USER MOD reduce.3.24.130724 H: found=0, std=0, add=672, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 669 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 38 TYR OH : rot -155:sc= 0.496 USER MOD Set 1.2: A 39 GLN : amide:sc= -4.63! C(o=-4.8!,f=-7.7!) USER MOD Set 1.3: A 84 GLN : amide:sc= -0.625 K(o=-4.8,f=-6) USER MOD Set 2.1: A 57 MET CE :methyl 175:sc= -0.0417 (180deg=0) USER MOD Set 2.2: A 65 CYS SG : rot 114:sc= 0.782 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc=-0.00771 X(o=-0.0077,f=-0.12) USER MOD Single : A 9 MET CE :methyl 165:sc=-0.00759 (180deg=-0.217) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0.093 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=-0.096) USER MOD Single : A 25 GLN : amide:sc= -0.0458 X(o=-0.046,f=-0.18) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN :FLIP amide:sc= -1.35 F(o=-2.4,f=-1.3) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 TYR OH : rot -30:sc= -1.17 USER MOD Single : A 48 SER OG : rot -46:sc= 1.14 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 55 CYS SG : rot 180:sc= -0.356 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot -80:sc= -0.833 USER MOD Single : A 64 ASN : amide:sc= -0.194 K(o=-0.19,f=-2!) USER MOD Single : A 80 GLN : amide:sc= -0.943 X(o=-0.94,f=-1.4) USER MOD Single : A 82 HIS : no HD1:sc=-0.00662 X(o=-0.0066,f=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.00411 USER MOD Single : A 90 SER OG : rot -43:sc= 1.1 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 38.149 13.398 19.583 1.00 0.00 N ATOM 2 CA GLY A 1 38.638 12.356 18.698 1.00 0.00 C ATOM 3 C GLY A 1 37.514 11.561 18.063 1.00 0.00 C ATOM 4 O GLY A 1 36.646 11.035 18.760 1.00 0.00 O ATOM 0 H1 GLY A 1 38.955 13.913 19.992 1.00 0.00 H new ATOM 0 H2 GLY A 1 37.553 14.059 19.045 1.00 0.00 H new ATOM 0 H3 GLY A 1 37.588 12.970 20.347 1.00 0.00 H new ATOM 0 HA2 GLY A 1 39.249 12.805 17.915 1.00 0.00 H new ATOM 0 HA3 GLY A 1 39.285 11.681 19.259 1.00 0.00 H new ATOM 8 N SER A 2 37.529 11.474 16.737 1.00 0.00 N ATOM 9 CA SER A 2 36.501 10.741 16.007 1.00 0.00 C ATOM 10 C SER A 2 35.127 11.366 16.231 1.00 0.00 C ATOM 11 O SER A 2 34.986 12.331 16.982 1.00 0.00 O ATOM 12 CB SER A 2 36.484 9.275 16.442 1.00 0.00 C ATOM 13 OG SER A 2 36.242 8.418 15.339 1.00 0.00 O ATOM 0 H SER A 2 38.242 11.902 16.146 1.00 0.00 H new ATOM 0 HA SER A 2 36.737 10.794 14.944 1.00 0.00 H new ATOM 0 HB2 SER A 2 37.438 9.018 16.904 1.00 0.00 H new ATOM 0 HB3 SER A 2 35.713 9.126 17.198 1.00 0.00 H new ATOM 0 HG SER A 2 36.238 7.486 15.643 1.00 0.00 H new ATOM 19 N SER A 3 34.115 10.807 15.575 1.00 0.00 N ATOM 20 CA SER A 3 32.752 11.310 15.698 1.00 0.00 C ATOM 21 C SER A 3 32.255 11.186 17.135 1.00 0.00 C ATOM 22 O SER A 3 32.323 10.115 17.737 1.00 0.00 O ATOM 23 CB SER A 3 31.818 10.549 14.756 1.00 0.00 C ATOM 24 OG SER A 3 31.389 11.375 13.687 1.00 0.00 O ATOM 0 H SER A 3 34.214 10.005 14.953 1.00 0.00 H new ATOM 0 HA SER A 3 32.754 12.365 15.422 1.00 0.00 H new ATOM 0 HB2 SER A 3 32.331 9.673 14.360 1.00 0.00 H new ATOM 0 HB3 SER A 3 30.952 10.188 15.311 1.00 0.00 H new ATOM 0 HG SER A 3 30.794 10.865 13.098 1.00 0.00 H new ATOM 30 N GLY A 4 31.755 12.291 17.680 1.00 0.00 N ATOM 31 CA GLY A 4 31.254 12.286 19.041 1.00 0.00 C ATOM 32 C GLY A 4 30.606 13.601 19.426 1.00 0.00 C ATOM 33 O GLY A 4 31.288 14.613 19.585 1.00 0.00 O ATOM 0 H GLY A 4 31.688 13.190 17.202 1.00 0.00 H new ATOM 0 HA2 GLY A 4 30.529 11.480 19.155 1.00 0.00 H new ATOM 0 HA3 GLY A 4 32.075 12.075 19.726 1.00 0.00 H new ATOM 37 N SER A 5 29.285 13.588 19.574 1.00 0.00 N ATOM 38 CA SER A 5 28.545 14.790 19.937 1.00 0.00 C ATOM 39 C SER A 5 27.239 14.432 20.640 1.00 0.00 C ATOM 40 O SER A 5 26.267 15.186 20.588 1.00 0.00 O ATOM 41 CB SER A 5 28.253 15.630 18.692 1.00 0.00 C ATOM 42 OG SER A 5 27.242 15.033 17.899 1.00 0.00 O ATOM 0 H SER A 5 28.706 12.758 19.448 1.00 0.00 H new ATOM 0 HA SER A 5 29.160 15.372 20.624 1.00 0.00 H new ATOM 0 HB2 SER A 5 27.942 16.631 18.990 1.00 0.00 H new ATOM 0 HB3 SER A 5 29.163 15.741 18.103 1.00 0.00 H new ATOM 0 HG SER A 5 27.073 15.590 17.111 1.00 0.00 H new ATOM 48 N SER A 6 27.225 13.277 21.297 1.00 0.00 N ATOM 49 CA SER A 6 26.038 12.816 22.007 1.00 0.00 C ATOM 50 C SER A 6 25.573 13.857 23.021 1.00 0.00 C ATOM 51 O SER A 6 26.373 14.396 23.785 1.00 0.00 O ATOM 52 CB SER A 6 26.325 11.490 22.716 1.00 0.00 C ATOM 53 OG SER A 6 26.715 10.492 21.790 1.00 0.00 O ATOM 0 H SER A 6 28.022 12.643 21.352 1.00 0.00 H new ATOM 0 HA SER A 6 25.243 12.665 21.276 1.00 0.00 H new ATOM 0 HB2 SER A 6 27.113 11.632 23.456 1.00 0.00 H new ATOM 0 HB3 SER A 6 25.436 11.163 23.256 1.00 0.00 H new ATOM 0 HG SER A 6 26.894 9.655 22.267 1.00 0.00 H new ATOM 59 N GLY A 7 24.273 14.135 23.021 1.00 0.00 N ATOM 60 CA GLY A 7 23.723 15.110 23.944 1.00 0.00 C ATOM 61 C GLY A 7 22.280 15.455 23.632 1.00 0.00 C ATOM 62 O GLY A 7 21.911 16.629 23.595 1.00 0.00 O ATOM 0 H GLY A 7 23.591 13.702 22.398 1.00 0.00 H new ATOM 0 HA2 GLY A 7 23.789 14.721 24.960 1.00 0.00 H new ATOM 0 HA3 GLY A 7 24.326 16.018 23.911 1.00 0.00 H new ATOM 66 N GLN A 8 21.464 14.431 23.404 1.00 0.00 N ATOM 67 CA GLN A 8 20.055 14.633 23.091 1.00 0.00 C ATOM 68 C GLN A 8 19.251 13.363 23.354 1.00 0.00 C ATOM 69 O GLN A 8 19.496 12.324 22.742 1.00 0.00 O ATOM 70 CB GLN A 8 19.891 15.060 21.631 1.00 0.00 C ATOM 71 CG GLN A 8 19.575 16.538 21.462 1.00 0.00 C ATOM 72 CD GLN A 8 18.244 16.775 20.777 1.00 0.00 C ATOM 73 OE1 GLN A 8 17.243 16.135 21.102 1.00 0.00 O ATOM 74 NE2 GLN A 8 18.224 17.698 19.823 1.00 0.00 N ATOM 0 H GLN A 8 21.755 13.454 23.430 1.00 0.00 H new ATOM 0 HA GLN A 8 19.675 15.423 23.739 1.00 0.00 H new ATOM 0 HB2 GLN A 8 20.807 14.828 21.088 1.00 0.00 H new ATOM 0 HB3 GLN A 8 19.094 14.472 21.176 1.00 0.00 H new ATOM 0 HG2 GLN A 8 19.566 17.018 22.441 1.00 0.00 H new ATOM 0 HG3 GLN A 8 20.367 17.011 20.882 1.00 0.00 H new ATOM 0 HE21 GLN A 8 19.077 18.205 19.586 1.00 0.00 H new ATOM 0 HE22 GLN A 8 17.356 17.900 19.327 1.00 0.00 H new ATOM 83 N MET A 9 18.292 13.455 24.270 1.00 0.00 N ATOM 84 CA MET A 9 17.452 12.314 24.613 1.00 0.00 C ATOM 85 C MET A 9 16.068 12.772 25.059 1.00 0.00 C ATOM 86 O MET A 9 15.430 12.130 25.894 1.00 0.00 O ATOM 87 CB MET A 9 18.109 11.485 25.718 1.00 0.00 C ATOM 88 CG MET A 9 17.638 10.040 25.756 1.00 0.00 C ATOM 89 SD MET A 9 18.011 9.227 27.321 1.00 0.00 S ATOM 90 CE MET A 9 16.785 9.974 28.392 1.00 0.00 C ATOM 0 H MET A 9 18.078 14.307 24.787 1.00 0.00 H new ATOM 0 HA MET A 9 17.340 11.696 23.722 1.00 0.00 H new ATOM 0 HB2 MET A 9 19.190 11.503 25.580 1.00 0.00 H new ATOM 0 HB3 MET A 9 17.903 11.951 26.682 1.00 0.00 H new ATOM 0 HG2 MET A 9 16.562 10.008 25.582 1.00 0.00 H new ATOM 0 HG3 MET A 9 18.109 9.487 24.943 1.00 0.00 H new ATOM 0 HE1 MET A 9 16.705 9.396 29.312 1.00 0.00 H new ATOM 0 HE2 MET A 9 17.083 10.995 28.630 1.00 0.00 H new ATOM 0 HE3 MET A 9 15.819 9.987 27.886 1.00 0.00 H new ATOM 100 N SER A 10 15.609 13.887 24.499 1.00 0.00 N ATOM 101 CA SER A 10 14.301 14.433 24.842 1.00 0.00 C ATOM 102 C SER A 10 13.426 14.569 23.600 1.00 0.00 C ATOM 103 O SER A 10 12.777 15.596 23.393 1.00 0.00 O ATOM 104 CB SER A 10 14.457 15.795 25.522 1.00 0.00 C ATOM 105 OG SER A 10 15.639 15.843 26.303 1.00 0.00 O ATOM 0 H SER A 10 16.124 14.430 23.806 1.00 0.00 H new ATOM 0 HA SER A 10 13.816 13.743 25.532 1.00 0.00 H new ATOM 0 HB2 SER A 10 14.484 16.581 24.767 1.00 0.00 H new ATOM 0 HB3 SER A 10 13.591 15.990 26.155 1.00 0.00 H new ATOM 0 HG SER A 10 15.716 16.724 26.725 1.00 0.00 H new ATOM 111 N LEU A 11 13.413 13.527 22.776 1.00 0.00 N ATOM 112 CA LEU A 11 12.618 13.529 21.553 1.00 0.00 C ATOM 113 C LEU A 11 11.137 13.338 21.866 1.00 0.00 C ATOM 114 O LEU A 11 10.272 13.749 21.094 1.00 0.00 O ATOM 115 CB LEU A 11 13.097 12.425 20.608 1.00 0.00 C ATOM 116 CG LEU A 11 13.970 12.877 19.437 1.00 0.00 C ATOM 117 CD1 LEU A 11 13.224 13.880 18.571 1.00 0.00 C ATOM 118 CD2 LEU A 11 15.275 13.474 19.944 1.00 0.00 C ATOM 0 H LEU A 11 13.944 12.670 22.933 1.00 0.00 H new ATOM 0 HA LEU A 11 12.746 14.496 21.067 1.00 0.00 H new ATOM 0 HB2 LEU A 11 13.656 11.693 21.191 1.00 0.00 H new ATOM 0 HB3 LEU A 11 12.222 11.913 20.207 1.00 0.00 H new ATOM 0 HG LEU A 11 14.205 12.005 18.827 1.00 0.00 H new ATOM 0 HD11 LEU A 11 13.861 14.190 17.743 1.00 0.00 H new ATOM 0 HD12 LEU A 11 12.318 13.419 18.179 1.00 0.00 H new ATOM 0 HD13 LEU A 11 12.958 14.751 19.170 1.00 0.00 H new ATOM 0 HD21 LEU A 11 15.884 13.790 19.097 1.00 0.00 H new ATOM 0 HD22 LEU A 11 15.060 14.335 20.577 1.00 0.00 H new ATOM 0 HD23 LEU A 11 15.818 12.725 20.521 1.00 0.00 H new ATOM 130 N GLU A 12 10.854 12.714 23.006 1.00 0.00 N ATOM 131 CA GLU A 12 9.477 12.471 23.421 1.00 0.00 C ATOM 132 C GLU A 12 9.292 12.787 24.902 1.00 0.00 C ATOM 133 O GLU A 12 10.259 12.849 25.661 1.00 0.00 O ATOM 134 CB GLU A 12 9.088 11.017 23.146 1.00 0.00 C ATOM 135 CG GLU A 12 9.282 10.598 21.699 1.00 0.00 C ATOM 136 CD GLU A 12 9.094 9.107 21.492 1.00 0.00 C ATOM 137 OE1 GLU A 12 9.442 8.333 22.408 1.00 0.00 O ATOM 138 OE2 GLU A 12 8.598 8.716 20.415 1.00 0.00 O ATOM 0 H GLU A 12 11.559 12.368 23.657 1.00 0.00 H new ATOM 0 HA GLU A 12 8.828 13.129 22.843 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.680 10.364 23.787 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.043 10.871 23.421 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.576 11.140 21.070 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.282 10.883 21.373 1.00 0.00 H new ATOM 145 N GLY A 13 8.041 12.988 25.307 1.00 0.00 N ATOM 146 CA GLY A 13 7.751 13.296 26.695 1.00 0.00 C ATOM 147 C GLY A 13 6.299 13.672 26.913 1.00 0.00 C ATOM 148 O GLY A 13 5.983 14.832 27.183 1.00 0.00 O ATOM 0 H GLY A 13 7.224 12.943 24.698 1.00 0.00 H new ATOM 0 HA2 GLY A 13 7.997 12.434 27.315 1.00 0.00 H new ATOM 0 HA3 GLY A 13 8.389 14.117 27.023 1.00 0.00 H new ATOM 152 N THR A 14 5.410 12.690 26.796 1.00 0.00 N ATOM 153 CA THR A 14 3.984 12.924 26.979 1.00 0.00 C ATOM 154 C THR A 14 3.258 11.635 27.347 1.00 0.00 C ATOM 155 O THR A 14 3.540 10.574 26.792 1.00 0.00 O ATOM 156 CB THR A 14 3.343 13.516 25.710 1.00 0.00 C ATOM 157 OG1 THR A 14 1.923 13.603 25.872 1.00 0.00 O ATOM 158 CG2 THR A 14 3.668 12.664 24.492 1.00 0.00 C ATOM 0 H THR A 14 5.654 11.724 26.575 1.00 0.00 H new ATOM 0 HA THR A 14 3.884 13.640 27.795 1.00 0.00 H new ATOM 0 HB THR A 14 3.752 14.515 25.556 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.524 13.982 25.061 1.00 0.00 H new ATOM 0 HG21 THR A 14 3.205 13.102 23.608 1.00 0.00 H new ATOM 0 HG22 THR A 14 4.748 12.624 24.354 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.284 11.655 24.641 1.00 0.00 H new ATOM 166 N GLU A 15 2.322 11.735 28.286 1.00 0.00 N ATOM 167 CA GLU A 15 1.556 10.575 28.727 1.00 0.00 C ATOM 168 C GLU A 15 0.057 10.835 28.605 1.00 0.00 C ATOM 169 O GLU A 15 -0.449 11.852 29.081 1.00 0.00 O ATOM 170 CB GLU A 15 1.908 10.224 30.174 1.00 0.00 C ATOM 171 CG GLU A 15 3.274 9.575 30.327 1.00 0.00 C ATOM 172 CD GLU A 15 3.292 8.135 29.852 1.00 0.00 C ATOM 173 OE1 GLU A 15 2.965 7.240 30.660 1.00 0.00 O ATOM 174 OE2 GLU A 15 3.632 7.902 28.674 1.00 0.00 O ATOM 0 H GLU A 15 2.076 12.607 28.756 1.00 0.00 H new ATOM 0 HA GLU A 15 1.815 9.734 28.084 1.00 0.00 H new ATOM 0 HB2 GLU A 15 1.876 11.131 30.777 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.148 9.551 30.571 1.00 0.00 H new ATOM 0 HG2 GLU A 15 4.010 10.149 29.764 1.00 0.00 H new ATOM 0 HG3 GLU A 15 3.575 9.612 31.374 1.00 0.00 H new ATOM 181 N LYS A 16 -0.648 9.909 27.965 1.00 0.00 N ATOM 182 CA LYS A 16 -2.088 10.035 27.780 1.00 0.00 C ATOM 183 C LYS A 16 -2.423 11.254 26.926 1.00 0.00 C ATOM 184 O LYS A 16 -1.530 11.942 26.433 1.00 0.00 O ATOM 185 CB LYS A 16 -2.790 10.141 29.136 1.00 0.00 C ATOM 186 CG LYS A 16 -3.855 9.080 29.354 1.00 0.00 C ATOM 187 CD LYS A 16 -3.240 7.711 29.587 1.00 0.00 C ATOM 188 CE LYS A 16 -4.238 6.597 29.311 1.00 0.00 C ATOM 189 NZ LYS A 16 -3.673 5.256 29.626 1.00 0.00 N ATOM 0 H LYS A 16 -0.245 9.062 27.565 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.442 9.143 27.263 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -2.045 10.064 29.928 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -3.248 11.126 29.223 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -4.472 9.353 30.210 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.514 9.041 28.486 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -2.369 7.588 28.943 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -2.889 7.639 30.616 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -5.138 6.760 29.904 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -4.537 6.628 28.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.384 4.524 29.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -2.829 5.089 29.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.411 5.217 30.632 1.00 0.00 H new ATOM 203 N ALA A 17 -3.715 11.516 26.757 1.00 0.00 N ATOM 204 CA ALA A 17 -4.166 12.654 25.966 1.00 0.00 C ATOM 205 C ALA A 17 -4.500 13.844 26.858 1.00 0.00 C ATOM 206 O ALA A 17 -5.134 13.691 27.903 1.00 0.00 O ATOM 207 CB ALA A 17 -5.374 12.266 25.126 1.00 0.00 C ATOM 0 H ALA A 17 -4.467 10.956 27.157 1.00 0.00 H new ATOM 0 HA ALA A 17 -3.354 12.948 25.301 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.701 13.125 24.540 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.104 11.451 24.455 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -6.184 11.944 25.780 1.00 0.00 H new ATOM 213 N SER A 18 -4.070 15.030 26.440 1.00 0.00 N ATOM 214 CA SER A 18 -4.320 16.247 27.204 1.00 0.00 C ATOM 215 C SER A 18 -5.817 16.508 27.336 1.00 0.00 C ATOM 216 O SER A 18 -6.252 17.264 28.205 1.00 0.00 O ATOM 217 CB SER A 18 -3.638 17.443 26.536 1.00 0.00 C ATOM 218 OG SER A 18 -3.385 17.185 25.166 1.00 0.00 O ATOM 0 H SER A 18 -3.547 15.174 25.576 1.00 0.00 H new ATOM 0 HA SER A 18 -3.904 16.112 28.202 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.269 18.326 26.633 1.00 0.00 H new ATOM 0 HB3 SER A 18 -2.701 17.664 27.047 1.00 0.00 H new ATOM 0 HG SER A 18 -2.951 17.965 24.761 1.00 0.00 H new ATOM 224 N TRP A 19 -6.599 15.878 26.467 1.00 0.00 N ATOM 225 CA TRP A 19 -8.048 16.042 26.484 1.00 0.00 C ATOM 226 C TRP A 19 -8.735 14.762 26.948 1.00 0.00 C ATOM 227 O TRP A 19 -9.932 14.574 26.729 1.00 0.00 O ATOM 228 CB TRP A 19 -8.555 16.433 25.095 1.00 0.00 C ATOM 229 CG TRP A 19 -7.943 15.626 23.991 1.00 0.00 C ATOM 230 CD1 TRP A 19 -6.828 15.939 23.267 1.00 0.00 C ATOM 231 CD2 TRP A 19 -8.414 14.372 23.484 1.00 0.00 C ATOM 232 NE1 TRP A 19 -6.577 14.956 22.340 1.00 0.00 N ATOM 233 CE2 TRP A 19 -7.535 13.983 22.453 1.00 0.00 C ATOM 234 CE3 TRP A 19 -9.490 13.540 23.800 1.00 0.00 C ATOM 235 CZ2 TRP A 19 -7.703 12.800 21.740 1.00 0.00 C ATOM 236 CZ3 TRP A 19 -9.655 12.365 23.091 1.00 0.00 C ATOM 237 CH2 TRP A 19 -8.765 12.004 22.071 1.00 0.00 C ATOM 0 H TRP A 19 -6.254 15.249 25.742 1.00 0.00 H new ATOM 0 HA TRP A 19 -8.290 16.838 27.188 1.00 0.00 H new ATOM 0 HB2 TRP A 19 -9.638 16.314 25.065 1.00 0.00 H new ATOM 0 HB3 TRP A 19 -8.345 17.489 24.923 1.00 0.00 H new ATOM 0 HD1 TRP A 19 -6.231 16.829 23.403 1.00 0.00 H new ATOM 0 HE1 TRP A 19 -5.803 14.951 21.676 1.00 0.00 H new ATOM 0 HE3 TRP A 19 -10.181 13.810 24.585 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 -7.019 12.520 20.953 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 -10.484 11.714 23.327 1.00 0.00 H new ATOM 0 HH2 TRP A 19 -8.920 11.079 21.536 1.00 0.00 H new ATOM 248 N LEU A 20 -7.971 13.885 27.589 1.00 0.00 N ATOM 249 CA LEU A 20 -8.507 12.621 28.084 1.00 0.00 C ATOM 250 C LEU A 20 -8.767 12.691 29.586 1.00 0.00 C ATOM 251 O LEU A 20 -7.861 12.966 30.371 1.00 0.00 O ATOM 252 CB LEU A 20 -7.539 11.478 27.776 1.00 0.00 C ATOM 253 CG LEU A 20 -7.903 10.593 26.583 1.00 0.00 C ATOM 254 CD1 LEU A 20 -6.849 9.517 26.375 1.00 0.00 C ATOM 255 CD2 LEU A 20 -9.275 9.967 26.784 1.00 0.00 C ATOM 0 H LEU A 20 -6.979 14.025 27.778 1.00 0.00 H new ATOM 0 HA LEU A 20 -9.454 12.433 27.578 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -6.551 11.903 27.599 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -7.461 10.846 28.661 1.00 0.00 H new ATOM 0 HG LEU A 20 -7.937 11.216 25.689 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -7.125 8.897 25.522 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -5.883 9.985 26.186 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -6.782 8.896 27.268 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -9.518 9.340 25.926 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -9.268 9.358 27.688 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -10.023 10.754 26.883 1.00 0.00 H new ATOM 267 N GLY A 21 -10.012 12.439 29.978 1.00 0.00 N ATOM 268 CA GLY A 21 -10.369 12.476 31.384 1.00 0.00 C ATOM 269 C GLY A 21 -11.320 13.611 31.711 1.00 0.00 C ATOM 270 O GLY A 21 -11.986 13.592 32.745 1.00 0.00 O ATOM 0 H GLY A 21 -10.780 12.210 29.347 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -10.829 11.528 31.664 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -9.464 12.580 31.983 1.00 0.00 H new ATOM 274 N GLU A 22 -11.382 14.602 30.827 1.00 0.00 N ATOM 275 CA GLU A 22 -12.257 15.751 31.029 1.00 0.00 C ATOM 276 C GLU A 22 -13.243 15.894 29.873 1.00 0.00 C ATOM 277 O GLU A 22 -12.903 15.634 28.719 1.00 0.00 O ATOM 278 CB GLU A 22 -11.431 17.031 31.171 1.00 0.00 C ATOM 279 CG GLU A 22 -12.217 18.204 31.733 1.00 0.00 C ATOM 280 CD GLU A 22 -12.524 18.047 33.209 1.00 0.00 C ATOM 281 OE1 GLU A 22 -11.692 17.453 33.928 1.00 0.00 O ATOM 282 OE2 GLU A 22 -13.594 18.518 33.647 1.00 0.00 O ATOM 0 H GLU A 22 -10.837 14.632 29.965 1.00 0.00 H new ATOM 0 HA GLU A 22 -12.821 15.588 31.947 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -10.578 16.832 31.819 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -11.032 17.306 30.195 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -11.651 19.123 31.579 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -13.151 18.309 31.181 1.00 0.00 H new ATOM 289 N GLN A 23 -14.464 16.310 30.192 1.00 0.00 N ATOM 290 CA GLN A 23 -15.499 16.487 29.181 1.00 0.00 C ATOM 291 C GLN A 23 -15.067 17.507 28.133 1.00 0.00 C ATOM 292 O GLN A 23 -14.170 18.320 28.355 1.00 0.00 O ATOM 293 CB GLN A 23 -16.809 16.932 29.833 1.00 0.00 C ATOM 294 CG GLN A 23 -17.687 15.776 30.284 1.00 0.00 C ATOM 295 CD GLN A 23 -18.898 16.235 31.073 1.00 0.00 C ATOM 296 OE1 GLN A 23 -19.569 17.198 30.698 1.00 0.00 O ATOM 297 NE2 GLN A 23 -19.185 15.548 32.172 1.00 0.00 N ATOM 0 H GLN A 23 -14.761 16.531 31.143 1.00 0.00 H new ATOM 0 HA GLN A 23 -15.655 15.528 28.686 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -16.582 17.562 30.693 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -17.367 17.547 29.126 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -18.019 15.215 29.411 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -17.097 15.094 30.896 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -18.602 14.757 32.446 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -19.988 15.811 32.743 1.00 0.00 H new ATOM 306 N PRO A 24 -15.720 17.465 26.961 1.00 0.00 N ATOM 307 CA PRO A 24 -15.420 18.380 25.855 1.00 0.00 C ATOM 308 C PRO A 24 -15.849 19.812 26.155 1.00 0.00 C ATOM 309 O PRO A 24 -15.532 20.734 25.404 1.00 0.00 O ATOM 310 CB PRO A 24 -16.236 17.809 24.693 1.00 0.00 C ATOM 311 CG PRO A 24 -17.355 17.071 25.341 1.00 0.00 C ATOM 312 CD PRO A 24 -16.800 16.522 26.627 1.00 0.00 C ATOM 0 HA PRO A 24 -14.350 18.441 25.654 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.608 18.602 24.044 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -15.632 17.147 24.073 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -18.200 17.733 25.532 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -17.717 16.269 24.698 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -17.558 16.486 27.409 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -16.423 15.507 26.501 1.00 0.00 H new ATOM 320 N GLN A 25 -16.572 19.990 27.256 1.00 0.00 N ATOM 321 CA GLN A 25 -17.045 21.311 27.654 1.00 0.00 C ATOM 322 C GLN A 25 -15.979 22.052 28.455 1.00 0.00 C ATOM 323 O GLN A 25 -15.971 23.282 28.508 1.00 0.00 O ATOM 324 CB GLN A 25 -18.328 21.190 28.478 1.00 0.00 C ATOM 325 CG GLN A 25 -19.341 20.224 27.887 1.00 0.00 C ATOM 326 CD GLN A 25 -20.736 20.813 27.815 1.00 0.00 C ATOM 327 OE1 GLN A 25 -20.922 21.947 27.374 1.00 0.00 O ATOM 328 NE2 GLN A 25 -21.727 20.043 28.249 1.00 0.00 N ATOM 0 H GLN A 25 -16.843 19.237 27.888 1.00 0.00 H new ATOM 0 HA GLN A 25 -17.256 21.882 26.750 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -18.073 20.864 29.486 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -18.787 22.175 28.568 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -19.021 19.935 26.886 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -19.365 19.315 28.489 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -21.528 19.109 28.607 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -22.687 20.386 28.225 1.00 0.00 H new ATOM 337 N PHE A 26 -15.082 21.295 29.078 1.00 0.00 N ATOM 338 CA PHE A 26 -14.012 21.880 29.878 1.00 0.00 C ATOM 339 C PHE A 26 -12.658 21.686 29.201 1.00 0.00 C ATOM 340 O PHE A 26 -11.681 21.301 29.843 1.00 0.00 O ATOM 341 CB PHE A 26 -13.991 21.255 31.275 1.00 0.00 C ATOM 342 CG PHE A 26 -15.283 21.418 32.023 1.00 0.00 C ATOM 343 CD1 PHE A 26 -16.317 20.512 31.851 1.00 0.00 C ATOM 344 CD2 PHE A 26 -15.463 22.475 32.900 1.00 0.00 C ATOM 345 CE1 PHE A 26 -17.507 20.659 32.538 1.00 0.00 C ATOM 346 CE2 PHE A 26 -16.651 22.627 33.591 1.00 0.00 C ATOM 347 CZ PHE A 26 -17.674 21.718 33.410 1.00 0.00 C ATOM 0 H PHE A 26 -15.075 20.276 29.044 1.00 0.00 H new ATOM 0 HA PHE A 26 -14.203 22.949 29.969 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -13.763 20.193 31.186 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -13.185 21.706 31.854 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -16.192 19.681 31.172 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.666 23.189 33.046 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -18.306 19.947 32.394 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.778 23.456 34.272 1.00 0.00 H new ATOM 0 HZ PHE A 26 -18.603 21.834 33.949 1.00 0.00 H new ATOM 357 N TRP A 27 -12.609 21.956 27.902 1.00 0.00 N ATOM 358 CA TRP A 27 -11.376 21.810 27.137 1.00 0.00 C ATOM 359 C TRP A 27 -10.669 23.152 26.984 1.00 0.00 C ATOM 360 O TRP A 27 -11.300 24.207 27.047 1.00 0.00 O ATOM 361 CB TRP A 27 -11.673 21.217 25.759 1.00 0.00 C ATOM 362 CG TRP A 27 -11.774 19.721 25.766 1.00 0.00 C ATOM 363 CD1 TRP A 27 -11.758 18.904 26.860 1.00 0.00 C ATOM 364 CD2 TRP A 27 -11.905 18.866 24.625 1.00 0.00 C ATOM 365 NE1 TRP A 27 -11.871 17.591 26.467 1.00 0.00 N ATOM 366 CE2 TRP A 27 -11.963 17.542 25.102 1.00 0.00 C ATOM 367 CE3 TRP A 27 -11.980 19.090 23.248 1.00 0.00 C ATOM 368 CZ2 TRP A 27 -12.092 16.449 24.249 1.00 0.00 C ATOM 369 CZ3 TRP A 27 -12.107 18.004 22.402 1.00 0.00 C ATOM 370 CH2 TRP A 27 -12.163 16.697 22.905 1.00 0.00 C ATOM 0 H TRP A 27 -13.409 22.277 27.356 1.00 0.00 H new ATOM 0 HA TRP A 27 -10.718 21.133 27.682 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -12.607 21.635 25.385 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -10.888 21.518 25.065 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -11.670 19.239 27.883 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -11.884 16.784 27.091 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -11.939 20.094 22.851 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -12.135 15.441 24.634 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -12.164 18.165 21.336 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -12.264 15.869 22.219 1.00 0.00 H new ATOM 381 N SER A 28 -9.356 23.105 26.784 1.00 0.00 N ATOM 382 CA SER A 28 -8.562 24.318 26.626 1.00 0.00 C ATOM 383 C SER A 28 -8.269 24.587 25.153 1.00 0.00 C ATOM 384 O SER A 28 -8.504 23.736 24.295 1.00 0.00 O ATOM 385 CB SER A 28 -7.251 24.201 27.405 1.00 0.00 C ATOM 386 OG SER A 28 -7.359 24.813 28.679 1.00 0.00 O ATOM 0 H SER A 28 -8.819 22.240 26.727 1.00 0.00 H new ATOM 0 HA SER A 28 -9.138 25.154 27.023 1.00 0.00 H new ATOM 0 HB2 SER A 28 -6.987 23.150 27.524 1.00 0.00 H new ATOM 0 HB3 SER A 28 -6.445 24.670 26.840 1.00 0.00 H new ATOM 0 HG SER A 28 -6.509 24.723 29.158 1.00 0.00 H new ATOM 392 N LYS A 29 -7.753 25.777 24.867 1.00 0.00 N ATOM 393 CA LYS A 29 -7.425 26.161 23.499 1.00 0.00 C ATOM 394 C LYS A 29 -6.413 25.195 22.890 1.00 0.00 C ATOM 395 O LYS A 29 -6.373 25.005 21.674 1.00 0.00 O ATOM 396 CB LYS A 29 -6.868 27.586 23.466 1.00 0.00 C ATOM 397 CG LYS A 29 -7.900 28.650 23.794 1.00 0.00 C ATOM 398 CD LYS A 29 -7.285 29.807 24.563 1.00 0.00 C ATOM 399 CE LYS A 29 -8.310 30.892 24.853 1.00 0.00 C ATOM 400 NZ LYS A 29 -7.681 32.238 24.951 1.00 0.00 N ATOM 0 H LYS A 29 -7.553 26.493 25.565 1.00 0.00 H new ATOM 0 HA LYS A 29 -8.340 26.121 22.909 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.043 27.661 24.175 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.457 27.784 22.476 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -8.346 29.022 22.872 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -8.705 28.208 24.382 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.867 29.440 25.500 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.460 30.229 23.989 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -9.063 30.900 24.065 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.826 30.664 25.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.413 32.950 25.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.980 32.239 25.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.210 32.467 24.053 1.00 0.00 H new ATOM 414 N THR A 30 -5.597 24.584 23.744 1.00 0.00 N ATOM 415 CA THR A 30 -4.587 23.637 23.291 1.00 0.00 C ATOM 416 C THR A 30 -5.174 22.239 23.133 1.00 0.00 C ATOM 417 O THR A 30 -4.840 21.519 22.193 1.00 0.00 O ATOM 418 CB THR A 30 -3.397 23.574 24.268 1.00 0.00 C ATOM 419 OG1 THR A 30 -3.188 24.858 24.867 1.00 0.00 O ATOM 420 CG2 THR A 30 -2.131 23.131 23.551 1.00 0.00 C ATOM 0 H THR A 30 -5.617 24.729 24.753 1.00 0.00 H new ATOM 0 HA THR A 30 -4.235 23.991 22.322 1.00 0.00 H new ATOM 0 HB THR A 30 -3.630 22.845 25.044 1.00 0.00 H new ATOM 0 HG1 THR A 30 -2.431 24.810 25.488 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.305 23.094 24.261 1.00 0.00 H new ATOM 0 HG22 THR A 30 -2.284 22.141 23.120 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.896 23.840 22.757 1.00 0.00 H new ATOM 428 N GLN A 31 -6.050 21.863 24.059 1.00 0.00 N ATOM 429 CA GLN A 31 -6.684 20.550 24.021 1.00 0.00 C ATOM 430 C GLN A 31 -7.430 20.343 22.707 1.00 0.00 C ATOM 431 O GLN A 31 -7.306 19.297 22.069 1.00 0.00 O ATOM 432 CB GLN A 31 -7.647 20.392 25.199 1.00 0.00 C ATOM 433 CG GLN A 31 -6.957 20.386 26.553 1.00 0.00 C ATOM 434 CD GLN A 31 -7.928 20.203 27.703 1.00 0.00 C ATOM 435 OE1 GLN A 31 -8.811 19.219 27.581 1.00 0.00 O flip ATOM 436 NE2 GLN A 31 -7.886 20.939 28.689 1.00 0.00 N flip ATOM 0 H GLN A 31 -6.337 22.448 24.844 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.902 19.794 24.096 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.374 21.204 25.175 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -8.204 19.462 25.080 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -6.218 19.585 26.576 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -6.416 21.323 26.685 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -7.190 21.683 28.741 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -8.547 20.805 29.454 1.00 0.00 H new ATOM 445 N VAL A 32 -8.205 21.346 22.308 1.00 0.00 N ATOM 446 CA VAL A 32 -8.971 21.275 21.070 1.00 0.00 C ATOM 447 C VAL A 32 -8.075 20.917 19.889 1.00 0.00 C ATOM 448 O VAL A 32 -8.230 19.859 19.276 1.00 0.00 O ATOM 449 CB VAL A 32 -9.684 22.607 20.773 1.00 0.00 C ATOM 450 CG1 VAL A 32 -10.452 22.522 19.462 1.00 0.00 C ATOM 451 CG2 VAL A 32 -10.610 22.983 21.920 1.00 0.00 C ATOM 0 H VAL A 32 -8.319 22.218 22.825 1.00 0.00 H new ATOM 0 HA VAL A 32 -9.719 20.494 21.206 1.00 0.00 H new ATOM 0 HB VAL A 32 -8.930 23.388 20.674 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -10.949 23.473 19.269 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -9.760 22.303 18.649 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.197 21.730 19.528 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -11.106 23.927 21.693 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -11.359 22.203 22.053 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -10.030 23.089 22.836 1.00 0.00 H new ATOM 461 N LEU A 33 -7.137 21.803 19.576 1.00 0.00 N ATOM 462 CA LEU A 33 -6.213 21.581 18.468 1.00 0.00 C ATOM 463 C LEU A 33 -5.501 20.240 18.614 1.00 0.00 C ATOM 464 O LEU A 33 -5.119 19.618 17.623 1.00 0.00 O ATOM 465 CB LEU A 33 -5.186 22.712 18.400 1.00 0.00 C ATOM 466 CG LEU A 33 -5.729 24.090 18.019 1.00 0.00 C ATOM 467 CD1 LEU A 33 -4.920 25.188 18.691 1.00 0.00 C ATOM 468 CD2 LEU A 33 -5.720 24.267 16.507 1.00 0.00 C ATOM 0 H LEU A 33 -6.995 22.682 20.073 1.00 0.00 H new ATOM 0 HA LEU A 33 -6.790 21.567 17.543 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.698 22.792 19.372 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.417 22.435 17.679 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.759 24.162 18.368 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.321 26.161 18.408 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -4.978 25.072 19.773 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -3.879 25.119 18.374 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.110 25.253 16.254 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.699 24.174 16.136 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.345 23.501 16.047 1.00 0.00 H new ATOM 480 N ASP A 34 -5.328 19.800 19.855 1.00 0.00 N ATOM 481 CA ASP A 34 -4.664 18.531 20.131 1.00 0.00 C ATOM 482 C ASP A 34 -5.577 17.356 19.793 1.00 0.00 C ATOM 483 O ASP A 34 -5.109 16.288 19.399 1.00 0.00 O ATOM 484 CB ASP A 34 -4.243 18.459 21.600 1.00 0.00 C ATOM 485 CG ASP A 34 -2.789 18.835 21.804 1.00 0.00 C ATOM 486 OD1 ASP A 34 -2.510 20.035 22.012 1.00 0.00 O ATOM 487 OD2 ASP A 34 -1.929 17.931 21.755 1.00 0.00 O ATOM 0 H ASP A 34 -5.638 20.303 20.686 1.00 0.00 H new ATOM 0 HA ASP A 34 -3.775 18.471 19.503 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -4.874 19.125 22.189 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -4.410 17.449 21.974 1.00 0.00 H new ATOM 492 N TRP A 35 -6.879 17.561 19.951 1.00 0.00 N ATOM 493 CA TRP A 35 -7.858 16.518 19.663 1.00 0.00 C ATOM 494 C TRP A 35 -8.054 16.355 18.160 1.00 0.00 C ATOM 495 O TRP A 35 -8.320 15.255 17.675 1.00 0.00 O ATOM 496 CB TRP A 35 -9.194 16.845 20.332 1.00 0.00 C ATOM 497 CG TRP A 35 -10.303 15.922 19.925 1.00 0.00 C ATOM 498 CD1 TRP A 35 -10.499 14.639 20.349 1.00 0.00 C ATOM 499 CD2 TRP A 35 -11.367 16.212 19.012 1.00 0.00 C ATOM 500 NE1 TRP A 35 -11.621 14.114 19.755 1.00 0.00 N ATOM 501 CE2 TRP A 35 -12.172 15.059 18.931 1.00 0.00 C ATOM 502 CE3 TRP A 35 -11.720 17.334 18.257 1.00 0.00 C ATOM 503 CZ2 TRP A 35 -13.305 14.998 18.124 1.00 0.00 C ATOM 504 CZ3 TRP A 35 -12.844 17.272 17.457 1.00 0.00 C ATOM 505 CH2 TRP A 35 -13.627 16.111 17.396 1.00 0.00 C ATOM 0 H TRP A 35 -7.282 18.439 20.277 1.00 0.00 H new ATOM 0 HA TRP A 35 -7.479 15.578 20.065 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -9.071 16.799 21.414 1.00 0.00 H new ATOM 0 HB3 TRP A 35 -9.474 17.869 20.086 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -9.865 14.114 21.048 1.00 0.00 H new ATOM 0 HE1 TRP A 35 -11.985 13.173 19.904 1.00 0.00 H new ATOM 0 HE3 TRP A 35 -11.124 18.234 18.299 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 -13.908 14.104 18.074 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 -13.125 18.133 16.868 1.00 0.00 H new ATOM 0 HH2 TRP A 35 -14.501 16.095 16.762 1.00 0.00 H new ATOM 516 N ILE A 36 -7.921 17.456 17.428 1.00 0.00 N ATOM 517 CA ILE A 36 -8.082 17.433 15.979 1.00 0.00 C ATOM 518 C ILE A 36 -7.059 16.510 15.326 1.00 0.00 C ATOM 519 O ILE A 36 -7.413 15.635 14.535 1.00 0.00 O ATOM 520 CB ILE A 36 -7.944 18.843 15.375 1.00 0.00 C ATOM 521 CG1 ILE A 36 -8.981 19.788 15.987 1.00 0.00 C ATOM 522 CG2 ILE A 36 -8.097 18.788 13.862 1.00 0.00 C ATOM 523 CD1 ILE A 36 -8.898 21.201 15.455 1.00 0.00 C ATOM 0 H ILE A 36 -7.702 18.374 17.814 1.00 0.00 H new ATOM 0 HA ILE A 36 -9.086 17.057 15.779 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.950 19.226 15.607 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.979 19.394 15.794 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -8.850 19.807 17.069 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -7.997 19.792 13.449 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.324 18.144 13.441 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -9.079 18.388 13.610 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -9.662 21.815 15.932 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.913 21.614 15.672 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -9.060 21.194 14.377 1.00 0.00 H new ATOM 535 N SER A 37 -5.789 16.710 15.664 1.00 0.00 N ATOM 536 CA SER A 37 -4.714 15.896 15.110 1.00 0.00 C ATOM 537 C SER A 37 -5.017 14.410 15.272 1.00 0.00 C ATOM 538 O SER A 37 -4.692 13.600 14.404 1.00 0.00 O ATOM 539 CB SER A 37 -3.386 16.235 15.791 1.00 0.00 C ATOM 540 OG SER A 37 -2.380 15.301 15.441 1.00 0.00 O ATOM 0 H SER A 37 -5.480 17.429 16.319 1.00 0.00 H new ATOM 0 HA SER A 37 -4.636 16.118 14.046 1.00 0.00 H new ATOM 0 HB2 SER A 37 -3.072 17.238 15.503 1.00 0.00 H new ATOM 0 HB3 SER A 37 -3.520 16.242 16.873 1.00 0.00 H new ATOM 0 HG SER A 37 -1.541 15.541 15.888 1.00 0.00 H new ATOM 546 N TYR A 38 -5.642 14.059 16.390 1.00 0.00 N ATOM 547 CA TYR A 38 -5.988 12.671 16.669 1.00 0.00 C ATOM 548 C TYR A 38 -6.952 12.128 15.618 1.00 0.00 C ATOM 549 O TYR A 38 -6.763 11.028 15.098 1.00 0.00 O ATOM 550 CB TYR A 38 -6.612 12.548 18.060 1.00 0.00 C ATOM 551 CG TYR A 38 -7.759 11.564 18.125 1.00 0.00 C ATOM 552 CD1 TYR A 38 -7.539 10.201 17.973 1.00 0.00 C ATOM 553 CD2 TYR A 38 -9.061 11.998 18.338 1.00 0.00 C ATOM 554 CE1 TYR A 38 -8.583 9.298 18.031 1.00 0.00 C ATOM 555 CE2 TYR A 38 -10.111 11.103 18.399 1.00 0.00 C ATOM 556 CZ TYR A 38 -9.867 9.754 18.245 1.00 0.00 C ATOM 557 OH TYR A 38 -10.911 8.859 18.303 1.00 0.00 O ATOM 0 H TYR A 38 -5.919 14.717 17.118 1.00 0.00 H new ATOM 0 HA TYR A 38 -5.072 12.082 16.636 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -5.842 12.243 18.769 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -6.967 13.528 18.378 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -6.534 9.841 17.807 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -9.256 13.054 18.458 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -8.395 8.241 17.910 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -11.117 11.457 18.566 1.00 0.00 H new ATOM 0 HH TYR A 38 -11.746 9.315 18.069 1.00 0.00 H new ATOM 567 N GLN A 39 -7.983 12.908 15.311 1.00 0.00 N ATOM 568 CA GLN A 39 -8.976 12.506 14.321 1.00 0.00 C ATOM 569 C GLN A 39 -8.433 12.673 12.906 1.00 0.00 C ATOM 570 O GLN A 39 -8.903 12.027 11.969 1.00 0.00 O ATOM 571 CB GLN A 39 -10.256 13.326 14.490 1.00 0.00 C ATOM 572 CG GLN A 39 -11.304 12.647 15.357 1.00 0.00 C ATOM 573 CD GLN A 39 -12.451 12.077 14.546 1.00 0.00 C ATOM 574 OE1 GLN A 39 -13.109 12.793 13.791 1.00 0.00 O ATOM 575 NE2 GLN A 39 -12.697 10.781 14.699 1.00 0.00 N ATOM 0 H GLN A 39 -8.153 13.821 15.733 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.205 11.452 14.480 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -10.004 14.291 14.929 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -10.683 13.524 13.507 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -10.834 11.846 15.928 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -11.695 13.365 16.078 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -12.126 10.225 15.336 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -13.457 10.341 14.180 1.00 0.00 H new ATOM 584 N VAL A 40 -7.441 13.545 12.757 1.00 0.00 N ATOM 585 CA VAL A 40 -6.834 13.797 11.456 1.00 0.00 C ATOM 586 C VAL A 40 -5.833 12.705 11.096 1.00 0.00 C ATOM 587 O VAL A 40 -5.597 12.429 9.920 1.00 0.00 O ATOM 588 CB VAL A 40 -6.121 15.162 11.424 1.00 0.00 C ATOM 589 CG1 VAL A 40 -5.449 15.383 10.078 1.00 0.00 C ATOM 590 CG2 VAL A 40 -7.104 16.283 11.728 1.00 0.00 C ATOM 0 H VAL A 40 -7.041 14.089 13.522 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.643 13.800 10.725 1.00 0.00 H new ATOM 0 HB VAL A 40 -5.349 15.167 12.193 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -4.951 16.352 10.075 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -4.714 14.597 9.905 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.200 15.358 9.288 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.584 17.240 11.701 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -7.899 16.281 10.983 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.534 16.131 12.718 1.00 0.00 H new ATOM 600 N GLU A 41 -5.246 12.088 12.117 1.00 0.00 N ATOM 601 CA GLU A 41 -4.270 11.025 11.907 1.00 0.00 C ATOM 602 C GLU A 41 -4.953 9.663 11.843 1.00 0.00 C ATOM 603 O GLU A 41 -4.438 8.725 11.234 1.00 0.00 O ATOM 604 CB GLU A 41 -3.227 11.033 13.027 1.00 0.00 C ATOM 605 CG GLU A 41 -2.130 9.997 12.844 1.00 0.00 C ATOM 606 CD GLU A 41 -1.600 9.953 11.424 1.00 0.00 C ATOM 607 OE1 GLU A 41 -1.306 11.032 10.867 1.00 0.00 O ATOM 608 OE2 GLU A 41 -1.480 8.841 10.869 1.00 0.00 O ATOM 0 H GLU A 41 -5.429 12.306 13.097 1.00 0.00 H new ATOM 0 HA GLU A 41 -3.772 11.207 10.954 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.774 12.023 13.084 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.727 10.856 13.979 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -1.310 10.217 13.527 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -2.515 9.014 13.115 1.00 0.00 H new ATOM 615 N LYS A 42 -6.117 9.561 12.476 1.00 0.00 N ATOM 616 CA LYS A 42 -6.873 8.314 12.491 1.00 0.00 C ATOM 617 C LYS A 42 -7.470 8.023 11.118 1.00 0.00 C ATOM 618 O LYS A 42 -7.325 6.922 10.589 1.00 0.00 O ATOM 619 CB LYS A 42 -7.987 8.382 13.539 1.00 0.00 C ATOM 620 CG LYS A 42 -7.914 7.275 14.576 1.00 0.00 C ATOM 621 CD LYS A 42 -6.802 7.524 15.581 1.00 0.00 C ATOM 622 CE LYS A 42 -6.654 6.360 16.549 1.00 0.00 C ATOM 623 NZ LYS A 42 -5.273 6.266 17.097 1.00 0.00 N ATOM 0 H LYS A 42 -6.557 10.327 12.985 1.00 0.00 H new ATOM 0 HA LYS A 42 -6.188 7.506 12.749 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -7.940 9.346 14.045 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.952 8.333 13.035 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -8.868 7.201 15.098 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -7.748 6.319 14.078 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.861 7.681 15.053 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -7.011 8.437 16.138 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -7.363 6.477 17.369 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -6.907 5.430 16.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.214 5.460 17.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -4.599 6.129 16.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.041 7.143 17.605 1.00 0.00 H new ATOM 637 N ASN A 43 -8.141 9.018 10.546 1.00 0.00 N ATOM 638 CA ASN A 43 -8.759 8.868 9.234 1.00 0.00 C ATOM 639 C ASN A 43 -7.732 9.065 8.123 1.00 0.00 C ATOM 640 O ASN A 43 -8.054 8.968 6.939 1.00 0.00 O ATOM 641 CB ASN A 43 -9.903 9.870 9.069 1.00 0.00 C ATOM 642 CG ASN A 43 -11.176 9.411 9.754 1.00 0.00 C ATOM 643 OD1 ASN A 43 -11.933 8.608 9.208 1.00 0.00 O ATOM 644 ND2 ASN A 43 -11.418 9.920 10.956 1.00 0.00 N ATOM 0 H ASN A 43 -8.270 9.936 10.971 1.00 0.00 H new ATOM 0 HA ASN A 43 -9.157 7.856 9.161 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -9.600 10.834 9.479 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.099 10.022 8.008 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -12.259 9.648 11.465 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -10.763 10.583 11.371 1.00 0.00 H new ATOM 651 N LYS A 44 -6.492 9.342 8.513 1.00 0.00 N ATOM 652 CA LYS A 44 -5.415 9.551 7.553 1.00 0.00 C ATOM 653 C LYS A 44 -5.692 10.773 6.683 1.00 0.00 C ATOM 654 O LYS A 44 -5.139 10.908 5.591 1.00 0.00 O ATOM 655 CB LYS A 44 -5.244 8.312 6.670 1.00 0.00 C ATOM 656 CG LYS A 44 -3.959 7.547 6.938 1.00 0.00 C ATOM 657 CD LYS A 44 -4.150 6.052 6.746 1.00 0.00 C ATOM 658 CE LYS A 44 -3.284 5.521 5.614 1.00 0.00 C ATOM 659 NZ LYS A 44 -3.540 4.078 5.350 1.00 0.00 N ATOM 0 H LYS A 44 -6.208 9.427 9.489 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.494 9.724 8.110 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -6.093 7.646 6.825 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.264 8.616 5.624 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.176 7.904 6.269 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -3.623 7.744 7.956 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.902 5.531 7.671 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -5.198 5.842 6.533 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.478 6.096 4.708 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -2.233 5.664 5.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.931 3.754 4.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.331 3.526 6.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.537 3.945 5.087 1.00 0.00 H new ATOM 673 N TYR A 45 -6.549 11.661 7.174 1.00 0.00 N ATOM 674 CA TYR A 45 -6.900 12.872 6.441 1.00 0.00 C ATOM 675 C TYR A 45 -5.649 13.657 6.057 1.00 0.00 C ATOM 676 O TYR A 45 -4.759 13.870 6.880 1.00 0.00 O ATOM 677 CB TYR A 45 -7.829 13.750 7.280 1.00 0.00 C ATOM 678 CG TYR A 45 -8.560 14.800 6.475 1.00 0.00 C ATOM 679 CD1 TYR A 45 -9.398 14.441 5.426 1.00 0.00 C ATOM 680 CD2 TYR A 45 -8.412 16.152 6.761 1.00 0.00 C ATOM 681 CE1 TYR A 45 -10.067 15.397 4.687 1.00 0.00 C ATOM 682 CE2 TYR A 45 -9.079 17.114 6.029 1.00 0.00 C ATOM 683 CZ TYR A 45 -9.905 16.732 4.992 1.00 0.00 C ATOM 684 OH TYR A 45 -10.570 17.688 4.259 1.00 0.00 O ATOM 0 H TYR A 45 -7.014 11.565 8.077 1.00 0.00 H new ATOM 0 HA TYR A 45 -7.417 12.577 5.528 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -8.559 13.116 7.782 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -7.245 14.242 8.058 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -9.528 13.396 5.185 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -7.764 16.455 7.570 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -10.714 15.100 3.874 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -8.955 18.160 6.267 1.00 0.00 H new ATOM 0 HH TYR A 45 -10.701 17.365 3.343 1.00 0.00 H new ATOM 694 N ASP A 46 -5.590 14.085 4.801 1.00 0.00 N ATOM 695 CA ASP A 46 -4.451 14.848 4.305 1.00 0.00 C ATOM 696 C ASP A 46 -4.158 16.038 5.214 1.00 0.00 C ATOM 697 O ASP A 46 -3.012 16.470 5.338 1.00 0.00 O ATOM 698 CB ASP A 46 -4.715 15.333 2.879 1.00 0.00 C ATOM 699 CG ASP A 46 -3.594 14.966 1.926 1.00 0.00 C ATOM 700 OD1 ASP A 46 -3.047 13.851 2.054 1.00 0.00 O ATOM 701 OD2 ASP A 46 -3.264 15.795 1.052 1.00 0.00 O ATOM 0 H ASP A 46 -6.318 13.916 4.107 1.00 0.00 H new ATOM 0 HA ASP A 46 -3.580 14.192 4.301 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.650 14.903 2.519 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -4.844 16.415 2.884 1.00 0.00 H new ATOM 706 N ALA A 47 -5.202 16.565 5.846 1.00 0.00 N ATOM 707 CA ALA A 47 -5.057 17.704 6.743 1.00 0.00 C ATOM 708 C ALA A 47 -4.559 18.935 5.992 1.00 0.00 C ATOM 709 O ALA A 47 -3.947 19.827 6.580 1.00 0.00 O ATOM 710 CB ALA A 47 -4.110 17.360 7.883 1.00 0.00 C ATOM 0 H ALA A 47 -6.158 16.221 5.753 1.00 0.00 H new ATOM 0 HA ALA A 47 -6.038 17.936 7.157 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -4.011 18.220 8.546 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -4.508 16.514 8.444 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.132 17.099 7.478 1.00 0.00 H new ATOM 716 N SER A 48 -4.825 18.975 4.690 1.00 0.00 N ATOM 717 CA SER A 48 -4.399 20.095 3.858 1.00 0.00 C ATOM 718 C SER A 48 -5.587 20.980 3.490 1.00 0.00 C ATOM 719 O SER A 48 -5.576 21.655 2.461 1.00 0.00 O ATOM 720 CB SER A 48 -3.717 19.583 2.588 1.00 0.00 C ATOM 721 OG SER A 48 -3.262 20.658 1.785 1.00 0.00 O ATOM 0 H SER A 48 -5.333 18.246 4.189 1.00 0.00 H new ATOM 0 HA SER A 48 -3.687 20.691 4.429 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.876 18.943 2.856 1.00 0.00 H new ATOM 0 HB3 SER A 48 -4.415 18.970 2.018 1.00 0.00 H new ATOM 0 HG SER A 48 -3.968 21.334 1.713 1.00 0.00 H new ATOM 727 N ALA A 49 -6.609 20.971 4.339 1.00 0.00 N ATOM 728 CA ALA A 49 -7.803 21.773 4.105 1.00 0.00 C ATOM 729 C ALA A 49 -8.239 22.492 5.377 1.00 0.00 C ATOM 730 O ALA A 49 -8.636 23.657 5.338 1.00 0.00 O ATOM 731 CB ALA A 49 -8.931 20.899 3.578 1.00 0.00 C ATOM 0 H ALA A 49 -6.634 20.417 5.195 1.00 0.00 H new ATOM 0 HA ALA A 49 -7.563 22.528 3.356 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -9.817 21.511 3.408 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -8.624 20.436 2.640 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.161 20.123 4.308 1.00 0.00 H new ATOM 737 N ILE A 50 -8.164 21.791 6.503 1.00 0.00 N ATOM 738 CA ILE A 50 -8.550 22.363 7.787 1.00 0.00 C ATOM 739 C ILE A 50 -7.848 23.695 8.029 1.00 0.00 C ATOM 740 O ILE A 50 -6.628 23.798 7.898 1.00 0.00 O ATOM 741 CB ILE A 50 -8.228 21.407 8.950 1.00 0.00 C ATOM 742 CG1 ILE A 50 -8.930 20.063 8.744 1.00 0.00 C ATOM 743 CG2 ILE A 50 -8.639 22.028 10.276 1.00 0.00 C ATOM 744 CD1 ILE A 50 -8.578 19.030 9.791 1.00 0.00 C ATOM 0 H ILE A 50 -7.839 20.825 6.552 1.00 0.00 H new ATOM 0 HA ILE A 50 -9.627 22.524 7.749 1.00 0.00 H new ATOM 0 HB ILE A 50 -7.152 21.234 8.971 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -10.008 20.221 8.750 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -8.670 19.674 7.760 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -8.405 21.340 11.088 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -8.097 22.962 10.424 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -9.710 22.228 10.268 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -9.112 18.103 9.582 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -7.504 18.843 9.771 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -8.864 19.399 10.776 1.00 0.00 H new ATOM 756 N ASP A 51 -8.625 24.712 8.384 1.00 0.00 N ATOM 757 CA ASP A 51 -8.077 26.037 8.647 1.00 0.00 C ATOM 758 C ASP A 51 -7.801 26.225 10.136 1.00 0.00 C ATOM 759 O ASP A 51 -8.603 26.819 10.857 1.00 0.00 O ATOM 760 CB ASP A 51 -9.041 27.118 8.155 1.00 0.00 C ATOM 761 CG ASP A 51 -8.639 27.682 6.807 1.00 0.00 C ATOM 762 OD1 ASP A 51 -7.736 28.545 6.770 1.00 0.00 O ATOM 763 OD2 ASP A 51 -9.225 27.260 5.788 1.00 0.00 O ATOM 0 H ASP A 51 -9.637 24.644 8.496 1.00 0.00 H new ATOM 0 HA ASP A 51 -7.135 26.127 8.106 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -10.046 26.701 8.086 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -9.081 27.925 8.886 1.00 0.00 H new ATOM 768 N PHE A 52 -6.661 25.714 10.590 1.00 0.00 N ATOM 769 CA PHE A 52 -6.279 25.823 11.993 1.00 0.00 C ATOM 770 C PHE A 52 -6.347 27.273 12.464 1.00 0.00 C ATOM 771 O PHE A 52 -6.636 27.546 13.629 1.00 0.00 O ATOM 772 CB PHE A 52 -4.868 25.272 12.204 1.00 0.00 C ATOM 773 CG PHE A 52 -4.757 23.795 11.953 1.00 0.00 C ATOM 774 CD1 PHE A 52 -4.557 23.309 10.671 1.00 0.00 C ATOM 775 CD2 PHE A 52 -4.853 22.893 13.000 1.00 0.00 C ATOM 776 CE1 PHE A 52 -4.455 21.951 10.438 1.00 0.00 C ATOM 777 CE2 PHE A 52 -4.752 21.533 12.774 1.00 0.00 C ATOM 778 CZ PHE A 52 -4.552 21.062 11.491 1.00 0.00 C ATOM 0 H PHE A 52 -5.986 25.220 10.006 1.00 0.00 H new ATOM 0 HA PHE A 52 -6.983 25.235 12.582 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -4.179 25.798 11.543 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -4.553 25.483 13.226 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -4.480 24.000 9.844 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -5.009 23.257 14.005 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.300 21.585 9.434 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.829 20.840 13.599 1.00 0.00 H new ATOM 0 HZ PHE A 52 -4.472 20.000 11.311 1.00 0.00 H new ATOM 788 N SER A 53 -6.079 28.199 11.549 1.00 0.00 N ATOM 789 CA SER A 53 -6.105 29.621 11.870 1.00 0.00 C ATOM 790 C SER A 53 -7.461 30.024 12.441 1.00 0.00 C ATOM 791 O SER A 53 -7.563 30.977 13.214 1.00 0.00 O ATOM 792 CB SER A 53 -5.795 30.453 10.624 1.00 0.00 C ATOM 793 OG SER A 53 -4.439 30.861 10.607 1.00 0.00 O ATOM 0 H SER A 53 -5.841 27.990 10.579 1.00 0.00 H new ATOM 0 HA SER A 53 -5.342 29.812 12.624 1.00 0.00 H new ATOM 0 HB2 SER A 53 -6.013 29.869 9.730 1.00 0.00 H new ATOM 0 HB3 SER A 53 -6.442 31.330 10.598 1.00 0.00 H new ATOM 0 HG SER A 53 -4.266 31.389 9.800 1.00 0.00 H new ATOM 799 N ARG A 54 -8.500 29.292 12.054 1.00 0.00 N ATOM 800 CA ARG A 54 -9.851 29.573 12.526 1.00 0.00 C ATOM 801 C ARG A 54 -10.089 28.947 13.896 1.00 0.00 C ATOM 802 O ARG A 54 -10.876 29.457 14.695 1.00 0.00 O ATOM 803 CB ARG A 54 -10.882 29.047 11.526 1.00 0.00 C ATOM 804 CG ARG A 54 -11.157 30.001 10.375 1.00 0.00 C ATOM 805 CD ARG A 54 -12.603 30.469 10.371 1.00 0.00 C ATOM 806 NE ARG A 54 -13.012 30.974 9.064 1.00 0.00 N ATOM 807 CZ ARG A 54 -14.232 31.430 8.801 1.00 0.00 C ATOM 808 NH1 ARG A 54 -15.157 31.445 9.750 1.00 0.00 N ATOM 809 NH2 ARG A 54 -14.527 31.874 7.586 1.00 0.00 N ATOM 0 H ARG A 54 -8.433 28.500 11.415 1.00 0.00 H new ATOM 0 HA ARG A 54 -9.961 30.654 12.616 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -10.533 28.096 11.123 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.816 28.847 12.051 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -10.495 30.864 10.450 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -10.931 29.507 9.430 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.252 29.642 10.659 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -12.733 31.252 11.119 1.00 0.00 H new ATOM 0 HE ARG A 54 -12.324 30.977 8.311 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.933 31.106 10.686 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -16.093 31.796 9.545 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -13.817 31.865 6.854 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -15.464 32.224 7.384 1.00 0.00 H new ATOM 823 N CYS A 55 -9.406 27.839 14.162 1.00 0.00 N ATOM 824 CA CYS A 55 -9.545 27.142 15.436 1.00 0.00 C ATOM 825 C CYS A 55 -8.918 27.949 16.568 1.00 0.00 C ATOM 826 O CYS A 55 -7.748 27.763 16.903 1.00 0.00 O ATOM 827 CB CYS A 55 -8.895 25.760 15.358 1.00 0.00 C ATOM 828 SG CYS A 55 -9.065 24.778 16.867 1.00 0.00 S ATOM 0 H CYS A 55 -8.751 27.404 13.513 1.00 0.00 H new ATOM 0 HA CYS A 55 -10.608 27.024 15.644 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -9.336 25.209 14.527 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -7.835 25.881 15.133 1.00 0.00 H new ATOM 0 HG CYS A 55 -8.485 23.626 16.703 1.00 0.00 H new ATOM 834 N ASP A 56 -9.703 28.846 17.153 1.00 0.00 N ATOM 835 CA ASP A 56 -9.225 29.683 18.248 1.00 0.00 C ATOM 836 C ASP A 56 -10.086 29.493 19.493 1.00 0.00 C ATOM 837 O ASP A 56 -9.949 30.225 20.472 1.00 0.00 O ATOM 838 CB ASP A 56 -9.227 31.155 17.832 1.00 0.00 C ATOM 839 CG ASP A 56 -7.878 31.816 18.036 1.00 0.00 C ATOM 840 OD1 ASP A 56 -6.945 31.511 17.263 1.00 0.00 O ATOM 841 OD2 ASP A 56 -7.756 32.639 18.967 1.00 0.00 O ATOM 0 H ASP A 56 -10.674 29.013 16.888 1.00 0.00 H new ATOM 0 HA ASP A 56 -8.204 29.381 18.484 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -9.511 31.233 16.783 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.982 31.691 18.407 1.00 0.00 H new ATOM 846 N MET A 57 -10.974 28.505 19.447 1.00 0.00 N ATOM 847 CA MET A 57 -11.857 28.218 20.572 1.00 0.00 C ATOM 848 C MET A 57 -11.072 27.640 21.745 1.00 0.00 C ATOM 849 O MET A 57 -9.844 27.570 21.708 1.00 0.00 O ATOM 850 CB MET A 57 -12.957 27.243 20.148 1.00 0.00 C ATOM 851 CG MET A 57 -13.600 27.593 18.816 1.00 0.00 C ATOM 852 SD MET A 57 -14.996 26.525 18.416 1.00 0.00 S ATOM 853 CE MET A 57 -14.650 26.143 16.701 1.00 0.00 C ATOM 0 H MET A 57 -11.101 27.890 18.643 1.00 0.00 H new ATOM 0 HA MET A 57 -12.315 29.154 20.891 1.00 0.00 H new ATOM 0 HB2 MET A 57 -12.537 26.239 20.087 1.00 0.00 H new ATOM 0 HB3 MET A 57 -13.727 27.220 20.919 1.00 0.00 H new ATOM 0 HG2 MET A 57 -13.936 28.630 18.841 1.00 0.00 H new ATOM 0 HG3 MET A 57 -12.853 27.519 18.026 1.00 0.00 H new ATOM 0 HE1 MET A 57 -15.378 25.418 16.336 1.00 0.00 H new ATOM 0 HE2 MET A 57 -14.714 27.054 16.105 1.00 0.00 H new ATOM 0 HE3 MET A 57 -13.647 25.724 16.617 1.00 0.00 H new ATOM 863 N ASP A 58 -11.790 27.227 22.784 1.00 0.00 N ATOM 864 CA ASP A 58 -11.160 26.653 23.968 1.00 0.00 C ATOM 865 C ASP A 58 -11.764 25.292 24.299 1.00 0.00 C ATOM 866 O ASP A 58 -11.045 24.306 24.460 1.00 0.00 O ATOM 867 CB ASP A 58 -11.315 27.597 25.162 1.00 0.00 C ATOM 868 CG ASP A 58 -12.737 28.095 25.325 1.00 0.00 C ATOM 869 OD1 ASP A 58 -13.157 28.965 24.533 1.00 0.00 O ATOM 870 OD2 ASP A 58 -13.432 27.615 26.245 1.00 0.00 O ATOM 0 H ASP A 58 -12.808 27.279 22.831 1.00 0.00 H new ATOM 0 HA ASP A 58 -10.099 26.518 23.756 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.007 27.081 26.072 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -10.647 28.449 25.037 1.00 0.00 H new ATOM 875 N GLY A 59 -13.089 25.245 24.399 1.00 0.00 N ATOM 876 CA GLY A 59 -13.766 24.001 24.711 1.00 0.00 C ATOM 877 C GLY A 59 -15.274 24.153 24.741 1.00 0.00 C ATOM 878 O GLY A 59 -15.985 23.505 23.974 1.00 0.00 O ATOM 0 H GLY A 59 -13.705 26.047 24.269 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -13.495 23.248 23.971 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.421 23.636 25.679 1.00 0.00 H new ATOM 882 N ALA A 60 -15.763 25.011 25.630 1.00 0.00 N ATOM 883 CA ALA A 60 -17.196 25.246 25.757 1.00 0.00 C ATOM 884 C ALA A 60 -17.786 25.756 24.447 1.00 0.00 C ATOM 885 O ALA A 60 -18.975 25.578 24.178 1.00 0.00 O ATOM 886 CB ALA A 60 -17.471 26.233 26.882 1.00 0.00 C ATOM 0 H ALA A 60 -15.188 25.555 26.273 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.676 24.297 25.996 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -18.545 26.399 26.966 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -17.092 25.829 27.821 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.973 27.178 26.666 1.00 0.00 H new ATOM 892 N THR A 61 -16.949 26.393 23.634 1.00 0.00 N ATOM 893 CA THR A 61 -17.388 26.931 22.353 1.00 0.00 C ATOM 894 C THR A 61 -17.408 25.849 21.280 1.00 0.00 C ATOM 895 O THR A 61 -18.252 25.865 20.382 1.00 0.00 O ATOM 896 CB THR A 61 -16.480 28.084 21.886 1.00 0.00 C ATOM 897 OG1 THR A 61 -16.464 29.124 22.871 1.00 0.00 O ATOM 898 CG2 THR A 61 -16.958 28.646 20.556 1.00 0.00 C ATOM 0 H THR A 61 -15.962 26.549 23.841 1.00 0.00 H new ATOM 0 HA THR A 61 -18.399 27.312 22.501 1.00 0.00 H new ATOM 0 HB THR A 61 -15.471 27.692 21.755 1.00 0.00 H new ATOM 0 HG1 THR A 61 -15.883 29.853 22.568 1.00 0.00 H new ATOM 0 HG21 THR A 61 -16.301 29.459 20.247 1.00 0.00 H new ATOM 0 HG22 THR A 61 -16.941 27.859 19.802 1.00 0.00 H new ATOM 0 HG23 THR A 61 -17.975 29.023 20.665 1.00 0.00 H new ATOM 906 N LEU A 62 -16.475 24.909 21.377 1.00 0.00 N ATOM 907 CA LEU A 62 -16.385 23.817 20.414 1.00 0.00 C ATOM 908 C LEU A 62 -17.650 22.965 20.437 1.00 0.00 C ATOM 909 O LEU A 62 -18.216 22.647 19.391 1.00 0.00 O ATOM 910 CB LEU A 62 -15.164 22.945 20.714 1.00 0.00 C ATOM 911 CG LEU A 62 -14.819 21.890 19.663 1.00 0.00 C ATOM 912 CD1 LEU A 62 -14.219 22.543 18.428 1.00 0.00 C ATOM 913 CD2 LEU A 62 -13.862 20.856 20.239 1.00 0.00 C ATOM 0 H LEU A 62 -15.770 24.881 22.113 1.00 0.00 H new ATOM 0 HA LEU A 62 -16.279 24.251 19.420 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -14.300 23.597 20.843 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -15.328 22.441 21.666 1.00 0.00 H new ATOM 0 HG LEU A 62 -15.738 21.383 19.371 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -13.980 21.776 17.691 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -14.937 23.244 18.002 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -13.310 23.077 18.704 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -13.627 20.113 19.477 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -12.944 21.349 20.560 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -14.328 20.365 21.093 1.00 0.00 H new ATOM 925 N CYS A 63 -18.090 22.601 21.637 1.00 0.00 N ATOM 926 CA CYS A 63 -19.290 21.788 21.797 1.00 0.00 C ATOM 927 C CYS A 63 -20.541 22.591 21.455 1.00 0.00 C ATOM 928 O CYS A 63 -21.562 22.029 21.061 1.00 0.00 O ATOM 929 CB CYS A 63 -19.385 21.258 23.228 1.00 0.00 C ATOM 930 SG CYS A 63 -19.698 19.480 23.338 1.00 0.00 S ATOM 0 H CYS A 63 -17.634 22.856 22.513 1.00 0.00 H new ATOM 0 HA CYS A 63 -19.222 20.945 21.109 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -18.456 21.485 23.751 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -20.182 21.789 23.749 1.00 0.00 H new ATOM 0 HG CYS A 63 -20.964 19.250 23.153 1.00 0.00 H new ATOM 936 N ASN A 64 -20.453 23.908 21.610 1.00 0.00 N ATOM 937 CA ASN A 64 -21.579 24.788 21.320 1.00 0.00 C ATOM 938 C ASN A 64 -21.675 25.073 19.824 1.00 0.00 C ATOM 939 O ASN A 64 -22.754 25.363 19.305 1.00 0.00 O ATOM 940 CB ASN A 64 -21.439 26.101 22.093 1.00 0.00 C ATOM 941 CG ASN A 64 -21.900 25.977 23.532 1.00 0.00 C ATOM 942 OD1 ASN A 64 -22.602 25.032 23.891 1.00 0.00 O ATOM 943 ND2 ASN A 64 -21.506 26.934 24.364 1.00 0.00 N ATOM 0 H ASN A 64 -19.614 24.389 21.935 1.00 0.00 H new ATOM 0 HA ASN A 64 -22.493 24.284 21.635 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -20.397 26.421 22.074 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -22.020 26.877 21.594 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -21.785 26.904 25.345 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -20.924 27.699 24.022 1.00 0.00 H new ATOM 950 N CYS A 65 -20.542 24.988 19.137 1.00 0.00 N ATOM 951 CA CYS A 65 -20.497 25.237 17.701 1.00 0.00 C ATOM 952 C CYS A 65 -21.544 24.400 16.971 1.00 0.00 C ATOM 953 O CYS A 65 -22.088 23.447 17.528 1.00 0.00 O ATOM 954 CB CYS A 65 -19.105 24.926 17.151 1.00 0.00 C ATOM 955 SG CYS A 65 -18.152 26.391 16.684 1.00 0.00 S ATOM 0 H CYS A 65 -19.641 24.748 19.551 1.00 0.00 H new ATOM 0 HA CYS A 65 -20.718 26.291 17.533 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -18.546 24.366 17.901 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -19.206 24.279 16.280 1.00 0.00 H new ATOM 0 HG CYS A 65 -17.119 26.503 17.465 1.00 0.00 H new ATOM 961 N ALA A 66 -21.820 24.765 15.724 1.00 0.00 N ATOM 962 CA ALA A 66 -22.801 24.048 14.918 1.00 0.00 C ATOM 963 C ALA A 66 -22.121 23.060 13.976 1.00 0.00 C ATOM 964 O ALA A 66 -20.944 23.211 13.646 1.00 0.00 O ATOM 965 CB ALA A 66 -23.656 25.029 14.130 1.00 0.00 C ATOM 0 H ALA A 66 -21.379 25.553 15.250 1.00 0.00 H new ATOM 0 HA ALA A 66 -23.445 23.483 15.592 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -24.384 24.479 13.533 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -24.179 25.692 14.820 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -23.019 25.620 13.472 1.00 0.00 H new ATOM 971 N LEU A 67 -22.868 22.049 13.547 1.00 0.00 N ATOM 972 CA LEU A 67 -22.337 21.036 12.642 1.00 0.00 C ATOM 973 C LEU A 67 -21.687 21.681 11.423 1.00 0.00 C ATOM 974 O LEU A 67 -20.491 21.515 11.185 1.00 0.00 O ATOM 975 CB LEU A 67 -23.451 20.086 12.198 1.00 0.00 C ATOM 976 CG LEU A 67 -23.149 19.224 10.972 1.00 0.00 C ATOM 977 CD1 LEU A 67 -21.833 18.482 11.152 1.00 0.00 C ATOM 978 CD2 LEU A 67 -24.285 18.244 10.716 1.00 0.00 C ATOM 0 H LEU A 67 -23.843 21.909 13.811 1.00 0.00 H new ATOM 0 HA LEU A 67 -21.576 20.469 13.178 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -23.692 19.426 13.031 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -24.344 20.676 11.991 1.00 0.00 H new ATOM 0 HG LEU A 67 -23.058 19.878 10.105 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -21.635 17.874 10.270 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -21.025 19.201 11.286 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -21.895 17.839 12.030 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -24.053 17.639 9.840 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -24.408 17.595 11.583 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -25.209 18.795 10.542 1.00 0.00 H new ATOM 990 N GLU A 68 -22.483 22.419 10.655 1.00 0.00 N ATOM 991 CA GLU A 68 -21.983 23.090 9.460 1.00 0.00 C ATOM 992 C GLU A 68 -20.744 23.921 9.781 1.00 0.00 C ATOM 993 O GLU A 68 -19.826 24.023 8.969 1.00 0.00 O ATOM 994 CB GLU A 68 -23.069 23.984 8.859 1.00 0.00 C ATOM 995 CG GLU A 68 -23.551 25.074 9.802 1.00 0.00 C ATOM 996 CD GLU A 68 -24.759 25.817 9.266 1.00 0.00 C ATOM 997 OE1 GLU A 68 -25.823 25.182 9.106 1.00 0.00 O ATOM 998 OE2 GLU A 68 -24.641 27.033 9.006 1.00 0.00 O ATOM 0 H GLU A 68 -23.475 22.567 10.839 1.00 0.00 H new ATOM 0 HA GLU A 68 -21.708 22.326 8.733 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -22.685 24.446 7.949 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -23.918 23.365 8.569 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -23.800 24.631 10.766 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -22.741 25.783 9.976 1.00 0.00 H new ATOM 1005 N GLU A 69 -20.728 24.513 10.972 1.00 0.00 N ATOM 1006 CA GLU A 69 -19.603 25.336 11.399 1.00 0.00 C ATOM 1007 C GLU A 69 -18.310 24.526 11.414 1.00 0.00 C ATOM 1008 O GLU A 69 -17.320 24.902 10.786 1.00 0.00 O ATOM 1009 CB GLU A 69 -19.868 25.920 12.789 1.00 0.00 C ATOM 1010 CG GLU A 69 -20.070 27.426 12.788 1.00 0.00 C ATOM 1011 CD GLU A 69 -19.958 28.030 14.174 1.00 0.00 C ATOM 1012 OE1 GLU A 69 -20.654 27.546 15.091 1.00 0.00 O ATOM 1013 OE2 GLU A 69 -19.173 28.987 14.341 1.00 0.00 O ATOM 0 H GLU A 69 -21.480 24.438 11.657 1.00 0.00 H new ATOM 0 HA GLU A 69 -19.492 26.152 10.685 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -20.753 25.444 13.211 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -19.031 25.675 13.443 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -19.331 27.888 12.134 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -21.051 27.657 12.373 1.00 0.00 H new ATOM 1020 N LEU A 70 -18.327 23.411 12.137 1.00 0.00 N ATOM 1021 CA LEU A 70 -17.156 22.546 12.235 1.00 0.00 C ATOM 1022 C LEU A 70 -16.708 22.077 10.855 1.00 0.00 C ATOM 1023 O LEU A 70 -15.536 21.762 10.645 1.00 0.00 O ATOM 1024 CB LEU A 70 -17.463 21.338 13.122 1.00 0.00 C ATOM 1025 CG LEU A 70 -18.082 21.647 14.486 1.00 0.00 C ATOM 1026 CD1 LEU A 70 -18.440 20.360 15.214 1.00 0.00 C ATOM 1027 CD2 LEU A 70 -17.131 22.488 15.325 1.00 0.00 C ATOM 0 H LEU A 70 -19.138 23.085 12.663 1.00 0.00 H new ATOM 0 HA LEU A 70 -16.346 23.122 12.683 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -18.139 20.677 12.580 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -16.537 20.785 13.282 1.00 0.00 H new ATOM 0 HG LEU A 70 -18.997 22.218 14.327 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -18.879 20.600 16.182 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -19.158 19.794 14.620 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -17.540 19.763 15.362 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -17.588 22.698 16.292 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -16.199 21.943 15.475 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -16.924 23.426 14.810 1.00 0.00 H new ATOM 1039 N ARG A 71 -17.648 22.034 9.916 1.00 0.00 N ATOM 1040 CA ARG A 71 -17.350 21.604 8.556 1.00 0.00 C ATOM 1041 C ARG A 71 -16.695 22.730 7.761 1.00 0.00 C ATOM 1042 O ARG A 71 -16.016 22.487 6.762 1.00 0.00 O ATOM 1043 CB ARG A 71 -18.628 21.145 7.851 1.00 0.00 C ATOM 1044 CG ARG A 71 -19.170 19.824 8.373 1.00 0.00 C ATOM 1045 CD ARG A 71 -20.595 19.582 7.903 1.00 0.00 C ATOM 1046 NE ARG A 71 -20.705 18.379 7.084 1.00 0.00 N ATOM 1047 CZ ARG A 71 -20.397 18.339 5.792 1.00 0.00 C ATOM 1048 NH1 ARG A 71 -19.963 19.430 5.176 1.00 0.00 N ATOM 1049 NH2 ARG A 71 -20.523 17.205 5.114 1.00 0.00 N ATOM 0 H ARG A 71 -18.622 22.292 10.073 1.00 0.00 H new ATOM 0 HA ARG A 71 -16.653 20.768 8.611 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -19.393 21.913 7.967 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -18.430 21.051 6.783 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -18.531 19.008 8.035 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -19.140 19.822 9.463 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -21.252 19.492 8.768 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -20.939 20.443 7.330 1.00 0.00 H new ATOM 0 HE ARG A 71 -21.036 17.522 7.528 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -19.865 20.303 5.694 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -19.727 19.396 4.184 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -20.856 16.364 5.585 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -20.286 17.175 4.122 1.00 0.00 H new ATOM 1063 N LEU A 72 -16.904 23.963 8.210 1.00 0.00 N ATOM 1064 CA LEU A 72 -16.334 25.128 7.541 1.00 0.00 C ATOM 1065 C LEU A 72 -14.988 25.502 8.152 1.00 0.00 C ATOM 1066 O LEU A 72 -14.210 26.248 7.556 1.00 0.00 O ATOM 1067 CB LEU A 72 -17.296 26.314 7.633 1.00 0.00 C ATOM 1068 CG LEU A 72 -18.160 26.575 6.399 1.00 0.00 C ATOM 1069 CD1 LEU A 72 -19.627 26.677 6.786 1.00 0.00 C ATOM 1070 CD2 LEU A 72 -17.704 27.840 5.687 1.00 0.00 C ATOM 0 H LEU A 72 -17.464 24.182 9.034 1.00 0.00 H new ATOM 0 HA LEU A 72 -16.178 24.875 6.492 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -17.955 26.156 8.486 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -16.715 27.212 7.841 1.00 0.00 H new ATOM 0 HG LEU A 72 -18.045 25.735 5.714 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -20.226 26.863 5.895 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -19.947 25.744 7.250 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -19.761 27.497 7.491 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -18.330 28.010 4.811 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.789 28.690 6.365 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.666 27.728 5.375 1.00 0.00 H new ATOM 1082 N VAL A 73 -14.717 24.978 9.343 1.00 0.00 N ATOM 1083 CA VAL A 73 -13.463 25.254 10.033 1.00 0.00 C ATOM 1084 C VAL A 73 -12.487 24.092 9.885 1.00 0.00 C ATOM 1085 O VAL A 73 -11.271 24.282 9.908 1.00 0.00 O ATOM 1086 CB VAL A 73 -13.695 25.528 11.531 1.00 0.00 C ATOM 1087 CG1 VAL A 73 -12.373 25.791 12.236 1.00 0.00 C ATOM 1088 CG2 VAL A 73 -14.649 26.698 11.716 1.00 0.00 C ATOM 0 H VAL A 73 -15.350 24.359 9.850 1.00 0.00 H new ATOM 0 HA VAL A 73 -13.036 26.144 9.570 1.00 0.00 H new ATOM 0 HB VAL A 73 -14.149 24.644 11.979 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -12.556 25.983 13.293 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -11.726 24.920 12.132 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -11.888 26.659 11.789 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -14.802 26.878 12.780 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -14.225 27.590 11.254 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.605 26.466 11.246 1.00 0.00 H new ATOM 1098 N PHE A 74 -13.028 22.888 9.733 1.00 0.00 N ATOM 1099 CA PHE A 74 -12.205 21.694 9.581 1.00 0.00 C ATOM 1100 C PHE A 74 -12.507 20.989 8.263 1.00 0.00 C ATOM 1101 O PHE A 74 -12.276 19.789 8.121 1.00 0.00 O ATOM 1102 CB PHE A 74 -12.440 20.736 10.751 1.00 0.00 C ATOM 1103 CG PHE A 74 -12.543 21.427 12.080 1.00 0.00 C ATOM 1104 CD1 PHE A 74 -11.488 22.180 12.568 1.00 0.00 C ATOM 1105 CD2 PHE A 74 -13.696 21.323 12.842 1.00 0.00 C ATOM 1106 CE1 PHE A 74 -11.581 22.816 13.792 1.00 0.00 C ATOM 1107 CE2 PHE A 74 -13.795 21.957 14.066 1.00 0.00 C ATOM 1108 CZ PHE A 74 -12.736 22.706 14.541 1.00 0.00 C ATOM 0 H PHE A 74 -14.033 22.713 9.712 1.00 0.00 H new ATOM 0 HA PHE A 74 -11.159 22.002 9.576 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -13.356 20.173 10.571 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -11.624 20.014 10.788 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -10.583 22.271 11.986 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -14.527 20.739 12.475 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -10.751 23.399 14.162 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -14.699 21.867 14.650 1.00 0.00 H new ATOM 0 HZ PHE A 74 -12.811 23.205 15.496 1.00 0.00 H new ATOM 1118 N GLY A 75 -13.027 21.744 7.300 1.00 0.00 N ATOM 1119 CA GLY A 75 -13.354 21.175 6.005 1.00 0.00 C ATOM 1120 C GLY A 75 -14.370 20.055 6.104 1.00 0.00 C ATOM 1121 O GLY A 75 -15.220 20.036 6.995 1.00 0.00 O ATOM 0 H GLY A 75 -13.228 22.740 7.393 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -13.744 21.959 5.355 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -12.445 20.796 5.538 1.00 0.00 H new ATOM 1125 N PRO A 76 -14.291 19.094 5.171 1.00 0.00 N ATOM 1126 CA PRO A 76 -15.204 17.948 5.135 1.00 0.00 C ATOM 1127 C PRO A 76 -14.968 16.982 6.291 1.00 0.00 C ATOM 1128 O PRO A 76 -15.728 16.032 6.485 1.00 0.00 O ATOM 1129 CB PRO A 76 -14.877 17.276 3.800 1.00 0.00 C ATOM 1130 CG PRO A 76 -13.470 17.671 3.511 1.00 0.00 C ATOM 1131 CD PRO A 76 -13.303 19.053 4.080 1.00 0.00 C ATOM 0 HA PRO A 76 -16.246 18.254 5.229 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -14.978 16.193 3.867 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -15.552 17.611 3.012 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -12.767 16.974 3.967 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -13.275 17.664 2.439 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -12.290 19.216 4.449 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -13.498 19.822 3.332 1.00 0.00 H new ATOM 1139 N LEU A 77 -13.910 17.229 7.055 1.00 0.00 N ATOM 1140 CA LEU A 77 -13.573 16.381 8.193 1.00 0.00 C ATOM 1141 C LEU A 77 -14.518 16.637 9.363 1.00 0.00 C ATOM 1142 O LEU A 77 -14.726 15.769 10.209 1.00 0.00 O ATOM 1143 CB LEU A 77 -12.127 16.627 8.628 1.00 0.00 C ATOM 1144 CG LEU A 77 -11.603 15.733 9.753 1.00 0.00 C ATOM 1145 CD1 LEU A 77 -11.836 14.267 9.422 1.00 0.00 C ATOM 1146 CD2 LEU A 77 -10.125 15.998 10.000 1.00 0.00 C ATOM 0 H LEU A 77 -13.270 18.010 6.907 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.681 15.342 7.883 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -11.481 16.500 7.759 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -12.036 17.666 8.944 1.00 0.00 H new ATOM 0 HG LEU A 77 -12.151 15.970 10.665 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -11.457 13.646 10.234 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -12.904 14.088 9.296 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -11.315 14.015 8.499 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -9.769 15.353 10.804 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -9.561 15.790 9.091 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -9.985 17.041 10.283 1.00 0.00 H new ATOM 1158 N GLY A 78 -15.091 17.837 9.402 1.00 0.00 N ATOM 1159 CA GLY A 78 -16.010 18.186 10.470 1.00 0.00 C ATOM 1160 C GLY A 78 -17.112 17.160 10.645 1.00 0.00 C ATOM 1161 O GLY A 78 -17.456 16.794 11.769 1.00 0.00 O ATOM 0 H GLY A 78 -14.935 18.573 8.713 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -15.457 18.283 11.404 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -16.454 19.159 10.260 1.00 0.00 H new ATOM 1165 N ASP A 79 -17.669 16.698 9.531 1.00 0.00 N ATOM 1166 CA ASP A 79 -18.740 15.708 9.566 1.00 0.00 C ATOM 1167 C ASP A 79 -18.344 14.507 10.419 1.00 0.00 C ATOM 1168 O ASP A 79 -19.192 13.868 11.039 1.00 0.00 O ATOM 1169 CB ASP A 79 -19.087 15.251 8.148 1.00 0.00 C ATOM 1170 CG ASP A 79 -20.480 14.659 8.055 1.00 0.00 C ATOM 1171 OD1 ASP A 79 -20.667 13.510 8.506 1.00 0.00 O ATOM 1172 OD2 ASP A 79 -21.382 15.345 7.531 1.00 0.00 O ATOM 0 H ASP A 79 -17.397 16.993 8.593 1.00 0.00 H new ATOM 0 HA ASP A 79 -19.617 16.174 10.014 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -19.009 16.099 7.467 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -18.358 14.510 7.819 1.00 0.00 H new ATOM 1177 N GLN A 80 -17.049 14.207 10.442 1.00 0.00 N ATOM 1178 CA GLN A 80 -16.541 13.081 11.217 1.00 0.00 C ATOM 1179 C GLN A 80 -16.222 13.505 12.647 1.00 0.00 C ATOM 1180 O GLN A 80 -16.343 12.712 13.582 1.00 0.00 O ATOM 1181 CB GLN A 80 -15.291 12.501 10.554 1.00 0.00 C ATOM 1182 CG GLN A 80 -15.553 11.903 9.180 1.00 0.00 C ATOM 1183 CD GLN A 80 -14.598 12.425 8.125 1.00 0.00 C ATOM 1184 OE1 GLN A 80 -13.423 12.057 8.098 1.00 0.00 O ATOM 1185 NE2 GLN A 80 -15.097 13.288 7.248 1.00 0.00 N ATOM 0 H GLN A 80 -16.334 14.727 9.934 1.00 0.00 H new ATOM 0 HA GLN A 80 -17.316 12.315 11.248 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -14.541 13.286 10.462 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -14.870 11.732 11.202 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -15.467 10.818 9.238 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -16.577 12.126 8.880 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -16.077 13.566 7.307 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -14.501 13.673 6.515 1.00 0.00 H new ATOM 1194 N LEU A 81 -15.813 14.758 12.810 1.00 0.00 N ATOM 1195 CA LEU A 81 -15.475 15.287 14.127 1.00 0.00 C ATOM 1196 C LEU A 81 -16.725 15.442 14.988 1.00 0.00 C ATOM 1197 O LEU A 81 -16.714 15.126 16.179 1.00 0.00 O ATOM 1198 CB LEU A 81 -14.767 16.636 13.990 1.00 0.00 C ATOM 1199 CG LEU A 81 -13.410 16.613 13.286 1.00 0.00 C ATOM 1200 CD1 LEU A 81 -12.904 18.028 13.054 1.00 0.00 C ATOM 1201 CD2 LEU A 81 -12.402 15.810 14.096 1.00 0.00 C ATOM 0 H LEU A 81 -15.707 15.427 12.047 1.00 0.00 H new ATOM 0 HA LEU A 81 -14.805 14.579 14.615 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.424 17.315 13.447 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -14.630 17.055 14.987 1.00 0.00 H new ATOM 0 HG LEU A 81 -13.534 16.130 12.317 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -11.937 17.991 12.552 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -13.615 18.571 12.432 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.796 18.537 14.012 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -11.442 15.804 13.580 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -12.282 16.263 15.080 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -12.759 14.786 14.209 1.00 0.00 H new ATOM 1213 N HIS A 82 -17.801 15.927 14.378 1.00 0.00 N ATOM 1214 CA HIS A 82 -19.060 16.121 15.089 1.00 0.00 C ATOM 1215 C HIS A 82 -19.549 14.810 15.697 1.00 0.00 C ATOM 1216 O HIS A 82 -19.863 14.744 16.885 1.00 0.00 O ATOM 1217 CB HIS A 82 -20.122 16.685 14.144 1.00 0.00 C ATOM 1218 CG HIS A 82 -21.364 17.144 14.844 1.00 0.00 C ATOM 1219 ND1 HIS A 82 -22.536 16.416 14.852 1.00 0.00 N ATOM 1220 CD2 HIS A 82 -21.613 18.262 15.564 1.00 0.00 C ATOM 1221 CE1 HIS A 82 -23.452 17.069 15.545 1.00 0.00 C ATOM 1222 NE2 HIS A 82 -22.917 18.192 15.989 1.00 0.00 N ATOM 0 H HIS A 82 -17.827 16.193 13.394 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.887 16.833 15.896 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -19.696 17.522 13.591 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -20.388 15.922 13.413 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -20.916 19.061 15.767 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -24.466 16.740 15.719 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -23.395 18.893 16.555 1.00 0.00 H new ATOM 1230 N ALA A 83 -19.610 13.768 14.874 1.00 0.00 N ATOM 1231 CA ALA A 83 -20.058 12.458 15.331 1.00 0.00 C ATOM 1232 C ALA A 83 -19.294 12.020 16.576 1.00 0.00 C ATOM 1233 O ALA A 83 -19.823 11.290 17.413 1.00 0.00 O ATOM 1234 CB ALA A 83 -19.898 11.429 14.222 1.00 0.00 C ATOM 0 H ALA A 83 -19.355 13.806 13.887 1.00 0.00 H new ATOM 0 HA ALA A 83 -21.114 12.533 15.592 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -20.236 10.456 14.577 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -20.494 11.728 13.360 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -18.849 11.365 13.933 1.00 0.00 H new ATOM 1240 N GLN A 84 -18.049 12.471 16.690 1.00 0.00 N ATOM 1241 CA GLN A 84 -17.213 12.123 17.833 1.00 0.00 C ATOM 1242 C GLN A 84 -17.578 12.966 19.050 1.00 0.00 C ATOM 1243 O GLN A 84 -17.770 12.441 20.148 1.00 0.00 O ATOM 1244 CB GLN A 84 -15.736 12.316 17.488 1.00 0.00 C ATOM 1245 CG GLN A 84 -15.192 11.267 16.531 1.00 0.00 C ATOM 1246 CD GLN A 84 -14.203 10.329 17.193 1.00 0.00 C ATOM 1247 OE1 GLN A 84 -13.085 10.723 17.529 1.00 0.00 O ATOM 1248 NE2 GLN A 84 -14.609 9.080 17.386 1.00 0.00 N ATOM 0 H GLN A 84 -17.597 13.078 16.006 1.00 0.00 H new ATOM 0 HA GLN A 84 -17.388 11.075 18.074 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -15.601 13.303 17.047 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -15.151 12.295 18.407 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -16.021 10.687 16.125 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -14.708 11.764 15.690 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -15.544 8.796 17.092 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.986 8.404 17.828 1.00 0.00 H new ATOM 1257 N LEU A 85 -17.671 14.276 18.850 1.00 0.00 N ATOM 1258 CA LEU A 85 -18.012 15.193 19.932 1.00 0.00 C ATOM 1259 C LEU A 85 -19.381 14.860 20.517 1.00 0.00 C ATOM 1260 O LEU A 85 -19.642 15.112 21.693 1.00 0.00 O ATOM 1261 CB LEU A 85 -17.998 16.637 19.427 1.00 0.00 C ATOM 1262 CG LEU A 85 -16.655 17.363 19.503 1.00 0.00 C ATOM 1263 CD1 LEU A 85 -16.694 18.647 18.689 1.00 0.00 C ATOM 1264 CD2 LEU A 85 -16.289 17.657 20.950 1.00 0.00 C ATOM 0 H LEU A 85 -17.515 14.727 17.949 1.00 0.00 H new ATOM 0 HA LEU A 85 -17.265 15.082 20.718 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -18.332 16.641 18.389 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -18.729 17.208 19.999 1.00 0.00 H new ATOM 0 HG LEU A 85 -15.889 16.713 19.080 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -15.729 19.149 18.756 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -16.909 18.411 17.647 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -17.472 19.302 19.080 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -15.330 18.174 20.985 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -17.057 18.287 21.399 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -16.217 16.721 21.504 1.00 0.00 H new ATOM 1276 N ARG A 86 -20.250 14.291 19.688 1.00 0.00 N ATOM 1277 CA ARG A 86 -21.591 13.922 20.124 1.00 0.00 C ATOM 1278 C ARG A 86 -21.540 12.779 21.133 1.00 0.00 C ATOM 1279 O ARG A 86 -22.412 12.658 21.994 1.00 0.00 O ATOM 1280 CB ARG A 86 -22.447 13.517 18.922 1.00 0.00 C ATOM 1281 CG ARG A 86 -23.102 14.694 18.217 1.00 0.00 C ATOM 1282 CD ARG A 86 -24.471 14.323 17.669 1.00 0.00 C ATOM 1283 NE ARG A 86 -25.392 15.457 17.683 1.00 0.00 N ATOM 1284 CZ ARG A 86 -26.701 15.344 17.486 1.00 0.00 C ATOM 1285 NH1 ARG A 86 -27.240 14.153 17.262 1.00 0.00 N ATOM 1286 NH2 ARG A 86 -27.473 16.422 17.514 1.00 0.00 N ATOM 0 H ARG A 86 -20.049 14.076 18.711 1.00 0.00 H new ATOM 0 HA ARG A 86 -22.040 14.790 20.607 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -21.824 12.978 18.208 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -23.222 12.826 19.255 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -23.201 15.527 18.913 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -22.462 15.033 17.402 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -24.365 13.954 16.649 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -24.890 13.509 18.260 1.00 0.00 H new ATOM 0 HE ARG A 86 -25.009 16.387 17.853 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -26.649 13.322 17.241 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -28.245 14.068 17.111 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -27.062 17.339 17.687 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -28.478 16.334 17.363 1.00 0.00 H new ATOM 1300 N ASP A 87 -20.514 11.943 21.021 1.00 0.00 N ATOM 1301 CA ASP A 87 -20.348 10.810 21.924 1.00 0.00 C ATOM 1302 C ASP A 87 -19.674 11.243 23.222 1.00 0.00 C ATOM 1303 O ASP A 87 -20.044 10.792 24.307 1.00 0.00 O ATOM 1304 CB ASP A 87 -19.526 9.710 21.251 1.00 0.00 C ATOM 1305 CG ASP A 87 -20.351 8.474 20.948 1.00 0.00 C ATOM 1306 OD1 ASP A 87 -20.585 7.674 21.878 1.00 0.00 O ATOM 1307 OD2 ASP A 87 -20.763 8.308 19.781 1.00 0.00 O ATOM 0 H ASP A 87 -19.784 12.028 20.313 1.00 0.00 H new ATOM 0 HA ASP A 87 -21.337 10.420 22.162 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -19.099 10.095 20.325 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -18.692 9.437 21.897 1.00 0.00 H new ATOM 1312 N LEU A 88 -18.683 12.119 23.104 1.00 0.00 N ATOM 1313 CA LEU A 88 -17.956 12.614 24.268 1.00 0.00 C ATOM 1314 C LEU A 88 -18.917 13.160 25.319 1.00 0.00 C ATOM 1315 O LEU A 88 -18.704 12.989 26.520 1.00 0.00 O ATOM 1316 CB LEU A 88 -16.966 13.702 23.851 1.00 0.00 C ATOM 1317 CG LEU A 88 -15.720 13.226 23.102 1.00 0.00 C ATOM 1318 CD1 LEU A 88 -15.028 14.396 22.420 1.00 0.00 C ATOM 1319 CD2 LEU A 88 -14.765 12.519 24.052 1.00 0.00 C ATOM 0 H LEU A 88 -18.364 12.502 22.214 1.00 0.00 H new ATOM 0 HA LEU A 88 -17.407 11.780 24.704 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.491 14.421 23.222 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -16.646 14.236 24.746 1.00 0.00 H new ATOM 0 HG LEU A 88 -16.029 12.516 22.335 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.144 14.038 21.892 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.712 14.859 21.709 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -14.731 15.130 23.169 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.884 12.187 23.502 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.462 13.206 24.842 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -15.264 11.656 24.494 1.00 0.00 H new ATOM 1331 N THR A 89 -19.978 13.816 24.859 1.00 0.00 N ATOM 1332 CA THR A 89 -20.973 14.387 25.759 1.00 0.00 C ATOM 1333 C THR A 89 -22.092 13.392 26.043 1.00 0.00 C ATOM 1334 O THR A 89 -22.649 13.366 27.140 1.00 0.00 O ATOM 1335 CB THR A 89 -21.583 15.676 25.177 1.00 0.00 C ATOM 1336 OG1 THR A 89 -21.944 15.471 23.806 1.00 0.00 O ATOM 1337 CG2 THR A 89 -20.602 16.834 25.281 1.00 0.00 C ATOM 0 H THR A 89 -20.170 13.965 23.868 1.00 0.00 H new ATOM 0 HA THR A 89 -20.458 14.626 26.689 1.00 0.00 H new ATOM 0 HB THR A 89 -22.474 15.923 25.754 1.00 0.00 H new ATOM 0 HG1 THR A 89 -22.333 16.294 23.443 1.00 0.00 H new ATOM 0 HG21 THR A 89 -21.055 17.733 24.864 1.00 0.00 H new ATOM 0 HG22 THR A 89 -20.352 17.006 26.328 1.00 0.00 H new ATOM 0 HG23 THR A 89 -19.695 16.594 24.726 1.00 0.00 H new ATOM 1345 N SER A 90 -22.416 12.573 25.047 1.00 0.00 N ATOM 1346 CA SER A 90 -23.472 11.577 25.189 1.00 0.00 C ATOM 1347 C SER A 90 -24.803 12.241 25.530 1.00 0.00 C ATOM 1348 O SER A 90 -25.615 11.685 26.269 1.00 0.00 O ATOM 1349 CB SER A 90 -23.103 10.563 26.273 1.00 0.00 C ATOM 1350 OG SER A 90 -21.699 10.501 26.458 1.00 0.00 O ATOM 0 H SER A 90 -21.963 12.580 24.133 1.00 0.00 H new ATOM 0 HA SER A 90 -23.578 11.058 24.236 1.00 0.00 H new ATOM 0 HB2 SER A 90 -23.585 10.838 27.211 1.00 0.00 H new ATOM 0 HB3 SER A 90 -23.480 9.578 25.998 1.00 0.00 H new ATOM 0 HG SER A 90 -21.253 10.509 25.585 1.00 0.00 H new ATOM 1356 N SER A 91 -25.018 13.434 24.986 1.00 0.00 N ATOM 1357 CA SER A 91 -26.248 14.178 25.234 1.00 0.00 C ATOM 1358 C SER A 91 -26.459 14.394 26.730 1.00 0.00 C ATOM 1359 O SER A 91 -25.627 14.002 27.548 1.00 0.00 O ATOM 1360 CB SER A 91 -27.446 13.435 24.641 1.00 0.00 C ATOM 1361 OG SER A 91 -27.176 13.005 23.318 1.00 0.00 O ATOM 0 H SER A 91 -24.356 13.907 24.370 1.00 0.00 H new ATOM 0 HA SER A 91 -26.159 15.152 24.752 1.00 0.00 H new ATOM 0 HB2 SER A 91 -27.689 12.574 25.264 1.00 0.00 H new ATOM 0 HB3 SER A 91 -28.320 14.087 24.644 1.00 0.00 H new ATOM 0 HG SER A 91 -27.957 12.531 22.962 1.00 0.00 H new ATOM 1367 N SER A 92 -27.577 15.022 27.079 1.00 0.00 N ATOM 1368 CA SER A 92 -27.897 15.295 28.475 1.00 0.00 C ATOM 1369 C SER A 92 -28.820 14.220 29.041 1.00 0.00 C ATOM 1370 O SER A 92 -30.024 14.228 28.790 1.00 0.00 O ATOM 1371 CB SER A 92 -28.553 16.670 28.610 1.00 0.00 C ATOM 1372 OG SER A 92 -28.817 16.978 29.968 1.00 0.00 O ATOM 0 H SER A 92 -28.277 15.351 26.414 1.00 0.00 H new ATOM 0 HA SER A 92 -26.967 15.287 29.044 1.00 0.00 H new ATOM 0 HB2 SER A 92 -27.901 17.431 28.181 1.00 0.00 H new ATOM 0 HB3 SER A 92 -29.483 16.690 28.042 1.00 0.00 H new ATOM 0 HG SER A 92 -29.235 17.862 30.028 1.00 0.00 H new TER 1378 SER A 92