1.749 5.222 1.00 0.00 C ATOM 155 C GLY A 9 -10.648 0.421 5.422 1.00 0.00 C ATOM 156 O GLY A 9 -10.293 0.091 6.552 1.00 0.00 O ATOM 0 H GLY A 9 -10.448 2.559 3.545 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.928 2.510 5.856 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.417 1.641 5.545 1.00 0.00 H new ATOM 160 N GLU A 10 -10.417 -0.339 4.346 1.00 0.00 N ATOM 161 CA GLU A 10 -9.734 -1.623 4.437 1.00 0.00 C ATOM 162 C GLU A 10 -8.213 -1.438 4.382 1.00 0.00 C ATOM 163 O GLU A 10 -7.721 -0.318 4.249 1.00 0.00 O ATOM 164 CB GLU A 10 -10.238 -2.535 3.319 1.00 0.00 C ATOM 165 CG GLU A 10 -11.750 -2.756 3.453 1.00 0.00 C ATOM 166 CD GLU A 10 -12.320 -3.591 2.305 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.664 -3.658 1.243 1.00 0.00 O ATOM 168 OE2 GLU A 10 -13.416 -4.163 2.495 1.00 0.00 O ATOM 0 H GLU A 10 -10.697 -0.081 3.400 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.958 -2.091 5.396 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -10.013 -2.091 2.349 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.719 -3.492 3.360 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.959 -3.254 4.400 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.255 -1.790 3.482 1.00 0.00 H new ATOM 175 N SER A 11 -7.459 -2.540 4.490 1.00 0.00 N ATOM 176 CA SER A 11 -6.006 -2.491 4.612 1.00 0.00 C ATOM 177 C SER A 11 -5.306 -3.627 3.863 1.00 0.00 C ATOM 178 O SER A 11 -5.950 -4.541 3.355 1.00 0.00 O ATOM 179 CB SER A 11 -5.621 -2.551 6.093 1.00 0.00 C ATOM 180 OG SER A 11 -6.169 -1.459 6.801 1.00 0.00 O ATOM 0 H SER A 11 -7.843 -3.485 4.495 1.00 0.00 H new ATOM 0 HA SER A 11 -5.677 -1.556 4.160 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.975 -3.486 6.527 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.535 -2.545 6.191 1.00 0.00 H new ATOM 0 HG SER A 11 -5.911 -1.519 7.745 1.00 0.00 H new ATOM 186 N ILE A 12 -3.974 -3.544 3.807 1.00 0.00 N ATOM 187 CA ILE A 12 -3.076 -4.479 3.139 1.00 0.00 C ATOM 188 C ILE A 12 -1.853 -4.634 4.047 1.00 0.00 C ATOM 189 O ILE A 12 -1.632 -3.797 4.922 1.00 0.00 O ATOM 190 CB ILE A 12 -2.670 -3.919 1.763 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.875 -3.729 0.827 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.641 -4.812 1.061 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.552 -5.047 0.456 1.00 0.00 C ATOM 0 H ILE A 12 -3.469 -2.778 4.253 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.553 -5.444 2.971 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.225 -2.945 1.968 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.603 -3.075 1.308 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.547 -3.226 -0.083 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.383 -4.379 0.094 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.744 -4.887 1.676 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.063 -5.806 0.913 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.395 -4.849 -0.206 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.836 -5.694 -0.051 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.909 -5.540 1.360 1.00 0.00 H new ATOM 205 N ASN A 13 -1.048 -5.684 3.857 1.00 0.00 N ATOM 206 CA ASN A 13 0.096 -5.938 4.724 1.00 0.00 C ATOM 207 C ASN A 13 1.325 -6.352 3.921 1.00 0.00 C ATOM 208 O ASN A 13 1.210 -6.923 2.838 1.00 0.00 O ATOM 209 CB ASN A 13 -0.281 -7.035 5.717 1.00 0.00 C ATOM 210 CG ASN A 13 -1.254 -6.532 6.773 1.00 0.00 C ATOM 211 OD1 ASN A 13 -2.467 -6.640 6.616 1.00 0.00 O ATOM 212 ND2 ASN A 13 -0.722 -5.980 7.855 1.00 0.00 N ATOM 0 H ASN A 13 -1.171 -6.368 3.110 1.00 0.00 H new ATOM 0 HA ASN A 13 0.350 -5.020 5.254 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.728 -7.873 5.181 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.620 -7.411 6.202 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -1.326 -5.626 8.596 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.292 -5.910 7.946 1.00 0.00 H new ATOM 219 N ILE A 14 2.506 -6.056 4.471 1.00 0.00 N ATOM 220 CA ILE A 14 3.786 -6.348 3.839 1.00 0.00 C ATOM 221 C ILE A 14 4.807 -6.735 4.908 1.00 0.00 C ATOM 222 O ILE A 14 4.734 -6.275 6.049 1.00 0.00 O ATOM 223 CB ILE A 14 4.270 -5.111 3.057 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.262 -4.742 1.954 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.654 -5.366 2.445 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.711 -3.528 1.136 1.00 0.00 C ATOM 0 H ILE A 14 2.596 -5.601 5.379 1.00 0.00 H new ATOM 0 HA ILE A 14 3.671 -7.180 3.144 1.00 0.00 H new ATOM 0 HB ILE A 14 4.347 -4.276 3.754 1.00 0.00 H new ATOM 0 HG12 ILE A 14 3.127 -5.595 1.289 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.292 -4.534 2.406 1.00 0.00 H new ATOM 0 HG21 ILE A 14 5.978 -4.481 1.897 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.369 -5.583 3.239 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.600 -6.215 1.764 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.966 -3.309 0.371 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.820 -2.666 1.794 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.667 -3.744 0.659 1.00 0.00 H new ATOM 238 N GLY A 15 5.768 -7.585 4.534 1.00 0.00 N ATOM 239 CA GLY A 15 6.861 -7.974 5.410 1.00 0.00 C ATOM 240 C GLY A 15 6.351 -8.603 6.704 1.00 0.00 C ATOM 241 O GLY A 15 5.446 -9.434 6.686 1.00 0.00 O ATOM 0 H GLY A 15 5.804 -8.020 3.612 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.508 -8.682 4.892 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.468 -7.100 5.645 1.00 0.00 H new ATOM 245 N ASP A 16 6.943 -8.189 7.825 1.00 0.00 N ATOM 246 CA ASP A 16 6.593 -8.680 9.150 1.00 0.00 C ATOM 247 C ASP A 16 6.360 -7.514 10.115 1.00 0.00 C ATOM 248 O ASP A 16 6.150 -7.721 11.308 1.00 0.00 O ATOM 249 CB ASP A 16 7.702 -9.620 9.634 1.00 0.00 C ATOM 250 CG ASP A 16 7.349 -10.302 10.956 1.00 0.00 C ATOM 251 OD1 ASP A 16 6.261 -10.918 11.016 1.00 0.00 O ATOM 252 OD2 ASP A 16 8.172 -10.205 11.895 1.00 0.00 O ATOM 0 H ASP A 16 7.689 -7.493 7.834 1.00 0.00 H new ATOM 0 HA ASP A 16 5.658 -9.239 9.109 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.889 -10.379 8.875 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.627 -9.056 9.754 1.00 0.00 H new ATOM 257 N ASP A 17 6.399 -6.277 9.600 1.00 0.00 N ATOM 258 CA ASP A 17 6.271 -5.081 10.418 1.00 0.00 C ATOM 259 C ASP A 17 5.541 -3.949 9.693 1.00 0.00 C ATOM 260 O ASP A 17 5.437 -2.855 10.244 1.00 0.00 O ATOM 261 CB ASP A 17 7.670 -4.599 10.817 1.00 0.00 C ATOM 262 CG ASP A 17 8.390 -5.594 11.722 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.092 -5.588 12.939 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.234 -6.357 11.194 1.00 0.00 O ATOM 0 H ASP A 17 6.520 -6.086 8.605 1.00 0.00 H new ATOM 0 HA ASP A 17 5.679 -5.344 11.295 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.264 -4.433 9.919 1.00 0.00 H new ATOM 0 HB3 ASP A 17 7.589 -3.639 11.328 1.00 0.00 H new ATOM 269 N ILE A 18 5.034 -4.179 8.476 1.00 0.00 N ATOM 270 CA ILE A 18 4.454 -3.112 7.675 1.00 0.00 C ATOM 271 C ILE A 18 2.976 -3.370 7.397 1.00 0.00 C ATOM 272 O ILE A 18 2.563 -4.500 7.136 1.00 0.00 O ATOM 273 CB ILE A 18 5.253 -2.975 6.373 1.00 0.00 C ATOM 274 CG1 ILE A 18 6.732 -2.709 6.697 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.660 -1.857 5.512 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.595 -2.608 5.439 1.00 0.00 C ATOM 0 H ILE A 18 5.017 -5.097 8.031 1.00 0.00 H new ATOM 0 HA ILE A 18 4.510 -2.175 8.229 1.00 0.00 H new ATOM 0 HB ILE A 18 5.192 -3.904 5.806 1.00 0.00 H new ATOM 0 HG12 ILE A 18 6.816 -1.784 7.267 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.112 -3.510 7.332 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.233 -1.766 4.589 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.623 -2.093 5.274 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.702 -0.915 6.059 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.631 -2.420 5.722 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.536 -3.543 4.881 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.235 -1.790 4.815 1.00 0.00 H new ATOM 288 N THR A 19 2.180 -2.301 7.455 1.00 0.00 N ATOM 289 CA THR A 19 0.759 -2.349 7.133 1.00 0.00 C ATOM 290 C THR A 19 0.386 -1.080 6.379 1.00 0.00 C ATOM 291 O THR A 19 0.965 -0.023 6.621 1.00 0.00 O ATOM 292 CB THR A 19 -0.066 -2.469 8.421 1.00 0.00 C ATOM 293 OG1 THR A 19 0.366 -3.585 9.171 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.557 -2.623 8.130 1.00 0.00 C ATOM 0 H THR A 19 2.508 -1.375 7.728 1.00 0.00 H new ATOM 0 HA THR A 19 0.547 -3.218 6.510 1.00 0.00 H new ATOM 0 HB THR A 19 0.084 -1.549 8.986 1.00 0.00 H new ATOM 0 HG1 THR A 19 -0.165 -3.653 9.992 1.00 0.00 H new ATOM 0 HG21 THR A 19 -2.104 -2.705 9.069 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.912 -1.753 7.578 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.721 -3.522 7.535 1.00 0.00 H new ATOM 302 N ILE A 20 -0.575 -1.185 5.458 1.00 0.00 N ATOM 303 CA ILE A 20 -0.991 -0.078 4.607 1.00 0.00 C ATOM 304 C ILE A 20 -2.515 0.014 4.641 1.00 0.00 C ATOM 305 O ILE A 20 -3.185 -1.002 4.811 1.00 0.00 O ATOM 306 CB ILE A 20 -0.505 -0.323 3.166 1.00 0.00 C ATOM 307 CG1 ILE A 20 0.976 -0.731 3.089 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.728 0.932 2.317 1.00 0.00 C ATOM 309 CD1 ILE A 20 1.943 0.351 3.564 1.00 0.00 C ATOM 0 H ILE A 20 -1.088 -2.049 5.284 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.559 0.856 4.965 1.00 0.00 H new ATOM 0 HB ILE A 20 -1.091 -1.156 2.779 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.127 -1.628 3.690 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.217 -0.993 2.059 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.381 0.749 1.300 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.790 1.176 2.300 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -0.171 1.765 2.746 1.00 0.00 H new ATOM 0 HD11 ILE A 20 2.967 -0.013 3.479 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.823 1.242 2.948 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.731 0.597 4.604 1.00 0.00 H new ATOM 321 N THR A 21 -3.067 1.221 4.487 1.00 0.00 N ATOM 322 CA THR A 21 -4.504 1.434 4.598 1.00 0.00 C ATOM 323 C THR A 21 -4.978 2.446 3.559 1.00 0.00 C ATOM 324 O THR A 21 -4.212 3.315 3.145 1.00 0.00 O ATOM 325 CB THR A 21 -4.816 1.927 6.016 1.00 0.00 C ATOM 326 OG1 THR A 21 -4.374 0.969 6.953 1.00 0.00 O ATOM 327 CG2 THR A 21 -6.310 2.154 6.243 1.00 0.00 C ATOM 0 H THR A 21 -2.533 2.066 4.284 1.00 0.00 H new ATOM 0 HA THR A 21 -5.031 0.498 4.411 1.00 0.00 H new ATOM 0 HB THR A 21 -4.301 2.879 6.141 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.952 0.179 6.911 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.474 2.502 7.263 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.675 2.903 5.540 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.848 1.219 6.088 1.00 0.00 H new ATOM 335 N ILE A 22 -6.238 2.329 3.138 1.00 0.00 N ATOM 336 CA ILE A 22 -6.859 3.243 2.190 1.00 0.00 C ATOM 337 C ILE A 22 -7.894 4.082 2.938 1.00 0.00 C ATOM 338 O ILE A 22 -9.047 3.683 3.095 1.00 0.00 O ATOM 339 CB ILE A 22 -7.414 2.458 0.988 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.249 3.338 0.049 1.00 0.00 C ATOM 341 CG2 ILE A 22 -8.264 1.265 1.416 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.408 4.446 -0.582 1.00 0.00 C ATOM 0 H ILE A 22 -6.861 1.585 3.453 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.136 3.939 1.765 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.534 2.099 0.454 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.686 2.721 -0.736 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.076 3.780 0.604 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.632 0.744 0.532 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.659 0.583 2.013 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.109 1.614 2.009 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.034 5.048 -1.240 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.993 5.079 0.202 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.596 4.003 -1.159 1.00 0.00 H new ATOM 354 N LEU A 23 -7.470 5.259 3.405 1.00 0.00 N ATOM 355 CA LEU A 23 -8.311 6.115 4.228 1.00 0.00 C ATOM 356 C LEU A 23 -9.490 6.675 3.435 1.00 0.00 C ATOM 357 O LEU A 23 -10.533 6.968 4.016 1.00 0.00 O ATOM 358 CB LEU A 23 -7.475 7.273 4.780 1.00 0.00 C ATOM 359 CG LEU A 23 -6.298 6.799 5.632 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.560 8.029 6.149 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.767 5.952 6.815 1.00 0.00 C ATOM 0 H LEU A 23 -6.541 5.638 3.222 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.708 5.512 5.045 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.099 7.872 3.950 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.113 7.923 5.379 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.644 6.178 5.019 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.714 7.715 6.761 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.199 8.618 5.306 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.238 8.634 6.750 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.904 5.632 7.399 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.432 6.543 7.445 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.300 5.076 6.446 1.00 0.00 H new ATOM 373 N GLY A 24 -9.330 6.825 2.119 1.00 0.00 N ATOM 374 CA GLY A 24 -10.411 7.288 1.269 1.00 0.00 C ATOM 375 C GLY A 24 -9.952 7.639 -0.143 1.00 0.00 C ATOM 376 O GLY A 24 -8.804 7.403 -0.512 1.00 0.00 O ATOM 0 H GLY A 24 -8.459 6.631 1.625 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.178 6.516 1.214 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.873 8.165 1.723 1.00 0.00 H new ATOM 380 N VAL A 25 -10.869 8.208 -0.926 1.00 0.00 N ATOM 381 CA VAL A 25 -10.625 8.578 -2.315 1.00 0.00 C ATOM 382 C VAL A 25 -11.323 9.902 -2.611 1.00 0.00 C ATOM 383 O VAL A 25 -12.312 10.246 -1.965 1.00 0.00 O ATOM 384 CB VAL A 25 -11.112 7.442 -3.225 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.616 7.212 -3.081 1.00 0.00 C ATOM 386 CG2 VAL A 25 -10.796 7.721 -4.694 1.00 0.00 C ATOM 0 H VAL A 25 -11.813 8.426 -0.607 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.561 8.720 -2.502 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.578 6.546 -2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.925 6.401 -3.740 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.847 6.949 -2.049 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.151 8.122 -3.351 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.156 6.895 -5.307 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.288 8.643 -5.003 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.718 7.824 -4.821 1.00 0.00 H new ATOM 396 N SER A 26 -10.805 10.639 -3.594 1.00 0.00 N ATOM 397 CA SER A 26 -11.290 11.969 -3.941 1.00 0.00 C ATOM 398 C SER A 26 -11.132 12.187 -5.445 1.00 0.00 C ATOM 399 O SER A 26 -10.367 13.047 -5.882 1.00 0.00 O ATOM 400 CB SER A 26 -10.520 13.032 -3.154 1.00 0.00 C ATOM 401 OG SER A 26 -10.676 12.836 -1.762 1.00 0.00 O ATOM 0 H SER A 26 -10.029 10.323 -4.176 1.00 0.00 H new ATOM 0 HA SER A 26 -12.345 12.053 -3.680 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.463 12.990 -3.416 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.877 14.024 -3.429 1.00 0.00 H new ATOM 0 HG SER A 26 -10.175 13.524 -1.277 1.00 0.00 H new ATOM 407 N GLY A 27 -11.856 11.395 -6.241 1.00 0.00 N ATOM 408 CA GLY A 27 -11.765 11.486 -7.686 1.00 0.00 C ATOM 409 C GLY A 27 -10.459 10.855 -8.151 1.00 0.00 C ATOM 410 O GLY A 27 -10.135 9.735 -7.765 1.00 0.00 O ATOM 0 H GLY A 27 -12.508 10.688 -5.902 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.612 10.978 -8.148 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.810 12.529 -7.999 1.00 0.00 H new ATOM 414 N GLN A 28 -9.704 11.577 -8.983 1.00 0.00 N ATOM 415 CA GLN A 28 -8.415 11.104 -9.454 1.00 0.00 C ATOM 416 C GLN A 28 -7.383 11.109 -8.318 1.00 0.00 C ATOM 417 O GLN A 28 -6.280 10.593 -8.491 1.00 0.00 O ATOM 418 CB GLN A 28 -7.969 11.978 -10.633 1.00 0.00 C ATOM 419 CG GLN A 28 -6.763 11.376 -11.361 1.00 0.00 C ATOM 420 CD GLN A 28 -6.383 12.173 -12.606 1.00 0.00 C ATOM 421 OE1 GLN A 28 -7.077 13.104 -13.007 1.00 0.00 O ATOM 422 NE2 GLN A 28 -5.266 11.812 -13.234 1.00 0.00 N ATOM 0 H GLN A 28 -9.971 12.494 -9.341 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.501 10.072 -9.794 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -8.796 12.094 -11.333 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -7.716 12.975 -10.272 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -5.912 11.340 -10.681 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -6.988 10.348 -11.645 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -4.709 11.035 -12.878 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -4.967 12.313 -14.071 1.00 0.00 H new ATOM 431 N GLN A 29 -7.725 11.678 -7.153 1.00 0.00 N ATOM 432 CA GLN A 29 -6.829 11.679 -6.003 1.00 0.00 C ATOM 433 C GLN A 29 -7.210 10.560 -5.039 1.00 0.00 C ATOM 434 O GLN A 29 -8.334 10.065 -5.057 1.00 0.00 O ATOM 435 CB GLN A 29 -6.873 13.023 -5.272 1.00 0.00 C ATOM 436 CG GLN A 29 -6.458 14.185 -6.184 1.00 0.00 C ATOM 437 CD GLN A 29 -6.414 15.499 -5.411 1.00 0.00 C ATOM 438 OE1 GLN A 29 -7.126 16.442 -5.738 1.00 0.00 O ATOM 439 NE2 GLN A 29 -5.574 15.567 -4.383 1.00 0.00 N ATOM 0 H GLN A 29 -8.618 12.142 -6.989 1.00 0.00 H new ATOM 0 HA GLN A 29 -5.815 11.516 -6.367 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.881 13.199 -4.896 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.212 12.987 -4.406 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.479 13.981 -6.616 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.161 14.270 -7.013 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.998 14.761 -4.141 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.506 16.425 -3.836 1.00 0.00 H new ATOM 448 N VAL A 30 -6.254 10.171 -4.199 1.00 0.00 N ATOM 449 CA VAL A 30 -6.370 9.046 -3.282 1.00 0.00 C ATOM 450 C VAL A 30 -5.667 9.384 -1.970 1.00 0.00 C ATOM 451 O VAL A 30 -4.640 10.060 -1.976 1.00 0.00 O ATOM 452 CB VAL A 30 -5.735 7.817 -3.940 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.582 6.667 -2.952 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.591 7.339 -5.112 1.00 0.00 C ATOM 0 H VAL A 30 -5.353 10.645 -4.138 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.417 8.836 -3.063 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.748 8.117 -4.291 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.128 5.813 -3.455 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.946 6.981 -2.124 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.562 6.384 -2.569 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.127 6.465 -5.569 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.586 7.075 -4.752 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.672 8.135 -5.852 1.00 0.00 H new ATOM 464 N ARG A 31 -6.220 8.910 -0.848 1.00 0.00 N ATOM 465 CA ARG A 31 -5.704 9.194 0.487 1.00 0.00 C ATOM 466 C ARG A 31 -5.403 7.870 1.179 1.00 0.00 C ATOM 467 O ARG A 31 -6.308 7.076 1.431 1.00 0.00 O ATOM 468 CB ARG A 31 -6.753 9.999 1.265 1.00 0.00 C ATOM 469 CG ARG A 31 -6.190 11.269 1.909 1.00 0.00 C ATOM 470 CD ARG A 31 -5.170 11.012 3.021 1.00 0.00 C ATOM 471 NE ARG A 31 -4.888 12.260 3.738 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.433 12.587 4.914 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.262 11.755 5.543 1.00 0.00 N ATOM 474 NH2 ARG A 31 -5.154 13.754 5.480 1.00 0.00 N ATOM 0 H ARG A 31 -7.047 8.313 -0.846 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.788 9.782 0.436 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.565 10.272 0.590 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -7.183 9.367 2.042 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.721 11.878 1.136 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -7.016 11.852 2.317 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -5.555 10.264 3.714 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.250 10.610 2.597 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.236 12.919 3.313 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.490 10.852 5.128 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.669 12.021 6.440 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.521 14.407 5.018 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.573 13.999 6.377 1.00 0.00 H new ATOM 488 N ILE A 32 -4.130 7.637 1.486 1.00 0.00 N ATOM 489 CA ILE A 32 -3.668 6.368 2.024 1.00 0.00 C ATOM 490 C ILE A 32 -2.742 6.588 3.212 1.00 0.00 C ATOM 491 O ILE A 32 -2.144 7.653 3.359 1.00 0.00 O ATOM 492 CB ILE A 32 -2.940 5.563 0.939 1.00 0.00 C ATOM 493 CG1 ILE A 32 -1.898 6.440 0.224 1.00 0.00 C ATOM 494 CG2 ILE A 32 -3.956 4.993 -0.051 1.00 0.00 C ATOM 495 CD1 ILE A 32 -1.123 5.661 -0.842 1.00 0.00 C ATOM 0 H ILE A 32 -3.389 8.328 1.367 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.539 5.807 2.362 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.409 4.733 1.405 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.398 7.290 -0.241 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.199 6.843 0.957 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.435 4.422 -0.819 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.651 4.340 0.477 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.507 5.810 -0.517 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.399 6.321 -1.320 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.600 4.826 -0.375 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.817 5.281 -1.591 1.00 0.00 H new ATOM 507 N GLY A 33 -2.629 5.569 4.064 1.00 0.00 N ATOM 508 CA GLY A 33 -1.766 5.611 5.227 1.00 0.00 C ATOM 509 C GLY A 33 -0.739 4.493 5.145 1.00 0.00 C ATOM 510 O GLY A 33 -0.966 3.481 4.484 1.00 0.00 O ATOM 0 H GLY A 33 -3.139 4.692 3.960 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -1.263 6.576 5.284 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.359 5.507 6.136 1.00 0.00 H new ATOM 514 N ILE A 34 0.392 4.689 5.823 1.00 0.00 N ATOM 515 CA ILE A 34 1.492 3.743 5.802 1.00 0.00 C ATOM 516 C ILE A 34 1.929 3.516 7.240 1.00 0.00 C ATOM 517 O ILE A 34 2.125 4.470 7.993 1.00 0.00 O ATOM 518 CB ILE A 34 2.642 4.301 4.951 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.155 4.611 3.529 1.00 0.00 C ATOM 520 CG2 ILE A 34 3.797 3.300 4.918 1.00 0.00 C ATOM 521 CD1 ILE A 34 3.227 5.325 2.711 1.00 0.00 C ATOM 0 H ILE A 34 0.565 5.511 6.401 1.00 0.00 H new ATOM 0 HA ILE A 34 1.188 2.796 5.357 1.00 0.00 H new ATOM 0 HB ILE A 34 2.995 5.230 5.399 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.873 3.684 3.030 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.260 5.231 3.577 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.610 3.702 4.313 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.154 3.123 5.933 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.452 2.361 4.485 1.00 0.00 H new ATOM 0 HD11 ILE A 34 2.846 5.528 1.710 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.490 6.265 3.197 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.112 4.693 2.641 1.00 0.00 H new ATOM 533 N ASN A 35 2.079 2.247 7.619 1.00 0.00 N ATOM 534 CA ASN A 35 2.359 1.863 8.988 1.00 0.00 C ATOM 535 C ASN A 35 3.517 0.872 9.019 1.00 0.00 C ATOM 536 O ASN A 35 3.422 -0.218 9.576 1.00 0.00 O ATOM 537 CB ASN A 35 1.074 1.325 9.613 1.00 0.00 C ATOM 538 CG ASN A 35 1.086 1.404 11.132 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.139 1.456 11.759 1.00 0.00 O ATOM 540 ND2 ASN A 35 -0.096 1.419 11.736 1.00 0.00 N ATOM 0 H ASN A 35 2.008 1.458 6.976 1.00 0.00 H new ATOM 0 HA ASN A 35 2.678 2.718 9.585 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.224 1.889 9.230 1.00 0.00 H new ATOM 0 HB3 ASN A 35 0.932 0.288 9.308 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -0.148 1.475 12.753 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.952 1.374 11.183 1.00 0.00 H new ATOM 547 N ALA A 36 4.619 1.284 8.393 1.00 0.00 N ATOM 548 CA ALA A 36 5.903 0.617 8.472 1.00 0.00 C ATOM 549 C ALA A 36 6.632 1.161 9.701 1.00 0.00 C ATOM 550 O ALA A 36 6.296 2.245 10.180 1.00 0.00 O ATOM 551 CB ALA A 36 6.700 0.922 7.206 1.00 0.00 C ATOM 0 H ALA A 36 4.636 2.115 7.802 1.00 0.00 H new ATOM 0 HA ALA A 36 5.783 -0.463 8.557 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.668 0.424 7.257 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.152 0.562 6.335 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.850 1.998 7.121 1.00 0.00 H new ATOM 557 N PRO A 37 7.628 0.441 10.224 1.00 0.00 N ATOM 558 CA PRO A 37 8.354 0.888 11.391 1.00 0.00 C ATOM 559 C PRO A 37 9.196 2.086 10.979 1.00 0.00 C ATOM 560 O PRO A 37 9.631 2.182 9.834 1.00 0.00 O ATOM 561 CB PRO A 37 9.207 -0.309 11.817 1.00 0.00 C ATOM 562 CG PRO A 37 9.411 -1.081 10.516 1.00 0.00 C ATOM 563 CD PRO A 37 8.122 -0.829 9.742 1.00 0.00 C ATOM 0 HA PRO A 37 7.722 1.203 12.221 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.156 0.008 12.249 1.00 0.00 H new ATOM 0 HB3 PRO A 37 8.701 -0.915 12.569 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.283 -0.722 9.970 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.566 -2.144 10.701 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.308 -0.797 8.668 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.397 -1.624 9.916 1.00 0.00 H new ATOM 571 N LYS A 38 9.439 3.012 11.912 1.00 0.00 N ATOM 572 CA LYS A 38 10.237 4.191 11.613 1.00 0.00 C ATOM 573 C LYS A 38 11.706 3.806 11.404 1.00 0.00 C ATOM 574 O LYS A 38 12.543 4.661 11.119 1.00 0.00 O ATOM 575 CB LYS A 38 10.033 5.235 12.713 1.00 0.00 C ATOM 576 CG LYS A 38 8.529 5.505 12.833 1.00 0.00 C ATOM 577 CD LYS A 38 8.225 6.688 13.751 1.00 0.00 C ATOM 578 CE LYS A 38 6.707 6.781 13.934 1.00 0.00 C ATOM 579 NZ LYS A 38 6.339 7.897 14.822 1.00 0.00 N ATOM 0 H LYS A 38 9.095 2.963 12.871 1.00 0.00 H new ATOM 0 HA LYS A 38 9.909 4.642 10.677 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.433 4.874 13.661 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.567 6.154 12.471 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.117 5.701 11.843 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.031 4.614 13.215 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.716 6.556 14.715 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.612 7.611 13.320 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.230 6.914 12.963 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.331 5.845 14.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.305 7.932 14.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.775 7.756 15.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.677 8.792 14.413 1.00 0.00 H new ATOM 593 N ASP A 39 12.004 2.509 11.546 1.00 0.00 N ATOM 594 CA ASP A 39 13.312 1.941 11.275 1.00 0.00 C ATOM 595 C ASP A 39 13.527 1.725 9.774 1.00 0.00 C ATOM 596 O ASP A 39 14.654 1.455 9.358 1.00 0.00 O ATOM 597 CB ASP A 39 13.447 0.612 12.014 1.00 0.00 C ATOM 598 CG ASP A 39 13.333 0.806 13.526 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.371 1.145 14.142 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.215 0.615 14.054 1.00 0.00 O ATOM 0 H ASP A 39 11.322 1.818 11.859 1.00 0.00 H new ATOM 0 HA ASP A 39 14.071 2.641 11.624 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.673 -0.076 11.674 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.408 0.156 11.775 1.00 0.00 H new ATOM 605 N VAL A 40 12.471 1.843 8.952 1.00 0.00 N ATOM 606 CA VAL A 40 12.621 1.788 7.502 1.00 0.00 C ATOM 607 C VAL A 40 12.114 3.079 6.869 1.00 0.00 C ATOM 608 O VAL A 40 11.151 3.690 7.337 1.00 0.00 O ATOM 609 CB VAL A 40 11.920 0.565 6.894 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.458 -0.723 7.514 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.403 0.621 7.061 1.00 0.00 C ATOM 0 H VAL A 40 11.512 1.976 9.272 1.00 0.00 H new ATOM 0 HA VAL A 40 13.684 1.683 7.284 1.00 0.00 H new ATOM 0 HB VAL A 40 12.136 0.577 5.826 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.950 -1.580 7.071 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.529 -0.798 7.325 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.280 -0.711 8.589 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.955 -0.267 6.614 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.155 0.658 8.122 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.015 1.511 6.566 1.00 0.00 H new ATOM 621 N ALA A 41 12.782 3.484 5.789 1.00 0.00 N ATOM 622 CA ALA A 41 12.472 4.711 5.080 1.00 0.00 C ATOM 623 C ALA A 41 11.126 4.606 4.370 1.00 0.00 C ATOM 624 O ALA A 41 10.739 3.537 3.905 1.00 0.00 O ATOM 625 CB ALA A 41 13.580 4.993 4.072 1.00 0.00 C ATOM 0 H ALA A 41 13.558 2.961 5.384 1.00 0.00 H new ATOM 0 HA ALA A 41 12.407 5.530 5.796 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.356 5.914 3.533 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.530 5.101 4.596 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.647 4.166 3.365 1.00 0.00 H new ATOM 631 N VAL A 42 10.416 5.732 4.296 1.00 0.00 N ATOM 632 CA VAL A 42 9.130 5.829 3.628 1.00 0.00 C ATOM 633 C VAL A 42 9.032 7.206 2.989 1.00 0.00 C ATOM 634 O VAL A 42 8.980 8.207 3.699 1.00 0.00 O ATOM 635 CB VAL A 42 8.002 5.641 4.647 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.641 5.839 3.994 1.00 0.00 C ATOM 637 CG2 VAL A 42 8.044 4.244 5.271 1.00 0.00 C ATOM 0 H VAL A 42 10.728 6.612 4.706 1.00 0.00 H new ATOM 0 HA VAL A 42 9.039 5.055 2.866 1.00 0.00 H new ATOM 0 HB VAL A 42 8.150 6.389 5.426 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.857 5.700 4.738 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.578 6.847 3.584 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.513 5.112 3.192 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.231 4.142 5.990 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.933 3.493 4.489 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.998 4.101 5.779 1.00 0.00 H new ATOM 647 N HIS A 43 9.011 7.264 1.655 1.00 0.00 N ATOM 648 CA HIS A 43 8.934 8.530 0.940 1.00 0.00 C ATOM 649 C HIS A 43 8.259 8.329 -0.410 1.00 0.00 C ATOM 650 O HIS A 43 8.178 7.210 -0.912 1.00 0.00 O ATOM 651 CB HIS A 43 10.336 9.101 0.699 1.00 0.00 C ATOM 652 CG HIS A 43 11.160 9.322 1.941 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.223 10.518 2.661 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.966 8.394 2.536 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.073 10.280 3.673 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.530 9.014 3.626 1.00 0.00 N ATOM 0 H HIS A 43 9.047 6.443 1.051 1.00 0.00 H new ATOM 0 HA HIS A 43 8.356 9.224 1.550 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.878 8.424 0.038 1.00 0.00 H new ATOM 0 HB3 HIS A 43 10.239 10.051 0.173 1.00 0.00 H new ATOM 0 HD2 HIS A 43 12.128 7.376 2.214 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.352 11.005 4.423 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.182 8.589 4.285 1.00 0.00 H new ATOM 664 N ARG A 44 7.770 9.418 -1.004 1.00 0.00 N ATOM 665 CA ARG A 44 7.215 9.379 -2.345 1.00 0.00 C ATOM 666 C ARG A 44 8.335 9.171 -3.358 1.00 0.00 C ATOM 667 O ARG A 44 9.498 9.464 -3.081 1.00 0.00 O ATOM 668 CB ARG A 44 6.449 10.675 -2.602 1.00 0.00 C ATOM 669 CG ARG A 44 7.375 11.896 -2.549 1.00 0.00 C ATOM 670 CD ARG A 44 6.548 13.176 -2.595 1.00 0.00 C ATOM 671 NE ARG A 44 5.810 13.360 -1.342 1.00 0.00 N ATOM 672 CZ ARG A 44 4.918 14.331 -1.131 1.00 0.00 C ATOM 673 NH1 ARG A 44 4.599 15.198 -2.089 1.00 0.00 N ATOM 674 NH2 ARG A 44 4.334 14.436 0.059 1.00 0.00 N ATOM 0 H ARG A 44 7.750 10.340 -0.569 1.00 0.00 H new ATOM 0 HA ARG A 44 6.521 8.545 -2.448 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.966 10.626 -3.578 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.658 10.785 -1.860 1.00 0.00 H new ATOM 0 HG2 ARG A 44 7.972 11.871 -1.638 1.00 0.00 H new ATOM 0 HG3 ARG A 44 8.071 11.872 -3.387 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.201 14.031 -2.767 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.850 13.134 -3.431 1.00 0.00 H new ATOM 0 HE ARG A 44 5.989 12.704 -0.582 1.00 0.00 H new ATOM 0 HH11 ARG A 44 5.039 15.129 -3.007 1.00 0.00 H new ATOM 0 HH12 ARG A 44 3.915 15.932 -1.905 1.00 0.00 H new ATOM 0 HH21 ARG A 44 4.569 13.778 0.802 1.00 0.00 H new ATOM 0 HH22 ARG A 44 3.652 15.175 0.229 1.00 0.00 H new ATOM 688 N GLU A 45 7.990 8.670 -4.542 1.00 0.00 N ATOM 689 CA GLU A 45 8.973 8.372 -5.578 1.00 0.00 C ATOM 690 C GLU A 45 9.613 9.647 -6.119 1.00 0.00 C ATOM 691 O GLU A 45 10.797 9.664 -6.449 1.00 0.00 O ATOM 692 CB GLU A 45 8.272 7.655 -6.728 1.00 0.00 C ATOM 693 CG GLU A 45 7.980 6.206 -6.361 1.00 0.00 C ATOM 694 CD GLU A 45 9.176 5.311 -6.684 1.00 0.00 C ATOM 695 OE1 GLU A 45 10.097 5.250 -5.840 1.00 0.00 O ATOM 696 OE2 GLU A 45 9.155 4.701 -7.776 1.00 0.00 O ATOM 0 H GLU A 45 7.028 8.461 -4.808 1.00 0.00 H new ATOM 0 HA GLU A 45 9.754 7.748 -5.142 1.00 0.00 H new ATOM 0 HB2 GLU A 45 7.342 8.169 -6.970 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.897 7.690 -7.620 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.744 6.136 -5.299 1.00 0.00 H new ATOM 0 HG3 GLU A 45 7.102 5.858 -6.906 1.00 0.00 H new ATOM 703 N GLU A 46 8.817 10.714 -6.204 1.00 0.00 N ATOM 704 CA GLU A 46 9.275 12.007 -6.688 1.00 0.00 C ATOM 705 C GLU A 46 10.240 12.696 -5.716 1.00 0.00 C ATOM 706 O GLU A 46 10.680 13.811 -5.992 1.00 0.00 O ATOM 707 CB GLU A 46 8.069 12.886 -7.015 1.00 0.00 C ATOM 708 CG GLU A 46 7.220 13.148 -5.776 1.00 0.00 C ATOM 709 CD GLU A 46 5.938 13.903 -6.122 1.00 0.00 C ATOM 710 OE1 GLU A 46 6.044 14.984 -6.744 1.00 0.00 O ATOM 711 OE2 GLU A 46 4.857 13.387 -5.761 1.00 0.00 O ATOM 0 H GLU A 46 7.833 10.700 -5.937 1.00 0.00 H new ATOM 0 HA GLU A 46 9.850 11.843 -7.599 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.410 13.834 -7.432 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.461 12.402 -7.779 1.00 0.00 H new ATOM 0 HG2 GLU A 46 6.968 12.200 -5.300 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.798 13.724 -5.053 1.00 0.00 H new ATOM 718 N ILE A 47 10.572 12.053 -4.588 1.00 0.00 N ATOM 719 CA ILE A 47 11.537 12.597 -3.640 1.00 0.00 C ATOM 720 C ILE A 47 12.528 11.528 -3.194 1.00 0.00 C ATOM 721 O ILE A 47 13.668 11.859 -2.885 1.00 0.00 O ATOM 722 CB ILE A 47 10.814 13.231 -2.440 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.163 14.542 -2.891 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.766 13.505 -1.270 1.00 0.00 C ATOM 725 CD1 ILE A 47 9.662 15.362 -1.701 1.00 0.00 C ATOM 0 H ILE A 47 10.181 11.152 -4.315 1.00 0.00 H new ATOM 0 HA ILE A 47 12.107 13.380 -4.140 1.00 0.00 H new ATOM 0 HB ILE A 47 10.060 12.527 -2.087 1.00 0.00 H new ATOM 0 HG12 ILE A 47 10.883 15.129 -3.460 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.330 14.324 -3.559 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.210 13.953 -0.446 1.00 0.00 H new ATOM 0 HG22 ILE A 47 12.214 12.568 -0.939 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.551 14.189 -1.592 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.207 16.285 -2.061 1.00 0.00 H new ATOM 0 HD12 ILE A 47 8.922 14.784 -1.147 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.500 15.602 -1.046 1.00 0.00 H new ATOM 737 N TYR A 48 12.144 10.251 -3.147 1.00 0.00 N ATOM 738 CA TYR A 48 13.065 9.248 -2.641 1.00 0.00 C ATOM 739 C TYR A 48 14.300 9.159 -3.531 1.00 0.00 C ATOM 740 O TYR A 48 15.409 8.939 -3.051 1.00 0.00 O ATOM 741 CB TYR A 48 12.391 7.883 -2.582 1.00 0.00 C ATOM 742 CG TYR A 48 13.338 6.853 -2.021 1.00 0.00 C ATOM 743 CD1 TYR A 48 13.463 6.711 -0.630 1.00 0.00 C ATOM 744 CD2 TYR A 48 14.105 6.062 -2.886 1.00 0.00 C ATOM 745 CE1 TYR A 48 14.367 5.781 -0.100 1.00 0.00 C ATOM 746 CE2 TYR A 48 15.008 5.130 -2.366 1.00 0.00 C ATOM 747 CZ TYR A 48 15.132 4.971 -0.969 1.00 0.00 C ATOM 748 OH TYR A 48 15.992 4.049 -0.454 1.00 0.00 O ATOM 0 H TYR A 48 11.233 9.901 -3.443 1.00 0.00 H new ATOM 0 HA TYR A 48 13.365 9.545 -1.636 1.00 0.00 H new ATOM 0 HB2 TYR A 48 11.496 7.939 -1.963 1.00 0.00 H new ATOM 0 HB3 TYR A 48 12.070 7.586 -3.580 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.863 7.318 0.031 1.00 0.00 H new ATOM 0 HD2 TYR A 48 13.999 6.172 -3.955 1.00 0.00 H new ATOM 0 HE1 TYR A 48 14.479 5.684 0.970 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.611 4.532 -3.033 1.00 0.00 H new ATOM 0 HH TYR A 48 16.297 3.451 -1.168 1.00 0.00 H new ATOM 758 N GLN A 49 14.099 9.335 -4.838 1.00 0.00 N ATOM 759 CA GLN A 49 15.170 9.236 -5.807 1.00 0.00 C ATOM 760 C GLN A 49 16.076 10.464 -5.748 1.00 0.00 C ATOM 761 O GLN A 49 17.175 10.447 -6.302 1.00 0.00 O ATOM 762 CB GLN A 49 14.552 9.077 -7.196 1.00 0.00 C ATOM 763 CG GLN A 49 13.600 7.883 -7.197 1.00 0.00 C ATOM 764 CD GLN A 49 12.992 7.662 -8.575 1.00 0.00 C ATOM 765 OE1 GLN A 49 13.595 7.024 -9.436 1.00 0.00 O ATOM 766 NE2 GLN A 49 11.787 8.188 -8.796 1.00 0.00 N ATOM 0 H GLN A 49 13.189 9.549 -5.245 1.00 0.00 H new ATOM 0 HA GLN A 49 15.791 8.369 -5.581 1.00 0.00 H new ATOM 0 HB2 GLN A 49 14.015 9.984 -7.472 1.00 0.00 H new ATOM 0 HB3 GLN A 49 15.335 8.931 -7.940 1.00 0.00 H new ATOM 0 HG2 GLN A 49 14.137 6.987 -6.886 1.00 0.00 H new ATOM 0 HG3 GLN A 49 12.806 8.048 -6.469 1.00 0.00 H new ATOM 0 HE21 GLN A 49 11.316 8.712 -8.058 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.336 8.067 -9.703 1.00 0.00 H new ATOM 775 N ARG A 50 15.620 11.527 -5.076 1.00 0.00 N ATOM 776 CA ARG A 50 16.423 12.724 -4.879 1.00 0.00 C ATOM 777 C ARG A 50 17.159 12.649 -3.545 1.00 0.00 C ATOM 778 O ARG A 50 18.209 13.264 -3.395 1.00 0.00 O ATOM 779 CB ARG A 50 15.534 13.971 -5.001 1.00 0.00 C ATOM 780 CG ARG A 50 15.171 14.611 -3.657 1.00 0.00 C ATOM 781 CD ARG A 50 14.077 15.656 -3.857 1.00 0.00 C ATOM 782 NE ARG A 50 14.518 16.747 -4.741 1.00 0.00 N ATOM 783 CZ ARG A 50 13.952 17.062 -5.906 1.00 0.00 C ATOM 784 NH1 ARG A 50 12.898 16.393 -6.373 1.00 0.00 N ATOM 785 NH2 ARG A 50 14.444 18.069 -6.625 1.00 0.00 N ATOM 0 H ARG A 50 14.690 11.575 -4.659 1.00 0.00 H new ATOM 0 HA ARG A 50 17.185 12.795 -5.655 1.00 0.00 H new ATOM 0 HB2 ARG A 50 16.045 14.710 -5.618 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.616 13.701 -5.523 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.831 13.845 -2.960 1.00 0.00 H new ATOM 0 HG3 ARG A 50 16.053 15.075 -3.216 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.193 15.180 -4.281 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.786 16.067 -2.890 1.00 0.00 H new ATOM 0 HE ARG A 50 15.317 17.304 -4.439 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.506 15.620 -5.836 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.484 16.654 -7.268 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.249 18.594 -6.283 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.016 18.315 -7.517 1.00 0.00 H new ATOM 799 N ILE A 51 16.613 11.899 -2.580 1.00 0.00 N ATOM 800 CA ILE A 51 17.268 11.664 -1.301 1.00 0.00 C ATOM 801 C ILE A 51 18.454 10.736 -1.518 1.00 0.00 C ATOM 802 O ILE A 51 19.572 11.031 -1.106 1.00 0.00 O ATOM 803 CB ILE A 51 16.281 11.015 -0.321 1.00 0.00 C ATOM 804 CG1 ILE A 51 15.159 11.992 0.036 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.981 10.602 0.981 1.00 0.00 C ATOM 806 CD1 ILE A 51 14.068 11.286 0.833 1.00 0.00 C ATOM 0 H ILE A 51 15.706 11.441 -2.670 1.00 0.00 H new ATOM 0 HA ILE A 51 17.609 12.612 -0.885 1.00 0.00 H new ATOM 0 HB ILE A 51 15.874 10.133 -0.814 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.562 12.821 0.617 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.735 12.416 -0.874 1.00 0.00 H new ATOM 0 HG21 ILE A 51 16.256 10.145 1.655 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.771 9.885 0.758 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.414 11.482 1.456 1.00 0.00 H new ATOM 0 HD11 ILE A 51 13.279 11.997 1.078 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.652 10.472 0.239 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.492 10.884 1.753 1.00 0.00 H new ATOM 818 N GLN A 52 18.204 9.603 -2.178 1.00 0.00 N ATOM 819 CA GLN A 52 19.209 8.579 -2.399 1.00 0.00 C ATOM 820 C GLN A 52 20.236 9.001 -3.446 1.00 0.00 C ATOM 821 O GLN A 52 21.093 8.206 -3.827 1.00 0.00 O ATOM 822 CB GLN A 52 18.514 7.263 -2.760 1.00 0.00 C ATOM 823 CG GLN A 52 17.672 6.786 -1.578 1.00 0.00 C ATOM 824 CD GLN A 52 18.443 6.870 -0.266 1.00 0.00 C ATOM 825 OE1 GLN A 52 19.474 6.225 -0.093 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.945 7.678 0.665 1.00 0.00 N ATOM 0 H GLN A 52 17.292 9.376 -2.573 1.00 0.00 H new ATOM 0 HA GLN A 52 19.775 8.432 -1.479 1.00 0.00 H new ATOM 0 HB2 GLN A 52 17.882 7.403 -3.637 1.00 0.00 H new ATOM 0 HB3 GLN A 52 19.256 6.508 -3.019 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.768 7.391 -1.508 1.00 0.00 H new ATOM 0 HG3 GLN A 52 17.355 5.757 -1.749 1.00 0.00 H new ATOM 0 HE21 GLN A 52 17.086 8.197 0.483 1.00 0.00 H new ATOM 0 HE22 GLN A 52 18.422 7.779 1.561 1.00 0.00 H new ATOM 835 N ALA A 53 20.153 10.251 -3.910 1.00 0.00 N ATOM 836 CA ALA A 53 21.103 10.782 -4.861 1.00 0.00 C ATOM 837 C ALA A 53 22.465 11.012 -4.195 1.00 0.00 C ATOM 838 O ALA A 53 23.472 11.147 -4.888 1.00 0.00 O ATOM 839 CB ALA A 53 20.564 12.092 -5.435 1.00 0.00 C ATOM 0 H ALA A 53 19.426 10.911 -3.632 1.00 0.00 H new ATOM 0 HA ALA A 53 21.240 10.062 -5.668 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.278 12.496 -6.153 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.613 11.906 -5.934 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.416 12.809 -4.628 1.00 0.00 H new ATOM 845 N GLY A 54 22.505 11.059 -2.855 1.00 0.00 N ATOM 846 CA GLY A 54 23.746 11.246 -2.119 1.00 0.00 C ATOM 847 C GLY A 54 23.590 12.242 -0.969 1.00 0.00 C ATOM 848 O GLY A 54 24.591 12.724 -0.440 1.00 0.00 O ATOM 0 H GLY A 54 21.680 10.968 -2.263 1.00 0.00 H new ATOM 0 HA2 GLY A 54 24.080 10.287 -1.724 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.521 11.598 -2.800 1.00 0.00 H new ATOM 852 N LEU A 55 22.349 12.547 -0.584 1.00 0.00 N ATOM 853 CA LEU A 55 22.043 13.567 0.406 1.00 0.00 C ATOM 854 C LEU A 55 20.938 13.104 1.353 1.00 0.00 C ATOM 855 O LEU A 55 20.531 11.946 1.328 1.00 0.00 O ATOM 856 CB LEU A 55 21.668 14.853 -0.334 1.00 0.00 C ATOM 857 CG LEU A 55 20.495 14.677 -1.312 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.150 14.572 -0.595 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.454 15.884 -2.243 1.00 0.00 C ATOM 0 H LEU A 55 21.522 12.083 -0.959 1.00 0.00 H new ATOM 0 HA LEU A 55 22.915 13.756 1.032 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.411 15.621 0.396 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.538 15.214 -0.883 1.00 0.00 H new ATOM 0 HG LEU A 55 20.655 13.749 -1.861 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.355 14.449 -1.330 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.161 13.712 0.075 1.00 0.00 H new ATOM 0 HD13 LEU A 55 18.973 15.480 -0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.627 15.775 -2.944 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.315 16.792 -1.656 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.391 15.949 -2.795 1.00 0.00 H new ATOM 871 N THR A 56 20.453 14.020 2.195 1.00 0.00 N ATOM 872 CA THR A 56 19.354 13.761 3.119 1.00 0.00 C ATOM 873 C THR A 56 18.418 14.966 3.150 1.00 0.00 C ATOM 874 O THR A 56 18.681 15.974 2.494 1.00 0.00 O ATOM 875 CB THR A 56 19.908 13.444 4.508 1.00 0.00 C ATOM 876 OG1 THR A 56 20.687 14.522 4.982 1.00 0.00 O ATOM 877 CG2 THR A 56 20.781 12.189 4.450 1.00 0.00 C ATOM 0 H THR A 56 20.818 14.971 2.252 1.00 0.00 H new ATOM 0 HA THR A 56 18.782 12.896 2.782 1.00 0.00 H new ATOM 0 HB THR A 56 19.068 13.278 5.183 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.035 14.308 5.873 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.171 11.971 5.444 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.184 11.346 4.102 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.611 12.354 3.763 1.00 0.00 H new ATOM 885 N ALA A 57 17.320 14.875 3.913 1.00 0.00 N ATOM 886 CA ALA A 57 16.323 15.935 3.974 1.00 0.00 C ATOM 887 C ALA A 57 16.964 17.299 4.251 1.00 0.00 C ATOM 888 O ALA A 57 17.961 17.388 4.968 1.00 0.00 O ATOM 889 CB ALA A 57 15.301 15.601 5.057 1.00 0.00 C ATOM 0 H ALA A 57 17.105 14.068 4.499 1.00 0.00 H new ATOM 0 HA ALA A 57 15.828 16.000 3.005 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.552 16.392 5.107 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.815 14.655 4.819 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.805 15.518 6.020 1.00 0.00 H new ATOM 895 N PRO A 58 16.392 18.366 3.683 1.00 0.00 N ATOM 896 CA PRO A 58 16.921 19.719 3.783 1.00 0.00 C ATOM 897 C PRO A 58 16.783 20.299 5.182 1.00 0.00 C ATOM 898 O PRO A 58 17.532 21.208 5.538 1.00 0.00 O ATOM 899 CB PRO A 58 16.110 20.541 2.778 1.00 0.00 C ATOM 900 CG PRO A 58 14.783 19.789 2.680 1.00 0.00 C ATOM 901 CD PRO A 58 15.181 18.331 2.888 1.00 0.00 C ATOM 0 HA PRO A 58 17.990 19.731 3.571 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.965 21.565 3.123 1.00 0.00 H new ATOM 0 HB3 PRO A 58 16.610 20.598 1.811 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.076 20.124 3.439 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.307 19.940 1.711 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.393 17.779 3.399 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.353 17.832 1.934 1.00 0.00 H new ATOM 909 N ASP A 59 15.840 19.797 5.979 1.00 0.00 N ATOM 910 CA ASP A 59 15.584 20.349 7.297 1.00 0.00 C ATOM 911 C ASP A 59 14.726 19.397 8.134 1.00 0.00 C ATOM 912 O ASP A 59 14.464 18.265 7.722 1.00 0.00 O ATOM 913 CB ASP A 59 14.920 21.718 7.129 1.00 0.00 C ATOM 914 CG ASP A 59 13.508 21.616 6.560 1.00 0.00 C ATOM 915 OD1 ASP A 59 12.584 21.373 7.369 1.00 0.00 O ATOM 916 OD2 ASP A 59 13.362 21.781 5.329 1.00 0.00 O ATOM 0 H ASP A 59 15.243 19.008 5.729 1.00 0.00 H new ATOM 0 HA ASP A 59 16.523 20.473 7.837 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.884 22.222 8.095 1.00 0.00 H new ATOM 0 HB3 ASP A 59 15.530 22.336 6.470 1.00 0.00 H new ATOM 1635 N MET C 1 1.881 6.712 12.291 1.00 0.00 N ATOM 1636 CA MET C 1 1.465 6.310 10.934 1.00 0.00 C ATOM 1637 C MET C 1 1.687 7.466 9.967 1.00 0.00 C ATOM 1638 O MET C 1 1.304 8.594 10.270 1.00 0.00 O ATOM 1639 CB MET C 1 -0.002 5.864 10.935 1.00 0.00 C ATOM 1640 CG MET C 1 -0.302 5.010 9.706 1.00 0.00 C ATOM 1641 SD MET C 1 -1.938 4.237 9.700 1.00 0.00 S ATOM 1642 CE MET C 1 -2.973 5.708 9.504 1.00 0.00 C ATOM 0 H1 MET C 1 1.195 6.352 12.985 1.00 0.00 H new ATOM 0 H2 MET C 1 2.821 6.318 12.497 1.00 0.00 H new ATOM 0 H3 MET C 1 1.920 7.750 12.349 1.00 0.00 H new ATOM 0 HA MET C 1 2.070 5.464 10.607 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.215 5.296 11.841 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.654 6.738 10.946 1.00 0.00 H new ATOM 0 HG2 MET C 1 -0.207 5.632 8.816 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.454 4.228 9.631 1.00 0.00 H new ATOM 0 HE1 MET C 1 -4.024 5.420 9.534 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.766 6.409 10.312 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.754 6.182 8.547 1.00 0.00 H new ATOM 1654 N LEU C 2 2.299 7.193 8.814 1.00 0.00 N ATOM 1655 CA LEU C 2 2.670 8.228 7.855 1.00 0.00 C ATOM 1656 C LEU C 2 1.644 8.253 6.716 1.00 0.00 C ATOM 1657 O LEU C 2 1.696 7.425 5.809 1.00 0.00 O ATOM 1658 CB LEU C 2 4.086 7.929 7.344 1.00 0.00 C ATOM 1659 CG LEU C 2 4.821 9.121 6.707 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.827 8.603 5.684 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.922 10.141 6.018 1.00 0.00 C ATOM 0 H LEU C 2 2.550 6.249 8.521 1.00 0.00 H new ATOM 0 HA LEU C 2 2.671 9.214 8.320 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.684 7.558 8.176 1.00 0.00 H new ATOM 0 HB3 LEU C 2 4.027 7.125 6.610 1.00 0.00 H new ATOM 0 HG LEU C 2 5.299 9.642 7.537 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.350 9.444 5.230 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.548 7.952 6.180 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.303 8.042 4.910 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.533 10.942 5.601 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.366 9.654 5.217 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.223 10.558 6.743 1.00 0.00 H new ATOM 1673 N ILE C 3 0.708 9.204 6.761 1.00 0.00 N ATOM 1674 CA ILE C 3 -0.305 9.360 5.727 1.00 0.00 C ATOM 1675 C ILE C 3 0.284 10.150 4.570 1.00 0.00 C ATOM 1676 O ILE C 3 1.127 11.022 4.770 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.553 10.077 6.279 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.401 9.145 7.144 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.468 10.554 5.152 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.769 8.903 8.508 1.00 0.00 C ATOM 0 H ILE C 3 0.635 9.885 7.517 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.613 8.373 5.382 1.00 0.00 H new ATOM 0 HB ILE C 3 -1.174 10.917 6.862 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.394 9.575 7.275 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -2.532 8.192 6.631 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.338 11.055 5.577 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.925 11.250 4.512 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.795 9.698 4.562 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.404 8.236 9.090 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.787 8.448 8.378 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -1.663 9.852 9.033 1.00 0.00 H new ATOM 1692 N LEU C 4 -0.169 9.833 3.357 1.00 0.00 N ATOM 1693 CA LEU C 4 0.205 10.535 2.140 1.00 0.00 C ATOM 1694 C LEU C 4 -1.010 10.570 1.218 1.00 0.00 C ATOM 1695 O LEU C 4 -2.006 9.888 1.449 1.00 0.00 O ATOM 1696 CB LEU C 4 1.369 9.826 1.438 1.00 0.00 C ATOM 1697 CG LEU C 4 2.675 9.872 2.240 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.757 9.073 1.516 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.190 11.301 2.372 1.00 0.00 C ATOM 0 H LEU C 4 -0.820 9.064 3.195 1.00 0.00 H new ATOM 0 HA LEU C 4 0.528 11.546 2.387 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.097 8.786 1.258 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.532 10.286 0.464 1.00 0.00 H new ATOM 0 HG LEU C 4 2.465 9.456 3.225 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.682 9.110 2.091 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.435 8.037 1.411 1.00 0.00 H new ATOM 0 HD13 LEU C 4 3.926 9.502 0.528 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.117 11.302 2.945 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.376 11.714 1.380 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.446 11.910 2.885 1.00 0.00 H new ATOM 1711 N THR C 5 -0.911 11.373 0.162 1.00 0.00 N ATOM 1712 CA THR C 5 -1.965 11.513 -0.825 1.00 0.00 C ATOM 1713 C THR C 5 -1.326 11.296 -2.185 1.00 0.00 C ATOM 1714 O THR C 5 -0.206 11.743 -2.433 1.00 0.00 O ATOM 1715 CB THR C 5 -2.602 12.899 -0.672 1.00 0.00 C ATOM 1716 OG1 THR C 5 -3.019 13.044 0.669 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.829 13.103 -1.559 1.00 0.00 C ATOM 0 H THR C 5 -0.090 11.947 -0.030 1.00 0.00 H new ATOM 0 HA THR C 5 -2.766 10.785 -0.698 1.00 0.00 H new ATOM 0 HB THR C 5 -1.852 13.632 -0.968 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.429 13.926 0.791 1.00 0.00 H new ATOM 0 HG21 THR C 5 -4.230 14.104 -1.401 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.545 12.987 -2.605 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.589 12.364 -1.305 1.00 0.00 H new ATOM 1725 N ARG C 6 -2.031 10.610 -3.084 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.478 10.196 -4.364 1.00 0.00 C ATOM 1727 C ARG C 6 -2.559 10.311 -5.427 1.00 0.00 C ATOM 1728 O ARG C 6 -3.710 10.587 -5.099 1.00 0.00 O ATOM 1729 CB ARG C 6 -0.982 8.752 -4.196 1.00 0.00 C ATOM 1730 CG ARG C 6 0.036 8.293 -5.244 1.00 0.00 C ATOM 1731 CD ARG C 6 1.383 9.005 -5.107 1.00 0.00 C ATOM 1732 NE ARG C 6 1.411 10.313 -5.773 1.00 0.00 N ATOM 1733 CZ ARG C 6 2.413 11.192 -5.675 1.00 0.00 C ATOM 1734 NH1 ARG C 6 3.489 10.941 -4.936 1.00 0.00 N ATOM 1735 NH2 ARG C 6 2.342 12.343 -6.332 1.00 0.00 N ATOM 0 H ARG C 6 -3.001 10.328 -2.941 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.645 10.825 -4.679 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -0.535 8.650 -3.207 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -1.841 8.082 -4.228 1.00 0.00 H new ATOM 0 HG2 ARG C 6 0.187 7.217 -5.152 1.00 0.00 H new ATOM 0 HG3 ARG C 6 -0.367 8.474 -6.240 1.00 0.00 H new ATOM 0 HD2 ARG C 6 1.612 9.137 -4.050 1.00 0.00 H new ATOM 0 HD3 ARG C 6 2.166 8.373 -5.526 1.00 0.00 H new ATOM 0 HE ARG C 6 0.610 10.569 -6.351 1.00 0.00 H new ATOM 0 HH11 ARG C 6 3.564 10.060 -4.427 1.00 0.00 H new ATOM 0 HH12 ARG C 6 4.240 11.629 -4.878 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.526 12.552 -6.907 1.00 0.00 H new ATOM 0 HH22 ARG C 6 3.103 13.018 -6.262 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.211 10.101 -6.699 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.183 10.204 -7.781 1.00 0.00 C ATOM 1751 C LYS C 7 -2.973 9.066 -8.765 1.00 0.00 C ATOM 1752 O LYS C 7 -1.872 8.527 -8.870 1.00 0.00 O ATOM 1753 CB LYS C 7 -3.048 11.562 -8.475 1.00 0.00 C ATOM 1754 CG LYS C 7 -2.918 12.692 -7.452 1.00 0.00 C ATOM 1755 CD LYS C 7 -2.885 14.053 -8.144 1.00 0.00 C ATOM 1756 CE LYS C 7 -2.527 15.125 -7.114 1.00 0.00 C ATOM 1757 NZ LYS C 7 -2.336 16.438 -7.754 1.00 0.00 N ATOM 0 H LYS C 7 -1.267 9.860 -7.000 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.192 10.128 -7.375 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.175 11.555 -9.127 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -3.918 11.739 -9.108 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -3.755 12.654 -6.755 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -2.009 12.555 -6.867 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -2.153 14.047 -8.952 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -3.854 14.271 -8.593 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -3.318 15.194 -6.367 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -1.616 14.838 -6.588 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -2.094 17.145 -7.031 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -1.565 16.376 -8.449 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -3.214 16.721 -8.235 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.035 8.701 -9.487 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.011 7.599 -10.443 1.00 0.00 C ATOM 1773 C VAL C 8 -2.845 7.762 -11.411 1.00 0.00 C ATOM 1774 O VAL C 8 -2.816 8.715 -12.190 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.340 7.558 -11.203 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.300 6.463 -12.267 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.482 7.280 -10.228 1.00 0.00 C ATOM 0 H VAL C 8 -4.940 9.167 -9.422 1.00 0.00 H new ATOM 0 HA VAL C 8 -3.877 6.659 -9.907 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.501 8.521 -11.687 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.249 6.441 -12.802 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.492 6.667 -12.969 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.130 5.498 -11.790 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.426 7.252 -10.772 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.317 6.321 -9.738 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.520 8.069 -9.477 1.00 0.00 H new ATOM 1787 N GLY C 9 -1.887 6.833 -11.358 1.00 0.00 N ATOM 1788 CA GLY C 9 -0.740 6.845 -12.259 1.00 0.00 C ATOM 1789 C GLY C 9 0.557 7.241 -11.555 1.00 0.00 C ATOM 1790 O GLY C 9 1.557 7.501 -12.221 1.00 0.00 O ATOM 0 H GLY C 9 -1.887 6.059 -10.694 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -0.621 5.856 -12.703 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -0.932 7.540 -13.076 1.00 0.00 H new ATOM 1794 N GLU C 10 0.551 7.290 -10.219 1.00 0.00 N ATOM 1795 CA GLU C 10 1.714 7.684 -9.436 1.00 0.00 C ATOM 1796 C GLU C 10 2.074 6.594 -8.425 1.00 0.00 C ATOM 1797 O GLU C 10 1.395 5.570 -8.347 1.00 0.00 O ATOM 1798 CB GLU C 10 1.435 9.016 -8.738 1.00 0.00 C ATOM 1799 CG GLU C 10 1.092 10.120 -9.739 1.00 0.00 C ATOM 1800 CD GLU C 10 0.803 11.440 -9.027 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.167 11.394 -7.950 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.217 12.491 -9.564 1.00 0.00 O ATOM 0 H GLU C 10 -0.265 7.056 -9.654 1.00 0.00 H new ATOM 0 HA GLU C 10 2.569 7.813 -10.100 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.610 8.893 -8.036 1.00 0.00 H new ATOM 0 HB3 GLU C 10 2.308 9.311 -8.156 1.00 0.00 H new ATOM 0 HG2 GLU C 10 1.920 10.253 -10.436 1.00 0.00 H new ATOM 0 HG3 GLU C 10 0.224 9.824 -10.328 1.00 0.00 H new ATOM 1809 N SER C 11 3.139 6.804 -7.650 1.00 0.00 N ATOM 1810 CA SER C 11 3.658 5.767 -6.766 1.00 0.00 C ATOM 1811 C SER C 11 4.396 6.328 -5.553 1.00 0.00 C ATOM 1812 O SER C 11 4.683 7.521 -5.468 1.00 0.00 O ATOM 1813 CB SER C 11 4.583 4.849 -7.571 1.00 0.00 C ATOM 1814 OG SER C 11 5.331 5.584 -8.519 1.00 0.00 O ATOM 0 H SER C 11 3.656 7.682 -7.619 1.00 0.00 H new ATOM 0 HA SER C 11 2.807 5.210 -6.374 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.260 4.327 -6.895 1.00 0.00 H new ATOM 0 HB3 SER C 11 3.992 4.088 -8.081 1.00 0.00 H new ATOM 0 HG SER C 11 5.915 4.975 -9.018 1.00 0.00 H new ATOM 1820 N ILE C 12 4.694 5.426 -4.615 1.00 0.00 N ATOM 1821 CA ILE C 12 5.334 5.691 -3.332 1.00 0.00 C ATOM 1822 C ILE C 12 6.400 4.616 -3.106 1.00 0.00 C ATOM 1823 O ILE C 12 6.388 3.593 -3.791 1.00 0.00 O ATOM 1824 CB ILE C 12 4.260 5.658 -2.234 1.00 0.00 C ATOM 1825 CG1 ILE C 12 3.198 6.752 -2.428 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.880 5.812 -0.844 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.766 8.170 -2.318 1.00 0.00 C ATOM 0 H ILE C 12 4.482 4.436 -4.741 1.00 0.00 H new ATOM 0 HA ILE C 12 5.812 6.671 -3.313 1.00 0.00 H new ATOM 0 HB ILE C 12 3.777 4.684 -2.313 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.733 6.629 -3.406 1.00 0.00 H new ATOM 0 HG13 ILE C 12 2.413 6.623 -1.683 1.00 0.00 H new ATOM 0 HG21 ILE C 12 4.094 5.785 -0.090 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.582 4.997 -0.666 1.00 0.00 H new ATOM 0 HG23 ILE C 12 5.407 6.764 -0.784 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.965 8.895 -2.465 1.00 0.00 H new ATOM 0 HD12 ILE C 12 4.206 8.310 -1.331 1.00 0.00 H new ATOM 0 HD13 ILE C 12 4.531 8.316 -3.080 1.00 0.00 H new ATOM 1839 N ASN C 13 7.320 4.819 -2.159 1.00 0.00 N ATOM 1840 CA ASN C 13 8.445 3.918 -1.960 1.00 0.00 C ATOM 1841 C ASN C 13 8.641 3.591 -0.477 1.00 0.00 C ATOM 1842 O ASN C 13 8.343 4.409 0.389 1.00 0.00 O ATOM 1843 CB ASN C 13 9.686 4.593 -2.547 1.00 0.00 C ATOM 1844 CG ASN C 13 10.819 3.611 -2.790 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.402 3.070 -1.858 1.00 0.00 O ATOM 1846 ND2 ASN C 13 11.138 3.377 -4.058 1.00 0.00 N ATOM 0 H ASN C 13 7.301 5.610 -1.515 1.00 0.00 H new ATOM 0 HA ASN C 13 8.259 2.969 -2.462 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.422 5.079 -3.486 1.00 0.00 H new ATOM 0 HB3 ASN C 13 10.026 5.375 -1.868 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.892 2.727 -4.283 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.629 3.847 -4.807 1.00 0.00 H new ATOM 1853 N ILE C 14 9.146 2.384 -0.201 1.00 0.00 N ATOM 1854 CA ILE C 14 9.385 1.883 1.150 1.00 0.00 C ATOM 1855 C ILE C 14 10.733 1.167 1.175 1.00 0.00 C ATOM 1856 O ILE C 14 11.117 0.513 0.205 1.00 0.00 O ATOM 1857 CB ILE C 14 8.280 0.889 1.547 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.857 1.439 1.371 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.490 0.421 2.991 1.00 0.00 C ATOM 1860 CD1 ILE C 14 6.524 2.556 2.358 1.00 0.00 C ATOM 0 H ILE C 14 9.404 1.717 -0.928 1.00 0.00 H new ATOM 0 HA ILE C 14 9.384 2.717 1.852 1.00 0.00 H new ATOM 0 HB ILE C 14 8.366 0.047 0.860 1.00 0.00 H new ATOM 0 HG12 ILE C 14 6.741 1.814 0.354 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.141 0.626 1.495 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.703 -0.282 3.264 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.460 -0.068 3.077 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.456 1.280 3.661 1.00 0.00 H new ATOM 0 HD11 ILE C 14 5.506 2.904 2.184 1.00 0.00 H new ATOM 0 HD12 ILE C 14 6.610 2.179 3.377 1.00 0.00 H new ATOM 0 HD13 ILE C 14 7.219 3.384 2.218 1.00 0.00 H new ATOM 1872 N GLY C 15 11.459 1.281 2.292 1.00 0.00 N ATOM 1873 CA GLY C 15 12.752 0.634 2.430 1.00 0.00 C ATOM 1874 C GLY C 15 13.676 1.048 1.286 1.00 0.00 C ATOM 1875 O GLY C 15 13.751 2.224 0.937 1.00 0.00 O ATOM 0 H GLY C 15 11.167 1.817 3.109 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.201 0.904 3.386 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.626 -0.449 2.432 1.00 0.00 H new ATOM 1879 N ASP C 16 14.378 0.069 0.713 1.00 0.00 N ATOM 1880 CA ASP C 16 15.246 0.280 -0.440 1.00 0.00 C ATOM 1881 C ASP C 16 14.962 -0.763 -1.524 1.00 0.00 C ATOM 1882 O ASP C 16 15.671 -0.829 -2.529 1.00 0.00 O ATOM 1883 CB ASP C 16 16.706 0.258 0.016 1.00 0.00 C ATOM 1884 CG ASP C 16 17.668 0.669 -1.097 1.00 0.00 C ATOM 1885 OD1 ASP C 16 17.435 1.740 -1.703 1.00 0.00 O ATOM 1886 OD2 ASP C 16 18.635 -0.092 -1.332 1.00 0.00 O ATOM 0 H ASP C 16 14.358 -0.897 1.040 1.00 0.00 H new ATOM 0 HA ASP C 16 15.044 1.256 -0.882 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.829 0.930 0.866 1.00 0.00 H new ATOM 0 HB3 ASP C 16 16.961 -0.744 0.362 1.00 0.00 H new ATOM 1891 N ASP C 17 13.920 -1.582 -1.326 1.00 0.00 N ATOM 1892 CA ASP C 17 13.576 -2.675 -2.229 1.00 0.00 C ATOM 1893 C ASP C 17 12.062 -2.837 -2.379 1.00 0.00 C ATOM 1894 O ASP C 17 11.610 -3.857 -2.896 1.00 0.00 O ATOM 1895 CB ASP C 17 14.180 -3.981 -1.705 1.00 0.00 C ATOM 1896 CG ASP C 17 15.700 -3.915 -1.571 1.00 0.00 C ATOM 1897 OD1 ASP C 17 16.382 -4.092 -2.606 1.00 0.00 O ATOM 1898 OD2 ASP C 17 16.172 -3.690 -0.434 1.00 0.00 O ATOM 0 H ASP C 17 13.291 -1.499 -0.527 1.00 0.00 H new ATOM 0 HA ASP C 17 13.985 -2.437 -3.211 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.744 -4.215 -0.734 1.00 0.00 H new ATOM 0 HB3 ASP C 17 13.914 -4.796 -2.378 1.00 0.00 H new ATOM 1903 N ILE C 18 11.271 -1.855 -1.937 1.00 0.00 N ATOM 1904 CA ILE C 18 9.820 -1.953 -2.003 1.00 0.00 C ATOM 1905 C ILE C 18 9.246 -0.663 -2.585 1.00 0.00 C ATOM 1906 O ILE C 18 9.703 0.431 -2.267 1.00 0.00 O ATOM 1907 CB ILE C 18 9.269 -2.223 -0.596 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.803 -3.554 -0.048 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.737 -2.231 -0.621 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.416 -3.772 1.417 1.00 0.00 C ATOM 0 H ILE C 18 11.616 -0.985 -1.531 1.00 0.00 H new ATOM 0 HA ILE C 18 9.527 -2.777 -2.653 1.00 0.00 H new ATOM 0 HB ILE C 18 9.605 -1.424 0.065 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.415 -4.375 -0.651 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.889 -3.575 -0.142 1.00 0.00 H new ATOM 0 HG21 ILE C 18 7.358 -2.424 0.383 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.374 -1.263 -0.967 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.388 -3.012 -1.297 1.00 0.00 H new ATOM 0 HD11 ILE C 18 9.816 -4.726 1.761 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.826 -2.966 2.026 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.330 -3.779 1.509 1.00 0.00 H new ATOM 1922 N THR C 19 8.234 -0.802 -3.445 1.00 0.00 N ATOM 1923 CA THR C 19 7.568 0.336 -4.073 1.00 0.00 C ATOM 1924 C THR C 19 6.084 0.010 -4.212 1.00 0.00 C ATOM 1925 O THR C 19 5.725 -1.164 -4.281 1.00 0.00 O ATOM 1926 CB THR C 19 8.199 0.617 -5.445 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.604 0.522 -5.375 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.854 2.018 -5.942 1.00 0.00 C ATOM 0 H THR C 19 7.855 -1.707 -3.724 1.00 0.00 H new ATOM 0 HA THR C 19 7.685 1.230 -3.461 1.00 0.00 H new ATOM 0 HB THR C 19 7.798 -0.127 -6.133 1.00 0.00 H new ATOM 0 HG1 THR C 19 9.988 0.703 -6.258 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.317 2.183 -6.915 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.772 2.116 -6.033 1.00 0.00 H new ATOM 0 HG23 THR C 19 8.226 2.758 -5.233 1.00 0.00 H new ATOM 1936 N ILE C 20 5.228 1.035 -4.256 1.00 0.00 N ATOM 1937 CA ILE C 20 3.779 0.863 -4.288 1.00 0.00 C ATOM 1938 C ILE C 20 3.203 1.800 -5.350 1.00 0.00 C ATOM 1939 O ILE C 20 3.774 2.859 -5.600 1.00 0.00 O ATOM 1940 CB ILE C 20 3.191 1.206 -2.911 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.950 0.549 -1.750 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.721 0.791 -2.857 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.817 -0.972 -1.714 1.00 0.00 C ATOM 0 H ILE C 20 5.526 2.011 -4.270 1.00 0.00 H new ATOM 0 HA ILE C 20 3.527 -0.169 -4.530 1.00 0.00 H new ATOM 0 HB ILE C 20 3.290 2.285 -2.789 1.00 0.00 H new ATOM 0 HG12 ILE C 20 5.005 0.811 -1.823 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.584 0.960 -0.809 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.309 1.037 -1.878 1.00 0.00 H new ATOM 0 HG22 ILE C 20 1.164 1.323 -3.629 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.640 -0.283 -3.026 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.379 -1.366 -0.868 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.766 -1.243 -1.610 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.210 -1.394 -2.639 1.00 0.00 H new ATOM 1955 N THR C 21 2.084 1.425 -5.975 1.00 0.00 N ATOM 1956 CA THR C 21 1.520 2.197 -7.079 1.00 0.00 C ATOM 1957 C THR C 21 -0.005 2.198 -7.019 1.00 0.00 C ATOM 1958 O THR C 21 -0.611 1.251 -6.523 1.00 0.00 O ATOM 1959 CB THR C 21 1.992 1.574 -8.402 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.401 1.449 -8.403 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.602 2.429 -9.604 1.00 0.00 C ATOM 0 H THR C 21 1.552 0.589 -5.733 1.00 0.00 H new ATOM 0 HA THR C 21 1.859 3.230 -7.006 1.00 0.00 H new ATOM 0 HB THR C 21 1.511 0.599 -8.482 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.693 1.050 -9.249 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.955 1.953 -10.519 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.517 2.530 -9.642 1.00 0.00 H new ATOM 0 HG23 THR C 21 2.055 3.416 -9.511 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.627 3.266 -7.529 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.073 3.411 -7.612 1.00 0.00 C ATOM 1971 C ILE C 22 -2.487 3.322 -9.079 1.00 0.00 C ATOM 1972 O ILE C 22 -2.400 4.298 -9.824 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.514 4.719 -6.925 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -3.990 5.052 -7.161 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -1.667 5.913 -7.366 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -4.905 3.986 -6.563 1.00 0.00 C ATOM 0 H ILE C 22 -0.122 4.069 -7.903 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.581 2.607 -7.079 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.366 4.539 -5.860 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.221 6.021 -6.719 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.179 5.137 -8.231 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.013 6.812 -6.857 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.623 5.732 -7.112 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.761 6.047 -8.444 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -5.945 4.254 -6.749 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -4.690 3.022 -7.024 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -4.733 3.920 -5.489 1.00 0.00 H new ATOM 1988 N LEU C 23 -2.940 2.137 -9.502 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.271 1.890 -10.899 1.00 0.00 C ATOM 1990 C LEU C 23 -4.554 2.616 -11.301 1.00 0.00 C ATOM 1991 O LEU C 23 -4.712 2.986 -12.463 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.459 0.389 -11.134 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.246 -0.445 -10.716 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.491 -1.880 -11.152 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -0.943 0.065 -11.328 1.00 0.00 C ATOM 0 H LEU C 23 -3.084 1.334 -8.890 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.448 2.266 -11.506 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.334 0.048 -10.580 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.663 0.216 -12.191 1.00 0.00 H new ATOM 0 HG LEU C 23 -2.133 -0.371 -9.634 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.640 -2.498 -10.866 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.392 -2.258 -10.669 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.617 -1.915 -12.234 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.116 -0.563 -10.998 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -1.014 0.031 -12.415 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -0.768 1.092 -11.008 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.466 2.820 -10.348 1.00 0.00 N ATOM 2008 CA GLY C 24 -6.709 3.528 -10.612 1.00 0.00 C ATOM 2009 C GLY C 24 -7.717 3.404 -9.477 1.00 0.00 C ATOM 2010 O GLY C 24 -7.413 2.894 -8.400 1.00 0.00 O ATOM 0 H GLY C 24 -5.361 2.501 -9.385 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.491 4.582 -10.783 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.153 3.141 -11.529 1.00 0.00 H new ATOM 2014 N VAL C 25 -8.938 3.880 -9.735 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.022 3.883 -8.760 1.00 0.00 C ATOM 2016 C VAL C 25 -11.295 3.346 -9.403 1.00 0.00 C ATOM 2017 O VAL C 25 -11.387 3.267 -10.628 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.248 5.300 -8.211 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -8.986 5.833 -7.531 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -10.654 6.273 -9.324 1.00 0.00 C ATOM 0 H VAL C 25 -9.200 4.277 -10.637 1.00 0.00 H new ATOM 0 HA VAL C 25 -9.750 3.237 -7.925 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.055 5.231 -7.482 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -9.174 6.837 -7.152 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -8.714 5.178 -6.704 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -8.170 5.864 -8.253 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -10.806 7.266 -8.901 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -9.866 6.315 -10.076 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.579 5.930 -9.787 1.00 0.00 H new ATOM 2030 N SER C 26 -12.272 2.977 -8.575 1.00 0.00 N ATOM 2031 CA SER C 26 -13.526 2.388 -9.022 1.00 0.00 C ATOM 2032 C SER C 26 -14.627 2.746 -8.026 1.00 0.00 C ATOM 2033 O SER C 26 -15.242 1.868 -7.423 1.00 0.00 O ATOM 2034 CB SER C 26 -13.368 0.867 -9.134 1.00 0.00 C ATOM 2035 OG SER C 26 -12.586 0.545 -10.267 1.00 0.00 O ATOM 0 H SER C 26 -12.210 3.082 -7.562 1.00 0.00 H new ATOM 0 HA SER C 26 -13.796 2.779 -10.003 1.00 0.00 H new ATOM 0 HB2 SER C 26 -12.897 0.475 -8.233 1.00 0.00 H new ATOM 0 HB3 SER C 26 -14.348 0.396 -9.212 1.00 0.00 H new ATOM 0 HG SER C 26 -12.205 1.365 -10.645 1.00 0.00 H new ATOM 2041 N GLY C 27 -14.875 4.045 -7.849 1.00 0.00 N ATOM 2042 CA GLY C 27 -15.852 4.507 -6.878 1.00 0.00 C ATOM 2043 C GLY C 27 -15.289 4.321 -5.475 1.00 0.00 C ATOM 2044 O GLY C 27 -14.157 4.710 -5.205 1.00 0.00 O ATOM 0 H GLY C 27 -14.410 4.790 -8.368 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.087 5.557 -7.052 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -16.782 3.949 -6.987 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.081 3.722 -4.585 1.00 0.00 N ATOM 2049 CA GLN C 28 -15.653 3.420 -3.228 1.00 0.00 C ATOM 2050 C GLN C 28 -14.579 2.325 -3.217 1.00 0.00 C ATOM 2051 O GLN C 28 -14.053 1.986 -2.159 1.00 0.00 O ATOM 2052 CB GLN C 28 -16.885 3.012 -2.416 1.00 0.00 C ATOM 2053 CG GLN C 28 -16.645 3.149 -0.911 1.00 0.00 C ATOM 2054 CD GLN C 28 -17.894 2.791 -0.110 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -17.815 2.044 0.865 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -19.054 3.312 -0.505 1.00 0.00 N ATOM 0 H GLN C 28 -17.038 3.434 -4.790 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.198 4.302 -2.777 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -17.733 3.632 -2.707 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.149 1.981 -2.650 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -15.822 2.500 -0.612 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.345 4.171 -0.681 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -19.086 3.928 -1.317 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -19.910 3.095 0.005 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.252 1.764 -4.385 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.201 0.768 -4.504 1.00 0.00 C ATOM 2067 C GLN C 29 -11.934 1.399 -5.084 1.00 0.00 C ATOM 2068 O GLN C 29 -11.963 2.506 -5.621 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.635 -0.385 -5.411 1.00 0.00 C ATOM 2070 CG GLN C 29 -14.968 -1.028 -5.035 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.181 -2.271 -5.887 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -15.805 -2.217 -6.942 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -14.659 -3.406 -5.426 1.00 0.00 N ATOM 0 H GLN C 29 -14.711 1.991 -5.267 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.000 0.381 -3.505 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -13.701 -0.018 -6.435 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -12.861 -1.152 -5.396 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -14.973 -1.292 -3.977 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -15.783 -0.321 -5.191 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -14.146 -3.410 -4.544 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -14.772 -4.271 -5.955 1.00 0.00 H new ATOM 2082 N VAL C 30 -10.817 0.673 -4.969 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.501 1.151 -5.358 1.00 0.00 C ATOM 2084 C VAL C 30 -8.684 -0.007 -5.936 1.00 0.00 C ATOM 2085 O VAL C 30 -8.853 -1.153 -5.520 1.00 0.00 O ATOM 2086 CB VAL C 30 -8.817 1.758 -4.121 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.353 2.088 -4.383 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.521 3.048 -3.697 1.00 0.00 C ATOM 0 H VAL C 30 -10.810 -0.277 -4.597 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.582 1.918 -6.128 1.00 0.00 H new ATOM 0 HB VAL C 30 -8.880 1.008 -3.333 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -6.909 2.514 -3.483 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -6.818 1.178 -4.655 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.283 2.808 -5.198 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.023 3.463 -2.821 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -9.481 3.770 -4.513 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.562 2.832 -3.455 1.00 0.00 H new ATOM 2098 N ARG C 31 -7.797 0.296 -6.889 1.00 0.00 N ATOM 2099 CA ARG C 31 -6.954 -0.688 -7.553 1.00 0.00 C ATOM 2100 C ARG C 31 -5.502 -0.259 -7.414 1.00 0.00 C ATOM 2101 O ARG C 31 -5.100 0.782 -7.934 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.365 -0.794 -9.027 1.00 0.00 C ATOM 2103 CG ARG C 31 -7.820 -2.206 -9.406 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.662 -3.205 -9.484 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.149 -4.510 -9.937 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.358 -4.837 -11.218 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.060 -4.000 -12.208 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -7.875 -6.022 -11.516 1.00 0.00 N ATOM 0 H ARG C 31 -7.647 1.248 -7.222 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.073 -1.670 -7.096 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.172 -0.089 -9.228 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.524 -0.505 -9.658 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -8.547 -2.557 -8.673 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.329 -2.172 -10.369 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -5.899 -2.836 -10.169 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.191 -3.304 -8.506 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.342 -5.218 -9.228 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.662 -3.084 -11.999 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.229 -4.274 -13.176 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.111 -6.678 -10.771 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -8.037 -6.277 -12.490 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.714 -1.067 -6.707 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.355 -0.719 -6.322 1.00 0.00 C ATOM 2124 C ILE C 32 -2.417 -1.898 -6.519 1.00 0.00 C ATOM 2125 O ILE C 32 -2.846 -3.052 -6.551 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.332 -0.278 -4.852 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.201 -1.205 -3.989 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -3.803 1.174 -4.749 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -4.114 -0.838 -2.508 1.00 0.00 C ATOM 0 H ILE C 32 -5.007 -1.989 -6.384 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.015 0.100 -6.956 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.312 -0.345 -4.475 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.238 -1.145 -4.319 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -3.882 -2.238 -4.128 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -3.787 1.488 -3.705 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.140 1.814 -5.331 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -4.818 1.256 -5.137 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.741 -1.515 -1.928 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.081 -0.924 -2.172 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.458 0.187 -2.366 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.124 -1.593 -6.652 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.104 -2.604 -6.860 1.00 0.00 C ATOM 2143 C GLY C 33 1.042 -2.436 -5.875 1.00 0.00 C ATOM 2144 O GLY C 33 1.191 -1.391 -5.243 1.00 0.00 O ATOM 0 H GLY C 33 -0.763 -0.640 -6.618 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.542 -3.596 -6.747 1.00 0.00 H new ATOM 0 HA3 GLY C 33 0.276 -2.537 -7.879 1.00 0.00 H new ATOM 2148 N ILE C 34 1.855 -3.485 -5.761 1.00 0.00 N ATOM 2149 CA ILE C 34 2.993 -3.548 -4.857 1.00 0.00 C ATOM 2150 C ILE C 34 4.158 -4.115 -5.659 1.00 0.00 C ATOM 2151 O ILE C 34 3.973 -5.020 -6.471 1.00 0.00 O ATOM 2152 CB ILE C 34 2.692 -4.462 -3.659 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.570 -3.932 -2.755 1.00 0.00 C ATOM 2154 CG2 ILE C 34 3.950 -4.594 -2.792 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.184 -4.376 -3.221 1.00 0.00 C ATOM 0 H ILE C 34 1.734 -4.335 -6.311 1.00 0.00 H new ATOM 0 HA ILE C 34 3.222 -2.558 -4.462 1.00 0.00 H new ATOM 0 HB ILE C 34 2.373 -5.416 -4.078 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.735 -4.279 -1.735 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.610 -2.843 -2.732 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.739 -5.242 -1.941 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.757 -5.025 -3.385 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.249 -3.609 -2.433 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.573 -3.974 -2.547 1.00 0.00 H new ATOM 0 HD12 ILE C 34 0.004 -4.007 -4.231 1.00 0.00 H new ATOM 0 HD13 ILE C 34 0.131 -5.465 -3.218 1.00 0.00 H new ATOM 2167 N ASN C 35 5.356 -3.584 -5.432 1.00 0.00 N ATOM 2168 CA ASN C 35 6.536 -3.968 -6.174 1.00 0.00 C ATOM 2169 C ASN C 35 7.668 -4.276 -5.199 1.00 0.00 C ATOM 2170 O ASN C 35 8.605 -3.500 -5.019 1.00 0.00 O ATOM 2171 CB ASN C 35 6.880 -2.876 -7.184 1.00 0.00 C ATOM 2172 CG ASN C 35 7.790 -3.391 -8.293 1.00 0.00 C ATOM 2173 OD1 ASN C 35 8.620 -4.271 -8.078 1.00 0.00 O ATOM 2174 ND2 ASN C 35 7.633 -2.843 -9.492 1.00 0.00 N ATOM 0 H ASN C 35 5.528 -2.872 -4.722 1.00 0.00 H new ATOM 0 HA ASN C 35 6.359 -4.878 -6.747 1.00 0.00 H new ATOM 0 HB2 ASN C 35 5.962 -2.484 -7.621 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.367 -2.047 -6.670 1.00 0.00 H new ATOM 0 HD21 ASN C 35 8.212 -3.151 -10.273 1.00 0.00 H new ATOM 0 HD22 ASN C 35 6.933 -2.114 -9.632 1.00 0.00 H new ATOM 2181 N ALA C 36 7.539 -5.444 -4.579 1.00 0.00 N ATOM 2182 CA ALA C 36 8.491 -6.011 -3.644 1.00 0.00 C ATOM 2183 C ALA C 36 8.847 -7.417 -4.124 1.00 0.00 C ATOM 2184 O ALA C 36 8.089 -8.011 -4.895 1.00 0.00 O ATOM 2185 CB ALA C 36 7.838 -6.059 -2.262 1.00 0.00 C ATOM 0 H ALA C 36 6.728 -6.046 -4.725 1.00 0.00 H new ATOM 0 HA ALA C 36 9.400 -5.412 -3.585 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.539 -6.483 -1.543 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.567 -5.050 -1.952 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.942 -6.679 -2.304 1.00 0.00 H new ATOM 2191 N PRO C 37 9.983 -7.963 -3.688 1.00 0.00 N ATOM 2192 CA PRO C 37 10.387 -9.306 -4.044 1.00 0.00 C ATOM 2193 C PRO C 37 9.573 -10.302 -3.225 1.00 0.00 C ATOM 2194 O PRO C 37 9.080 -9.971 -2.146 1.00 0.00 O ATOM 2195 CB PRO C 37 11.864 -9.369 -3.670 1.00 0.00 C ATOM 2196 CG PRO C 37 11.959 -8.427 -2.469 1.00 0.00 C ATOM 2197 CD PRO C 37 10.956 -7.332 -2.814 1.00 0.00 C ATOM 0 HA PRO C 37 10.228 -9.545 -5.096 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.172 -10.382 -3.413 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.502 -9.041 -4.491 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.701 -8.932 -1.538 1.00 0.00 H new ATOM 0 HG3 PRO C 37 12.966 -8.028 -2.347 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.480 -6.938 -1.916 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.445 -6.494 -3.310 1.00 0.00 H new ATOM 2205 N LYS C 38 9.424 -11.531 -3.723 1.00 0.00 N ATOM 2206 CA LYS C 38 8.739 -12.575 -2.969 1.00 0.00 C ATOM 2207 C LYS C 38 9.567 -13.020 -1.765 1.00 0.00 C ATOM 2208 O LYS C 38 9.141 -13.883 -1.004 1.00 0.00 O ATOM 2209 CB LYS C 38 8.356 -13.731 -3.889 1.00 0.00 C ATOM 2210 CG LYS C 38 7.229 -13.204 -4.775 1.00 0.00 C ATOM 2211 CD LYS C 38 6.540 -14.304 -5.576 1.00 0.00 C ATOM 2212 CE LYS C 38 7.485 -14.868 -6.636 1.00 0.00 C ATOM 2213 NZ LYS C 38 6.786 -15.832 -7.504 1.00 0.00 N ATOM 0 H LYS C 38 9.767 -11.823 -4.638 1.00 0.00 H new ATOM 0 HA LYS C 38 7.812 -12.169 -2.565 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.208 -14.051 -4.489 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.028 -14.597 -3.313 1.00 0.00 H new ATOM 0 HG2 LYS C 38 6.491 -12.698 -4.153 1.00 0.00 H new ATOM 0 HG3 LYS C 38 7.631 -12.459 -5.462 1.00 0.00 H new ATOM 0 HD2 LYS C 38 6.218 -15.102 -4.907 1.00 0.00 H new ATOM 0 HD3 LYS C 38 5.644 -13.907 -6.054 1.00 0.00 H new ATOM 0 HE2 LYS C 38 7.888 -14.055 -7.240 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.331 -15.355 -6.152 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 7.448 -16.202 -8.216 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 6.423 -16.618 -6.928 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 5.993 -15.358 -7.982 1.00 0.00 H new ATOM 2227 N ASP C 39 10.750 -12.424 -1.601 1.00 0.00 N ATOM 2228 CA ASP C 39 11.561 -12.597 -0.409 1.00 0.00 C ATOM 2229 C ASP C 39 10.891 -11.916 0.786 1.00 0.00 C ATOM 2230 O ASP C 39 11.297 -12.140 1.925 1.00 0.00 O ATOM 2231 CB ASP C 39 12.961 -12.023 -0.645 1.00 0.00 C ATOM 2232 CG ASP C 39 13.717 -12.828 -1.699 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.281 -13.881 -1.323 1.00 0.00 O ATOM 2234 OD2 ASP C 39 13.732 -12.392 -2.870 1.00 0.00 O ATOM 0 H ASP C 39 11.168 -11.807 -2.298 1.00 0.00 H new ATOM 0 HA ASP C 39 11.654 -13.661 -0.189 1.00 0.00 H new ATOM 0 HB2 ASP C 39 12.882 -10.984 -0.965 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.521 -12.027 0.290 1.00 0.00 H new ATOM 2239 N VAL C 40 9.866 -11.088 0.535 1.00 0.00 N ATOM 2240 CA VAL C 40 9.040 -10.529 1.593 1.00 0.00 C ATOM 2241 C VAL C 40 7.565 -10.797 1.302 1.00 0.00 C ATOM 2242 O VAL C 40 7.119 -10.788 0.154 1.00 0.00 O ATOM 2243 CB VAL C 40 9.317 -9.034 1.782 1.00 0.00 C ATOM 2244 CG1 VAL C 40 10.805 -8.784 2.026 1.00 0.00 C ATOM 2245 CG2 VAL C 40 8.861 -8.203 0.586 1.00 0.00 C ATOM 0 H VAL C 40 9.595 -10.794 -0.403 1.00 0.00 H new ATOM 0 HA VAL C 40 9.296 -11.020 2.532 1.00 0.00 H new ATOM 0 HB VAL C 40 8.741 -8.722 2.653 1.00 0.00 H new ATOM 0 HG11 VAL C 40 10.978 -7.716 2.157 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.121 -9.316 2.924 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.379 -9.142 1.171 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.080 -7.151 0.769 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.389 -8.533 -0.309 1.00 0.00 H new ATOM 0 HG23 VAL C 40 7.788 -8.331 0.442 1.00 0.00 H new ATOM 2255 N ALA C 41 6.810 -11.043 2.371 1.00 0.00 N ATOM 2256 CA ALA C 41 5.400 -11.375 2.281 1.00 0.00 C ATOM 2257 C ALA C 41 4.580 -10.152 1.879 1.00 0.00 C ATOM 2258 O ALA C 41 4.885 -9.034 2.287 1.00 0.00 O ATOM 2259 CB ALA C 41 4.940 -11.900 3.638 1.00 0.00 C ATOM 0 H ALA C 41 7.166 -11.016 3.326 1.00 0.00 H new ATOM 0 HA ALA C 41 5.252 -12.138 1.516 1.00 0.00 H new ATOM 0 HB1 ALA C 41 3.881 -12.155 3.590 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.516 -12.788 3.899 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.094 -11.132 4.396 1.00 0.00 H new ATOM 2265 N VAL C 42 3.537 -10.374 1.078 1.00 0.00 N ATOM 2266 CA VAL C 42 2.598 -9.338 0.679 1.00 0.00 C ATOM 2267 C VAL C 42 1.225 -9.985 0.529 1.00 0.00 C ATOM 2268 O VAL C 42 1.045 -10.847 -0.334 1.00 0.00 O ATOM 2269 CB VAL C 42 3.037 -8.708 -0.646 1.00 0.00 C ATOM 2270 CG1 VAL C 42 2.055 -7.616 -1.062 1.00 0.00 C ATOM 2271 CG2 VAL C 42 4.421 -8.066 -0.551 1.00 0.00 C ATOM 0 H VAL C 42 3.323 -11.291 0.686 1.00 0.00 H new ATOM 0 HA VAL C 42 2.563 -8.548 1.429 1.00 0.00 H new ATOM 0 HB VAL C 42 3.064 -9.516 -1.377 1.00 0.00 H new ATOM 0 HG11 VAL C 42 2.378 -7.176 -2.005 1.00 0.00 H new ATOM 0 HG12 VAL C 42 1.062 -8.047 -1.184 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.023 -6.844 -0.294 1.00 0.00 H new ATOM 0 HG21 VAL C 42 4.688 -7.633 -1.515 1.00 0.00 H new ATOM 0 HG22 VAL C 42 4.408 -7.283 0.207 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.155 -8.824 -0.277 1.00 0.00 H new ATOM 2281 N HIS C 43 0.266 -9.572 1.369 1.00 0.00 N ATOM 2282 CA HIS C 43 -1.077 -10.147 1.394 1.00 0.00 C ATOM 2283 C HIS C 43 -2.119 -9.105 1.797 1.00 0.00 C ATOM 2284 O HIS C 43 -1.771 -8.020 2.260 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.144 -11.282 2.425 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.132 -12.384 2.249 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.394 -13.629 1.677 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.176 -12.329 2.626 1.00 0.00 C ATOM 2289 CE1 HIS C 43 0.772 -14.297 1.721 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.732 -13.540 2.283 1.00 0.00 N ATOM 0 H HIS C 43 0.405 -8.827 2.051 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.288 -10.514 0.390 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -1.018 -10.853 3.419 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -2.141 -11.721 2.391 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.678 -11.499 3.101 1.00 0.00 H new ATOM 0 HE1 HIS C 43 0.918 -15.303 1.356 1.00 0.00 H new ATOM 0 HE2 HIS C 43 2.703 -13.816 2.429 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.401 -9.438 1.619 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.505 -8.596 2.067 1.00 0.00 C ATOM 2300 C ARG C 44 -4.632 -8.685 3.591 1.00 0.00 C ATOM 2301 O ARG C 44 -4.088 -9.603 4.204 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.797 -9.059 1.390 1.00 0.00 C ATOM 2303 CG ARG C 44 -6.289 -10.373 2.004 1.00 0.00 C ATOM 2304 CD ARG C 44 -7.479 -10.937 1.238 1.00 0.00 C ATOM 2305 NE ARG C 44 -7.040 -11.624 0.022 1.00 0.00 N ATOM 2306 CZ ARG C 44 -7.692 -12.646 -0.537 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -8.859 -13.062 -0.054 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -7.172 -13.260 -1.593 1.00 0.00 N ATOM 0 H ARG C 44 -3.698 -10.299 1.160 1.00 0.00 H new ATOM 0 HA ARG C 44 -4.316 -7.557 1.795 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.564 -8.292 1.497 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.626 -9.192 0.322 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -5.478 -11.101 2.005 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.570 -10.207 3.044 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -8.030 -11.630 1.873 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -8.164 -10.130 0.977 1.00 0.00 H new ATOM 0 HE ARG C 44 -6.182 -11.302 -0.426 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -9.270 -12.599 0.756 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -9.343 -13.845 -0.494 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -6.278 -12.950 -1.974 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -7.667 -14.041 -2.023 1.00 0.00 H new ATOM 2322 N GLU C 45 -5.345 -7.747 4.216 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.485 -7.756 5.670 1.00 0.00 C ATOM 2324 C GLU C 45 -6.418 -8.871 6.141 1.00 0.00 C ATOM 2325 O GLU C 45 -6.329 -9.311 7.285 1.00 0.00 O ATOM 2326 CB GLU C 45 -5.945 -6.382 6.169 1.00 0.00 C ATOM 2327 CG GLU C 45 -7.380 -6.023 5.763 1.00 0.00 C ATOM 2328 CD GLU C 45 -8.441 -6.659 6.661 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -8.271 -6.596 7.900 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -9.416 -7.208 6.100 1.00 0.00 O ATOM 0 H GLU C 45 -5.828 -6.982 3.745 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.507 -7.964 6.104 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -5.868 -6.356 7.256 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -5.267 -5.620 5.783 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -7.496 -4.939 5.787 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -7.549 -6.339 4.734 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.319 -9.333 5.269 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.277 -10.383 5.592 1.00 0.00 C ATOM 2339 C GLU C 46 -7.602 -11.757 5.673 1.00 0.00 C ATOM 2340 O GLU C 46 -8.218 -12.725 6.113 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.368 -10.365 4.515 1.00 0.00 C ATOM 2342 CG GLU C 46 -10.533 -11.298 4.845 1.00 0.00 C ATOM 2343 CD GLU C 46 -11.644 -11.155 3.809 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -11.388 -11.498 2.635 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -12.744 -10.705 4.199 1.00 0.00 O ATOM 0 H GLU C 46 -7.401 -8.984 4.314 1.00 0.00 H new ATOM 0 HA GLU C 46 -8.712 -10.198 6.574 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.743 -9.348 4.399 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -8.934 -10.655 3.558 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -10.183 -12.330 4.872 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -10.921 -11.067 5.837 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.336 -11.855 5.249 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.625 -13.126 5.215 1.00 0.00 C ATOM 2354 C ILE C 47 -4.255 -12.999 5.861 1.00 0.00 C ATOM 2355 O ILE C 47 -3.703 -13.992 6.324 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.544 -13.619 3.759 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.901 -14.208 3.351 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.432 -14.644 3.543 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.819 -14.937 2.007 1.00 0.00 C ATOM 0 H ILE C 47 -5.785 -11.060 4.924 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.170 -13.869 5.797 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.300 -12.762 3.131 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.244 -14.900 4.120 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.640 -13.410 3.288 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.422 -14.956 2.499 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.471 -14.197 3.797 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.608 -15.512 4.179 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.799 -15.340 1.752 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.501 -14.238 1.233 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.099 -15.752 2.078 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.668 -11.802 5.914 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.362 -11.685 6.530 1.00 0.00 C ATOM 2373 C TYR C 48 -2.440 -12.049 8.008 1.00 0.00 C ATOM 2374 O TYR C 48 -1.507 -12.616 8.569 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.824 -10.268 6.371 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.454 -10.165 6.985 1.00 0.00 C ATOM 2377 CD1 TYR C 48 0.671 -10.522 6.231 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.316 -9.732 8.311 1.00 0.00 C ATOM 2379 CE1 TYR C 48 1.947 -10.463 6.806 1.00 0.00 C ATOM 2380 CE2 TYR C 48 0.955 -9.670 8.893 1.00 0.00 C ATOM 2381 CZ TYR C 48 2.095 -10.020 8.135 1.00 0.00 C ATOM 2382 OH TYR C 48 3.336 -9.932 8.688 1.00 0.00 O ATOM 0 H TYR C 48 -4.064 -10.935 5.551 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.683 -12.376 6.031 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.779 -10.004 5.314 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.500 -9.558 6.848 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.555 -10.843 5.206 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -1.188 -9.447 8.882 1.00 0.00 H new ATOM 0 HE1 TYR C 48 2.814 -10.756 6.233 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.065 -9.355 9.920 1.00 0.00 H new ATOM 0 HH TYR C 48 4.003 -9.816 7.979 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.569 -11.719 8.638 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.762 -11.962 10.057 1.00 0.00 C ATOM 2394 C GLN C 49 -4.041 -13.435 10.338 1.00 0.00 C ATOM 2395 O GLN C 49 -3.989 -13.858 11.493 1.00 0.00 O ATOM 2396 CB GLN C 49 -4.914 -11.083 10.549 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.609 -9.622 10.209 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.684 -8.677 10.736 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.758 -8.410 11.930 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -6.527 -8.168 9.842 1.00 0.00 N ATOM 0 H GLN C 49 -4.366 -11.279 8.178 1.00 0.00 H new ATOM 0 HA GLN C 49 -2.848 -11.707 10.593 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -5.849 -11.391 10.080 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -5.043 -11.200 11.625 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.643 -9.345 10.632 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.527 -9.511 9.128 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -6.434 -8.413 8.856 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -7.266 -7.532 10.142 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.339 -14.219 9.298 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.552 -15.652 9.441 1.00 0.00 C ATOM 2411 C ARG C 50 -3.253 -16.410 9.183 1.00 0.00 C ATOM 2412 O ARG C 50 -3.065 -17.504 9.707 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.703 -16.115 8.530 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.239 -16.722 7.201 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.434 -16.964 6.280 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.323 -18.001 6.813 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.424 -18.432 6.193 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.785 -17.932 5.015 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.170 -19.375 6.755 1.00 0.00 N ATOM 0 H ARG C 50 -4.438 -13.876 8.342 1.00 0.00 H new ATOM 0 HA ARG C 50 -4.850 -15.875 10.466 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.302 -16.852 9.065 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.353 -15.265 8.322 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.528 -16.053 6.717 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.718 -17.661 7.385 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.991 -16.036 6.154 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -6.079 -17.260 5.293 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.086 -18.419 7.713 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.218 -17.209 4.573 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.629 -18.272 4.554 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -8.901 -19.768 7.657 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -10.012 -19.707 6.285 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.358 -15.826 8.379 1.00 0.00 N ATOM 2434 CA ILE C 51 -1.032 -16.376 8.128 1.00 0.00 C ATOM 2435 C ILE C 51 -0.184 -16.201 9.380 1.00 0.00 C ATOM 2436 O ILE C 51 0.454 -17.139 9.847 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.402 -15.621 6.950 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.175 -15.933 5.665 1.00 0.00 C ATOM 2439 CG2 ILE C 51 1.069 -16.006 6.744 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.762 -14.971 4.558 1.00 0.00 C ATOM 0 H ILE C 51 -2.540 -14.953 7.884 1.00 0.00 H new ATOM 0 HA ILE C 51 -1.094 -17.436 7.883 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.451 -14.557 7.181 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -0.982 -16.960 5.356 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.247 -15.851 5.847 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.476 -15.449 5.900 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.637 -15.769 7.644 1.00 0.00 H new ATOM 0 HG23 ILE C 51 1.140 -17.075 6.541 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.318 -15.202 3.649 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -0.978 -13.948 4.866 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.306 -15.074 4.366 1.00 0.00 H new ATOM 2452 N GLN C 52 -0.176 -14.984 9.926 1.00 0.00 N ATOM 2453 CA GLN C 52 0.626 -14.657 11.091 1.00 0.00 C ATOM 2454 C GLN C 52 0.031 -15.263 12.358 1.00 0.00 C ATOM 2455 O GLN C 52 0.520 -15.007 13.458 1.00 0.00 O ATOM 2456 CB GLN C 52 0.801 -13.139 11.171 1.00 0.00 C ATOM 2457 CG GLN C 52 1.572 -12.661 9.940 1.00 0.00 C ATOM 2458 CD GLN C 52 2.839 -13.470 9.719 1.00 0.00 C ATOM 2459 OE1 GLN C 52 3.769 -13.427 10.521 1.00 0.00 O ATOM 2460 NE2 GLN C 52 2.886 -14.226 8.626 1.00 0.00 N ATOM 0 H GLN C 52 -0.727 -14.203 9.569 1.00 0.00 H new ATOM 0 HA GLN C 52 1.618 -15.099 10.995 1.00 0.00 H new ATOM 0 HB2 GLN C 52 -0.172 -12.650 11.219 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.339 -12.869 12.080 1.00 0.00 H new ATOM 0 HG2 GLN C 52 0.934 -12.737 9.059 1.00 0.00 H new ATOM 0 HG3 GLN C 52 1.829 -11.608 10.058 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.096 -14.239 7.980 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.712 -14.793 8.433 1.00 0.00 H new ATOM 2469 N ALA C 53 -1.025 -16.071 12.212 1.00 0.00 N ATOM 2470 CA ALA C 53 -1.626 -16.771 13.327 1.00 0.00 C ATOM 2471 C ALA C 53 -0.733 -17.920 13.804 1.00 0.00 C ATOM 2472 O ALA C 53 -0.896 -18.403 14.927 1.00 0.00 O ATOM 2473 CB ALA C 53 -2.995 -17.303 12.918 1.00 0.00 C ATOM 0 H ALA C 53 -1.478 -16.250 11.316 1.00 0.00 H new ATOM 0 HA ALA C 53 -1.740 -16.071 14.154 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.447 -17.830 13.759 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -3.636 -16.471 12.625 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -2.883 -17.989 12.078 1.00 0.00 H new ATOM 2479 N GLY C 54 0.208 -18.364 12.963 1.00 0.00 N ATOM 2480 CA GLY C 54 1.118 -19.449 13.307 1.00 0.00 C ATOM 2481 C GLY C 54 1.233 -20.485 12.186 1.00 0.00 C ATOM 2482 O GLY C 54 1.684 -21.601 12.432 1.00 0.00 O ATOM 0 H GLY C 54 0.355 -17.980 12.030 1.00 0.00 H new ATOM 0 HA2 GLY C 54 2.105 -19.039 13.523 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.770 -19.938 14.217 1.00 0.00 H new ATOM 2486 N LEU C 55 0.826 -20.118 10.966 1.00 0.00 N ATOM 2487 CA LEU C 55 0.763 -21.023 9.830 1.00 0.00 C ATOM 2488 C LEU C 55 1.214 -20.328 8.543 1.00 0.00 C ATOM 2489 O LEU C 55 1.695 -19.199 8.581 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.670 -21.566 9.739 1.00 0.00 C ATOM 2491 CG LEU C 55 -1.735 -20.468 9.601 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -1.842 -19.951 8.167 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.086 -21.043 10.006 1.00 0.00 C ATOM 0 H LEU C 55 0.528 -19.168 10.744 1.00 0.00 H new ATOM 0 HA LEU C 55 1.451 -21.858 9.967 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.741 -22.239 8.885 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -0.883 -22.157 10.629 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.444 -19.637 10.243 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.607 -19.176 8.116 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -0.883 -19.535 7.858 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.113 -20.772 7.503 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -3.852 -20.273 9.913 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.334 -21.882 9.356 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -3.040 -21.386 11.040 1.00 0.00 H new ATOM 2505 N THR C 56 1.059 -21.003 7.401 1.00 0.00 N ATOM 2506 CA THR C 56 1.438 -20.454 6.105 1.00 0.00 C ATOM 2507 C THR C 56 0.406 -20.822 5.043 1.00 0.00 C ATOM 2508 O THR C 56 -0.525 -21.586 5.307 1.00 0.00 O ATOM 2509 CB THR C 56 2.828 -20.964 5.712 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.843 -22.376 5.690 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.877 -20.471 6.706 1.00 0.00 C ATOM 0 H THR C 56 0.668 -21.944 7.353 1.00 0.00 H new ATOM 0 HA THR C 56 1.471 -19.367 6.178 1.00 0.00 H new ATOM 0 HB THR C 56 3.062 -20.581 4.719 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.736 -22.690 5.436 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.859 -20.842 6.413 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.888 -19.381 6.713 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.634 -20.837 7.703 1.00 0.00 H new ATOM 2519 N ALA C 57 0.568 -20.278 3.833 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.338 -20.507 2.718 1.00 0.00 C ATOM 2521 C ALA C 57 -0.526 -22.001 2.443 1.00 0.00 C ATOM 2522 O ALA C 57 0.366 -22.802 2.730 1.00 0.00 O ATOM 2523 CB ALA C 57 0.221 -19.808 1.485 1.00 0.00 C ATOM 0 H ALA C 57 1.345 -19.658 3.604 1.00 0.00 H new ATOM 0 HA ALA C 57 -1.318 -20.100 2.969 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -0.448 -19.971 0.640 1.00 0.00 H new ATOM 0 HB2 ALA C 57 0.306 -18.739 1.680 1.00 0.00 H new ATOM 0 HB3 ALA C 57 1.205 -20.214 1.252 1.00 0.00 H new