USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 967 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 26 THR OG1 : rot -110:sc= 0.566 USER MOD Set 1.2: A 62 THR OG1 : rot 142:sc= 0.621 USER MOD Set 2.1: A 5 THR OG1 : rot 180:sc= -0.0141 USER MOD Set 2.2: A 8 GLN : amide:sc= -0.844 X(o=-0.86,f=-0.72) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0699 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.007 USER MOD Single : A 30 LYS NZ :NH3+ 171:sc= -0.0139 (180deg=-0.104) USER MOD Single : A 34 THR OG1 : rot 53:sc= 0.0154 USER MOD Single : A 36 MET CE :methyl -136:sc= 0 (180deg=-0.136) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc=-0.00941 K(o=-0.0094,f=-1.8!) USER MOD Single : A 42 ASN : amide:sc= 1.41 K(o=1.4,f=-8.4!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.0531 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 MET CE :methyl -163:sc= 0 (180deg=-0.0916) USER MOD Single : A 53 ASN : amide:sc= -0.382 X(o=-0.38,f=-0.14) USER MOD Single : A 60 ASN : amide:sc= 0.249 K(o=0.25,f=-2.5!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 160:sc= 0 (180deg=-0.447) USER MOD Single : A 72 MET CE :methyl -174:sc= -0.0172 (180deg=-0.0757) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc=-0.00607 K(o=-0.0061,f=-3.8!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -72:sc= 0.823 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 109 MET CE :methyl -174:sc= -0.317 (180deg=-0.42) USER MOD Single : A 110 THR OG1 : rot 64:sc= 0.356 USER MOD Single : A 111 ASN : amide:sc= 1.19 K(o=1.2,f=-0.0028) USER MOD Single : A 115 LYS NZ :NH3+ -135:sc= -0.0194 (180deg=-0.412) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -175:sc= 0 (180deg=-0.0332) USER MOD Single : A 135 GLN : amide:sc= -0.845 K(o=-0.85,f=-4.7!) USER MOD Single : A 137 ASN : amide:sc= 0.0498 K(o=0.05,f=-7.2!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.191 X(o=-0.19,f=0) USER MOD Single : A 144 MET CE :methyl -162:sc= -0.0339 (180deg=-0.203) USER MOD Single : A 145 MET CE :methyl -114:sc= -0.0357 (180deg=-0.271) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -12.328 16.362 0.430 1.00 0.00 N ATOM 59 CA THR A 5 -13.037 17.423 -0.214 1.00 0.00 C ATOM 60 C THR A 5 -14.331 16.896 -0.732 1.00 0.00 C ATOM 61 O THR A 5 -14.446 15.709 -1.035 1.00 0.00 O ATOM 62 CB THR A 5 -12.335 18.025 -1.395 1.00 0.00 C ATOM 63 OG1 THR A 5 -12.099 17.152 -2.489 1.00 0.00 O ATOM 64 CG2 THR A 5 -10.942 18.600 -1.087 1.00 0.00 C ATOM 0 HA THR A 5 -13.143 18.196 0.547 1.00 0.00 H new ATOM 0 HB THR A 5 -13.060 18.796 -1.655 1.00 0.00 H new ATOM 0 HG1 THR A 5 -11.640 17.640 -3.204 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.510 19.014 -1.998 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.031 19.387 -0.338 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.297 17.808 -0.707 1.00 0.00 H new ATOM 72 N GLU A 6 -15.341 17.751 -0.974 1.00 0.00 N ATOM 73 CA GLU A 6 -16.675 17.428 -1.377 1.00 0.00 C ATOM 74 C GLU A 6 -16.713 16.684 -2.667 1.00 0.00 C ATOM 75 O GLU A 6 -17.544 15.790 -2.818 1.00 0.00 O ATOM 76 CB GLU A 6 -17.671 18.598 -1.310 1.00 0.00 C ATOM 77 CG GLU A 6 -18.148 18.996 0.088 1.00 0.00 C ATOM 78 CD GLU A 6 -19.114 18.038 0.771 1.00 0.00 C ATOM 79 OE1 GLU A 6 -20.052 17.651 0.023 1.00 0.00 O ATOM 80 OE2 GLU A 6 -18.930 17.730 1.979 1.00 0.00 O ATOM 0 H GLU A 6 -15.210 18.758 -0.878 1.00 0.00 H new ATOM 0 HA GLU A 6 -17.041 16.741 -0.614 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -17.209 19.469 -1.776 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -18.544 18.340 -1.910 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -17.273 19.113 0.727 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -18.626 19.973 0.021 1.00 0.00 H new ATOM 87 N GLU A 7 -15.911 17.037 -3.687 1.00 0.00 N ATOM 88 CA GLU A 7 -15.743 16.300 -4.901 1.00 0.00 C ATOM 89 C GLU A 7 -15.253 14.910 -4.685 1.00 0.00 C ATOM 90 O GLU A 7 -15.682 13.968 -5.350 1.00 0.00 O ATOM 91 CB GLU A 7 -14.783 17.048 -5.842 1.00 0.00 C ATOM 92 CG GLU A 7 -13.338 17.316 -5.419 1.00 0.00 C ATOM 93 CD GLU A 7 -12.654 17.950 -6.622 1.00 0.00 C ATOM 94 OE1 GLU A 7 -12.162 17.159 -7.470 1.00 0.00 O ATOM 95 OE2 GLU A 7 -12.456 19.194 -6.657 1.00 0.00 O ATOM 0 H GLU A 7 -15.347 17.887 -3.662 1.00 0.00 H new ATOM 0 HA GLU A 7 -16.731 16.219 -5.353 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -14.747 16.488 -6.777 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -15.238 18.013 -6.066 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -13.302 17.981 -4.556 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.839 16.391 -5.130 1.00 0.00 H new ATOM 102 N GLN A 8 -14.366 14.627 -3.715 1.00 0.00 N ATOM 103 CA GLN A 8 -13.879 13.338 -3.331 1.00 0.00 C ATOM 104 C GLN A 8 -14.874 12.403 -2.734 1.00 0.00 C ATOM 105 O GLN A 8 -15.078 11.306 -3.253 1.00 0.00 O ATOM 106 CB GLN A 8 -12.662 13.389 -2.392 1.00 0.00 C ATOM 107 CG GLN A 8 -11.443 13.916 -3.150 1.00 0.00 C ATOM 108 CD GLN A 8 -10.363 14.419 -2.203 1.00 0.00 C ATOM 109 OE1 GLN A 8 -10.655 15.046 -1.185 1.00 0.00 O ATOM 110 NE2 GLN A 8 -9.075 14.148 -2.543 1.00 0.00 N ATOM 0 H GLN A 8 -13.953 15.369 -3.149 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.595 12.936 -4.304 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.877 14.032 -1.539 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.454 12.394 -1.997 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.035 13.124 -3.778 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.749 14.724 -3.814 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.872 13.625 -3.395 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.312 14.467 -1.946 1.00 0.00 H new ATOM 119 N ILE A 9 -15.695 12.915 -1.800 1.00 0.00 N ATOM 120 CA ILE A 9 -16.813 12.221 -1.238 1.00 0.00 C ATOM 121 C ILE A 9 -17.767 11.892 -2.335 1.00 0.00 C ATOM 122 O ILE A 9 -18.363 10.822 -2.451 1.00 0.00 O ATOM 123 CB ILE A 9 -17.561 13.041 -0.229 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.564 13.695 0.742 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.562 12.217 0.598 1.00 0.00 C ATOM 126 CD1 ILE A 9 -17.282 14.579 1.760 1.00 0.00 C ATOM 0 H ILE A 9 -15.575 13.854 -1.420 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.422 11.334 -0.739 1.00 0.00 H new ATOM 0 HB ILE A 9 -18.123 13.786 -0.792 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.999 12.922 1.263 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.845 14.292 0.181 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -19.070 12.869 1.309 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.297 11.763 -0.067 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.030 11.435 1.139 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.551 15.027 2.432 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -17.826 15.367 1.238 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.982 13.975 2.337 1.00 0.00 H new ATOM 138 N ALA A 10 -17.979 12.860 -3.244 1.00 0.00 N ATOM 139 CA ALA A 10 -18.820 12.766 -4.397 1.00 0.00 C ATOM 140 C ALA A 10 -18.341 11.722 -5.347 1.00 0.00 C ATOM 141 O ALA A 10 -19.126 10.916 -5.842 1.00 0.00 O ATOM 142 CB ALA A 10 -19.036 14.196 -4.921 1.00 0.00 C ATOM 0 H ALA A 10 -17.530 13.773 -3.167 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.816 12.384 -4.174 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -19.675 14.167 -5.804 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -19.512 14.799 -4.148 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.074 14.636 -5.183 1.00 0.00 H new ATOM 148 N GLU A 11 -17.011 11.539 -5.439 1.00 0.00 N ATOM 149 CA GLU A 11 -16.486 10.454 -6.208 1.00 0.00 C ATOM 150 C GLU A 11 -16.741 9.133 -5.567 1.00 0.00 C ATOM 151 O GLU A 11 -17.046 8.145 -6.234 1.00 0.00 O ATOM 152 CB GLU A 11 -14.988 10.606 -6.521 1.00 0.00 C ATOM 153 CG GLU A 11 -14.656 11.636 -7.602 1.00 0.00 C ATOM 154 CD GLU A 11 -13.375 11.389 -8.386 1.00 0.00 C ATOM 155 OE1 GLU A 11 -13.012 10.241 -8.756 1.00 0.00 O ATOM 156 OE2 GLU A 11 -12.566 12.342 -8.550 1.00 0.00 O ATOM 0 H GLU A 11 -16.311 12.130 -4.990 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.026 10.490 -7.154 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -14.467 10.882 -5.604 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.597 9.637 -6.831 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.487 11.676 -8.306 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.588 12.617 -7.133 1.00 0.00 H new ATOM 163 N PHE A 12 -16.591 9.019 -4.236 1.00 0.00 N ATOM 164 CA PHE A 12 -16.813 7.896 -3.378 1.00 0.00 C ATOM 165 C PHE A 12 -18.228 7.429 -3.363 1.00 0.00 C ATOM 166 O PHE A 12 -18.473 6.226 -3.292 1.00 0.00 O ATOM 167 CB PHE A 12 -16.348 8.160 -1.935 1.00 0.00 C ATOM 168 CG PHE A 12 -14.887 8.370 -1.731 1.00 0.00 C ATOM 169 CD1 PHE A 12 -13.948 8.360 -2.735 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.507 8.766 -0.471 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.680 8.842 -2.513 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.247 9.270 -0.244 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.303 9.209 -1.242 1.00 0.00 C ATOM 0 H PHE A 12 -16.272 9.822 -3.694 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.204 7.101 -3.808 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.873 9.040 -1.564 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.660 7.318 -1.317 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.209 7.970 -3.708 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.204 8.681 0.349 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.983 8.932 -3.333 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -13.001 9.710 0.711 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.271 9.448 -1.029 1.00 0.00 H new ATOM 183 N LYS A 13 -19.188 8.371 -3.399 1.00 0.00 N ATOM 184 CA LYS A 13 -20.591 8.233 -3.639 1.00 0.00 C ATOM 185 C LYS A 13 -20.936 7.714 -4.992 1.00 0.00 C ATOM 186 O LYS A 13 -21.498 6.621 -4.968 1.00 0.00 O ATOM 187 CB LYS A 13 -21.292 9.566 -3.328 1.00 0.00 C ATOM 188 CG LYS A 13 -22.809 9.381 -3.256 1.00 0.00 C ATOM 189 CD LYS A 13 -23.393 10.669 -2.673 1.00 0.00 C ATOM 190 CE LYS A 13 -23.516 11.807 -3.688 1.00 0.00 C ATOM 191 NZ LYS A 13 -24.329 12.883 -3.078 1.00 0.00 N ATOM 0 H LYS A 13 -18.946 9.349 -3.240 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.960 7.461 -2.963 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.925 9.963 -2.381 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.047 10.299 -4.097 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.220 9.185 -4.246 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.063 8.525 -2.630 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -24.379 10.455 -2.260 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -22.765 10.999 -1.845 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -22.530 12.183 -3.959 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -23.984 11.450 -4.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -24.426 13.669 -3.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.271 12.513 -2.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -23.862 13.224 -2.214 1.00 0.00 H new ATOM 205 N GLU A 14 -20.527 8.369 -6.093 1.00 0.00 N ATOM 206 CA GLU A 14 -20.563 7.891 -7.440 1.00 0.00 C ATOM 207 C GLU A 14 -20.148 6.469 -7.592 1.00 0.00 C ATOM 208 O GLU A 14 -20.824 5.745 -8.321 1.00 0.00 O ATOM 209 CB GLU A 14 -19.922 8.829 -8.477 1.00 0.00 C ATOM 210 CG GLU A 14 -20.616 10.151 -8.811 1.00 0.00 C ATOM 211 CD GLU A 14 -22.127 10.085 -8.977 1.00 0.00 C ATOM 212 OE1 GLU A 14 -22.645 9.262 -9.778 1.00 0.00 O ATOM 213 OE2 GLU A 14 -22.794 10.978 -8.390 1.00 0.00 O ATOM 0 H GLU A 14 -20.139 9.311 -6.034 1.00 0.00 H new ATOM 0 HA GLU A 14 -21.625 7.907 -7.685 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -18.916 9.064 -8.130 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -19.816 8.269 -9.406 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.388 10.868 -8.023 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -20.185 10.542 -9.733 1.00 0.00 H new ATOM 220 N ALA A 15 -19.070 6.076 -6.890 1.00 0.00 N ATOM 221 CA ALA A 15 -18.561 4.739 -6.873 1.00 0.00 C ATOM 222 C ALA A 15 -19.403 3.777 -6.109 1.00 0.00 C ATOM 223 O ALA A 15 -19.695 2.675 -6.572 1.00 0.00 O ATOM 224 CB ALA A 15 -17.157 4.688 -6.248 1.00 0.00 C ATOM 0 H ALA A 15 -18.530 6.717 -6.309 1.00 0.00 H new ATOM 0 HA ALA A 15 -18.552 4.444 -7.922 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.796 3.660 -6.248 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.477 5.312 -6.829 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.201 5.056 -5.223 1.00 0.00 H new ATOM 230 N PHE A 16 -19.869 4.219 -4.927 1.00 0.00 N ATOM 231 CA PHE A 16 -20.621 3.418 -4.011 1.00 0.00 C ATOM 232 C PHE A 16 -21.863 2.820 -4.576 1.00 0.00 C ATOM 233 O PHE A 16 -22.233 1.660 -4.407 1.00 0.00 O ATOM 234 CB PHE A 16 -20.915 4.264 -2.760 1.00 0.00 C ATOM 235 CG PHE A 16 -21.599 3.524 -1.662 1.00 0.00 C ATOM 236 CD1 PHE A 16 -22.967 3.396 -1.597 1.00 0.00 C ATOM 237 CD2 PHE A 16 -20.810 3.037 -0.647 1.00 0.00 C ATOM 238 CE1 PHE A 16 -23.544 2.858 -0.471 1.00 0.00 C ATOM 239 CE2 PHE A 16 -21.389 2.547 0.500 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.758 2.442 0.578 1.00 0.00 C ATOM 0 H PHE A 16 -19.716 5.172 -4.596 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.010 2.551 -3.758 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -19.976 4.667 -2.380 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.533 5.114 -3.048 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.583 3.716 -2.424 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.735 3.039 -0.750 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -24.618 2.762 -0.410 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.773 2.247 1.334 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.217 2.032 1.465 1.00 0.00 H new ATOM 250 N SER A 17 -22.529 3.759 -5.273 1.00 0.00 N ATOM 251 CA SER A 17 -23.808 3.525 -5.868 1.00 0.00 C ATOM 252 C SER A 17 -23.817 2.641 -7.067 1.00 0.00 C ATOM 253 O SER A 17 -24.722 1.855 -7.344 1.00 0.00 O ATOM 254 CB SER A 17 -24.422 4.860 -6.322 1.00 0.00 C ATOM 255 OG SER A 17 -24.688 5.745 -5.243 1.00 0.00 O ATOM 0 H SER A 17 -22.170 4.702 -5.426 1.00 0.00 H new ATOM 0 HA SER A 17 -24.370 3.021 -5.082 1.00 0.00 H new ATOM 0 HB2 SER A 17 -23.744 5.345 -7.024 1.00 0.00 H new ATOM 0 HB3 SER A 17 -25.349 4.663 -6.860 1.00 0.00 H new ATOM 0 HG SER A 17 -25.075 6.576 -5.589 1.00 0.00 H new ATOM 261 N LEU A 18 -22.674 2.535 -7.767 1.00 0.00 N ATOM 262 CA LEU A 18 -22.379 1.453 -8.655 1.00 0.00 C ATOM 263 C LEU A 18 -22.237 0.127 -7.990 1.00 0.00 C ATOM 264 O LEU A 18 -22.825 -0.799 -8.547 1.00 0.00 O ATOM 265 CB LEU A 18 -21.141 1.721 -9.528 1.00 0.00 C ATOM 266 CG LEU A 18 -21.390 2.838 -10.556 1.00 0.00 C ATOM 267 CD1 LEU A 18 -20.124 3.648 -10.883 1.00 0.00 C ATOM 268 CD2 LEU A 18 -22.185 2.343 -11.776 1.00 0.00 C ATOM 0 H LEU A 18 -21.927 3.228 -7.713 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.263 1.401 -9.291 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -20.301 1.996 -8.890 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -20.860 0.806 -10.049 1.00 0.00 H new ATOM 0 HG LEU A 18 -22.046 3.569 -10.083 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.365 4.420 -11.614 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -19.745 4.114 -9.973 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -19.363 2.984 -11.294 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -22.335 3.168 -12.472 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -21.631 1.546 -12.272 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -23.153 1.963 -11.450 1.00 0.00 H new ATOM 280 N PHE A 19 -21.604 -0.076 -6.821 1.00 0.00 N ATOM 281 CA PHE A 19 -21.349 -1.393 -6.326 1.00 0.00 C ATOM 282 C PHE A 19 -22.473 -1.981 -5.544 1.00 0.00 C ATOM 283 O PHE A 19 -22.402 -3.205 -5.445 1.00 0.00 O ATOM 284 CB PHE A 19 -19.978 -1.453 -5.631 1.00 0.00 C ATOM 285 CG PHE A 19 -18.840 -1.031 -6.495 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.476 -1.852 -7.536 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.032 0.064 -6.298 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.339 -1.680 -8.290 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.923 0.351 -7.058 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.583 -0.562 -8.029 1.00 0.00 C ATOM 0 H PHE A 19 -21.268 0.674 -6.217 1.00 0.00 H new ATOM 0 HA PHE A 19 -21.293 -2.059 -7.187 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.003 -0.818 -4.746 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -19.801 -2.472 -5.287 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -19.123 -2.683 -7.776 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.285 0.741 -5.496 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.053 -2.390 -9.052 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.346 1.250 -6.900 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.687 -0.394 -8.609 1.00 0.00 H new ATOM 300 N ASP A 20 -23.439 -1.118 -5.181 1.00 0.00 N ATOM 301 CA ASP A 20 -24.705 -1.386 -4.572 1.00 0.00 C ATOM 302 C ASP A 20 -25.604 -1.861 -5.661 1.00 0.00 C ATOM 303 O ASP A 20 -26.197 -1.078 -6.401 1.00 0.00 O ATOM 304 CB ASP A 20 -25.284 -0.152 -3.859 1.00 0.00 C ATOM 305 CG ASP A 20 -26.380 -0.390 -2.830 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.741 -1.584 -2.656 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.941 0.620 -2.326 1.00 0.00 O ATOM 0 H ASP A 20 -23.314 -0.117 -5.334 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.599 -2.140 -3.792 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.463 0.367 -3.364 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.676 0.524 -4.619 1.00 0.00 H new ATOM 312 N LYS A 21 -25.819 -3.177 -5.837 1.00 0.00 N ATOM 313 CA LYS A 21 -26.455 -3.705 -7.004 1.00 0.00 C ATOM 314 C LYS A 21 -27.941 -3.679 -6.899 1.00 0.00 C ATOM 315 O LYS A 21 -28.654 -3.181 -7.768 1.00 0.00 O ATOM 316 CB LYS A 21 -26.020 -5.141 -7.342 1.00 0.00 C ATOM 317 CG LYS A 21 -26.297 -5.618 -8.769 1.00 0.00 C ATOM 318 CD LYS A 21 -25.310 -6.724 -9.150 1.00 0.00 C ATOM 319 CE LYS A 21 -25.527 -7.133 -10.608 1.00 0.00 C ATOM 320 NZ LYS A 21 -24.557 -8.148 -11.076 1.00 0.00 N ATOM 0 H LYS A 21 -25.546 -3.887 -5.157 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.130 -3.045 -7.808 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -24.950 -5.227 -7.155 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.520 -5.821 -6.652 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -27.319 -5.989 -8.846 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.208 -4.783 -9.464 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -24.287 -6.375 -9.009 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -25.446 -7.586 -8.497 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -26.538 -7.525 -10.723 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -25.454 -6.249 -11.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -24.754 -8.385 -12.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -23.592 -7.769 -10.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -24.642 -9.005 -10.493 1.00 0.00 H new ATOM 334 N ASP A 22 -28.503 -4.015 -5.724 1.00 0.00 N ATOM 335 CA ASP A 22 -29.886 -3.872 -5.389 1.00 0.00 C ATOM 336 C ASP A 22 -30.288 -2.453 -5.178 1.00 0.00 C ATOM 337 O ASP A 22 -31.421 -2.066 -5.457 1.00 0.00 O ATOM 338 CB ASP A 22 -30.329 -4.772 -4.224 1.00 0.00 C ATOM 339 CG ASP A 22 -29.240 -5.017 -3.190 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.504 -4.074 -2.796 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.154 -6.184 -2.722 1.00 0.00 O ATOM 0 H ASP A 22 -27.956 -4.412 -4.960 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.426 -4.225 -6.268 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.189 -4.317 -3.732 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.661 -5.731 -4.623 1.00 0.00 H new ATOM 346 N GLY A 23 -29.437 -1.578 -4.611 1.00 0.00 N ATOM 347 CA GLY A 23 -29.703 -0.195 -4.365 1.00 0.00 C ATOM 348 C GLY A 23 -30.514 0.014 -3.132 1.00 0.00 C ATOM 349 O GLY A 23 -31.262 0.982 -3.011 1.00 0.00 O ATOM 0 H GLY A 23 -28.504 -1.856 -4.306 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.760 0.343 -4.272 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.230 0.229 -5.220 1.00 0.00 H new ATOM 353 N ASP A 24 -30.248 -0.800 -2.095 1.00 0.00 N ATOM 354 CA ASP A 24 -30.759 -0.642 -0.770 1.00 0.00 C ATOM 355 C ASP A 24 -30.099 0.401 0.065 1.00 0.00 C ATOM 356 O ASP A 24 -30.791 0.918 0.940 1.00 0.00 O ATOM 357 CB ASP A 24 -30.771 -1.915 0.094 1.00 0.00 C ATOM 358 CG ASP A 24 -29.511 -2.742 0.303 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.479 -2.448 -0.358 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.578 -3.818 0.955 1.00 0.00 O ATOM 0 H ASP A 24 -29.641 -1.615 -2.188 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.775 -0.337 -1.019 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.128 -1.625 1.082 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.521 -2.581 -0.333 1.00 0.00 H new ATOM 365 N GLY A 25 -28.819 0.721 -0.199 1.00 0.00 N ATOM 366 CA GLY A 25 -28.076 1.670 0.570 1.00 0.00 C ATOM 367 C GLY A 25 -26.919 1.155 1.356 1.00 0.00 C ATOM 368 O GLY A 25 -26.280 2.045 1.913 1.00 0.00 O ATOM 0 H GLY A 25 -28.288 0.309 -0.966 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.708 2.440 -0.108 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.764 2.157 1.261 1.00 0.00 H new ATOM 372 N THR A 26 -26.540 -0.124 1.180 1.00 0.00 N ATOM 373 CA THR A 26 -25.330 -0.545 1.814 1.00 0.00 C ATOM 374 C THR A 26 -24.668 -1.535 0.918 1.00 0.00 C ATOM 375 O THR A 26 -25.283 -2.065 -0.006 1.00 0.00 O ATOM 376 CB THR A 26 -25.426 -1.129 3.192 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.058 -2.400 3.219 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.266 -0.274 4.155 1.00 0.00 C ATOM 0 H THR A 26 -27.036 -0.829 0.634 1.00 0.00 H new ATOM 0 HA THR A 26 -24.765 0.375 1.967 1.00 0.00 H new ATOM 0 HB THR A 26 -24.382 -1.186 3.500 1.00 0.00 H new ATOM 0 HG1 THR A 26 -26.935 -2.320 3.650 1.00 0.00 H new ATOM 0 HG21 THR A 26 -26.296 -0.752 5.134 1.00 0.00 H new ATOM 0 HG22 THR A 26 -25.819 0.716 4.248 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.280 -0.179 3.767 1.00 0.00 H new ATOM 386 N ILE A 27 -23.454 -1.985 1.281 1.00 0.00 N ATOM 387 CA ILE A 27 -22.565 -2.816 0.529 1.00 0.00 C ATOM 388 C ILE A 27 -22.437 -4.070 1.324 1.00 0.00 C ATOM 389 O ILE A 27 -22.083 -4.161 2.498 1.00 0.00 O ATOM 390 CB ILE A 27 -21.218 -2.248 0.194 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.298 -0.811 -0.348 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.668 -3.194 -0.886 1.00 0.00 C ATOM 393 CD1 ILE A 27 -20.092 -0.352 -1.167 1.00 0.00 C ATOM 0 H ILE A 27 -23.059 -1.742 2.189 1.00 0.00 H new ATOM 0 HA ILE A 27 -22.995 -2.956 -0.463 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.587 -2.184 1.080 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -22.191 -0.723 -0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.425 -0.130 0.493 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.679 -2.857 -1.196 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.597 -4.204 -0.483 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.338 -3.193 -1.746 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -20.248 0.673 -1.502 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.194 -0.400 -0.551 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.972 -1.002 -2.034 1.00 0.00 H new ATOM 405 N THR A 28 -22.770 -5.207 0.687 1.00 0.00 N ATOM 406 CA THR A 28 -22.504 -6.550 1.098 1.00 0.00 C ATOM 407 C THR A 28 -21.196 -7.180 0.764 1.00 0.00 C ATOM 408 O THR A 28 -20.278 -6.539 0.254 1.00 0.00 O ATOM 409 CB THR A 28 -23.617 -7.420 0.594 1.00 0.00 C ATOM 410 OG1 THR A 28 -23.648 -7.463 -0.825 1.00 0.00 O ATOM 411 CG2 THR A 28 -24.979 -6.951 1.134 1.00 0.00 C ATOM 0 H THR A 28 -23.273 -5.180 -0.200 1.00 0.00 H new ATOM 0 HA THR A 28 -22.440 -6.469 2.183 1.00 0.00 H new ATOM 0 HB THR A 28 -23.422 -8.427 0.962 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.384 -8.040 -1.119 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.766 -7.601 0.751 1.00 0.00 H new ATOM 0 HG22 THR A 28 -24.972 -6.992 2.223 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.165 -5.927 0.811 1.00 0.00 H new ATOM 419 N THR A 29 -21.114 -8.475 1.118 1.00 0.00 N ATOM 420 CA THR A 29 -20.037 -9.326 0.718 1.00 0.00 C ATOM 421 C THR A 29 -19.937 -9.572 -0.748 1.00 0.00 C ATOM 422 O THR A 29 -18.877 -9.422 -1.352 1.00 0.00 O ATOM 423 CB THR A 29 -20.003 -10.633 1.454 1.00 0.00 C ATOM 424 OG1 THR A 29 -21.302 -11.206 1.429 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.716 -10.477 2.957 1.00 0.00 C ATOM 0 H THR A 29 -21.813 -8.942 1.696 1.00 0.00 H new ATOM 0 HA THR A 29 -19.160 -8.743 1.000 1.00 0.00 H new ATOM 0 HB THR A 29 -19.225 -11.222 0.968 1.00 0.00 H new ATOM 0 HG1 THR A 29 -21.291 -12.062 1.906 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.705 -11.459 3.429 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.747 -9.998 3.095 1.00 0.00 H new ATOM 0 HG23 THR A 29 -20.492 -9.863 3.414 1.00 0.00 H new ATOM 433 N LYS A 30 -21.078 -9.944 -1.355 1.00 0.00 N ATOM 434 CA LYS A 30 -21.262 -10.101 -2.764 1.00 0.00 C ATOM 435 C LYS A 30 -20.982 -8.928 -3.639 1.00 0.00 C ATOM 436 O LYS A 30 -20.659 -8.999 -4.824 1.00 0.00 O ATOM 437 CB LYS A 30 -22.651 -10.702 -3.039 1.00 0.00 C ATOM 438 CG LYS A 30 -22.859 -11.344 -4.412 1.00 0.00 C ATOM 439 CD LYS A 30 -23.726 -12.605 -4.392 1.00 0.00 C ATOM 440 CE LYS A 30 -25.242 -12.400 -4.365 1.00 0.00 C ATOM 441 NZ LYS A 30 -25.774 -11.594 -5.487 1.00 0.00 N ATOM 0 H LYS A 30 -21.926 -10.148 -0.827 1.00 0.00 H new ATOM 0 HA LYS A 30 -20.468 -10.786 -3.061 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -22.854 -11.454 -2.277 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.394 -9.914 -2.915 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -23.318 -10.612 -5.077 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -21.886 -11.593 -4.835 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -23.479 -13.201 -5.271 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -23.447 -13.195 -3.519 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -25.728 -13.376 -4.373 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -25.514 -11.917 -3.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -26.813 -11.631 -5.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -25.462 -10.607 -5.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -25.421 -11.977 -6.387 1.00 0.00 H new ATOM 455 N GLU A 31 -21.317 -7.762 -3.058 1.00 0.00 N ATOM 456 CA GLU A 31 -20.936 -6.470 -3.538 1.00 0.00 C ATOM 457 C GLU A 31 -19.536 -5.989 -3.369 1.00 0.00 C ATOM 458 O GLU A 31 -18.958 -5.346 -4.243 1.00 0.00 O ATOM 459 CB GLU A 31 -22.005 -5.430 -3.162 1.00 0.00 C ATOM 460 CG GLU A 31 -23.416 -5.863 -3.567 1.00 0.00 C ATOM 461 CD GLU A 31 -24.462 -5.047 -2.821 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.370 -4.784 -1.593 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.545 -4.730 -3.383 1.00 0.00 O ATOM 0 H GLU A 31 -21.882 -7.719 -2.210 1.00 0.00 H new ATOM 0 HA GLU A 31 -20.902 -6.619 -4.617 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -21.977 -5.258 -2.086 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.768 -4.481 -3.643 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.547 -5.736 -4.642 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.553 -6.923 -3.352 1.00 0.00 H new ATOM 470 N LEU A 32 -18.880 -6.329 -2.245 1.00 0.00 N ATOM 471 CA LEU A 32 -17.485 -6.066 -2.069 1.00 0.00 C ATOM 472 C LEU A 32 -16.682 -6.982 -2.928 1.00 0.00 C ATOM 473 O LEU A 32 -15.591 -6.741 -3.442 1.00 0.00 O ATOM 474 CB LEU A 32 -16.976 -5.999 -0.619 1.00 0.00 C ATOM 475 CG LEU A 32 -15.816 -4.996 -0.506 1.00 0.00 C ATOM 476 CD1 LEU A 32 -16.236 -3.518 -0.573 1.00 0.00 C ATOM 477 CD2 LEU A 32 -15.166 -5.189 0.874 1.00 0.00 C ATOM 0 H LEU A 32 -19.321 -6.791 -1.450 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.341 -5.038 -2.400 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.788 -5.703 0.045 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.645 -6.986 -0.297 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.160 -5.195 -1.353 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.353 -2.885 -0.485 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.729 -3.323 -1.525 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.923 -3.298 0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.337 -4.490 0.987 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.905 -5.004 1.653 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -14.795 -6.210 0.962 1.00 0.00 H new ATOM 489 N GLY A 33 -17.267 -8.167 -3.176 1.00 0.00 N ATOM 490 CA GLY A 33 -16.933 -8.995 -4.293 1.00 0.00 C ATOM 491 C GLY A 33 -16.752 -8.416 -5.654 1.00 0.00 C ATOM 492 O GLY A 33 -15.856 -8.712 -6.443 1.00 0.00 O ATOM 0 H GLY A 33 -17.995 -8.562 -2.581 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.007 -9.512 -4.041 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.711 -9.754 -4.371 1.00 0.00 H new ATOM 496 N THR A 34 -17.602 -7.435 -6.004 1.00 0.00 N ATOM 497 CA THR A 34 -17.686 -6.786 -7.276 1.00 0.00 C ATOM 498 C THR A 34 -16.648 -5.718 -7.314 1.00 0.00 C ATOM 499 O THR A 34 -15.989 -5.515 -8.332 1.00 0.00 O ATOM 500 CB THR A 34 -19.024 -6.139 -7.473 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.140 -7.010 -7.366 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.101 -5.449 -8.845 1.00 0.00 C ATOM 0 H THR A 34 -18.286 -7.067 -5.343 1.00 0.00 H new ATOM 0 HA THR A 34 -17.539 -7.529 -8.060 1.00 0.00 H new ATOM 0 HB THR A 34 -19.091 -5.425 -6.652 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.095 -7.497 -6.517 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.081 -4.987 -8.965 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.328 -4.683 -8.911 1.00 0.00 H new ATOM 0 HG23 THR A 34 -18.949 -6.187 -9.633 1.00 0.00 H new ATOM 510 N VAL A 35 -16.510 -5.023 -6.170 1.00 0.00 N ATOM 511 CA VAL A 35 -15.437 -4.088 -6.025 1.00 0.00 C ATOM 512 C VAL A 35 -14.057 -4.607 -6.244 1.00 0.00 C ATOM 513 O VAL A 35 -13.278 -4.009 -6.984 1.00 0.00 O ATOM 514 CB VAL A 35 -15.519 -3.529 -4.636 1.00 0.00 C ATOM 515 CG1 VAL A 35 -14.391 -2.596 -4.161 1.00 0.00 C ATOM 516 CG2 VAL A 35 -16.849 -2.793 -4.400 1.00 0.00 C ATOM 0 H VAL A 35 -17.127 -5.105 -5.362 1.00 0.00 H new ATOM 0 HA VAL A 35 -15.579 -3.353 -6.817 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.421 -4.438 -4.043 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -14.591 -2.274 -3.139 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -13.440 -3.128 -4.194 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.342 -1.724 -4.813 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -16.873 -2.401 -3.383 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -16.940 -1.969 -5.108 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -17.678 -3.486 -4.541 1.00 0.00 H new ATOM 526 N MET A 36 -13.719 -5.699 -5.535 1.00 0.00 N ATOM 527 CA MET A 36 -12.444 -6.346 -5.573 1.00 0.00 C ATOM 528 C MET A 36 -12.343 -6.917 -6.946 1.00 0.00 C ATOM 529 O MET A 36 -11.267 -6.751 -7.518 1.00 0.00 O ATOM 530 CB MET A 36 -12.247 -7.462 -4.534 1.00 0.00 C ATOM 531 CG MET A 36 -12.168 -6.772 -3.170 1.00 0.00 C ATOM 532 SD MET A 36 -11.180 -7.671 -1.937 1.00 0.00 S ATOM 533 CE MET A 36 -9.565 -7.104 -2.545 1.00 0.00 C ATOM 0 H MET A 36 -14.373 -6.156 -4.899 1.00 0.00 H new ATOM 0 HA MET A 36 -11.671 -5.617 -5.330 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.075 -8.171 -4.564 1.00 0.00 H new ATOM 0 HB3 MET A 36 -11.337 -8.026 -4.737 1.00 0.00 H new ATOM 0 HG2 MET A 36 -11.744 -5.776 -3.303 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.178 -6.640 -2.783 1.00 0.00 H new ATOM 0 HE1 MET A 36 -8.872 -7.945 -2.575 1.00 0.00 H new ATOM 0 HE2 MET A 36 -9.678 -6.691 -3.547 1.00 0.00 H new ATOM 0 HE3 MET A 36 -9.175 -6.335 -1.878 1.00 0.00 H new ATOM 543 N ARG A 37 -13.321 -7.520 -7.644 1.00 0.00 N ATOM 544 CA ARG A 37 -13.266 -7.824 -9.040 1.00 0.00 C ATOM 545 C ARG A 37 -12.901 -6.723 -9.975 1.00 0.00 C ATOM 546 O ARG A 37 -12.095 -6.907 -10.886 1.00 0.00 O ATOM 547 CB ARG A 37 -14.508 -8.581 -9.539 1.00 0.00 C ATOM 548 CG ARG A 37 -14.269 -10.084 -9.705 1.00 0.00 C ATOM 549 CD ARG A 37 -14.180 -10.842 -8.379 1.00 0.00 C ATOM 550 NE ARG A 37 -13.566 -12.190 -8.540 1.00 0.00 N ATOM 551 CZ ARG A 37 -14.260 -13.364 -8.604 1.00 0.00 C ATOM 552 NH1 ARG A 37 -15.623 -13.354 -8.671 1.00 0.00 N ATOM 553 NH2 ARG A 37 -13.565 -14.522 -8.803 1.00 0.00 N ATOM 0 H ARG A 37 -14.197 -7.811 -7.211 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.400 -8.485 -9.075 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.327 -8.425 -8.837 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -14.822 -8.161 -10.495 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -15.076 -10.508 -10.302 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -13.346 -10.237 -10.264 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.593 -10.260 -7.669 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -15.179 -10.948 -7.956 1.00 0.00 H new ATOM 0 HE ARG A 37 -12.549 -12.240 -8.608 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -16.127 -12.467 -8.673 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -16.138 -14.233 -8.719 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -12.550 -14.497 -8.900 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -14.061 -15.412 -8.854 1.00 0.00 H new ATOM 567 N SER A 38 -13.453 -5.523 -9.720 1.00 0.00 N ATOM 568 CA SER A 38 -13.117 -4.400 -10.538 1.00 0.00 C ATOM 569 C SER A 38 -11.761 -3.831 -10.299 1.00 0.00 C ATOM 570 O SER A 38 -11.278 -2.986 -11.051 1.00 0.00 O ATOM 571 CB SER A 38 -14.078 -3.199 -10.552 1.00 0.00 C ATOM 572 OG SER A 38 -15.333 -3.554 -11.111 1.00 0.00 O ATOM 0 H SER A 38 -14.115 -5.332 -8.968 1.00 0.00 H new ATOM 0 HA SER A 38 -13.184 -4.903 -11.503 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.220 -2.832 -9.536 1.00 0.00 H new ATOM 0 HB3 SER A 38 -13.638 -2.384 -11.127 1.00 0.00 H new ATOM 0 HG SER A 38 -15.926 -2.774 -11.107 1.00 0.00 H new ATOM 578 N LEU A 39 -11.155 -4.224 -9.164 1.00 0.00 N ATOM 579 CA LEU A 39 -9.754 -3.971 -9.021 1.00 0.00 C ATOM 580 C LEU A 39 -8.904 -4.975 -9.721 1.00 0.00 C ATOM 581 O LEU A 39 -7.764 -4.768 -10.134 1.00 0.00 O ATOM 582 CB LEU A 39 -9.215 -3.914 -7.582 1.00 0.00 C ATOM 583 CG LEU A 39 -9.632 -2.698 -6.739 1.00 0.00 C ATOM 584 CD1 LEU A 39 -9.087 -2.996 -5.332 1.00 0.00 C ATOM 585 CD2 LEU A 39 -8.993 -1.399 -7.260 1.00 0.00 C ATOM 0 H LEU A 39 -11.607 -4.694 -8.380 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.683 -2.979 -9.467 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -9.537 -4.816 -7.062 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.126 -3.942 -7.625 1.00 0.00 H new ATOM 0 HG LEU A 39 -10.712 -2.552 -6.768 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -9.341 -2.175 -4.662 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -9.530 -3.919 -4.958 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -8.003 -3.106 -5.377 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -9.312 -0.562 -6.639 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.907 -1.487 -7.222 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -9.307 -1.227 -8.289 1.00 0.00 H new ATOM 597 N GLY A 40 -9.441 -6.192 -9.916 1.00 0.00 N ATOM 598 CA GLY A 40 -8.741 -7.266 -10.550 1.00 0.00 C ATOM 599 C GLY A 40 -8.296 -8.215 -9.491 1.00 0.00 C ATOM 600 O GLY A 40 -7.306 -8.921 -9.682 1.00 0.00 O ATOM 0 H GLY A 40 -10.388 -6.436 -9.625 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -9.388 -7.771 -11.267 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -7.884 -6.886 -11.106 1.00 0.00 H new ATOM 604 N GLN A 41 -8.992 -8.362 -8.350 1.00 0.00 N ATOM 605 CA GLN A 41 -8.673 -9.285 -7.306 1.00 0.00 C ATOM 606 C GLN A 41 -9.736 -10.317 -7.146 1.00 0.00 C ATOM 607 O GLN A 41 -10.833 -10.079 -7.649 1.00 0.00 O ATOM 608 CB GLN A 41 -8.548 -8.459 -6.015 1.00 0.00 C ATOM 609 CG GLN A 41 -7.624 -7.246 -6.132 1.00 0.00 C ATOM 610 CD GLN A 41 -6.199 -7.713 -6.394 1.00 0.00 C ATOM 611 OE1 GLN A 41 -5.869 -8.867 -6.122 1.00 0.00 O ATOM 612 NE2 GLN A 41 -5.370 -6.766 -6.908 1.00 0.00 N ATOM 0 H GLN A 41 -9.822 -7.806 -8.145 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.749 -9.814 -7.540 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.540 -8.118 -5.718 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.181 -9.105 -5.218 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.959 -6.597 -6.941 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.662 -6.658 -5.215 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.725 -5.830 -7.105 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.393 -6.991 -7.096 1.00 0.00 H new ATOM 621 N ASN A 42 -9.436 -11.480 -6.542 1.00 0.00 N ATOM 622 CA ASN A 42 -10.285 -12.621 -6.393 1.00 0.00 C ATOM 623 C ASN A 42 -10.297 -13.091 -4.979 1.00 0.00 C ATOM 624 O ASN A 42 -9.541 -13.985 -4.601 1.00 0.00 O ATOM 625 CB ASN A 42 -9.723 -13.757 -7.263 1.00 0.00 C ATOM 626 CG ASN A 42 -9.924 -13.425 -8.735 1.00 0.00 C ATOM 627 OD1 ASN A 42 -11.073 -13.338 -9.164 1.00 0.00 O ATOM 628 ND2 ASN A 42 -8.852 -13.421 -9.572 1.00 0.00 N ATOM 0 H ASN A 42 -8.519 -11.634 -6.122 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.298 -12.348 -6.690 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.663 -13.897 -7.054 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.223 -14.695 -7.020 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -8.992 -13.345 -10.579 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.908 -13.494 -9.192 1.00 0.00 H new ATOM 635 N PRO A 43 -11.038 -12.452 -4.123 1.00 0.00 N ATOM 636 CA PRO A 43 -11.107 -12.901 -2.763 1.00 0.00 C ATOM 637 C PRO A 43 -11.984 -14.104 -2.692 1.00 0.00 C ATOM 638 O PRO A 43 -12.709 -14.458 -3.620 1.00 0.00 O ATOM 639 CB PRO A 43 -11.777 -11.725 -2.058 1.00 0.00 C ATOM 640 CG PRO A 43 -12.722 -11.109 -3.102 1.00 0.00 C ATOM 641 CD PRO A 43 -11.967 -11.371 -4.414 1.00 0.00 C ATOM 0 HA PRO A 43 -10.144 -13.173 -2.331 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -12.327 -12.056 -1.177 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.039 -10.998 -1.718 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.703 -11.584 -3.094 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.882 -10.045 -2.929 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.654 -11.650 -5.213 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -11.437 -10.478 -4.746 1.00 0.00 H new ATOM 649 N THR A 44 -11.953 -14.870 -1.587 1.00 0.00 N ATOM 650 CA THR A 44 -12.990 -15.801 -1.267 1.00 0.00 C ATOM 651 C THR A 44 -14.116 -15.188 -0.508 1.00 0.00 C ATOM 652 O THR A 44 -13.983 -14.090 0.029 1.00 0.00 O ATOM 653 CB THR A 44 -12.436 -16.954 -0.484 1.00 0.00 C ATOM 654 OG1 THR A 44 -11.819 -16.614 0.749 1.00 0.00 O ATOM 655 CG2 THR A 44 -11.440 -17.670 -1.411 1.00 0.00 C ATOM 0 H THR A 44 -11.196 -14.843 -0.904 1.00 0.00 H new ATOM 0 HA THR A 44 -13.390 -16.148 -2.220 1.00 0.00 H new ATOM 0 HB THR A 44 -13.270 -17.589 -0.184 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.492 -17.428 1.186 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.005 -18.522 -0.889 1.00 0.00 H new ATOM 0 HG22 THR A 44 -11.960 -18.018 -2.304 1.00 0.00 H new ATOM 0 HG23 THR A 44 -10.649 -16.978 -1.699 1.00 0.00 H new ATOM 663 N GLU A 45 -15.278 -15.847 -0.349 1.00 0.00 N ATOM 664 CA GLU A 45 -16.285 -15.497 0.604 1.00 0.00 C ATOM 665 C GLU A 45 -15.767 -15.256 1.980 1.00 0.00 C ATOM 666 O GLU A 45 -16.176 -14.375 2.735 1.00 0.00 O ATOM 667 CB GLU A 45 -17.423 -16.532 0.611 1.00 0.00 C ATOM 668 CG GLU A 45 -18.095 -16.640 -0.759 1.00 0.00 C ATOM 669 CD GLU A 45 -19.035 -17.834 -0.678 1.00 0.00 C ATOM 670 OE1 GLU A 45 -18.564 -19.001 -0.608 1.00 0.00 O ATOM 671 OE2 GLU A 45 -20.266 -17.569 -0.636 1.00 0.00 O ATOM 0 H GLU A 45 -15.526 -16.661 -0.911 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.681 -14.537 0.272 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.028 -17.506 0.901 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.165 -16.253 1.360 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -18.643 -15.728 -0.997 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.354 -16.781 -1.546 1.00 0.00 H new ATOM 678 N ALA A 46 -14.807 -16.055 2.479 1.00 0.00 N ATOM 679 CA ALA A 46 -14.270 -16.000 3.803 1.00 0.00 C ATOM 680 C ALA A 46 -13.454 -14.770 4.005 1.00 0.00 C ATOM 681 O ALA A 46 -13.660 -14.076 5.000 1.00 0.00 O ATOM 682 CB ALA A 46 -13.409 -17.218 4.179 1.00 0.00 C ATOM 0 H ALA A 46 -14.377 -16.790 1.917 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.144 -15.994 4.455 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -13.039 -17.101 5.197 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -14.012 -18.124 4.114 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -12.566 -17.293 3.493 1.00 0.00 H new ATOM 688 N GLU A 47 -12.650 -14.388 2.997 1.00 0.00 N ATOM 689 CA GLU A 47 -11.823 -13.222 3.038 1.00 0.00 C ATOM 690 C GLU A 47 -12.731 -12.047 3.160 1.00 0.00 C ATOM 691 O GLU A 47 -12.369 -11.096 3.851 1.00 0.00 O ATOM 692 CB GLU A 47 -10.926 -13.091 1.795 1.00 0.00 C ATOM 693 CG GLU A 47 -9.734 -14.050 1.795 1.00 0.00 C ATOM 694 CD GLU A 47 -8.726 -13.590 0.751 1.00 0.00 C ATOM 695 OE1 GLU A 47 -7.962 -12.624 1.014 1.00 0.00 O ATOM 696 OE2 GLU A 47 -8.694 -14.165 -0.370 1.00 0.00 O ATOM 0 H GLU A 47 -12.573 -14.909 2.123 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.143 -13.288 3.887 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.527 -13.271 0.903 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.558 -12.067 1.729 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.270 -14.074 2.781 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.067 -15.064 1.575 1.00 0.00 H new ATOM 703 N LEU A 48 -13.824 -12.061 2.376 1.00 0.00 N ATOM 704 CA LEU A 48 -14.761 -10.982 2.332 1.00 0.00 C ATOM 705 C LEU A 48 -15.587 -10.828 3.563 1.00 0.00 C ATOM 706 O LEU A 48 -15.941 -9.769 4.079 1.00 0.00 O ATOM 707 CB LEU A 48 -15.717 -11.270 1.162 1.00 0.00 C ATOM 708 CG LEU A 48 -15.189 -10.904 -0.235 1.00 0.00 C ATOM 709 CD1 LEU A 48 -16.069 -11.582 -1.300 1.00 0.00 C ATOM 710 CD2 LEU A 48 -15.139 -9.405 -0.574 1.00 0.00 C ATOM 0 H LEU A 48 -14.062 -12.838 1.760 1.00 0.00 H new ATOM 0 HA LEU A 48 -14.189 -10.060 2.226 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.963 -12.332 1.171 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.646 -10.726 1.333 1.00 0.00 H new ATOM 0 HG LEU A 48 -14.156 -11.251 -0.230 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.700 -11.327 -2.293 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -16.034 -12.663 -1.167 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -17.098 -11.237 -1.195 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -14.750 -9.273 -1.584 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -16.143 -8.985 -0.514 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -14.489 -8.893 0.135 1.00 0.00 H new ATOM 722 N GLN A 49 -16.089 -11.941 4.129 1.00 0.00 N ATOM 723 CA GLN A 49 -16.776 -11.853 5.379 1.00 0.00 C ATOM 724 C GLN A 49 -15.985 -11.342 6.534 1.00 0.00 C ATOM 725 O GLN A 49 -16.532 -10.679 7.415 1.00 0.00 O ATOM 726 CB GLN A 49 -17.343 -13.214 5.817 1.00 0.00 C ATOM 727 CG GLN A 49 -18.296 -13.397 7.000 1.00 0.00 C ATOM 728 CD GLN A 49 -19.717 -12.930 6.719 1.00 0.00 C ATOM 729 OE1 GLN A 49 -20.422 -13.329 5.793 1.00 0.00 O ATOM 730 NE2 GLN A 49 -20.095 -11.833 7.429 1.00 0.00 N ATOM 0 H GLN A 49 -16.022 -12.879 3.733 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.554 -11.123 5.155 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.853 -13.627 4.947 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.483 -13.854 6.015 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -18.318 -14.451 7.278 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -17.906 -12.849 7.858 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -19.514 -11.498 8.198 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -20.959 -11.345 7.193 1.00 0.00 H new ATOM 739 N ASP A 50 -14.701 -11.720 6.656 1.00 0.00 N ATOM 740 CA ASP A 50 -13.734 -11.094 7.504 1.00 0.00 C ATOM 741 C ASP A 50 -13.549 -9.626 7.328 1.00 0.00 C ATOM 742 O ASP A 50 -13.439 -8.885 8.304 1.00 0.00 O ATOM 743 CB ASP A 50 -12.361 -11.780 7.410 1.00 0.00 C ATOM 744 CG ASP A 50 -12.304 -13.181 8.005 1.00 0.00 C ATOM 745 OD1 ASP A 50 -13.231 -13.474 8.806 1.00 0.00 O ATOM 746 OD2 ASP A 50 -11.277 -13.886 7.819 1.00 0.00 O ATOM 0 H ASP A 50 -14.316 -12.507 6.134 1.00 0.00 H new ATOM 0 HA ASP A 50 -14.171 -11.224 8.494 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -12.069 -11.834 6.361 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.624 -11.156 7.915 1.00 0.00 H new ATOM 751 N MET A 51 -13.287 -9.165 6.093 1.00 0.00 N ATOM 752 CA MET A 51 -13.372 -7.760 5.839 1.00 0.00 C ATOM 753 C MET A 51 -14.636 -7.077 6.234 1.00 0.00 C ATOM 754 O MET A 51 -14.586 -6.009 6.841 1.00 0.00 O ATOM 755 CB MET A 51 -13.163 -7.469 4.344 1.00 0.00 C ATOM 756 CG MET A 51 -11.839 -7.910 3.716 1.00 0.00 C ATOM 757 SD MET A 51 -11.828 -7.638 1.919 1.00 0.00 S ATOM 758 CE MET A 51 -10.163 -8.309 1.642 1.00 0.00 C ATOM 0 H MET A 51 -13.025 -9.742 5.294 1.00 0.00 H new ATOM 0 HA MET A 51 -12.586 -7.357 6.477 1.00 0.00 H new ATOM 0 HB2 MET A 51 -13.972 -7.947 3.792 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.265 -6.394 4.193 1.00 0.00 H new ATOM 0 HG2 MET A 51 -11.017 -7.359 4.173 1.00 0.00 H new ATOM 0 HG3 MET A 51 -11.670 -8.966 3.926 1.00 0.00 H new ATOM 0 HE1 MET A 51 -9.798 -7.985 0.667 1.00 0.00 H new ATOM 0 HE2 MET A 51 -9.491 -7.947 2.420 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.200 -9.398 1.672 1.00 0.00 H new ATOM 768 N ILE A 52 -15.849 -7.585 5.952 1.00 0.00 N ATOM 769 CA ILE A 52 -17.102 -7.076 6.418 1.00 0.00 C ATOM 770 C ILE A 52 -17.257 -7.036 7.899 1.00 0.00 C ATOM 771 O ILE A 52 -18.044 -6.213 8.366 1.00 0.00 O ATOM 772 CB ILE A 52 -18.177 -7.847 5.712 1.00 0.00 C ATOM 773 CG1 ILE A 52 -19.087 -7.057 4.756 1.00 0.00 C ATOM 774 CG2 ILE A 52 -19.061 -8.752 6.587 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.404 -6.712 3.433 1.00 0.00 C ATOM 0 H ILE A 52 -15.961 -8.407 5.358 1.00 0.00 H new ATOM 0 HA ILE A 52 -17.171 -6.017 6.170 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.528 -8.481 5.108 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -19.986 -7.640 4.554 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -19.407 -6.137 5.245 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.799 -9.255 5.961 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.439 -9.496 7.085 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -19.572 -8.147 7.336 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -19.096 -6.155 2.801 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -17.520 -6.104 3.627 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -18.108 -7.630 2.926 1.00 0.00 H new ATOM 787 N ASN A 53 -16.558 -7.838 8.723 1.00 0.00 N ATOM 788 CA ASN A 53 -16.470 -7.708 10.144 1.00 0.00 C ATOM 789 C ASN A 53 -15.715 -6.469 10.482 1.00 0.00 C ATOM 790 O ASN A 53 -16.096 -5.675 11.341 1.00 0.00 O ATOM 791 CB ASN A 53 -15.817 -8.883 10.892 1.00 0.00 C ATOM 792 CG ASN A 53 -16.612 -10.156 10.642 1.00 0.00 C ATOM 793 OD1 ASN A 53 -17.832 -10.279 10.540 1.00 0.00 O ATOM 794 ND2 ASN A 53 -15.815 -11.233 10.409 1.00 0.00 N ATOM 0 H ASN A 53 -16.019 -8.629 8.372 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.507 -7.681 10.479 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.788 -9.014 10.556 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.779 -8.670 11.960 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -16.230 -12.129 10.153 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -14.802 -11.145 10.490 1.00 0.00 H new ATOM 801 N GLU A 54 -14.521 -6.348 9.874 1.00 0.00 N ATOM 802 CA GLU A 54 -13.629 -5.273 10.179 1.00 0.00 C ATOM 803 C GLU A 54 -14.138 -3.892 9.948 1.00 0.00 C ATOM 804 O GLU A 54 -14.013 -3.016 10.803 1.00 0.00 O ATOM 805 CB GLU A 54 -12.244 -5.474 9.542 1.00 0.00 C ATOM 806 CG GLU A 54 -11.153 -4.548 10.083 1.00 0.00 C ATOM 807 CD GLU A 54 -9.709 -4.768 9.654 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.107 -5.770 10.123 1.00 0.00 O ATOM 809 OE2 GLU A 54 -9.156 -3.892 8.936 1.00 0.00 O ATOM 0 H GLU A 54 -14.173 -6.997 9.169 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.539 -5.334 11.264 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.934 -6.508 9.696 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.329 -5.324 8.466 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.424 -3.528 9.810 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.184 -4.606 11.171 1.00 0.00 H new ATOM 816 N VAL A 55 -14.742 -3.661 8.769 1.00 0.00 N ATOM 817 CA VAL A 55 -14.964 -2.330 8.293 1.00 0.00 C ATOM 818 C VAL A 55 -16.195 -1.789 8.935 1.00 0.00 C ATOM 819 O VAL A 55 -16.547 -0.626 8.742 1.00 0.00 O ATOM 820 CB VAL A 55 -14.962 -2.133 6.806 1.00 0.00 C ATOM 821 CG1 VAL A 55 -13.635 -2.538 6.143 1.00 0.00 C ATOM 822 CG2 VAL A 55 -16.081 -2.936 6.121 1.00 0.00 C ATOM 0 H VAL A 55 -15.077 -4.395 8.145 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.085 -1.758 8.592 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.119 -1.063 6.672 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -13.700 -2.371 5.068 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.824 -1.938 6.555 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -13.439 -3.593 6.335 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -16.045 -2.766 5.045 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.944 -3.998 6.325 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -17.048 -2.614 6.507 1.00 0.00 H new ATOM 832 N ASP A 56 -16.956 -2.633 9.654 1.00 0.00 N ATOM 833 CA ASP A 56 -18.237 -2.262 10.170 1.00 0.00 C ATOM 834 C ASP A 56 -18.134 -1.509 11.452 1.00 0.00 C ATOM 835 O ASP A 56 -18.061 -2.049 12.554 1.00 0.00 O ATOM 836 CB ASP A 56 -19.064 -3.552 10.299 1.00 0.00 C ATOM 837 CG ASP A 56 -20.572 -3.468 10.490 1.00 0.00 C ATOM 838 OD1 ASP A 56 -21.067 -2.310 10.526 1.00 0.00 O ATOM 839 OD2 ASP A 56 -21.211 -4.551 10.568 1.00 0.00 O ATOM 0 H ASP A 56 -16.678 -3.588 9.881 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.735 -1.571 9.490 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.882 -4.146 9.403 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.660 -4.114 11.141 1.00 0.00 H new ATOM 844 N ALA A 57 -18.318 -0.177 11.444 1.00 0.00 N ATOM 845 CA ALA A 57 -18.247 0.638 12.617 1.00 0.00 C ATOM 846 C ALA A 57 -19.393 0.504 13.559 1.00 0.00 C ATOM 847 O ALA A 57 -19.238 0.349 14.770 1.00 0.00 O ATOM 848 CB ALA A 57 -17.937 2.105 12.273 1.00 0.00 C ATOM 0 H ALA A 57 -18.523 0.350 10.595 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.404 0.237 13.179 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -17.891 2.692 13.190 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -16.979 2.163 11.757 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.721 2.501 11.628 1.00 0.00 H new ATOM 854 N ASP A 58 -20.606 0.522 12.980 1.00 0.00 N ATOM 855 CA ASP A 58 -21.875 0.474 13.639 1.00 0.00 C ATOM 856 C ASP A 58 -22.188 -0.915 14.078 1.00 0.00 C ATOM 857 O ASP A 58 -22.973 -1.163 14.992 1.00 0.00 O ATOM 858 CB ASP A 58 -23.010 1.147 12.849 1.00 0.00 C ATOM 859 CG ASP A 58 -23.148 0.570 11.448 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.381 -0.657 11.279 1.00 0.00 O ATOM 861 OD2 ASP A 58 -22.976 1.261 10.409 1.00 0.00 O ATOM 0 H ASP A 58 -20.706 0.575 11.966 1.00 0.00 H new ATOM 0 HA ASP A 58 -21.794 1.084 14.539 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -23.950 1.022 13.387 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -22.820 2.218 12.783 1.00 0.00 H new ATOM 866 N GLY A 59 -21.698 -1.915 13.324 1.00 0.00 N ATOM 867 CA GLY A 59 -21.887 -3.306 13.598 1.00 0.00 C ATOM 868 C GLY A 59 -23.169 -3.873 13.093 1.00 0.00 C ATOM 869 O GLY A 59 -23.581 -4.946 13.532 1.00 0.00 O ATOM 0 H GLY A 59 -21.144 -1.746 12.484 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -21.061 -3.864 13.158 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -21.837 -3.460 14.676 1.00 0.00 H new ATOM 873 N ASN A 60 -23.924 -3.282 12.150 1.00 0.00 N ATOM 874 CA ASN A 60 -25.144 -3.772 11.588 1.00 0.00 C ATOM 875 C ASN A 60 -24.974 -5.084 10.903 1.00 0.00 C ATOM 876 O ASN A 60 -25.853 -5.939 11.000 1.00 0.00 O ATOM 877 CB ASN A 60 -25.958 -2.758 10.766 1.00 0.00 C ATOM 878 CG ASN A 60 -25.335 -2.156 9.514 1.00 0.00 C ATOM 879 OD1 ASN A 60 -24.188 -2.429 9.164 1.00 0.00 O ATOM 880 ND2 ASN A 60 -26.136 -1.358 8.758 1.00 0.00 N ATOM 0 H ASN A 60 -23.656 -2.384 11.747 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.778 -3.947 12.457 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.888 -3.244 10.470 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.225 -1.935 11.429 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.789 -0.972 7.880 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -27.084 -1.146 9.069 1.00 0.00 H new ATOM 887 N GLY A 61 -23.860 -5.291 10.178 1.00 0.00 N ATOM 888 CA GLY A 61 -23.474 -6.382 9.338 1.00 0.00 C ATOM 889 C GLY A 61 -23.029 -6.023 7.963 1.00 0.00 C ATOM 890 O GLY A 61 -22.395 -6.794 7.244 1.00 0.00 O ATOM 0 H GLY A 61 -23.125 -4.584 10.187 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -22.666 -6.925 9.829 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -24.317 -7.068 9.258 1.00 0.00 H new ATOM 894 N THR A 62 -23.343 -4.818 7.455 1.00 0.00 N ATOM 895 CA THR A 62 -23.111 -4.331 6.131 1.00 0.00 C ATOM 896 C THR A 62 -22.384 -3.032 6.187 1.00 0.00 C ATOM 897 O THR A 62 -22.209 -2.465 7.264 1.00 0.00 O ATOM 898 CB THR A 62 -24.296 -4.273 5.212 1.00 0.00 C ATOM 899 OG1 THR A 62 -25.331 -3.486 5.783 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.955 -5.608 4.828 1.00 0.00 C ATOM 0 H THR A 62 -23.806 -4.116 8.032 1.00 0.00 H new ATOM 0 HA THR A 62 -22.490 -5.094 5.661 1.00 0.00 H new ATOM 0 HB THR A 62 -23.860 -3.855 4.305 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.768 -2.960 5.081 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.797 -5.420 4.162 1.00 0.00 H new ATOM 0 HG22 THR A 62 -24.226 -6.241 4.322 1.00 0.00 H new ATOM 0 HG23 THR A 62 -25.310 -6.111 5.728 1.00 0.00 H new ATOM 908 N ILE A 63 -21.833 -2.643 5.023 1.00 0.00 N ATOM 909 CA ILE A 63 -21.036 -1.472 4.828 1.00 0.00 C ATOM 910 C ILE A 63 -21.851 -0.295 4.414 1.00 0.00 C ATOM 911 O ILE A 63 -22.307 -0.224 3.273 1.00 0.00 O ATOM 912 CB ILE A 63 -19.778 -1.547 4.015 1.00 0.00 C ATOM 913 CG1 ILE A 63 -19.081 -2.916 4.090 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.860 -0.434 4.549 1.00 0.00 C ATOM 915 CD1 ILE A 63 -18.204 -3.153 2.862 1.00 0.00 C ATOM 0 H ILE A 63 -21.952 -3.181 4.165 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.644 -1.355 5.838 1.00 0.00 H new ATOM 0 HB ILE A 63 -20.016 -1.416 2.959 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -18.471 -2.969 4.992 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -19.829 -3.705 4.165 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.922 -0.438 3.993 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.350 0.532 4.427 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.656 -0.606 5.606 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -17.723 -4.128 2.941 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -18.821 -3.124 1.964 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -17.442 -2.376 2.804 1.00 0.00 H new ATOM 927 N ASP A 64 -22.130 0.637 5.342 1.00 0.00 N ATOM 928 CA ASP A 64 -22.848 1.846 5.084 1.00 0.00 C ATOM 929 C ASP A 64 -21.973 2.927 4.549 1.00 0.00 C ATOM 930 O ASP A 64 -20.747 2.834 4.598 1.00 0.00 O ATOM 931 CB ASP A 64 -23.634 2.369 6.298 1.00 0.00 C ATOM 932 CG ASP A 64 -24.404 1.249 6.984 1.00 0.00 C ATOM 933 OD1 ASP A 64 -23.807 0.434 7.737 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.663 1.271 6.949 1.00 0.00 O ATOM 0 H ASP A 64 -21.842 0.544 6.316 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.573 1.570 4.318 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.947 2.828 7.008 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.328 3.146 5.977 1.00 0.00 H new ATOM 939 N PHE A 65 -22.555 4.022 4.028 1.00 0.00 N ATOM 940 CA PHE A 65 -21.770 5.028 3.382 1.00 0.00 C ATOM 941 C PHE A 65 -20.805 5.749 4.259 1.00 0.00 C ATOM 942 O PHE A 65 -19.680 5.868 3.778 1.00 0.00 O ATOM 943 CB PHE A 65 -22.730 5.932 2.591 1.00 0.00 C ATOM 944 CG PHE A 65 -22.059 6.942 1.724 1.00 0.00 C ATOM 945 CD1 PHE A 65 -21.186 6.476 0.770 1.00 0.00 C ATOM 946 CD2 PHE A 65 -22.240 8.302 1.814 1.00 0.00 C ATOM 947 CE1 PHE A 65 -20.461 7.336 -0.021 1.00 0.00 C ATOM 948 CE2 PHE A 65 -21.542 9.135 0.971 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.598 8.701 0.071 1.00 0.00 C ATOM 0 H PHE A 65 -23.557 4.210 4.053 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.080 4.544 2.691 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -23.368 5.305 1.969 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -23.381 6.451 3.294 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -21.067 5.411 0.639 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.925 8.713 2.541 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.763 6.927 -0.736 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.748 10.194 1.019 1.00 0.00 H new ATOM 0 HZ PHE A 65 -20.006 9.383 -0.521 1.00 0.00 H new ATOM 959 N PRO A 66 -21.054 6.297 5.411 1.00 0.00 N ATOM 960 CA PRO A 66 -20.026 6.943 6.175 1.00 0.00 C ATOM 961 C PRO A 66 -18.829 6.142 6.554 1.00 0.00 C ATOM 962 O PRO A 66 -17.695 6.605 6.674 1.00 0.00 O ATOM 963 CB PRO A 66 -20.818 7.579 7.315 1.00 0.00 C ATOM 964 CG PRO A 66 -22.012 6.631 7.508 1.00 0.00 C ATOM 965 CD PRO A 66 -22.366 6.441 6.024 1.00 0.00 C ATOM 0 HA PRO A 66 -19.476 7.671 5.578 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -20.219 7.658 8.222 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -21.145 8.587 7.061 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.741 5.699 8.005 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.822 7.077 8.086 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.989 5.561 5.863 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.911 7.295 5.623 1.00 0.00 H new ATOM 973 N GLU A 67 -19.009 4.814 6.670 1.00 0.00 N ATOM 974 CA GLU A 67 -17.979 3.837 6.842 1.00 0.00 C ATOM 975 C GLU A 67 -17.210 3.625 5.583 1.00 0.00 C ATOM 976 O GLU A 67 -16.029 3.282 5.604 1.00 0.00 O ATOM 977 CB GLU A 67 -18.432 2.441 7.303 1.00 0.00 C ATOM 978 CG GLU A 67 -19.466 2.533 8.426 1.00 0.00 C ATOM 979 CD GLU A 67 -20.118 1.175 8.643 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.712 0.571 7.710 1.00 0.00 O ATOM 981 OE2 GLU A 67 -20.255 0.695 9.800 1.00 0.00 O ATOM 0 H GLU A 67 -19.939 4.395 6.641 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.381 4.277 7.640 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -18.857 1.897 6.459 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.569 1.872 7.647 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -18.987 2.867 9.346 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -20.224 3.274 8.174 1.00 0.00 H new ATOM 988 N PHE A 68 -17.788 3.729 4.373 1.00 0.00 N ATOM 989 CA PHE A 68 -17.066 3.629 3.142 1.00 0.00 C ATOM 990 C PHE A 68 -16.131 4.761 2.888 1.00 0.00 C ATOM 991 O PHE A 68 -15.185 4.503 2.146 1.00 0.00 O ATOM 992 CB PHE A 68 -18.045 3.271 2.011 1.00 0.00 C ATOM 993 CG PHE A 68 -17.357 2.796 0.778 1.00 0.00 C ATOM 994 CD1 PHE A 68 -17.158 1.479 0.434 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.164 3.724 -0.218 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.699 1.104 -0.807 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.696 3.377 -1.463 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.407 2.063 -1.748 1.00 0.00 C ATOM 0 H PHE A 68 -18.788 3.887 4.247 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.356 2.804 3.205 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.729 2.497 2.360 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.649 4.146 1.770 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.370 0.712 1.164 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.388 4.761 -0.015 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.568 0.058 -1.042 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.555 4.137 -2.218 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.960 1.790 -2.692 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.370 6.000 3.355 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.402 7.051 3.317 1.00 0.00 C ATOM 1010 C LEU A 69 -14.131 6.770 4.043 1.00 0.00 C ATOM 1011 O LEU A 69 -13.071 7.155 3.551 1.00 0.00 O ATOM 1012 CB LEU A 69 -15.911 8.361 3.942 1.00 0.00 C ATOM 1013 CG LEU A 69 -16.861 9.120 3.000 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -18.220 8.485 2.659 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -17.088 10.536 3.553 1.00 0.00 C ATOM 0 H LEU A 69 -17.260 6.278 3.770 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.221 7.135 2.245 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -16.427 8.140 4.876 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.062 8.998 4.190 1.00 0.00 H new ATOM 0 HG LEU A 69 -16.335 9.101 2.045 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -18.770 9.143 1.986 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.060 7.522 2.175 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -18.794 8.340 3.574 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.761 11.082 2.891 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -17.530 10.472 4.547 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.134 11.060 3.613 1.00 0.00 H new ATOM 1027 N THR A 70 -14.229 6.022 5.156 1.00 0.00 N ATOM 1028 CA THR A 70 -13.077 5.530 5.847 1.00 0.00 C ATOM 1029 C THR A 70 -12.236 4.588 5.058 1.00 0.00 C ATOM 1030 O THR A 70 -11.013 4.490 5.151 1.00 0.00 O ATOM 1031 CB THR A 70 -13.461 4.958 7.179 1.00 0.00 C ATOM 1032 OG1 THR A 70 -13.906 5.998 8.038 1.00 0.00 O ATOM 1033 CG2 THR A 70 -12.285 4.310 7.928 1.00 0.00 C ATOM 0 H THR A 70 -15.117 5.755 5.582 1.00 0.00 H new ATOM 0 HA THR A 70 -12.435 6.396 6.008 1.00 0.00 H new ATOM 0 HB THR A 70 -14.224 4.211 6.959 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.158 5.620 8.906 1.00 0.00 H new ATOM 0 HG21 THR A 70 -12.634 3.917 8.883 1.00 0.00 H new ATOM 0 HG22 THR A 70 -11.876 3.497 7.329 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.510 5.056 8.104 1.00 0.00 H new ATOM 1041 N MET A 71 -12.873 3.753 4.217 1.00 0.00 N ATOM 1042 CA MET A 71 -12.206 2.816 3.367 1.00 0.00 C ATOM 1043 C MET A 71 -11.421 3.450 2.271 1.00 0.00 C ATOM 1044 O MET A 71 -10.196 3.353 2.220 1.00 0.00 O ATOM 1045 CB MET A 71 -13.113 1.702 2.818 1.00 0.00 C ATOM 1046 CG MET A 71 -13.998 0.981 3.838 1.00 0.00 C ATOM 1047 SD MET A 71 -15.375 -0.112 3.373 1.00 0.00 S ATOM 1048 CE MET A 71 -14.404 -1.309 2.413 1.00 0.00 C ATOM 0 H MET A 71 -13.889 3.730 4.126 1.00 0.00 H new ATOM 0 HA MET A 71 -11.493 2.336 4.038 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.757 2.132 2.051 1.00 0.00 H new ATOM 0 HB3 MET A 71 -12.484 0.960 2.327 1.00 0.00 H new ATOM 0 HG2 MET A 71 -13.329 0.385 4.459 1.00 0.00 H new ATOM 0 HG3 MET A 71 -14.422 1.755 4.478 1.00 0.00 H new ATOM 0 HE1 MET A 71 -14.959 -2.243 2.328 1.00 0.00 H new ATOM 0 HE2 MET A 71 -14.213 -0.908 1.418 1.00 0.00 H new ATOM 0 HE3 MET A 71 -13.456 -1.496 2.917 1.00 0.00 H new ATOM 1058 N MET A 72 -12.115 4.204 1.400 1.00 0.00 N ATOM 1059 CA MET A 72 -11.469 4.864 0.308 1.00 0.00 C ATOM 1060 C MET A 72 -10.481 5.865 0.796 1.00 0.00 C ATOM 1061 O MET A 72 -9.525 6.035 0.041 1.00 0.00 O ATOM 1062 CB MET A 72 -12.555 5.469 -0.598 1.00 0.00 C ATOM 1063 CG MET A 72 -13.443 4.446 -1.309 1.00 0.00 C ATOM 1064 SD MET A 72 -12.506 3.264 -2.322 1.00 0.00 S ATOM 1065 CE MET A 72 -11.539 4.301 -3.458 1.00 0.00 C ATOM 0 H MET A 72 -13.122 4.357 1.452 1.00 0.00 H new ATOM 0 HA MET A 72 -10.889 4.154 -0.282 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.187 6.122 0.004 1.00 0.00 H new ATOM 0 HB3 MET A 72 -12.074 6.095 -1.349 1.00 0.00 H new ATOM 0 HG2 MET A 72 -14.022 3.898 -0.565 1.00 0.00 H new ATOM 0 HG3 MET A 72 -14.156 4.972 -1.943 1.00 0.00 H new ATOM 0 HE1 MET A 72 -11.023 3.667 -4.179 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.206 4.982 -3.986 1.00 0.00 H new ATOM 0 HE3 MET A 72 -10.807 4.876 -2.891 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.603 6.616 1.906 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.567 7.422 2.471 1.00 0.00 C ATOM 1077 C ALA A 73 -8.369 6.621 2.851 1.00 0.00 C ATOM 1078 O ALA A 73 -7.193 6.949 2.705 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.066 8.248 3.669 1.00 0.00 C ATOM 0 H ALA A 73 -11.473 6.662 2.437 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.265 8.116 1.686 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.245 8.845 4.066 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.871 8.908 3.346 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.436 7.577 4.445 1.00 0.00 H new ATOM 1234 N GLU A 83 2.661 -0.157 3.482 1.00 0.00 N ATOM 1235 CA GLU A 83 2.955 -1.524 3.780 1.00 0.00 C ATOM 1236 C GLU A 83 4.177 -1.831 4.575 1.00 0.00 C ATOM 1237 O GLU A 83 4.334 -2.932 5.102 1.00 0.00 O ATOM 1238 CB GLU A 83 3.076 -2.437 2.548 1.00 0.00 C ATOM 1239 CG GLU A 83 4.174 -2.113 1.532 1.00 0.00 C ATOM 1240 CD GLU A 83 4.252 -3.136 0.407 1.00 0.00 C ATOM 1241 OE1 GLU A 83 4.459 -4.364 0.597 1.00 0.00 O ATOM 1242 OE2 GLU A 83 3.979 -2.631 -0.714 1.00 0.00 O ATOM 0 HA GLU A 83 2.071 -1.724 4.386 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.234 -3.457 2.899 1.00 0.00 H new ATOM 0 HB3 GLU A 83 2.120 -2.424 2.025 1.00 0.00 H new ATOM 0 HG2 GLU A 83 3.991 -1.126 1.108 1.00 0.00 H new ATOM 0 HG3 GLU A 83 5.135 -2.067 2.044 1.00 0.00 H new ATOM 1249 N GLU A 84 5.062 -0.835 4.759 1.00 0.00 N ATOM 1250 CA GLU A 84 6.193 -0.873 5.632 1.00 0.00 C ATOM 1251 C GLU A 84 5.769 -0.898 7.060 1.00 0.00 C ATOM 1252 O GLU A 84 6.198 -1.754 7.833 1.00 0.00 O ATOM 1253 CB GLU A 84 7.169 0.267 5.294 1.00 0.00 C ATOM 1254 CG GLU A 84 8.516 0.108 6.003 1.00 0.00 C ATOM 1255 CD GLU A 84 9.614 1.037 5.504 1.00 0.00 C ATOM 1256 OE1 GLU A 84 9.653 2.198 5.992 1.00 0.00 O ATOM 1257 OE2 GLU A 84 10.508 0.641 4.709 1.00 0.00 O ATOM 0 H GLU A 84 4.981 0.054 4.265 1.00 0.00 H new ATOM 0 HA GLU A 84 6.740 -1.803 5.474 1.00 0.00 H new ATOM 0 HB2 GLU A 84 7.330 0.297 4.216 1.00 0.00 H new ATOM 0 HB3 GLU A 84 6.722 1.220 5.577 1.00 0.00 H new ATOM 0 HG2 GLU A 84 8.372 0.279 7.070 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.852 -0.923 5.888 1.00 0.00 H new ATOM 1264 N ILE A 85 4.833 -0.038 7.499 1.00 0.00 N ATOM 1265 CA ILE A 85 4.297 -0.017 8.825 1.00 0.00 C ATOM 1266 C ILE A 85 3.105 -0.874 9.080 1.00 0.00 C ATOM 1267 O ILE A 85 2.740 -1.211 10.206 1.00 0.00 O ATOM 1268 CB ILE A 85 4.196 1.378 9.366 1.00 0.00 C ATOM 1269 CG1 ILE A 85 3.270 2.277 8.529 1.00 0.00 C ATOM 1270 CG2 ILE A 85 5.625 1.941 9.441 1.00 0.00 C ATOM 1271 CD1 ILE A 85 3.916 3.314 7.612 1.00 0.00 C ATOM 0 H ILE A 85 4.429 0.680 6.898 1.00 0.00 H new ATOM 0 HA ILE A 85 5.045 -0.534 9.425 1.00 0.00 H new ATOM 0 HB ILE A 85 3.740 1.355 10.356 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.644 1.631 7.914 1.00 0.00 H new ATOM 0 HG13 ILE A 85 2.607 2.804 9.215 1.00 0.00 H new ATOM 0 HG21 ILE A 85 5.595 2.958 9.831 1.00 0.00 H new ATOM 0 HG22 ILE A 85 6.228 1.317 10.101 1.00 0.00 H new ATOM 0 HG23 ILE A 85 6.066 1.947 8.444 1.00 0.00 H new ATOM 0 HD11 ILE A 85 3.139 3.871 7.088 1.00 0.00 H new ATOM 0 HD12 ILE A 85 4.517 4.002 8.207 1.00 0.00 H new ATOM 0 HD13 ILE A 85 4.554 2.810 6.886 1.00 0.00 H new ATOM 1283 N ARG A 86 2.371 -1.335 8.051 1.00 0.00 N ATOM 1284 CA ARG A 86 1.363 -2.345 8.146 1.00 0.00 C ATOM 1285 C ARG A 86 1.863 -3.693 8.539 1.00 0.00 C ATOM 1286 O ARG A 86 1.355 -4.367 9.434 1.00 0.00 O ATOM 1287 CB ARG A 86 0.652 -2.337 6.783 1.00 0.00 C ATOM 1288 CG ARG A 86 -0.833 -2.616 7.024 1.00 0.00 C ATOM 1289 CD ARG A 86 -1.685 -2.677 5.754 1.00 0.00 C ATOM 1290 NE ARG A 86 -3.089 -3.006 6.129 1.00 0.00 N ATOM 1291 CZ ARG A 86 -4.167 -3.043 5.293 1.00 0.00 C ATOM 1292 NH1 ARG A 86 -3.989 -2.756 3.970 1.00 0.00 N ATOM 1293 NH2 ARG A 86 -5.444 -3.135 5.765 1.00 0.00 N ATOM 0 H ARG A 86 2.488 -0.983 7.101 1.00 0.00 H new ATOM 0 HA ARG A 86 0.678 -2.116 8.963 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.784 -1.374 6.290 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.080 -3.093 6.125 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.930 -3.562 7.556 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -1.233 -1.841 7.677 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -1.649 -1.722 5.230 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -1.291 -3.430 5.072 1.00 0.00 H new ATOM 0 HE ARG A 86 -3.262 -3.226 7.110 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.061 -2.519 3.620 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -4.784 -2.779 3.332 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -5.614 -3.178 6.770 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -6.228 -3.160 5.113 1.00 0.00 H new ATOM 1307 N GLU A 87 3.012 -4.095 7.968 1.00 0.00 N ATOM 1308 CA GLU A 87 3.867 -5.158 8.397 1.00 0.00 C ATOM 1309 C GLU A 87 4.365 -5.027 9.796 1.00 0.00 C ATOM 1310 O GLU A 87 4.274 -5.974 10.576 1.00 0.00 O ATOM 1311 CB GLU A 87 5.020 -5.350 7.398 1.00 0.00 C ATOM 1312 CG GLU A 87 6.039 -6.407 7.829 1.00 0.00 C ATOM 1313 CD GLU A 87 5.604 -7.785 7.348 1.00 0.00 C ATOM 1314 OE1 GLU A 87 5.196 -7.864 6.159 1.00 0.00 O ATOM 1315 OE2 GLU A 87 5.680 -8.806 8.082 1.00 0.00 O ATOM 0 H GLU A 87 3.373 -3.634 7.133 1.00 0.00 H new ATOM 0 HA GLU A 87 3.249 -6.056 8.411 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.606 -5.631 6.429 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.533 -4.398 7.262 1.00 0.00 H new ATOM 0 HG2 GLU A 87 7.020 -6.164 7.421 1.00 0.00 H new ATOM 0 HG3 GLU A 87 6.137 -6.407 8.915 1.00 0.00 H new ATOM 1322 N ALA A 88 4.687 -3.798 10.238 1.00 0.00 N ATOM 1323 CA ALA A 88 5.165 -3.436 11.536 1.00 0.00 C ATOM 1324 C ALA A 88 4.075 -3.498 12.549 1.00 0.00 C ATOM 1325 O ALA A 88 4.347 -3.787 13.714 1.00 0.00 O ATOM 1326 CB ALA A 88 5.874 -2.071 11.557 1.00 0.00 C ATOM 0 H ALA A 88 4.604 -2.984 9.629 1.00 0.00 H new ATOM 0 HA ALA A 88 5.920 -4.175 11.803 1.00 0.00 H new ATOM 0 HB1 ALA A 88 6.214 -1.853 12.570 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.731 -2.096 10.884 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.180 -1.296 11.232 1.00 0.00 H new ATOM 1332 N PHE A 89 2.836 -3.144 12.164 1.00 0.00 N ATOM 1333 CA PHE A 89 1.654 -3.472 12.899 1.00 0.00 C ATOM 1334 C PHE A 89 1.512 -4.917 13.233 1.00 0.00 C ATOM 1335 O PHE A 89 1.462 -5.283 14.406 1.00 0.00 O ATOM 1336 CB PHE A 89 0.449 -2.974 12.084 1.00 0.00 C ATOM 1337 CG PHE A 89 -0.857 -3.126 12.784 1.00 0.00 C ATOM 1338 CD1 PHE A 89 -1.145 -2.267 13.819 1.00 0.00 C ATOM 1339 CD2 PHE A 89 -1.851 -3.986 12.380 1.00 0.00 C ATOM 1340 CE1 PHE A 89 -2.375 -2.159 14.424 1.00 0.00 C ATOM 1341 CE2 PHE A 89 -3.078 -4.005 12.999 1.00 0.00 C ATOM 1342 CZ PHE A 89 -3.298 -3.084 13.996 1.00 0.00 C ATOM 0 H PHE A 89 2.651 -2.612 11.314 1.00 0.00 H new ATOM 0 HA PHE A 89 1.716 -2.979 13.869 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.598 -1.923 11.839 1.00 0.00 H new ATOM 0 HB3 PHE A 89 0.410 -3.519 11.141 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.349 -1.633 14.182 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.663 -4.661 11.558 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.597 -1.412 15.171 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.840 -4.716 12.713 1.00 0.00 H new ATOM 0 HZ PHE A 89 -4.265 -3.087 14.477 1.00 0.00 H new ATOM 1352 N ARG A 90 1.600 -5.837 12.256 1.00 0.00 N ATOM 1353 CA ARG A 90 1.313 -7.197 12.590 1.00 0.00 C ATOM 1354 C ARG A 90 2.470 -7.869 13.245 1.00 0.00 C ATOM 1355 O ARG A 90 2.478 -8.839 14.001 1.00 0.00 O ATOM 1356 CB ARG A 90 0.946 -7.915 11.280 1.00 0.00 C ATOM 1357 CG ARG A 90 0.546 -9.385 11.415 1.00 0.00 C ATOM 1358 CD ARG A 90 0.415 -10.133 10.087 1.00 0.00 C ATOM 1359 NE ARG A 90 -0.379 -9.342 9.104 1.00 0.00 N ATOM 1360 CZ ARG A 90 -0.293 -9.703 7.790 1.00 0.00 C ATOM 1361 NH1 ARG A 90 -0.104 -10.992 7.384 1.00 0.00 N ATOM 1362 NH2 ARG A 90 -0.320 -8.690 6.876 1.00 0.00 N ATOM 0 H ARG A 90 1.855 -5.656 11.285 1.00 0.00 H new ATOM 0 HA ARG A 90 0.493 -7.234 13.307 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.123 -7.376 10.811 1.00 0.00 H new ATOM 0 HB3 ARG A 90 1.797 -7.851 10.602 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.286 -9.894 12.032 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -0.405 -9.442 11.945 1.00 0.00 H new ATOM 0 HD2 ARG A 90 1.406 -10.336 9.680 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.064 -11.098 10.255 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.964 -8.561 9.402 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -0.020 -11.737 8.075 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -0.047 -11.210 6.389 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.401 -7.723 7.189 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -0.259 -8.900 5.880 1.00 0.00 H new ATOM 1376 N VAL A 91 3.637 -7.211 13.124 1.00 0.00 N ATOM 1377 CA VAL A 91 4.840 -7.584 13.802 1.00 0.00 C ATOM 1378 C VAL A 91 4.718 -7.334 15.265 1.00 0.00 C ATOM 1379 O VAL A 91 5.203 -8.093 16.103 1.00 0.00 O ATOM 1380 CB VAL A 91 6.058 -6.928 13.222 1.00 0.00 C ATOM 1381 CG1 VAL A 91 7.191 -6.729 14.242 1.00 0.00 C ATOM 1382 CG2 VAL A 91 6.530 -7.764 12.020 1.00 0.00 C ATOM 0 H VAL A 91 3.747 -6.388 12.532 1.00 0.00 H new ATOM 0 HA VAL A 91 4.977 -8.655 13.651 1.00 0.00 H new ATOM 0 HB VAL A 91 5.784 -5.922 12.904 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.040 -6.250 13.754 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.839 -6.099 15.059 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.499 -7.697 14.637 1.00 0.00 H new ATOM 0 HG21 VAL A 91 7.416 -7.304 11.582 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.771 -8.774 12.352 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.737 -7.807 11.273 1.00 0.00 H new ATOM 1392 N PHE A 92 3.910 -6.308 15.587 1.00 0.00 N ATOM 1393 CA PHE A 92 3.532 -5.936 16.915 1.00 0.00 C ATOM 1394 C PHE A 92 2.478 -6.787 17.534 1.00 0.00 C ATOM 1395 O PHE A 92 2.626 -7.167 18.695 1.00 0.00 O ATOM 1396 CB PHE A 92 3.258 -4.426 16.818 1.00 0.00 C ATOM 1397 CG PHE A 92 4.419 -3.621 17.292 1.00 0.00 C ATOM 1398 CD1 PHE A 92 5.699 -3.776 16.815 1.00 0.00 C ATOM 1399 CD2 PHE A 92 4.174 -2.657 18.241 1.00 0.00 C ATOM 1400 CE1 PHE A 92 6.754 -3.115 17.398 1.00 0.00 C ATOM 1401 CE2 PHE A 92 5.219 -1.971 18.813 1.00 0.00 C ATOM 1402 CZ PHE A 92 6.504 -2.172 18.367 1.00 0.00 C ATOM 0 H PHE A 92 3.496 -5.703 14.878 1.00 0.00 H new ATOM 0 HA PHE A 92 4.319 -6.127 17.645 1.00 0.00 H new ATOM 0 HB2 PHE A 92 3.031 -4.163 15.785 1.00 0.00 H new ATOM 0 HB3 PHE A 92 2.377 -4.178 17.410 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.878 -4.426 15.971 1.00 0.00 H new ATOM 0 HD2 PHE A 92 3.159 -2.438 18.538 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.768 -3.334 17.098 1.00 0.00 H new ATOM 0 HE2 PHE A 92 5.030 -1.272 19.615 1.00 0.00 H new ATOM 0 HZ PHE A 92 7.316 -1.590 18.777 1.00 0.00 H new ATOM 1412 N ASP A 93 1.376 -7.037 16.804 1.00 0.00 N ATOM 1413 CA ASP A 93 0.267 -7.731 17.381 1.00 0.00 C ATOM 1414 C ASP A 93 0.510 -9.188 17.576 1.00 0.00 C ATOM 1415 O ASP A 93 0.712 -9.960 16.640 1.00 0.00 O ATOM 1416 CB ASP A 93 -1.048 -7.518 16.613 1.00 0.00 C ATOM 1417 CG ASP A 93 -2.174 -7.836 17.586 1.00 0.00 C ATOM 1418 OD1 ASP A 93 -2.149 -7.384 18.762 1.00 0.00 O ATOM 1419 OD2 ASP A 93 -3.206 -8.465 17.230 1.00 0.00 O ATOM 0 H ASP A 93 1.253 -6.763 15.829 1.00 0.00 H new ATOM 0 HA ASP A 93 0.160 -7.279 18.367 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -1.125 -6.492 16.253 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -1.096 -8.167 15.739 1.00 0.00 H new ATOM 1424 N LYS A 94 0.352 -9.573 18.855 1.00 0.00 N ATOM 1425 CA LYS A 94 0.723 -10.862 19.352 1.00 0.00 C ATOM 1426 C LYS A 94 -0.070 -12.076 19.011 1.00 0.00 C ATOM 1427 O LYS A 94 0.430 -12.965 18.323 1.00 0.00 O ATOM 1428 CB LYS A 94 0.950 -10.906 20.873 1.00 0.00 C ATOM 1429 CG LYS A 94 1.998 -9.941 21.431 1.00 0.00 C ATOM 1430 CD LYS A 94 3.373 -9.882 20.764 1.00 0.00 C ATOM 1431 CE LYS A 94 4.166 -11.176 20.958 1.00 0.00 C ATOM 1432 NZ LYS A 94 5.468 -11.072 20.262 1.00 0.00 N ATOM 0 H LYS A 94 -0.049 -8.965 19.569 1.00 0.00 H new ATOM 0 HA LYS A 94 1.638 -10.944 18.766 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.000 -10.702 21.367 1.00 0.00 H new ATOM 0 HB3 LYS A 94 1.240 -11.921 21.146 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.573 -8.938 21.400 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.151 -10.190 22.481 1.00 0.00 H new ATOM 0 HD2 LYS A 94 3.250 -9.690 19.698 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.939 -9.046 21.175 1.00 0.00 H new ATOM 0 HE2 LYS A 94 4.324 -11.361 22.020 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.601 -12.022 20.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 6.004 -11.953 20.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 5.307 -10.915 19.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 6.008 -10.275 20.654 1.00 0.00 H new ATOM 1446 N ASP A 95 -1.372 -12.044 19.347 1.00 0.00 N ATOM 1447 CA ASP A 95 -2.302 -13.007 18.846 1.00 0.00 C ATOM 1448 C ASP A 95 -2.588 -12.901 17.387 1.00 0.00 C ATOM 1449 O ASP A 95 -2.781 -13.919 16.724 1.00 0.00 O ATOM 1450 CB ASP A 95 -3.554 -13.093 19.734 1.00 0.00 C ATOM 1451 CG ASP A 95 -4.386 -11.839 19.507 1.00 0.00 C ATOM 1452 OD1 ASP A 95 -3.880 -10.724 19.207 1.00 0.00 O ATOM 1453 OD2 ASP A 95 -5.612 -12.044 19.711 1.00 0.00 O ATOM 0 H ASP A 95 -1.782 -11.347 19.969 1.00 0.00 H new ATOM 0 HA ASP A 95 -1.803 -13.973 18.917 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -4.133 -13.983 19.489 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -3.271 -13.176 20.783 1.00 0.00 H new ATOM 1458 N GLY A 96 -2.659 -11.654 16.889 1.00 0.00 N ATOM 1459 CA GLY A 96 -2.879 -11.346 15.510 1.00 0.00 C ATOM 1460 C GLY A 96 -4.334 -11.353 15.189 1.00 0.00 C ATOM 1461 O GLY A 96 -4.753 -12.104 14.309 1.00 0.00 O ATOM 0 H GLY A 96 -2.559 -10.824 17.473 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -2.456 -10.368 15.280 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.361 -12.072 14.884 1.00 0.00 H new ATOM 1465 N ASN A 97 -5.185 -10.593 15.902 1.00 0.00 N ATOM 1466 CA ASN A 97 -6.573 -10.458 15.588 1.00 0.00 C ATOM 1467 C ASN A 97 -6.811 -9.306 14.673 1.00 0.00 C ATOM 1468 O ASN A 97 -7.473 -9.554 13.666 1.00 0.00 O ATOM 1469 CB ASN A 97 -7.426 -10.292 16.857 1.00 0.00 C ATOM 1470 CG ASN A 97 -7.215 -9.001 17.635 1.00 0.00 C ATOM 1471 OD1 ASN A 97 -6.120 -8.441 17.641 1.00 0.00 O ATOM 1472 ND2 ASN A 97 -8.167 -8.624 18.530 1.00 0.00 N ATOM 0 H ASN A 97 -4.898 -10.057 16.721 1.00 0.00 H new ATOM 0 HA ASN A 97 -6.873 -11.377 15.085 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -8.477 -10.357 16.576 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -7.222 -11.132 17.521 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -7.971 -7.881 19.201 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -9.077 -9.084 18.531 1.00 0.00 H new ATOM 1479 N GLY A 98 -6.115 -8.161 14.788 1.00 0.00 N ATOM 1480 CA GLY A 98 -6.333 -6.956 14.049 1.00 0.00 C ATOM 1481 C GLY A 98 -6.343 -5.613 14.695 1.00 0.00 C ATOM 1482 O GLY A 98 -6.274 -4.562 14.060 1.00 0.00 O ATOM 0 H GLY A 98 -5.342 -8.072 15.448 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -5.569 -6.923 13.273 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.294 -7.068 13.546 1.00 0.00 H new ATOM 1486 N TYR A 99 -6.503 -5.584 16.030 1.00 0.00 N ATOM 1487 CA TYR A 99 -6.307 -4.435 16.859 1.00 0.00 C ATOM 1488 C TYR A 99 -5.060 -4.719 17.622 1.00 0.00 C ATOM 1489 O TYR A 99 -4.870 -5.915 17.834 1.00 0.00 O ATOM 1490 CB TYR A 99 -7.385 -4.350 17.953 1.00 0.00 C ATOM 1491 CG TYR A 99 -8.710 -3.923 17.421 1.00 0.00 C ATOM 1492 CD1 TYR A 99 -8.959 -2.628 17.034 1.00 0.00 C ATOM 1493 CD2 TYR A 99 -9.727 -4.848 17.439 1.00 0.00 C ATOM 1494 CE1 TYR A 99 -10.230 -2.289 16.634 1.00 0.00 C ATOM 1495 CE2 TYR A 99 -10.982 -4.517 16.984 1.00 0.00 C ATOM 1496 CZ TYR A 99 -11.249 -3.212 16.643 1.00 0.00 C ATOM 1497 OH TYR A 99 -12.484 -2.895 16.038 1.00 0.00 O ATOM 0 H TYR A 99 -6.785 -6.409 16.560 1.00 0.00 H new ATOM 0 HA TYR A 99 -6.307 -3.536 16.242 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -7.487 -5.323 18.433 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -7.063 -3.647 18.721 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -8.171 -1.890 17.044 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -9.539 -5.843 17.814 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -10.432 -1.280 16.307 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -11.748 -5.273 16.896 1.00 0.00 H new ATOM 0 HH TYR A 99 -13.097 -3.654 16.129 1.00 0.00 H new ATOM 1507 N ILE A 100 -4.249 -3.734 18.049 1.00 0.00 N ATOM 1508 CA ILE A 100 -3.295 -4.107 19.046 1.00 0.00 C ATOM 1509 C ILE A 100 -4.072 -3.722 20.257 1.00 0.00 C ATOM 1510 O ILE A 100 -4.626 -2.624 20.229 1.00 0.00 O ATOM 1511 CB ILE A 100 -2.015 -3.325 19.023 1.00 0.00 C ATOM 1512 CG1 ILE A 100 -1.408 -3.511 17.622 1.00 0.00 C ATOM 1513 CG2 ILE A 100 -1.071 -4.167 19.898 1.00 0.00 C ATOM 1514 CD1 ILE A 100 -0.173 -2.659 17.334 1.00 0.00 C ATOM 0 H ILE A 100 -4.245 -2.762 17.738 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.962 -5.140 18.947 1.00 0.00 H new ATOM 0 HB ILE A 100 -2.151 -2.282 19.309 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -1.144 -4.561 17.493 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.171 -3.281 16.879 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -0.096 -3.683 19.951 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -1.487 -4.255 20.902 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -0.960 -5.160 19.462 1.00 0.00 H new ATOM 0 HD11 ILE A 100 0.181 -2.861 16.323 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -0.430 -1.604 17.425 1.00 0.00 H new ATOM 0 HD13 ILE A 100 0.613 -2.904 18.049 1.00 0.00 H new ATOM 1526 N SER A 101 -4.070 -4.431 21.400 1.00 0.00 N ATOM 1527 CA SER A 101 -4.553 -3.830 22.605 1.00 0.00 C ATOM 1528 C SER A 101 -3.517 -2.925 23.177 1.00 0.00 C ATOM 1529 O SER A 101 -2.316 -3.158 23.048 1.00 0.00 O ATOM 1530 CB SER A 101 -4.898 -4.856 23.697 1.00 0.00 C ATOM 1531 OG SER A 101 -3.794 -5.687 24.025 1.00 0.00 O ATOM 0 H SER A 101 -3.744 -5.393 21.491 1.00 0.00 H new ATOM 0 HA SER A 101 -5.458 -3.293 22.323 1.00 0.00 H new ATOM 0 HB2 SER A 101 -5.234 -4.332 24.592 1.00 0.00 H new ATOM 0 HB3 SER A 101 -5.729 -5.476 23.360 1.00 0.00 H new ATOM 0 HG SER A 101 -3.631 -6.318 23.293 1.00 0.00 H new ATOM 1537 N ALA A 102 -3.845 -1.900 23.984 1.00 0.00 N ATOM 1538 CA ALA A 102 -2.848 -1.140 24.672 1.00 0.00 C ATOM 1539 C ALA A 102 -1.895 -1.870 25.554 1.00 0.00 C ATOM 1540 O ALA A 102 -0.696 -1.598 25.604 1.00 0.00 O ATOM 1541 CB ALA A 102 -3.547 0.033 25.380 1.00 0.00 C ATOM 0 H ALA A 102 -4.803 -1.597 24.160 1.00 0.00 H new ATOM 0 HA ALA A 102 -2.159 -0.791 23.903 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -2.807 0.629 25.913 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -4.051 0.656 24.641 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -4.280 -0.354 26.088 1.00 0.00 H new ATOM 1547 N ALA A 103 -2.318 -2.975 26.192 1.00 0.00 N ATOM 1548 CA ALA A 103 -1.594 -3.916 26.990 1.00 0.00 C ATOM 1549 C ALA A 103 -0.656 -4.769 26.208 1.00 0.00 C ATOM 1550 O ALA A 103 0.458 -5.078 26.627 1.00 0.00 O ATOM 1551 CB ALA A 103 -2.598 -4.873 27.656 1.00 0.00 C ATOM 0 H ALA A 103 -3.301 -3.240 26.138 1.00 0.00 H new ATOM 0 HA ALA A 103 -1.015 -3.328 27.702 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -2.060 -5.597 28.268 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.282 -4.303 28.285 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -3.165 -5.398 26.887 1.00 0.00 H new ATOM 1557 N GLU A 104 -0.983 -5.206 24.979 1.00 0.00 N ATOM 1558 CA GLU A 104 -0.053 -5.808 24.074 1.00 0.00 C ATOM 1559 C GLU A 104 1.029 -4.876 23.648 1.00 0.00 C ATOM 1560 O GLU A 104 2.179 -5.309 23.617 1.00 0.00 O ATOM 1561 CB GLU A 104 -0.690 -6.348 22.782 1.00 0.00 C ATOM 1562 CG GLU A 104 -1.469 -7.636 23.057 1.00 0.00 C ATOM 1563 CD GLU A 104 -2.471 -7.910 21.944 1.00 0.00 C ATOM 1564 OE1 GLU A 104 -3.323 -7.031 21.644 1.00 0.00 O ATOM 1565 OE2 GLU A 104 -2.599 -9.046 21.413 1.00 0.00 O ATOM 0 H GLU A 104 -1.928 -5.138 24.602 1.00 0.00 H new ATOM 0 HA GLU A 104 0.349 -6.634 24.660 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -1.358 -5.597 22.359 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.086 -6.538 22.041 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -0.777 -8.474 23.144 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.991 -7.554 24.010 1.00 0.00 H new ATOM 1572 N LEU A 105 0.673 -3.610 23.366 1.00 0.00 N ATOM 1573 CA LEU A 105 1.481 -2.558 22.833 1.00 0.00 C ATOM 1574 C LEU A 105 2.627 -2.215 23.722 1.00 0.00 C ATOM 1575 O LEU A 105 3.809 -2.150 23.388 1.00 0.00 O ATOM 1576 CB LEU A 105 0.600 -1.453 22.226 1.00 0.00 C ATOM 1577 CG LEU A 105 1.466 -0.283 21.730 1.00 0.00 C ATOM 1578 CD1 LEU A 105 0.875 0.292 20.432 1.00 0.00 C ATOM 1579 CD2 LEU A 105 1.453 0.891 22.723 1.00 0.00 C ATOM 0 H LEU A 105 -0.283 -3.293 23.530 1.00 0.00 H new ATOM 0 HA LEU A 105 2.043 -2.882 21.957 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.018 -1.858 21.398 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -0.111 -1.096 22.971 1.00 0.00 H new ATOM 0 HG LEU A 105 2.473 -0.680 21.599 1.00 0.00 H new ATOM 0 HD11 LEU A 105 1.493 1.120 20.086 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.850 -0.485 19.668 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.138 0.649 20.620 1.00 0.00 H new ATOM 0 HD21 LEU A 105 2.076 1.699 22.339 1.00 0.00 H new ATOM 0 HD22 LEU A 105 0.431 1.249 22.850 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.843 0.558 23.685 1.00 0.00 H new ATOM 1591 N ARG A 106 2.337 -2.031 25.022 1.00 0.00 N ATOM 1592 CA ARG A 106 3.274 -1.577 26.002 1.00 0.00 C ATOM 1593 C ARG A 106 4.221 -2.687 26.304 1.00 0.00 C ATOM 1594 O ARG A 106 5.343 -2.399 26.716 1.00 0.00 O ATOM 1595 CB ARG A 106 2.551 -1.120 27.281 1.00 0.00 C ATOM 1596 CG ARG A 106 1.817 -2.148 28.145 1.00 0.00 C ATOM 1597 CD ARG A 106 1.324 -1.610 29.490 1.00 0.00 C ATOM 1598 NE ARG A 106 0.206 -0.696 29.124 1.00 0.00 N ATOM 1599 CZ ARG A 106 0.230 0.669 29.123 1.00 0.00 C ATOM 1600 NH1 ARG A 106 1.343 1.362 29.501 1.00 0.00 N ATOM 1601 NH2 ARG A 106 -0.907 1.349 28.794 1.00 0.00 N ATOM 0 H ARG A 106 1.409 -2.206 25.407 1.00 0.00 H new ATOM 0 HA ARG A 106 3.822 -0.720 25.612 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.290 -0.630 27.915 1.00 0.00 H new ATOM 0 HB3 ARG A 106 1.825 -0.360 26.991 1.00 0.00 H new ATOM 0 HG2 ARG A 106 0.963 -2.530 27.586 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.482 -2.992 28.327 1.00 0.00 H new ATOM 0 HD2 ARG A 106 0.984 -2.415 30.142 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.114 -1.081 30.022 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.670 -1.137 28.845 1.00 0.00 H new ATOM 0 HH11 ARG A 106 2.182 0.860 29.793 1.00 0.00 H new ATOM 0 HH12 ARG A 106 1.336 2.382 29.492 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -1.756 0.837 28.554 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -0.908 2.369 28.788 1.00 0.00 H new ATOM 1615 N HIS A 107 3.782 -3.947 26.132 1.00 0.00 N ATOM 1616 CA HIS A 107 4.608 -5.105 26.278 1.00 0.00 C ATOM 1617 C HIS A 107 5.695 -5.110 25.259 1.00 0.00 C ATOM 1618 O HIS A 107 6.868 -5.376 25.516 1.00 0.00 O ATOM 1619 CB HIS A 107 3.849 -6.440 26.346 1.00 0.00 C ATOM 1620 CG HIS A 107 4.675 -7.593 26.835 1.00 0.00 C ATOM 1621 ND1 HIS A 107 5.241 -7.600 28.094 1.00 0.00 N ATOM 1622 CD2 HIS A 107 5.005 -8.809 26.324 1.00 0.00 C ATOM 1623 CE1 HIS A 107 5.891 -8.786 28.236 1.00 0.00 C ATOM 1624 NE2 HIS A 107 5.773 -9.570 27.181 1.00 0.00 N ATOM 0 H HIS A 107 2.818 -4.167 25.882 1.00 0.00 H new ATOM 0 HA HIS A 107 5.063 -5.023 27.265 1.00 0.00 H new ATOM 0 HB2 HIS A 107 2.986 -6.322 27.002 1.00 0.00 H new ATOM 0 HB3 HIS A 107 3.465 -6.678 25.354 1.00 0.00 H new ATOM 0 HD2 HIS A 107 4.697 -9.146 25.345 1.00 0.00 H new ATOM 0 HE1 HIS A 107 6.447 -9.058 29.121 1.00 0.00 H new ATOM 0 HE2 HIS A 107 6.154 -10.505 27.036 1.00 0.00 H new ATOM 1632 N VAL A 108 5.344 -4.711 24.024 1.00 0.00 N ATOM 1633 CA VAL A 108 6.299 -4.652 22.961 1.00 0.00 C ATOM 1634 C VAL A 108 7.306 -3.608 23.297 1.00 0.00 C ATOM 1635 O VAL A 108 8.492 -3.679 22.978 1.00 0.00 O ATOM 1636 CB VAL A 108 5.812 -4.435 21.558 1.00 0.00 C ATOM 1637 CG1 VAL A 108 6.948 -4.845 20.606 1.00 0.00 C ATOM 1638 CG2 VAL A 108 4.511 -5.202 21.267 1.00 0.00 C ATOM 0 H VAL A 108 4.400 -4.429 23.761 1.00 0.00 H new ATOM 0 HA VAL A 108 6.697 -5.666 22.918 1.00 0.00 H new ATOM 0 HB VAL A 108 5.561 -3.384 21.412 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.628 -4.700 19.574 1.00 0.00 H new ATOM 0 HG12 VAL A 108 7.827 -4.231 20.803 1.00 0.00 H new ATOM 0 HG13 VAL A 108 7.195 -5.895 20.765 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.199 -5.013 20.240 1.00 0.00 H new ATOM 0 HG22 VAL A 108 4.680 -6.270 21.404 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.731 -4.867 21.951 1.00 0.00 H new ATOM 1648 N MET A 109 6.833 -2.472 23.841 1.00 0.00 N ATOM 1649 CA MET A 109 7.617 -1.297 24.061 1.00 0.00 C ATOM 1650 C MET A 109 8.479 -1.385 25.273 1.00 0.00 C ATOM 1651 O MET A 109 9.454 -0.638 25.344 1.00 0.00 O ATOM 1652 CB MET A 109 6.691 -0.071 23.983 1.00 0.00 C ATOM 1653 CG MET A 109 6.154 0.231 22.582 1.00 0.00 C ATOM 1654 SD MET A 109 5.040 1.668 22.596 1.00 0.00 S ATOM 1655 CE MET A 109 4.663 1.405 20.839 1.00 0.00 C ATOM 0 H MET A 109 5.863 -2.369 24.140 1.00 0.00 H new ATOM 0 HA MET A 109 8.359 -1.188 23.270 1.00 0.00 H new ATOM 0 HB2 MET A 109 5.848 -0.225 24.656 1.00 0.00 H new ATOM 0 HB3 MET A 109 7.233 0.802 24.346 1.00 0.00 H new ATOM 0 HG2 MET A 109 6.986 0.420 21.904 1.00 0.00 H new ATOM 0 HG3 MET A 109 5.623 -0.640 22.199 1.00 0.00 H new ATOM 0 HE1 MET A 109 4.045 2.225 20.473 1.00 0.00 H new ATOM 0 HE2 MET A 109 5.591 1.368 20.269 1.00 0.00 H new ATOM 0 HE3 MET A 109 4.126 0.464 20.719 1.00 0.00 H new ATOM 1665 N THR A 110 8.212 -2.305 26.217 1.00 0.00 N ATOM 1666 CA THR A 110 9.106 -2.792 27.221 1.00 0.00 C ATOM 1667 C THR A 110 10.193 -3.574 26.567 1.00 0.00 C ATOM 1668 O THR A 110 11.351 -3.555 26.982 1.00 0.00 O ATOM 1669 CB THR A 110 8.466 -3.738 28.194 1.00 0.00 C ATOM 1670 OG1 THR A 110 7.415 -3.050 28.857 1.00 0.00 O ATOM 1671 CG2 THR A 110 9.384 -4.395 29.239 1.00 0.00 C ATOM 0 H THR A 110 7.293 -2.744 26.282 1.00 0.00 H new ATOM 0 HA THR A 110 9.456 -1.909 27.755 1.00 0.00 H new ATOM 0 HB THR A 110 8.121 -4.576 27.588 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.726 -2.800 28.206 1.00 0.00 H new ATOM 0 HG21 THR A 110 8.795 -5.054 29.878 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.155 -4.975 28.732 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.853 -3.622 29.849 1.00 0.00 H new ATOM 1679 N ASN A 111 9.928 -4.317 25.478 1.00 0.00 N ATOM 1680 CA ASN A 111 10.773 -5.306 24.884 1.00 0.00 C ATOM 1681 C ASN A 111 11.522 -4.853 23.678 1.00 0.00 C ATOM 1682 O ASN A 111 12.144 -5.619 22.944 1.00 0.00 O ATOM 1683 CB ASN A 111 9.913 -6.553 24.622 1.00 0.00 C ATOM 1684 CG ASN A 111 9.888 -7.322 25.935 1.00 0.00 C ATOM 1685 OD1 ASN A 111 10.763 -8.111 26.288 1.00 0.00 O ATOM 1686 ND2 ASN A 111 8.755 -7.090 26.651 1.00 0.00 N ATOM 0 H ASN A 111 9.048 -4.216 24.972 1.00 0.00 H new ATOM 0 HA ASN A 111 11.577 -5.535 25.584 1.00 0.00 H new ATOM 0 HB2 ASN A 111 8.906 -6.275 24.312 1.00 0.00 H new ATOM 0 HB3 ASN A 111 10.337 -7.159 23.822 1.00 0.00 H new ATOM 0 HD21 ASN A 111 8.597 -7.583 27.530 1.00 0.00 H new ATOM 0 HD22 ASN A 111 8.063 -6.423 26.309 1.00 0.00 H new ATOM 1693 N LEU A 112 11.407 -3.554 23.351 1.00 0.00 N ATOM 1694 CA LEU A 112 11.984 -2.863 22.239 1.00 0.00 C ATOM 1695 C LEU A 112 13.471 -2.821 22.158 1.00 0.00 C ATOM 1696 O LEU A 112 14.037 -3.068 21.094 1.00 0.00 O ATOM 1697 CB LEU A 112 11.401 -1.447 22.094 1.00 0.00 C ATOM 1698 CG LEU A 112 11.494 -0.951 20.641 1.00 0.00 C ATOM 1699 CD1 LEU A 112 10.692 -1.775 19.621 1.00 0.00 C ATOM 1700 CD2 LEU A 112 11.009 0.496 20.451 1.00 0.00 C ATOM 0 H LEU A 112 10.851 -2.923 23.928 1.00 0.00 H new ATOM 0 HA LEU A 112 11.694 -3.489 21.395 1.00 0.00 H new ATOM 0 HB2 LEU A 112 10.359 -1.446 22.415 1.00 0.00 H new ATOM 0 HB3 LEU A 112 11.938 -0.761 22.750 1.00 0.00 H new ATOM 0 HG LEU A 112 12.563 -1.049 20.453 1.00 0.00 H new ATOM 0 HD11 LEU A 112 10.821 -1.348 18.626 1.00 0.00 H new ATOM 0 HD12 LEU A 112 11.050 -2.804 19.623 1.00 0.00 H new ATOM 0 HD13 LEU A 112 9.636 -1.758 19.889 1.00 0.00 H new ATOM 0 HD21 LEU A 112 11.104 0.777 19.402 1.00 0.00 H new ATOM 0 HD22 LEU A 112 9.965 0.572 20.754 1.00 0.00 H new ATOM 0 HD23 LEU A 112 11.614 1.166 21.062 1.00 0.00 H new ATOM 1712 N GLY A 113 14.162 -2.595 23.290 1.00 0.00 N ATOM 1713 CA GLY A 113 15.560 -2.300 23.358 1.00 0.00 C ATOM 1714 C GLY A 113 15.838 -0.912 23.825 1.00 0.00 C ATOM 1715 O GLY A 113 16.416 -0.564 24.853 1.00 0.00 O ATOM 0 H GLY A 113 13.720 -2.620 24.209 1.00 0.00 H new ATOM 0 HA2 GLY A 113 16.043 -3.008 24.031 1.00 0.00 H new ATOM 0 HA3 GLY A 113 16.005 -2.442 22.373 1.00 0.00 H new ATOM 1719 N GLU A 114 15.479 0.003 22.907 1.00 0.00 N ATOM 1720 CA GLU A 114 15.336 1.419 23.045 1.00 0.00 C ATOM 1721 C GLU A 114 14.445 1.661 24.214 1.00 0.00 C ATOM 1722 O GLU A 114 13.369 1.075 24.327 1.00 0.00 O ATOM 1723 CB GLU A 114 14.822 2.208 21.829 1.00 0.00 C ATOM 1724 CG GLU A 114 15.775 2.231 20.633 1.00 0.00 C ATOM 1725 CD GLU A 114 15.337 3.022 19.409 1.00 0.00 C ATOM 1726 OE1 GLU A 114 14.916 4.207 19.329 1.00 0.00 O ATOM 1727 OE2 GLU A 114 15.265 2.327 18.360 1.00 0.00 O ATOM 0 H GLU A 114 15.264 -0.290 21.954 1.00 0.00 H new ATOM 0 HA GLU A 114 16.349 1.802 23.170 1.00 0.00 H new ATOM 0 HB2 GLU A 114 13.871 1.780 21.511 1.00 0.00 H new ATOM 0 HB3 GLU A 114 14.622 3.234 22.137 1.00 0.00 H new ATOM 0 HG2 GLU A 114 16.731 2.633 20.970 1.00 0.00 H new ATOM 0 HG3 GLU A 114 15.953 1.201 20.323 1.00 0.00 H new ATOM 1734 N LYS A 115 14.839 2.478 25.207 1.00 0.00 N ATOM 1735 CA LYS A 115 14.069 2.709 26.389 1.00 0.00 C ATOM 1736 C LYS A 115 12.908 3.631 26.241 1.00 0.00 C ATOM 1737 O LYS A 115 13.047 4.835 26.030 1.00 0.00 O ATOM 1738 CB LYS A 115 15.018 3.335 27.425 1.00 0.00 C ATOM 1739 CG LYS A 115 16.134 2.457 27.994 1.00 0.00 C ATOM 1740 CD LYS A 115 15.660 1.310 28.889 1.00 0.00 C ATOM 1741 CE LYS A 115 14.627 1.671 29.959 1.00 0.00 C ATOM 1742 NZ LYS A 115 14.948 2.886 30.740 1.00 0.00 N ATOM 0 H LYS A 115 15.719 2.993 25.187 1.00 0.00 H new ATOM 0 HA LYS A 115 13.649 1.744 26.671 1.00 0.00 H new ATOM 0 HB2 LYS A 115 15.480 4.211 26.969 1.00 0.00 H new ATOM 0 HB3 LYS A 115 14.414 3.692 28.260 1.00 0.00 H new ATOM 0 HG2 LYS A 115 16.706 2.039 27.165 1.00 0.00 H new ATOM 0 HG3 LYS A 115 16.816 3.087 28.566 1.00 0.00 H new ATOM 0 HD2 LYS A 115 15.238 0.532 28.254 1.00 0.00 H new ATOM 0 HD3 LYS A 115 16.530 0.880 29.384 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.659 1.809 29.478 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.525 0.830 30.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.783 2.703 31.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 15.946 3.140 30.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 14.341 3.670 30.427 1.00 0.00 H new ATOM 1756 N LEU A 116 11.703 3.056 26.409 1.00 0.00 N ATOM 1757 CA LEU A 116 10.434 3.702 26.543 1.00 0.00 C ATOM 1758 C LEU A 116 9.754 3.302 27.807 1.00 0.00 C ATOM 1759 O LEU A 116 9.756 2.117 28.138 1.00 0.00 O ATOM 1760 CB LEU A 116 9.591 3.247 25.340 1.00 0.00 C ATOM 1761 CG LEU A 116 9.720 4.099 24.066 1.00 0.00 C ATOM 1762 CD1 LEU A 116 10.215 3.201 22.920 1.00 0.00 C ATOM 1763 CD2 LEU A 116 8.499 4.815 23.466 1.00 0.00 C ATOM 0 H LEU A 116 11.612 2.041 26.455 1.00 0.00 H new ATOM 0 HA LEU A 116 10.559 4.784 26.572 1.00 0.00 H new ATOM 0 HB2 LEU A 116 9.866 2.221 25.096 1.00 0.00 H new ATOM 0 HB3 LEU A 116 8.543 3.234 25.640 1.00 0.00 H new ATOM 0 HG LEU A 116 10.375 4.891 24.428 1.00 0.00 H new ATOM 0 HD11 LEU A 116 10.311 3.793 22.010 1.00 0.00 H new ATOM 0 HD12 LEU A 116 11.185 2.778 23.182 1.00 0.00 H new ATOM 0 HD13 LEU A 116 9.500 2.395 22.755 1.00 0.00 H new ATOM 0 HD21 LEU A 116 8.800 5.361 22.572 1.00 0.00 H new ATOM 0 HD22 LEU A 116 7.739 4.079 23.203 1.00 0.00 H new ATOM 0 HD23 LEU A 116 8.091 5.513 24.197 1.00 0.00 H new ATOM 1775 N THR A 117 9.113 4.256 28.505 1.00 0.00 N ATOM 1776 CA THR A 117 8.422 3.935 29.716 1.00 0.00 C ATOM 1777 C THR A 117 6.956 3.891 29.452 1.00 0.00 C ATOM 1778 O THR A 117 6.589 4.453 28.421 1.00 0.00 O ATOM 1779 CB THR A 117 8.665 4.857 30.874 1.00 0.00 C ATOM 1780 OG1 THR A 117 8.675 6.208 30.437 1.00 0.00 O ATOM 1781 CG2 THR A 117 10.078 4.552 31.400 1.00 0.00 C ATOM 0 H THR A 117 9.072 5.239 28.236 1.00 0.00 H new ATOM 0 HA THR A 117 8.827 2.968 30.016 1.00 0.00 H new ATOM 0 HB THR A 117 7.888 4.716 31.625 1.00 0.00 H new ATOM 0 HG1 THR A 117 8.833 6.798 31.203 1.00 0.00 H new ATOM 0 HG21 THR A 117 10.299 5.202 32.247 1.00 0.00 H new ATOM 0 HG22 THR A 117 10.131 3.511 31.718 1.00 0.00 H new ATOM 0 HG23 THR A 117 10.807 4.727 30.608 1.00 0.00 H new ATOM 1789 N ASP A 118 6.151 3.278 30.338 1.00 0.00 N ATOM 1790 CA ASP A 118 4.747 3.127 30.116 1.00 0.00 C ATOM 1791 C ASP A 118 3.926 4.368 30.191 1.00 0.00 C ATOM 1792 O ASP A 118 2.886 4.420 29.536 1.00 0.00 O ATOM 1793 CB ASP A 118 4.175 2.214 31.214 1.00 0.00 C ATOM 1794 CG ASP A 118 4.737 0.800 31.167 1.00 0.00 C ATOM 1795 OD1 ASP A 118 4.494 0.090 30.155 1.00 0.00 O ATOM 1796 OD2 ASP A 118 5.439 0.313 32.093 1.00 0.00 O ATOM 0 H ASP A 118 6.478 2.882 31.219 1.00 0.00 H new ATOM 0 HA ASP A 118 4.681 2.745 29.097 1.00 0.00 H new ATOM 0 HB2 ASP A 118 4.388 2.651 32.189 1.00 0.00 H new ATOM 0 HB3 ASP A 118 3.090 2.171 31.114 1.00 0.00 H new ATOM 1801 N GLU A 119 4.385 5.445 30.852 1.00 0.00 N ATOM 1802 CA GLU A 119 3.860 6.772 30.769 1.00 0.00 C ATOM 1803 C GLU A 119 3.945 7.338 29.393 1.00 0.00 C ATOM 1804 O GLU A 119 2.881 7.584 28.828 1.00 0.00 O ATOM 1805 CB GLU A 119 4.449 7.681 31.861 1.00 0.00 C ATOM 1806 CG GLU A 119 5.973 7.792 31.925 1.00 0.00 C ATOM 1807 CD GLU A 119 6.363 8.782 33.013 1.00 0.00 C ATOM 1808 OE1 GLU A 119 6.417 10.010 32.737 1.00 0.00 O ATOM 1809 OE2 GLU A 119 6.726 8.361 34.143 1.00 0.00 O ATOM 0 H GLU A 119 5.179 5.383 31.489 1.00 0.00 H new ATOM 0 HA GLU A 119 2.791 6.716 30.975 1.00 0.00 H new ATOM 0 HB2 GLU A 119 4.042 8.683 31.724 1.00 0.00 H new ATOM 0 HB3 GLU A 119 4.095 7.323 32.827 1.00 0.00 H new ATOM 0 HG2 GLU A 119 6.411 6.816 32.132 1.00 0.00 H new ATOM 0 HG3 GLU A 119 6.365 8.120 30.962 1.00 0.00 H new ATOM 1816 N GLU A 120 5.138 7.331 28.772 1.00 0.00 N ATOM 1817 CA GLU A 120 5.411 7.698 27.417 1.00 0.00 C ATOM 1818 C GLU A 120 4.495 6.984 26.484 1.00 0.00 C ATOM 1819 O GLU A 120 4.040 7.551 25.492 1.00 0.00 O ATOM 1820 CB GLU A 120 6.907 7.428 27.178 1.00 0.00 C ATOM 1821 CG GLU A 120 7.526 7.771 25.822 1.00 0.00 C ATOM 1822 CD GLU A 120 7.979 9.214 25.648 1.00 0.00 C ATOM 1823 OE1 GLU A 120 7.072 10.084 25.563 1.00 0.00 O ATOM 1824 OE2 GLU A 120 9.214 9.464 25.673 1.00 0.00 O ATOM 0 H GLU A 120 5.984 7.043 29.263 1.00 0.00 H new ATOM 0 HA GLU A 120 5.218 8.753 27.225 1.00 0.00 H new ATOM 0 HB2 GLU A 120 7.463 7.975 27.939 1.00 0.00 H new ATOM 0 HB3 GLU A 120 7.080 6.367 27.357 1.00 0.00 H new ATOM 0 HG2 GLU A 120 8.384 7.118 25.660 1.00 0.00 H new ATOM 0 HG3 GLU A 120 6.799 7.542 25.043 1.00 0.00 H new ATOM 1831 N VAL A 121 4.303 5.676 26.735 1.00 0.00 N ATOM 1832 CA VAL A 121 3.488 4.759 26.001 1.00 0.00 C ATOM 1833 C VAL A 121 2.048 5.142 26.030 1.00 0.00 C ATOM 1834 O VAL A 121 1.451 5.507 25.019 1.00 0.00 O ATOM 1835 CB VAL A 121 3.717 3.308 26.306 1.00 0.00 C ATOM 1836 CG1 VAL A 121 2.709 2.419 25.558 1.00 0.00 C ATOM 1837 CG2 VAL A 121 5.147 2.965 25.858 1.00 0.00 C ATOM 0 H VAL A 121 4.762 5.221 27.525 1.00 0.00 H new ATOM 0 HA VAL A 121 3.829 4.855 24.970 1.00 0.00 H new ATOM 0 HB VAL A 121 3.584 3.127 27.373 1.00 0.00 H new ATOM 0 HG11 VAL A 121 2.899 1.373 25.798 1.00 0.00 H new ATOM 0 HG12 VAL A 121 1.696 2.683 25.861 1.00 0.00 H new ATOM 0 HG13 VAL A 121 2.817 2.570 24.484 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.351 1.914 26.065 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.248 3.151 24.789 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.858 3.586 26.403 1.00 0.00 H new ATOM 1847 N ASP A 122 1.422 5.203 27.219 1.00 0.00 N ATOM 1848 CA ASP A 122 0.095 5.653 27.504 1.00 0.00 C ATOM 1849 C ASP A 122 -0.157 7.034 27.005 1.00 0.00 C ATOM 1850 O ASP A 122 -1.248 7.335 26.522 1.00 0.00 O ATOM 1851 CB ASP A 122 -0.228 5.762 29.003 1.00 0.00 C ATOM 1852 CG ASP A 122 -0.576 4.405 29.597 1.00 0.00 C ATOM 1853 OD1 ASP A 122 -1.726 3.942 29.373 1.00 0.00 O ATOM 1854 OD2 ASP A 122 0.276 3.773 30.277 1.00 0.00 O ATOM 0 H ASP A 122 1.899 4.904 28.069 1.00 0.00 H new ATOM 0 HA ASP A 122 -0.515 4.894 27.014 1.00 0.00 H new ATOM 0 HB2 ASP A 122 0.627 6.183 29.531 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -1.062 6.449 29.148 1.00 0.00 H new ATOM 1859 N GLU A 123 0.833 7.942 27.068 1.00 0.00 N ATOM 1860 CA GLU A 123 0.722 9.241 26.481 1.00 0.00 C ATOM 1861 C GLU A 123 0.472 9.253 25.012 1.00 0.00 C ATOM 1862 O GLU A 123 -0.303 10.066 24.511 1.00 0.00 O ATOM 1863 CB GLU A 123 1.996 10.082 26.666 1.00 0.00 C ATOM 1864 CG GLU A 123 2.094 10.642 28.087 1.00 0.00 C ATOM 1865 CD GLU A 123 1.190 11.806 28.468 1.00 0.00 C ATOM 1866 OE1 GLU A 123 1.132 12.806 27.703 1.00 0.00 O ATOM 1867 OE2 GLU A 123 0.752 11.785 29.649 1.00 0.00 O ATOM 0 H GLU A 123 1.724 7.772 27.534 1.00 0.00 H new ATOM 0 HA GLU A 123 -0.137 9.652 27.010 1.00 0.00 H new ATOM 0 HB2 GLU A 123 2.872 9.469 26.453 1.00 0.00 H new ATOM 0 HB3 GLU A 123 1.999 10.903 25.949 1.00 0.00 H new ATOM 0 HG2 GLU A 123 1.894 9.825 28.781 1.00 0.00 H new ATOM 0 HG3 GLU A 123 3.125 10.955 28.251 1.00 0.00 H new ATOM 1874 N MET A 124 1.233 8.415 24.284 1.00 0.00 N ATOM 1875 CA MET A 124 1.185 8.123 22.885 1.00 0.00 C ATOM 1876 C MET A 124 -0.158 7.639 22.457 1.00 0.00 C ATOM 1877 O MET A 124 -0.791 8.095 21.506 1.00 0.00 O ATOM 1878 CB MET A 124 2.389 7.210 22.600 1.00 0.00 C ATOM 1879 CG MET A 124 2.947 7.433 21.194 1.00 0.00 C ATOM 1880 SD MET A 124 4.051 6.105 20.626 1.00 0.00 S ATOM 1881 CE MET A 124 5.258 5.969 21.976 1.00 0.00 C ATOM 0 H MET A 124 1.972 7.878 24.737 1.00 0.00 H new ATOM 0 HA MET A 124 1.290 9.008 22.258 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.171 7.398 23.336 1.00 0.00 H new ATOM 0 HB3 MET A 124 2.090 6.168 22.712 1.00 0.00 H new ATOM 0 HG2 MET A 124 2.117 7.527 20.494 1.00 0.00 H new ATOM 0 HG3 MET A 124 3.490 8.378 21.174 1.00 0.00 H new ATOM 0 HE1 MET A 124 6.032 5.253 21.701 1.00 0.00 H new ATOM 0 HE2 MET A 124 5.713 6.943 22.157 1.00 0.00 H new ATOM 0 HE3 MET A 124 4.755 5.630 22.881 1.00 0.00 H new ATOM 1891 N ILE A 125 -0.709 6.693 23.237 1.00 0.00 N ATOM 1892 CA ILE A 125 -1.999 6.084 23.134 1.00 0.00 C ATOM 1893 C ILE A 125 -3.114 7.059 23.291 1.00 0.00 C ATOM 1894 O ILE A 125 -3.961 7.229 22.415 1.00 0.00 O ATOM 1895 CB ILE A 125 -2.050 5.046 24.216 1.00 0.00 C ATOM 1896 CG1 ILE A 125 -1.136 3.861 23.860 1.00 0.00 C ATOM 1897 CG2 ILE A 125 -3.471 4.459 24.254 1.00 0.00 C ATOM 1898 CD1 ILE A 125 -0.846 2.851 24.970 1.00 0.00 C ATOM 0 H ILE A 125 -0.189 6.314 24.029 1.00 0.00 H new ATOM 0 HA ILE A 125 -2.131 5.655 22.141 1.00 0.00 H new ATOM 0 HB ILE A 125 -1.751 5.512 25.155 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -1.586 3.326 23.024 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -0.185 4.260 23.508 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -3.531 3.701 25.035 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -4.187 5.253 24.464 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -3.703 4.006 23.290 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.191 2.068 24.588 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -0.359 3.357 25.804 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.781 2.407 25.311 1.00 0.00 H new ATOM 1910 N ARG A 126 -3.031 7.810 24.404 1.00 0.00 N ATOM 1911 CA ARG A 126 -3.999 8.788 24.791 1.00 0.00 C ATOM 1912 C ARG A 126 -4.291 9.807 23.744 1.00 0.00 C ATOM 1913 O ARG A 126 -5.460 9.987 23.405 1.00 0.00 O ATOM 1914 CB ARG A 126 -3.817 9.396 26.192 1.00 0.00 C ATOM 1915 CG ARG A 126 -4.995 10.253 26.659 1.00 0.00 C ATOM 1916 CD ARG A 126 -4.694 11.084 27.908 1.00 0.00 C ATOM 1917 NE ARG A 126 -3.858 12.238 27.472 1.00 0.00 N ATOM 1918 CZ ARG A 126 -2.561 12.577 27.730 1.00 0.00 C ATOM 1919 NH1 ARG A 126 -1.824 11.794 28.571 1.00 0.00 N ATOM 1920 NH2 ARG A 126 -2.094 13.764 27.243 1.00 0.00 N ATOM 0 H ARG A 126 -2.256 7.732 25.062 1.00 0.00 H new ATOM 0 HA ARG A 126 -4.906 8.191 24.886 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -3.662 8.590 26.909 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -2.913 10.006 26.197 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -5.289 10.922 25.850 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -5.847 9.604 26.862 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -5.617 11.430 28.373 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -4.168 10.486 28.652 1.00 0.00 H new ATOM 0 HE ARG A 126 -4.346 12.898 26.867 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -2.244 10.968 28.997 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -0.854 12.035 28.773 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -2.710 14.371 26.702 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.129 14.044 27.420 1.00 0.00 H new ATOM 1934 N GLU A 127 -3.224 10.378 23.156 1.00 0.00 N ATOM 1935 CA GLU A 127 -3.157 11.403 22.161 1.00 0.00 C ATOM 1936 C GLU A 127 -3.623 10.921 20.830 1.00 0.00 C ATOM 1937 O GLU A 127 -4.380 11.544 20.087 1.00 0.00 O ATOM 1938 CB GLU A 127 -1.757 12.039 22.149 1.00 0.00 C ATOM 1939 CG GLU A 127 -1.514 13.007 20.989 1.00 0.00 C ATOM 1940 CD GLU A 127 -2.158 14.366 21.223 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -2.762 14.605 22.303 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -1.970 15.286 20.383 1.00 0.00 O ATOM 0 H GLU A 127 -2.285 10.076 23.417 1.00 0.00 H new ATOM 0 HA GLU A 127 -3.856 12.198 22.421 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -1.604 12.571 23.088 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -1.011 11.246 22.107 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -0.441 13.136 20.846 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -1.909 12.574 20.070 1.00 0.00 H new ATOM 1949 N ALA A 128 -3.236 9.681 20.482 1.00 0.00 N ATOM 1950 CA ALA A 128 -3.813 9.024 19.350 1.00 0.00 C ATOM 1951 C ALA A 128 -5.232 8.572 19.358 1.00 0.00 C ATOM 1952 O ALA A 128 -5.893 8.831 18.354 1.00 0.00 O ATOM 1953 CB ALA A 128 -2.892 7.802 19.186 1.00 0.00 C ATOM 0 H ALA A 128 -2.530 9.137 20.979 1.00 0.00 H new ATOM 0 HA ALA A 128 -3.870 9.763 18.551 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -3.229 7.204 18.339 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -1.870 8.138 19.010 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -2.924 7.198 20.093 1.00 0.00 H new ATOM 1959 N ASP A 129 -5.756 7.922 20.414 1.00 0.00 N ATOM 1960 CA ASP A 129 -7.005 7.227 20.458 1.00 0.00 C ATOM 1961 C ASP A 129 -8.228 8.076 20.508 1.00 0.00 C ATOM 1962 O ASP A 129 -8.384 8.886 21.420 1.00 0.00 O ATOM 1963 CB ASP A 129 -7.049 6.305 21.688 1.00 0.00 C ATOM 1964 CG ASP A 129 -8.063 5.187 21.487 1.00 0.00 C ATOM 1965 OD1 ASP A 129 -9.256 5.382 21.134 1.00 0.00 O ATOM 1966 OD2 ASP A 129 -7.661 4.003 21.639 1.00 0.00 O ATOM 0 H ASP A 129 -5.265 7.881 21.307 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.033 6.688 19.511 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.061 5.879 21.865 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.310 6.884 22.574 1.00 0.00 H new ATOM 1971 N ILE A 130 -9.179 7.912 19.571 1.00 0.00 N ATOM 1972 CA ILE A 130 -10.438 8.592 19.546 1.00 0.00 C ATOM 1973 C ILE A 130 -11.384 8.220 20.635 1.00 0.00 C ATOM 1974 O ILE A 130 -11.859 9.037 21.421 1.00 0.00 O ATOM 1975 CB ILE A 130 -10.939 8.686 18.135 1.00 0.00 C ATOM 1976 CG1 ILE A 130 -10.298 9.933 17.502 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -12.472 8.648 18.024 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -10.346 9.875 15.976 1.00 0.00 C ATOM 0 H ILE A 130 -9.063 7.269 18.787 1.00 0.00 H new ATOM 0 HA ILE A 130 -10.298 9.630 19.847 1.00 0.00 H new ATOM 0 HB ILE A 130 -10.637 7.800 17.576 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -10.817 10.826 17.850 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -9.262 10.018 17.831 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -12.763 8.720 16.976 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -12.844 7.712 18.440 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -12.898 9.485 18.577 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -9.884 10.772 15.563 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.805 8.995 15.628 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -11.383 9.816 15.647 1.00 0.00 H new ATOM 1990 N ASP A 131 -11.611 6.899 20.749 1.00 0.00 N ATOM 1991 CA ASP A 131 -12.621 6.266 21.538 1.00 0.00 C ATOM 1992 C ASP A 131 -12.193 6.220 22.965 1.00 0.00 C ATOM 1993 O ASP A 131 -12.986 6.519 23.857 1.00 0.00 O ATOM 1994 CB ASP A 131 -12.898 4.839 21.035 1.00 0.00 C ATOM 1995 CG ASP A 131 -13.416 4.941 19.608 1.00 0.00 C ATOM 1996 OD1 ASP A 131 -14.658 5.143 19.552 1.00 0.00 O ATOM 1997 OD2 ASP A 131 -12.611 4.798 18.649 1.00 0.00 O ATOM 0 H ASP A 131 -11.040 6.219 20.247 1.00 0.00 H new ATOM 0 HA ASP A 131 -13.539 6.848 21.450 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -11.989 4.239 21.069 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -13.631 4.345 21.673 1.00 0.00 H new ATOM 2002 N GLY A 132 -10.940 5.854 23.288 1.00 0.00 N ATOM 2003 CA GLY A 132 -10.597 5.569 24.647 1.00 0.00 C ATOM 2004 C GLY A 132 -11.096 4.199 24.952 1.00 0.00 C ATOM 2005 O GLY A 132 -11.453 3.996 26.112 1.00 0.00 O ATOM 0 H GLY A 132 -10.175 5.756 22.621 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -9.518 5.626 24.791 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -11.047 6.300 25.318 1.00 0.00 H new ATOM 2009 N ASP A 133 -11.235 3.374 23.899 1.00 0.00 N ATOM 2010 CA ASP A 133 -11.679 2.026 24.080 1.00 0.00 C ATOM 2011 C ASP A 133 -10.665 1.250 24.848 1.00 0.00 C ATOM 2012 O ASP A 133 -10.966 0.502 25.777 1.00 0.00 O ATOM 2013 CB ASP A 133 -12.128 1.455 22.725 1.00 0.00 C ATOM 2014 CG ASP A 133 -11.113 1.359 21.595 1.00 0.00 C ATOM 2015 OD1 ASP A 133 -10.515 2.427 21.298 1.00 0.00 O ATOM 2016 OD2 ASP A 133 -10.889 0.242 21.056 1.00 0.00 O ATOM 0 H ASP A 133 -11.043 3.636 22.932 1.00 0.00 H new ATOM 0 HA ASP A 133 -12.568 1.962 24.707 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -12.519 0.453 22.903 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -12.960 2.064 22.370 1.00 0.00 H new ATOM 2021 N GLY A 134 -9.379 1.445 24.504 1.00 0.00 N ATOM 2022 CA GLY A 134 -8.316 0.654 25.042 1.00 0.00 C ATOM 2023 C GLY A 134 -7.667 -0.259 24.060 1.00 0.00 C ATOM 2024 O GLY A 134 -6.795 -1.030 24.458 1.00 0.00 O ATOM 0 H GLY A 134 -9.073 2.160 23.844 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -7.558 1.320 25.456 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -8.705 0.060 25.869 1.00 0.00 H new ATOM 2028 N GLN A 135 -7.887 -0.063 22.747 1.00 0.00 N ATOM 2029 CA GLN A 135 -7.246 -0.794 21.698 1.00 0.00 C ATOM 2030 C GLN A 135 -6.682 0.273 20.825 1.00 0.00 C ATOM 2031 O GLN A 135 -7.257 1.323 20.541 1.00 0.00 O ATOM 2032 CB GLN A 135 -8.232 -1.563 20.803 1.00 0.00 C ATOM 2033 CG GLN A 135 -8.982 -2.693 21.511 1.00 0.00 C ATOM 2034 CD GLN A 135 -8.065 -3.826 21.950 1.00 0.00 C ATOM 2035 OE1 GLN A 135 -7.226 -4.314 21.194 1.00 0.00 O ATOM 2036 NE2 GLN A 135 -8.319 -4.225 23.224 1.00 0.00 N ATOM 0 H GLN A 135 -8.542 0.638 22.401 1.00 0.00 H new ATOM 0 HA GLN A 135 -6.546 -1.511 22.126 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -8.959 -0.860 20.397 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -7.686 -1.980 19.957 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -9.497 -2.290 22.383 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -9.747 -3.089 20.843 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -9.039 -3.754 23.772 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -7.790 -4.996 23.632 1.00 0.00 H new ATOM 2045 N VAL A 136 -5.499 -0.021 20.258 1.00 0.00 N ATOM 2046 CA VAL A 136 -4.891 0.785 19.245 1.00 0.00 C ATOM 2047 C VAL A 136 -5.092 0.113 17.931 1.00 0.00 C ATOM 2048 O VAL A 136 -4.706 -1.047 17.797 1.00 0.00 O ATOM 2049 CB VAL A 136 -3.436 1.029 19.515 1.00 0.00 C ATOM 2050 CG1 VAL A 136 -2.727 1.496 18.233 1.00 0.00 C ATOM 2051 CG2 VAL A 136 -3.419 2.165 20.552 1.00 0.00 C ATOM 0 H VAL A 136 -4.949 -0.842 20.511 1.00 0.00 H new ATOM 0 HA VAL A 136 -5.364 1.767 19.238 1.00 0.00 H new ATOM 0 HB VAL A 136 -2.927 0.130 19.862 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -1.672 1.669 18.443 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -2.823 0.729 17.464 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -3.184 2.421 17.881 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -2.388 2.409 20.808 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -3.907 3.046 20.135 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.950 1.847 21.449 1.00 0.00 H new ATOM 2061 N ASN A 137 -5.815 0.755 16.996 1.00 0.00 N ATOM 2062 CA ASN A 137 -5.875 0.142 15.705 1.00 0.00 C ATOM 2063 C ASN A 137 -4.652 0.422 14.900 1.00 0.00 C ATOM 2064 O ASN A 137 -3.746 1.133 15.331 1.00 0.00 O ATOM 2065 CB ASN A 137 -7.240 0.434 15.059 1.00 0.00 C ATOM 2066 CG ASN A 137 -7.589 1.884 14.755 1.00 0.00 C ATOM 2067 OD1 ASN A 137 -6.793 2.690 14.274 1.00 0.00 O ATOM 2068 ND2 ASN A 137 -8.851 2.254 15.099 1.00 0.00 N ATOM 0 H ASN A 137 -6.323 1.632 17.115 1.00 0.00 H new ATOM 0 HA ASN A 137 -5.841 -0.945 15.782 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -7.295 -0.126 14.125 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -8.013 0.035 15.716 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -9.156 3.217 14.960 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -9.493 1.568 15.496 1.00 0.00 H new ATOM 2075 N TYR A 138 -4.633 -0.073 13.650 1.00 0.00 N ATOM 2076 CA TYR A 138 -3.619 0.233 12.689 1.00 0.00 C ATOM 2077 C TYR A 138 -3.502 1.694 12.422 1.00 0.00 C ATOM 2078 O TYR A 138 -2.427 2.290 12.373 1.00 0.00 O ATOM 2079 CB TYR A 138 -3.840 -0.630 11.435 1.00 0.00 C ATOM 2080 CG TYR A 138 -2.866 -0.330 10.348 1.00 0.00 C ATOM 2081 CD1 TYR A 138 -1.517 -0.415 10.598 1.00 0.00 C ATOM 2082 CD2 TYR A 138 -3.290 0.206 9.154 1.00 0.00 C ATOM 2083 CE1 TYR A 138 -0.637 0.143 9.700 1.00 0.00 C ATOM 2084 CE2 TYR A 138 -2.406 0.709 8.229 1.00 0.00 C ATOM 2085 CZ TYR A 138 -1.058 0.632 8.486 1.00 0.00 C ATOM 2086 OH TYR A 138 -0.171 1.208 7.553 1.00 0.00 O ATOM 0 H TYR A 138 -5.348 -0.708 13.296 1.00 0.00 H new ATOM 0 HA TYR A 138 -2.642 -0.027 13.096 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -3.762 -1.683 11.706 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -4.852 -0.471 11.064 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -1.154 -0.912 11.485 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -4.348 0.232 8.937 1.00 0.00 H new ATOM 0 HE1 TYR A 138 0.411 0.198 9.955 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -2.765 1.158 7.315 1.00 0.00 H new ATOM 0 HH TYR A 138 -0.670 1.490 6.758 1.00 0.00 H new ATOM 2096 N GLU A 139 -4.598 2.397 12.085 1.00 0.00 N ATOM 2097 CA GLU A 139 -4.538 3.807 11.856 1.00 0.00 C ATOM 2098 C GLU A 139 -4.117 4.619 13.032 1.00 0.00 C ATOM 2099 O GLU A 139 -3.359 5.550 12.761 1.00 0.00 O ATOM 2100 CB GLU A 139 -5.898 4.401 11.451 1.00 0.00 C ATOM 2101 CG GLU A 139 -5.917 5.787 10.804 1.00 0.00 C ATOM 2102 CD GLU A 139 -7.310 6.082 10.265 1.00 0.00 C ATOM 2103 OE1 GLU A 139 -8.278 5.924 11.056 1.00 0.00 O ATOM 2104 OE2 GLU A 139 -7.489 6.337 9.044 1.00 0.00 O ATOM 0 H GLU A 139 -5.526 1.989 11.971 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.794 3.871 11.062 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -6.373 3.704 10.760 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -6.523 4.441 12.343 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -5.631 6.544 11.534 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -5.187 5.832 9.996 1.00 0.00 H new ATOM 2111 N GLU A 140 -4.532 4.288 14.267 1.00 0.00 N ATOM 2112 CA GLU A 140 -3.916 4.878 15.415 1.00 0.00 C ATOM 2113 C GLU A 140 -2.500 4.533 15.726 1.00 0.00 C ATOM 2114 O GLU A 140 -1.804 5.371 16.295 1.00 0.00 O ATOM 2115 CB GLU A 140 -4.722 4.559 16.686 1.00 0.00 C ATOM 2116 CG GLU A 140 -6.194 4.929 16.499 1.00 0.00 C ATOM 2117 CD GLU A 140 -7.001 4.366 17.660 1.00 0.00 C ATOM 2118 OE1 GLU A 140 -6.980 3.162 18.034 1.00 0.00 O ATOM 2119 OE2 GLU A 140 -7.884 5.119 18.151 1.00 0.00 O ATOM 0 H GLU A 140 -5.280 3.625 14.470 1.00 0.00 H new ATOM 0 HA GLU A 140 -3.911 5.930 15.128 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -4.635 3.498 16.921 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -4.309 5.108 17.532 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -6.306 6.012 16.453 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -6.565 4.530 15.555 1.00 0.00 H new ATOM 2126 N PHE A 141 -2.020 3.339 15.334 1.00 0.00 N ATOM 2127 CA PHE A 141 -0.617 3.067 15.394 1.00 0.00 C ATOM 2128 C PHE A 141 0.271 3.818 14.463 1.00 0.00 C ATOM 2129 O PHE A 141 1.355 4.258 14.844 1.00 0.00 O ATOM 2130 CB PHE A 141 -0.294 1.583 15.152 1.00 0.00 C ATOM 2131 CG PHE A 141 1.081 1.091 15.446 1.00 0.00 C ATOM 2132 CD1 PHE A 141 1.720 1.458 16.607 1.00 0.00 C ATOM 2133 CD2 PHE A 141 1.695 0.249 14.550 1.00 0.00 C ATOM 2134 CE1 PHE A 141 2.941 0.879 16.862 1.00 0.00 C ATOM 2135 CE2 PHE A 141 2.970 -0.230 14.743 1.00 0.00 C ATOM 2136 CZ PHE A 141 3.582 0.098 15.930 1.00 0.00 C ATOM 0 H PHE A 141 -2.593 2.573 14.981 1.00 0.00 H new ATOM 0 HA PHE A 141 -0.402 3.400 16.409 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -0.990 0.992 15.747 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -0.506 1.366 14.105 1.00 0.00 H new ATOM 0 HD1 PHE A 141 1.282 2.171 17.290 1.00 0.00 H new ATOM 0 HD2 PHE A 141 1.157 -0.047 13.662 1.00 0.00 H new ATOM 0 HE1 PHE A 141 3.409 1.042 17.821 1.00 0.00 H new ATOM 0 HE2 PHE A 141 3.466 -0.834 13.998 1.00 0.00 H new ATOM 0 HZ PHE A 141 4.580 -0.263 16.133 1.00 0.00 H new ATOM 2146 N VAL A 142 -0.233 4.111 13.251 1.00 0.00 N ATOM 2147 CA VAL A 142 0.437 4.918 12.280 1.00 0.00 C ATOM 2148 C VAL A 142 0.529 6.319 12.781 1.00 0.00 C ATOM 2149 O VAL A 142 1.546 7.001 12.667 1.00 0.00 O ATOM 2150 CB VAL A 142 -0.208 4.982 10.927 1.00 0.00 C ATOM 2151 CG1 VAL A 142 0.687 5.883 10.059 1.00 0.00 C ATOM 2152 CG2 VAL A 142 -0.326 3.574 10.320 1.00 0.00 C ATOM 0 H VAL A 142 -1.142 3.773 12.936 1.00 0.00 H new ATOM 0 HA VAL A 142 1.405 4.435 12.149 1.00 0.00 H new ATOM 0 HB VAL A 142 -1.219 5.385 10.989 1.00 0.00 H new ATOM 0 HG11 VAL A 142 0.261 5.964 9.059 1.00 0.00 H new ATOM 0 HG12 VAL A 142 0.750 6.874 10.508 1.00 0.00 H new ATOM 0 HG13 VAL A 142 1.685 5.450 9.994 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -0.796 3.639 9.339 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.667 3.137 10.218 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -0.933 2.946 10.972 1.00 0.00 H new ATOM 2162 N GLN A 143 -0.589 6.850 13.307 1.00 0.00 N ATOM 2163 CA GLN A 143 -0.539 8.185 13.817 1.00 0.00 C ATOM 2164 C GLN A 143 0.331 8.455 14.997 1.00 0.00 C ATOM 2165 O GLN A 143 0.849 9.559 15.159 1.00 0.00 O ATOM 2166 CB GLN A 143 -1.930 8.742 14.164 1.00 0.00 C ATOM 2167 CG GLN A 143 -2.702 8.961 12.861 1.00 0.00 C ATOM 2168 CD GLN A 143 -4.182 9.249 13.067 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -4.646 10.343 12.747 1.00 0.00 O ATOM 2170 NE2 GLN A 143 -4.944 8.256 13.599 1.00 0.00 N ATOM 0 H GLN A 143 -1.491 6.380 13.379 1.00 0.00 H new ATOM 0 HA GLN A 143 -0.080 8.688 12.966 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -2.466 8.047 14.810 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -1.837 9.680 14.712 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -2.252 9.792 12.318 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -2.597 8.076 12.234 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -4.517 7.364 13.850 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -5.942 8.403 13.747 1.00 0.00 H new ATOM 2179 N MET A 144 0.623 7.394 15.770 1.00 0.00 N ATOM 2180 CA MET A 144 1.541 7.292 16.861 1.00 0.00 C ATOM 2181 C MET A 144 2.959 7.390 16.413 1.00 0.00 C ATOM 2182 O MET A 144 3.738 8.225 16.868 1.00 0.00 O ATOM 2183 CB MET A 144 1.265 6.019 17.680 1.00 0.00 C ATOM 2184 CG MET A 144 0.099 6.071 18.669 1.00 0.00 C ATOM 2185 SD MET A 144 -0.607 4.574 19.421 1.00 0.00 S ATOM 2186 CE MET A 144 0.729 4.244 20.606 1.00 0.00 C ATOM 0 H MET A 144 0.157 6.502 15.607 1.00 0.00 H new ATOM 0 HA MET A 144 1.380 8.146 17.519 1.00 0.00 H new ATOM 0 HB2 MET A 144 1.083 5.201 16.984 1.00 0.00 H new ATOM 0 HB3 MET A 144 2.170 5.770 18.235 1.00 0.00 H new ATOM 0 HG2 MET A 144 0.414 6.714 19.490 1.00 0.00 H new ATOM 0 HG3 MET A 144 -0.719 6.581 18.161 1.00 0.00 H new ATOM 0 HE1 MET A 144 0.665 3.211 20.948 1.00 0.00 H new ATOM 0 HE2 MET A 144 1.692 4.407 20.123 1.00 0.00 H new ATOM 0 HE3 MET A 144 0.633 4.916 21.459 1.00 0.00 H new ATOM 2196 N MET A 145 3.384 6.469 15.529 1.00 0.00 N ATOM 2197 CA MET A 145 4.781 6.301 15.276 1.00 0.00 C ATOM 2198 C MET A 145 4.938 5.595 13.973 1.00 0.00 C ATOM 2199 O MET A 145 4.043 4.839 13.598 1.00 0.00 O ATOM 2200 CB MET A 145 5.373 5.514 16.457 1.00 0.00 C ATOM 2201 CG MET A 145 4.630 4.236 16.852 1.00 0.00 C ATOM 2202 SD MET A 145 5.517 3.180 18.037 1.00 0.00 S ATOM 2203 CE MET A 145 6.588 2.448 16.766 1.00 0.00 C ATOM 0 H MET A 145 2.772 5.850 14.997 1.00 0.00 H new ATOM 0 HA MET A 145 5.313 7.249 15.199 1.00 0.00 H new ATOM 0 HB2 MET A 145 6.402 5.251 16.213 1.00 0.00 H new ATOM 0 HB3 MET A 145 5.409 6.172 17.325 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.666 4.510 17.280 1.00 0.00 H new ATOM 0 HG3 MET A 145 4.426 3.657 15.951 1.00 0.00 H new ATOM 0 HE1 MET A 145 6.361 1.387 16.666 1.00 0.00 H new ATOM 0 HE2 MET A 145 6.415 2.947 15.813 1.00 0.00 H new ATOM 0 HE3 MET A 145 7.632 2.570 17.055 1.00 0.00 H new