USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 844 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 13 ASN : amide:sc= -0.42 K(o=-0.42,f=-0.94) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot -87:sc= 0.02 USER MOD Set 2.2: C 21 THR OG1 : rot 180:sc= 0.0168 USER MOD Set 3.1: A 13 ASN : amide:sc= 0.0594 K(o=0.059,f=-1.1!) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc=-0.000791 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0.233 USER MOD Set 4.2: A 21 THR OG1 : rot -70:sc= 0.241 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -166:sc=-0.00814 (180deg=-0.219) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.515 X(o=-0.52,f=-0.37) USER MOD Single : A 29 GLN :FLIP amide:sc= 0 F(o=-0.65,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.0774 K(o=-0.077,f=-2.1) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= -1.39 K(o=-1.4,f=-2.4) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.988 K(o=0.99,f=0) USER MOD Single : C 1 MET CE :methyl 175:sc= 0 (180deg=-0.0133) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ -158:sc= -0.0963 (180deg=-0.535) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0.302 K(o=0.3,f=-1.3) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 35 ASN : amide:sc= -0.107 K(o=-0.11,f=-2.1!) USER MOD Single : C 38 LYS NZ :NH3+ -109:sc= -0.572 (180deg=-2.72!) USER MOD Single : C 43 HIS : no HE2:sc= -1.26 K(o=-1.3,f=-2.3) USER MOD Single : C 48 TYR OH : rot 180:sc= 0 USER MOD Single : C 49 GLN : amide:sc= 0.954 K(o=0.95,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.964 2.967 -1.838 1.00 0.00 N ATOM 2 CA MET A 1 -12.025 2.455 -0.821 1.00 0.00 C ATOM 3 C MET A 1 -12.028 0.936 -0.800 1.00 0.00 C ATOM 4 O MET A 1 -13.076 0.333 -0.597 1.00 0.00 O ATOM 5 CB MET A 1 -12.396 2.958 0.574 1.00 0.00 C ATOM 6 CG MET A 1 -11.505 2.328 1.645 1.00 0.00 C ATOM 7 SD MET A 1 -9.781 2.853 1.594 1.00 0.00 S ATOM 8 CE MET A 1 -9.973 4.371 2.554 1.00 0.00 C ATOM 0 H1 MET A 1 -12.946 4.007 -1.835 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.683 2.618 -2.777 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.926 2.637 -1.620 1.00 0.00 H new ATOM 0 HA MET A 1 -11.033 2.820 -1.088 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.300 4.043 0.610 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.440 2.724 0.782 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.915 2.567 2.626 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.544 1.244 1.539 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.007 4.867 2.648 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.674 5.035 2.049 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.354 4.128 3.546 1.00 0.00 H new ATOM 20 N LEU A 2 -10.867 0.311 -1.005 1.00 0.00 N ATOM 21 CA LEU A 2 -10.726 -1.133 -0.941 1.00 0.00 C ATOM 22 C LEU A 2 -9.587 -1.438 0.033 1.00 0.00 C ATOM 23 O LEU A 2 -8.425 -1.157 -0.265 1.00 0.00 O ATOM 24 CB LEU A 2 -10.476 -1.663 -2.358 1.00 0.00 C ATOM 25 CG LEU A 2 -10.534 -3.188 -2.519 1.00 0.00 C ATOM 26 CD1 LEU A 2 -9.122 -3.748 -2.559 1.00 0.00 C ATOM 27 CD2 LEU A 2 -11.285 -3.921 -1.406 1.00 0.00 C ATOM 0 H LEU A 2 -9.998 0.800 -1.221 1.00 0.00 H new ATOM 0 HA LEU A 2 -11.624 -1.630 -0.574 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -11.212 -1.217 -3.028 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -9.496 -1.319 -2.687 1.00 0.00 H new ATOM 0 HG LEU A 2 -11.082 -3.356 -3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -9.163 -4.831 -2.673 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -8.582 -3.315 -3.401 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -8.606 -3.501 -1.631 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -11.274 -4.993 -1.604 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -10.801 -3.724 -0.450 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -12.316 -3.569 -1.370 1.00 0.00 H new ATOM 39 N ILE A 3 -9.924 -2.006 1.193 1.00 0.00 N ATOM 40 CA ILE A 3 -8.959 -2.333 2.234 1.00 0.00 C ATOM 41 C ILE A 3 -8.424 -3.739 2.008 1.00 0.00 C ATOM 42 O ILE A 3 -9.149 -4.621 1.548 1.00 0.00 O ATOM 43 CB ILE A 3 -9.601 -2.263 3.631 1.00 0.00 C ATOM 44 CG1 ILE A 3 -10.001 -0.832 4.011 1.00 0.00 C ATOM 45 CG2 ILE A 3 -8.576 -2.732 4.666 1.00 0.00 C ATOM 46 CD1 ILE A 3 -11.415 -0.496 3.562 1.00 0.00 C ATOM 0 H ILE A 3 -10.884 -2.252 1.434 1.00 0.00 H new ATOM 0 HA ILE A 3 -8.149 -1.605 2.185 1.00 0.00 H new ATOM 0 HB ILE A 3 -10.492 -2.890 3.613 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -9.925 -0.709 5.091 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -9.301 -0.128 3.560 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -9.018 -2.688 5.662 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -8.280 -3.758 4.446 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -7.699 -2.085 4.629 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -11.656 0.527 3.852 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -11.485 -0.592 2.478 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -12.119 -1.182 4.033 1.00 0.00 H new ATOM 58 N LEU A 4 -7.150 -3.938 2.347 1.00 0.00 N ATOM 59 CA LEU A 4 -6.488 -5.228 2.310 1.00 0.00 C ATOM 60 C LEU A 4 -5.566 -5.322 3.522 1.00 0.00 C ATOM 61 O LEU A 4 -5.165 -4.296 4.074 1.00 0.00 O ATOM 62 CB LEU A 4 -5.693 -5.361 1.000 1.00 0.00 C ATOM 63 CG LEU A 4 -6.589 -5.294 -0.243 1.00 0.00 C ATOM 64 CD1 LEU A 4 -5.731 -5.223 -1.504 1.00 0.00 C ATOM 65 CD2 LEU A 4 -7.491 -6.524 -0.343 1.00 0.00 C ATOM 0 H LEU A 4 -6.541 -3.183 2.662 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.215 -6.039 2.345 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.948 -4.567 0.949 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.151 -6.307 1.002 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.208 -4.401 -0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.376 -5.176 -2.381 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.103 -4.333 -1.467 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.100 -6.110 -1.565 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -8.114 -6.447 -1.234 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.876 -7.422 -0.407 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -8.127 -6.582 0.540 1.00 0.00 H new ATOM 77 N THR A 5 -5.220 -6.541 3.944 1.00 0.00 N ATOM 78 CA THR A 5 -4.324 -6.750 5.078 1.00 0.00 C ATOM 79 C THR A 5 -3.101 -7.534 4.626 1.00 0.00 C ATOM 80 O THR A 5 -3.220 -8.485 3.855 1.00 0.00 O ATOM 81 CB THR A 5 -5.035 -7.493 6.216 1.00 0.00 C ATOM 82 OG1 THR A 5 -5.585 -8.708 5.761 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.169 -6.642 6.776 1.00 0.00 C ATOM 0 H THR A 5 -5.552 -7.403 3.511 1.00 0.00 H new ATOM 0 HA THR A 5 -4.013 -5.776 5.455 1.00 0.00 H new ATOM 0 HB THR A 5 -4.292 -7.693 6.988 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.031 -9.164 6.505 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.665 -7.182 7.583 1.00 0.00 H new ATOM 0 HG22 THR A 5 -5.765 -5.705 7.160 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.889 -6.430 5.986 1.00 0.00 H new ATOM 91 N ARG A 6 -1.923 -7.132 5.107 1.00 0.00 N ATOM 92 CA ARG A 6 -0.668 -7.772 4.732 1.00 0.00 C ATOM 93 C ARG A 6 0.298 -7.799 5.909 1.00 0.00 C ATOM 94 O ARG A 6 0.459 -6.792 6.596 1.00 0.00 O ATOM 95 CB ARG A 6 -0.018 -6.970 3.599 1.00 0.00 C ATOM 96 CG ARG A 6 -0.770 -7.023 2.268 1.00 0.00 C ATOM 97 CD ARG A 6 -0.510 -8.325 1.508 1.00 0.00 C ATOM 98 NE ARG A 6 -1.246 -9.463 2.064 1.00 0.00 N ATOM 99 CZ ARG A 6 -1.368 -10.638 1.441 1.00 0.00 C ATOM 100 NH1 ARG A 6 -0.827 -10.832 0.243 1.00 0.00 N ATOM 101 NH2 ARG A 6 -2.032 -11.639 2.013 1.00 0.00 N ATOM 0 H ARG A 6 -1.816 -6.358 5.763 1.00 0.00 H new ATOM 0 HA ARG A 6 -0.882 -8.794 4.417 1.00 0.00 H new ATOM 0 HB2 ARG A 6 0.068 -5.929 3.911 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.995 -7.341 3.444 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -1.839 -6.920 2.453 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -0.470 -6.177 1.649 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -0.790 -8.193 0.463 1.00 0.00 H new ATOM 0 HD3 ARG A 6 0.558 -8.544 1.527 1.00 0.00 H new ATOM 0 HE ARG A 6 -1.689 -9.352 2.976 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.311 -10.079 -0.212 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -0.928 -11.734 -0.222 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -2.452 -11.512 2.934 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.121 -12.533 1.531 1.00 0.00 H new ATOM 115 N LYS A 7 0.938 -8.947 6.140 1.00 0.00 N ATOM 116 CA LYS A 7 1.998 -9.068 7.134 1.00 0.00 C ATOM 117 C LYS A 7 3.268 -8.503 6.501 1.00 0.00 C ATOM 118 O LYS A 7 3.372 -8.487 5.271 1.00 0.00 O ATOM 119 CB LYS A 7 2.200 -10.542 7.510 1.00 0.00 C ATOM 120 CG LYS A 7 2.242 -10.785 9.020 1.00 0.00 C ATOM 121 CD LYS A 7 0.880 -10.527 9.673 1.00 0.00 C ATOM 122 CE LYS A 7 0.914 -10.869 11.165 1.00 0.00 C ATOM 123 NZ LYS A 7 1.124 -12.308 11.398 1.00 0.00 N ATOM 0 H LYS A 7 0.735 -9.814 5.643 1.00 0.00 H new ATOM 0 HA LYS A 7 1.745 -8.525 8.045 1.00 0.00 H new ATOM 0 HB2 LYS A 7 1.393 -11.133 7.077 1.00 0.00 H new ATOM 0 HB3 LYS A 7 3.130 -10.898 7.066 1.00 0.00 H new ATOM 0 HG2 LYS A 7 2.550 -11.812 9.215 1.00 0.00 H new ATOM 0 HG3 LYS A 7 2.992 -10.136 9.473 1.00 0.00 H new ATOM 0 HD2 LYS A 7 0.602 -9.481 9.542 1.00 0.00 H new ATOM 0 HD3 LYS A 7 0.115 -11.125 9.176 1.00 0.00 H new ATOM 0 HE2 LYS A 7 1.711 -10.304 11.648 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -0.023 -10.560 11.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 0.907 -12.534 12.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 0.499 -12.856 10.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 2.115 -12.551 11.197 1.00 0.00 H new ATOM 137 N VAL A 8 4.240 -8.046 7.295 1.00 0.00 N ATOM 138 CA VAL A 8 5.468 -7.532 6.698 1.00 0.00 C ATOM 139 C VAL A 8 6.132 -8.608 5.837 1.00 0.00 C ATOM 140 O VAL A 8 6.298 -9.745 6.277 1.00 0.00 O ATOM 141 CB VAL A 8 6.426 -6.962 7.753 1.00 0.00 C ATOM 142 CG1 VAL A 8 5.719 -5.879 8.570 1.00 0.00 C ATOM 143 CG2 VAL A 8 6.967 -8.022 8.709 1.00 0.00 C ATOM 0 H VAL A 8 4.203 -8.022 8.314 1.00 0.00 H new ATOM 0 HA VAL A 8 5.204 -6.698 6.048 1.00 0.00 H new ATOM 0 HB VAL A 8 7.273 -6.548 7.206 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.406 -5.480 9.316 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.396 -5.076 7.907 1.00 0.00 H new ATOM 0 HG13 VAL A 8 4.850 -6.309 9.069 1.00 0.00 H new ATOM 0 HG21 VAL A 8 7.638 -7.554 9.430 1.00 0.00 H new ATOM 0 HG22 VAL A 8 6.138 -8.492 9.237 1.00 0.00 H new ATOM 0 HG23 VAL A 8 7.512 -8.778 8.144 1.00 0.00 H new ATOM 153 N GLY A 9 6.507 -8.238 4.607 1.00 0.00 N ATOM 154 CA GLY A 9 7.151 -9.143 3.661 1.00 0.00 C ATOM 155 C GLY A 9 6.213 -9.570 2.532 1.00 0.00 C ATOM 156 O GLY A 9 6.677 -10.099 1.524 1.00 0.00 O ATOM 0 H GLY A 9 6.369 -7.295 4.242 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.028 -8.656 3.236 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.503 -10.028 4.191 1.00 0.00 H new ATOM 160 N GLU A 10 4.902 -9.345 2.676 1.00 0.00 N ATOM 161 CA GLU A 10 3.926 -9.707 1.655 1.00 0.00 C ATOM 162 C GLU A 10 3.765 -8.578 0.635 1.00 0.00 C ATOM 163 O GLU A 10 4.424 -7.543 0.743 1.00 0.00 O ATOM 164 CB GLU A 10 2.585 -10.051 2.314 1.00 0.00 C ATOM 165 CG GLU A 10 2.736 -11.264 3.234 1.00 0.00 C ATOM 166 CD GLU A 10 1.381 -11.763 3.735 1.00 0.00 C ATOM 167 OE1 GLU A 10 0.591 -10.927 4.223 1.00 0.00 O ATOM 168 OE2 GLU A 10 1.142 -12.988 3.624 1.00 0.00 O ATOM 0 H GLU A 10 4.494 -8.908 3.502 1.00 0.00 H new ATOM 0 HA GLU A 10 4.284 -10.586 1.120 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.224 -9.196 2.886 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.839 -10.259 1.547 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.244 -12.066 2.699 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.364 -11.000 4.085 1.00 0.00 H new ATOM 175 N SER A 11 2.892 -8.766 -0.365 1.00 0.00 N ATOM 176 CA SER A 11 2.746 -7.812 -1.458 1.00 0.00 C ATOM 177 C SER A 11 1.293 -7.652 -1.913 1.00 0.00 C ATOM 178 O SER A 11 0.423 -8.444 -1.547 1.00 0.00 O ATOM 179 CB SER A 11 3.605 -8.267 -2.643 1.00 0.00 C ATOM 180 OG SER A 11 4.974 -8.253 -2.301 1.00 0.00 O ATOM 0 H SER A 11 2.276 -9.576 -0.433 1.00 0.00 H new ATOM 0 HA SER A 11 3.077 -6.841 -1.090 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.311 -9.272 -2.947 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.432 -7.612 -3.497 1.00 0.00 H new ATOM 0 HG SER A 11 5.506 -8.548 -3.069 1.00 0.00 H new ATOM 186 N ILE A 12 1.057 -6.609 -2.717 1.00 0.00 N ATOM 187 CA ILE A 12 -0.241 -6.186 -3.231 1.00 0.00 C ATOM 188 C ILE A 12 -0.030 -5.694 -4.669 1.00 0.00 C ATOM 189 O ILE A 12 1.103 -5.454 -5.075 1.00 0.00 O ATOM 190 CB ILE A 12 -0.785 -5.064 -2.324 1.00 0.00 C ATOM 191 CG1 ILE A 12 -1.060 -5.560 -0.897 1.00 0.00 C ATOM 192 CG2 ILE A 12 -2.052 -4.417 -2.889 1.00 0.00 C ATOM 193 CD1 ILE A 12 -2.208 -6.566 -0.820 1.00 0.00 C ATOM 0 H ILE A 12 1.813 -6.006 -3.042 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.965 -7.000 -3.235 1.00 0.00 H new ATOM 0 HB ILE A 12 0.001 -4.309 -2.290 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -0.156 -6.019 -0.498 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.291 -4.706 -0.260 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.393 -3.634 -2.212 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.835 -3.984 -3.865 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.831 -5.172 -2.992 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.351 -6.877 0.215 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.123 -6.103 -1.189 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.970 -7.437 -1.431 1.00 0.00 H new ATOM 205 N ASN A 13 -1.104 -5.541 -5.452 1.00 0.00 N ATOM 206 CA ASN A 13 -1.000 -5.136 -6.850 1.00 0.00 C ATOM 207 C ASN A 13 -2.080 -4.133 -7.240 1.00 0.00 C ATOM 208 O ASN A 13 -3.155 -4.096 -6.648 1.00 0.00 O ATOM 209 CB ASN A 13 -1.103 -6.377 -7.740 1.00 0.00 C ATOM 210 CG ASN A 13 0.255 -7.045 -7.890 1.00 0.00 C ATOM 211 OD1 ASN A 13 0.531 -8.063 -7.262 1.00 0.00 O ATOM 212 ND2 ASN A 13 1.109 -6.471 -8.729 1.00 0.00 N ATOM 0 H ASN A 13 -2.061 -5.694 -5.133 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.036 -4.646 -6.987 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.815 -7.081 -7.309 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.486 -6.096 -8.721 1.00 0.00 H new ATOM 0 HD21 ASN A 13 2.034 -6.876 -8.871 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.840 -5.625 -9.232 1.00 0.00 H new ATOM 219 N ILE A 14 -1.767 -3.319 -8.253 1.00 0.00 N ATOM 220 CA ILE A 14 -2.655 -2.290 -8.774 1.00 0.00 C ATOM 221 C ILE A 14 -2.481 -2.233 -10.291 1.00 0.00 C ATOM 222 O ILE A 14 -1.375 -2.408 -10.802 1.00 0.00 O ATOM 223 CB ILE A 14 -2.331 -0.933 -8.133 1.00 0.00 C ATOM 224 CG1 ILE A 14 -2.417 -1.025 -6.604 1.00 0.00 C ATOM 225 CG2 ILE A 14 -3.302 0.132 -8.654 1.00 0.00 C ATOM 226 CD1 ILE A 14 -2.074 0.299 -5.920 1.00 0.00 C ATOM 0 H ILE A 14 -0.871 -3.362 -8.739 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.691 -2.527 -8.533 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.313 -0.652 -8.403 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.424 -1.329 -6.317 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.737 -1.800 -6.251 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -3.068 1.093 -8.196 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.206 0.213 -9.737 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.323 -0.152 -8.400 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.150 0.180 -4.839 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -1.057 0.592 -6.183 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.770 1.070 -6.250 1.00 0.00 H new ATOM 238 N GLY A 15 -3.576 -1.981 -11.014 1.00 0.00 N ATOM 239 CA GLY A 15 -3.558 -1.942 -12.465 1.00 0.00 C ATOM 240 C GLY A 15 -2.964 -3.230 -13.022 1.00 0.00 C ATOM 241 O GLY A 15 -3.208 -4.318 -12.498 1.00 0.00 O ATOM 0 H GLY A 15 -4.493 -1.800 -10.605 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -4.571 -1.807 -12.844 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -2.974 -1.087 -12.805 1.00 0.00 H new ATOM 245 N ASP A 16 -2.183 -3.099 -14.091 1.00 0.00 N ATOM 246 CA ASP A 16 -1.474 -4.213 -14.712 1.00 0.00 C ATOM 247 C ASP A 16 -0.001 -3.854 -14.911 1.00 0.00 C ATOM 248 O ASP A 16 0.720 -4.558 -15.615 1.00 0.00 O ATOM 249 CB ASP A 16 -2.167 -4.631 -16.014 1.00 0.00 C ATOM 250 CG ASP A 16 -2.138 -3.538 -17.080 1.00 0.00 C ATOM 251 OD1 ASP A 16 -2.759 -2.477 -16.840 1.00 0.00 O ATOM 252 OD2 ASP A 16 -1.499 -3.775 -18.127 1.00 0.00 O ATOM 0 H ASP A 16 -2.023 -2.205 -14.556 1.00 0.00 H new ATOM 0 HA ASP A 16 -1.504 -5.079 -14.051 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.684 -5.526 -16.406 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -3.203 -4.895 -15.800 1.00 0.00 H new ATOM 257 N ASP A 17 0.438 -2.756 -14.286 1.00 0.00 N ATOM 258 CA ASP A 17 1.803 -2.260 -14.381 1.00 0.00 C ATOM 259 C ASP A 17 2.333 -1.792 -13.023 1.00 0.00 C ATOM 260 O ASP A 17 3.418 -1.215 -12.969 1.00 0.00 O ATOM 261 CB ASP A 17 1.875 -1.111 -15.393 1.00 0.00 C ATOM 262 CG ASP A 17 1.565 -1.568 -16.816 1.00 0.00 C ATOM 263 OD1 ASP A 17 2.389 -2.325 -17.380 1.00 0.00 O ATOM 264 OD2 ASP A 17 0.504 -1.154 -17.333 1.00 0.00 O ATOM 0 H ASP A 17 -0.160 -2.182 -13.692 1.00 0.00 H new ATOM 0 HA ASP A 17 2.431 -3.084 -14.718 1.00 0.00 H new ATOM 0 HB2 ASP A 17 1.171 -0.331 -15.103 1.00 0.00 H new ATOM 0 HB3 ASP A 17 2.871 -0.668 -15.365 1.00 0.00 H new ATOM 269 N ILE A 18 1.600 -2.017 -11.924 1.00 0.00 N ATOM 270 CA ILE A 18 2.058 -1.567 -10.612 1.00 0.00 C ATOM 271 C ILE A 18 1.990 -2.703 -9.591 1.00 0.00 C ATOM 272 O ILE A 18 1.105 -3.558 -9.635 1.00 0.00 O ATOM 273 CB ILE A 18 1.240 -0.354 -10.134 1.00 0.00 C ATOM 274 CG1 ILE A 18 1.305 0.824 -11.119 1.00 0.00 C ATOM 275 CG2 ILE A 18 1.780 0.136 -8.785 1.00 0.00 C ATOM 276 CD1 ILE A 18 0.187 0.753 -12.163 1.00 0.00 C ATOM 0 H ILE A 18 0.702 -2.501 -11.920 1.00 0.00 H new ATOM 0 HA ILE A 18 3.099 -1.259 -10.706 1.00 0.00 H new ATOM 0 HB ILE A 18 0.205 -0.687 -10.054 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.230 1.762 -10.569 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.272 0.825 -11.621 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.198 0.995 -8.450 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.702 -0.664 -8.049 1.00 0.00 H new ATOM 0 HG23 ILE A 18 2.825 0.426 -8.895 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.267 1.603 -12.841 1.00 0.00 H new ATOM 0 HD12 ILE A 18 0.277 -0.173 -12.730 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.781 0.779 -11.662 1.00 0.00 H new ATOM 288 N THR A 19 2.946 -2.696 -8.659 1.00 0.00 N ATOM 289 CA THR A 19 3.034 -3.656 -7.569 1.00 0.00 C ATOM 290 C THR A 19 3.432 -2.904 -6.303 1.00 0.00 C ATOM 291 O THR A 19 4.023 -1.828 -6.378 1.00 0.00 O ATOM 292 CB THR A 19 4.063 -4.740 -7.914 1.00 0.00 C ATOM 293 OG1 THR A 19 3.748 -5.327 -9.160 1.00 0.00 O ATOM 294 CG2 THR A 19 4.094 -5.846 -6.862 1.00 0.00 C ATOM 0 H THR A 19 3.695 -2.004 -8.646 1.00 0.00 H new ATOM 0 HA THR A 19 2.074 -4.147 -7.410 1.00 0.00 H new ATOM 0 HB THR A 19 5.039 -4.256 -7.950 1.00 0.00 H new ATOM 0 HG1 THR A 19 4.410 -6.017 -9.373 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.835 -6.594 -7.143 1.00 0.00 H new ATOM 0 HG22 THR A 19 4.357 -5.420 -5.894 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.112 -6.314 -6.797 1.00 0.00 H new ATOM 302 N ILE A 20 3.111 -3.470 -5.138 1.00 0.00 N ATOM 303 CA ILE A 20 3.363 -2.861 -3.845 1.00 0.00 C ATOM 304 C ILE A 20 3.882 -3.940 -2.904 1.00 0.00 C ATOM 305 O ILE A 20 3.490 -5.102 -3.030 1.00 0.00 O ATOM 306 CB ILE A 20 2.054 -2.274 -3.299 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.417 -1.244 -4.243 1.00 0.00 C ATOM 308 CG2 ILE A 20 2.274 -1.653 -1.917 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.232 0.046 -4.342 1.00 0.00 C ATOM 0 H ILE A 20 2.660 -4.383 -5.073 1.00 0.00 H new ATOM 0 HA ILE A 20 4.098 -2.061 -3.934 1.00 0.00 H new ATOM 0 HB ILE A 20 1.356 -3.107 -3.218 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.314 -1.682 -5.236 1.00 0.00 H new ATOM 0 HG13 ILE A 20 0.412 -1.008 -3.893 1.00 0.00 H new ATOM 0 HG21 ILE A 20 1.334 -1.243 -1.549 1.00 0.00 H new ATOM 0 HG22 ILE A 20 2.631 -2.418 -1.227 1.00 0.00 H new ATOM 0 HG23 ILE A 20 3.014 -0.856 -1.990 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.736 0.738 -5.022 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.313 0.502 -3.355 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.229 -0.182 -4.719 1.00 0.00 H new ATOM 321 N THR A 21 4.751 -3.572 -1.962 1.00 0.00 N ATOM 322 CA THR A 21 5.306 -4.517 -1.005 1.00 0.00 C ATOM 323 C THR A 21 5.471 -3.842 0.350 1.00 0.00 C ATOM 324 O THR A 21 6.085 -2.784 0.446 1.00 0.00 O ATOM 325 CB THR A 21 6.662 -5.020 -1.506 1.00 0.00 C ATOM 326 OG1 THR A 21 6.525 -5.603 -2.783 1.00 0.00 O ATOM 327 CG2 THR A 21 7.243 -6.069 -0.558 1.00 0.00 C ATOM 0 H THR A 21 5.085 -2.616 -1.845 1.00 0.00 H new ATOM 0 HA THR A 21 4.627 -5.363 -0.899 1.00 0.00 H new ATOM 0 HB THR A 21 7.333 -4.162 -1.553 1.00 0.00 H new ATOM 0 HG1 THR A 21 6.041 -6.452 -2.705 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.206 -6.409 -0.938 1.00 0.00 H new ATOM 0 HG22 THR A 21 7.377 -5.631 0.431 1.00 0.00 H new ATOM 0 HG23 THR A 21 6.560 -6.916 -0.490 1.00 0.00 H new ATOM 335 N ILE A 22 4.921 -4.456 1.399 1.00 0.00 N ATOM 336 CA ILE A 22 5.071 -3.962 2.759 1.00 0.00 C ATOM 337 C ILE A 22 6.444 -4.392 3.276 1.00 0.00 C ATOM 338 O ILE A 22 6.619 -5.507 3.768 1.00 0.00 O ATOM 339 CB ILE A 22 3.902 -4.439 3.638 1.00 0.00 C ATOM 340 CG1 ILE A 22 4.168 -4.178 5.125 1.00 0.00 C ATOM 341 CG2 ILE A 22 3.584 -5.924 3.457 1.00 0.00 C ATOM 342 CD1 ILE A 22 4.454 -2.702 5.391 1.00 0.00 C ATOM 0 H ILE A 22 4.362 -5.306 1.325 1.00 0.00 H new ATOM 0 HA ILE A 22 5.030 -2.873 2.789 1.00 0.00 H new ATOM 0 HB ILE A 22 3.042 -3.857 3.306 1.00 0.00 H new ATOM 0 HG12 ILE A 22 3.305 -4.494 5.711 1.00 0.00 H new ATOM 0 HG13 ILE A 22 5.015 -4.779 5.455 1.00 0.00 H new ATOM 0 HG21 ILE A 22 2.751 -6.199 4.104 1.00 0.00 H new ATOM 0 HG22 ILE A 22 3.315 -6.115 2.418 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.459 -6.518 3.720 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.638 -2.553 6.455 1.00 0.00 H new ATOM 0 HD12 ILE A 22 5.332 -2.394 4.824 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.596 -2.104 5.084 1.00 0.00 H new ATOM 354 N LEU A 23 7.424 -3.498 3.164 1.00 0.00 N ATOM 355 CA LEU A 23 8.797 -3.805 3.531 1.00 0.00 C ATOM 356 C LEU A 23 8.934 -3.972 5.042 1.00 0.00 C ATOM 357 O LEU A 23 9.784 -4.735 5.497 1.00 0.00 O ATOM 358 CB LEU A 23 9.721 -2.695 3.028 1.00 0.00 C ATOM 359 CG LEU A 23 9.557 -2.435 1.528 1.00 0.00 C ATOM 360 CD1 LEU A 23 10.497 -1.313 1.102 1.00 0.00 C ATOM 361 CD2 LEU A 23 9.883 -3.672 0.699 1.00 0.00 C ATOM 0 H LEU A 23 7.287 -2.548 2.818 1.00 0.00 H new ATOM 0 HA LEU A 23 9.082 -4.748 3.065 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.514 -1.777 3.578 1.00 0.00 H new ATOM 0 HB3 LEU A 23 10.756 -2.965 3.236 1.00 0.00 H new ATOM 0 HG LEU A 23 8.516 -2.163 1.354 1.00 0.00 H new ATOM 0 HD11 LEU A 23 10.381 -1.127 0.034 1.00 0.00 H new ATOM 0 HD12 LEU A 23 10.256 -0.406 1.657 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.527 -1.603 1.310 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.754 -3.445 -0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.915 -3.972 0.883 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.214 -4.485 0.980 1.00 0.00 H new ATOM 373 N GLY A 24 8.111 -3.268 5.831 1.00 0.00 N ATOM 374 CA GLY A 24 8.101 -3.471 7.276 1.00 0.00 C ATOM 375 C GLY A 24 7.511 -2.288 8.030 1.00 0.00 C ATOM 376 O GLY A 24 6.977 -1.363 7.421 1.00 0.00 O ATOM 0 H GLY A 24 7.454 -2.564 5.494 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.527 -4.368 7.509 1.00 0.00 H new ATOM 0 HA3 GLY A 24 9.120 -3.646 7.622 1.00 0.00 H new ATOM 380 N VAL A 25 7.613 -2.320 9.362 1.00 0.00 N ATOM 381 CA VAL A 25 7.111 -1.249 10.220 1.00 0.00 C ATOM 382 C VAL A 25 8.154 -0.877 11.271 1.00 0.00 C ATOM 383 O VAL A 25 9.093 -1.630 11.527 1.00 0.00 O ATOM 384 CB VAL A 25 5.784 -1.643 10.893 1.00 0.00 C ATOM 385 CG1 VAL A 25 4.800 -2.234 9.882 1.00 0.00 C ATOM 386 CG2 VAL A 25 5.999 -2.660 12.011 1.00 0.00 C ATOM 0 H VAL A 25 8.046 -3.089 9.873 1.00 0.00 H new ATOM 0 HA VAL A 25 6.919 -0.379 9.592 1.00 0.00 H new ATOM 0 HB VAL A 25 5.370 -0.727 11.314 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.873 -2.502 10.390 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.589 -1.498 9.106 1.00 0.00 H new ATOM 0 HG13 VAL A 25 5.235 -3.124 9.428 1.00 0.00 H new ATOM 0 HG21 VAL A 25 5.040 -2.913 12.462 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.456 -3.560 11.601 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.655 -2.233 12.770 1.00 0.00 H new ATOM 396 N SER A 26 7.969 0.296 11.875 1.00 0.00 N ATOM 397 CA SER A 26 8.825 0.833 12.922 1.00 0.00 C ATOM 398 C SER A 26 7.930 1.633 13.860 1.00 0.00 C ATOM 399 O SER A 26 7.871 2.860 13.782 1.00 0.00 O ATOM 400 CB SER A 26 9.924 1.718 12.335 1.00 0.00 C ATOM 401 OG SER A 26 10.757 0.970 11.476 1.00 0.00 O ATOM 0 H SER A 26 7.194 0.915 11.639 1.00 0.00 H new ATOM 0 HA SER A 26 9.326 0.026 13.457 1.00 0.00 H new ATOM 0 HB2 SER A 26 9.477 2.547 11.786 1.00 0.00 H new ATOM 0 HB3 SER A 26 10.518 2.152 13.140 1.00 0.00 H new ATOM 0 HG SER A 26 11.454 1.552 11.108 1.00 0.00 H new ATOM 407 N GLY A 27 7.225 0.928 14.743 1.00 0.00 N ATOM 408 CA GLY A 27 6.213 1.545 15.577 1.00 0.00 C ATOM 409 C GLY A 27 4.982 1.779 14.720 1.00 0.00 C ATOM 410 O GLY A 27 4.352 0.823 14.269 1.00 0.00 O ATOM 0 H GLY A 27 7.342 -0.074 14.894 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.972 0.902 16.424 1.00 0.00 H new ATOM 0 HA3 GLY A 27 6.578 2.487 15.986 1.00 0.00 H new ATOM 414 N GLN A 28 4.636 3.046 14.492 1.00 0.00 N ATOM 415 CA GLN A 28 3.504 3.408 13.652 1.00 0.00 C ATOM 416 C GLN A 28 3.985 3.827 12.269 1.00 0.00 C ATOM 417 O GLN A 28 3.171 4.124 11.401 1.00 0.00 O ATOM 418 CB GLN A 28 2.698 4.514 14.335 1.00 0.00 C ATOM 419 CG GLN A 28 1.602 3.914 15.215 1.00 0.00 C ATOM 420 CD GLN A 28 2.132 2.779 16.086 1.00 0.00 C ATOM 421 OE1 GLN A 28 2.783 3.009 17.103 1.00 0.00 O ATOM 422 NE2 GLN A 28 1.855 1.541 15.685 1.00 0.00 N ATOM 0 H GLN A 28 5.133 3.845 14.885 1.00 0.00 H new ATOM 0 HA GLN A 28 2.852 2.545 13.519 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.360 5.133 14.940 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.253 5.165 13.583 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.179 4.692 15.850 1.00 0.00 H new ATOM 0 HG3 GLN A 28 0.794 3.542 14.586 1.00 0.00 H new ATOM 0 HE21 GLN A 28 1.312 1.390 14.835 1.00 0.00 H new ATOM 0 HE22 GLN A 28 2.186 0.743 16.227 1.00 0.00 H new ATOM 431 N GLN A 29 5.303 3.848 12.059 1.00 0.00 N ATOM 432 CA GLN A 29 5.865 4.082 10.743 1.00 0.00 C ATOM 433 C GLN A 29 5.773 2.791 9.943 1.00 0.00 C ATOM 434 O GLN A 29 5.762 1.703 10.513 1.00 0.00 O ATOM 435 CB GLN A 29 7.325 4.502 10.868 1.00 0.00 C ATOM 436 CG GLN A 29 7.405 5.927 11.406 1.00 0.00 C ATOM 437 CD GLN A 29 8.813 6.317 11.798 1.00 0.00 C ATOM 438 OE1 GLN A 29 9.814 5.707 11.174 1.00 0.00 O flip ATOM 439 NE2 GLN A 29 8.993 7.169 12.661 1.00 0.00 N flip ATOM 0 H GLN A 29 5.997 3.704 12.792 1.00 0.00 H new ATOM 0 HA GLN A 29 5.313 4.877 10.241 1.00 0.00 H new ATOM 0 HB2 GLN A 29 7.854 3.821 11.535 1.00 0.00 H new ATOM 0 HB3 GLN A 29 7.815 4.442 9.896 1.00 0.00 H new ATOM 0 HG2 GLN A 29 7.036 6.619 10.649 1.00 0.00 H new ATOM 0 HG3 GLN A 29 6.750 6.023 12.272 1.00 0.00 H new ATOM 0 HE21 GLN A 29 8.194 7.612 13.115 1.00 0.00 H new ATOM 0 HE22 GLN A 29 9.942 7.435 12.925 1.00 0.00 H new ATOM 448 N VAL A 30 5.711 2.913 8.619 1.00 0.00 N ATOM 449 CA VAL A 30 5.612 1.769 7.741 1.00 0.00 C ATOM 450 C VAL A 30 6.453 2.031 6.501 1.00 0.00 C ATOM 451 O VAL A 30 6.187 2.985 5.774 1.00 0.00 O ATOM 452 CB VAL A 30 4.142 1.564 7.349 1.00 0.00 C ATOM 453 CG1 VAL A 30 4.008 0.306 6.498 1.00 0.00 C ATOM 454 CG2 VAL A 30 3.243 1.414 8.579 1.00 0.00 C ATOM 0 H VAL A 30 5.729 3.810 8.134 1.00 0.00 H new ATOM 0 HA VAL A 30 5.975 0.872 8.242 1.00 0.00 H new ATOM 0 HB VAL A 30 3.827 2.445 6.790 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.963 0.163 6.221 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.611 0.411 5.596 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.354 -0.557 7.067 1.00 0.00 H new ATOM 0 HG21 VAL A 30 2.211 1.271 8.260 1.00 0.00 H new ATOM 0 HG22 VAL A 30 3.565 0.552 9.162 1.00 0.00 H new ATOM 0 HG23 VAL A 30 3.312 2.313 9.192 1.00 0.00 H new ATOM 464 N ARG A 31 7.464 1.191 6.261 1.00 0.00 N ATOM 465 CA ARG A 31 8.194 1.217 5.003 1.00 0.00 C ATOM 466 C ARG A 31 7.334 0.514 3.971 1.00 0.00 C ATOM 467 O ARG A 31 7.034 -0.675 4.117 1.00 0.00 O ATOM 468 CB ARG A 31 9.524 0.470 5.100 1.00 0.00 C ATOM 469 CG ARG A 31 10.659 1.319 5.665 1.00 0.00 C ATOM 470 CD ARG A 31 11.977 0.593 5.380 1.00 0.00 C ATOM 471 NE ARG A 31 13.134 1.326 5.907 1.00 0.00 N ATOM 472 CZ ARG A 31 13.487 1.371 7.194 1.00 0.00 C ATOM 473 NH1 ARG A 31 12.813 0.694 8.117 1.00 0.00 N ATOM 474 NH2 ARG A 31 14.531 2.104 7.567 1.00 0.00 N ATOM 0 H ARG A 31 7.791 0.488 6.924 1.00 0.00 H new ATOM 0 HA ARG A 31 8.406 2.253 4.739 1.00 0.00 H new ATOM 0 HB2 ARG A 31 9.392 -0.411 5.729 1.00 0.00 H new ATOM 0 HB3 ARG A 31 9.805 0.115 4.109 1.00 0.00 H new ATOM 0 HG2 ARG A 31 10.661 2.308 5.206 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.528 1.466 6.737 1.00 0.00 H new ATOM 0 HD2 ARG A 31 11.946 -0.402 5.823 1.00 0.00 H new ATOM 0 HD3 ARG A 31 12.092 0.459 4.304 1.00 0.00 H new ATOM 0 HE ARG A 31 13.711 1.839 5.241 1.00 0.00 H new ATOM 0 HH11 ARG A 31 12.009 0.126 7.848 1.00 0.00 H new ATOM 0 HH12 ARG A 31 13.099 0.742 9.095 1.00 0.00 H new ATOM 0 HH21 ARG A 31 15.060 2.630 6.871 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.804 2.141 8.549 1.00 0.00 H new ATOM 488 N ILE A 32 6.949 1.251 2.934 1.00 0.00 N ATOM 489 CA ILE A 32 6.136 0.730 1.855 1.00 0.00 C ATOM 490 C ILE A 32 6.915 0.897 0.564 1.00 0.00 C ATOM 491 O ILE A 32 7.288 2.011 0.199 1.00 0.00 O ATOM 492 CB ILE A 32 4.796 1.472 1.791 1.00 0.00 C ATOM 493 CG1 ILE A 32 4.165 1.591 3.183 1.00 0.00 C ATOM 494 CG2 ILE A 32 3.880 0.722 0.820 1.00 0.00 C ATOM 495 CD1 ILE A 32 2.760 2.194 3.141 1.00 0.00 C ATOM 0 H ILE A 32 7.198 2.234 2.824 1.00 0.00 H new ATOM 0 HA ILE A 32 5.914 -0.325 2.018 1.00 0.00 H new ATOM 0 HB ILE A 32 4.950 2.490 1.433 1.00 0.00 H new ATOM 0 HG12 ILE A 32 4.119 0.604 3.643 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.803 2.208 3.816 1.00 0.00 H new ATOM 0 HG21 ILE A 32 2.919 1.233 0.758 1.00 0.00 H new ATOM 0 HG22 ILE A 32 4.341 0.695 -0.168 1.00 0.00 H new ATOM 0 HG23 ILE A 32 3.727 -0.297 1.177 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.360 2.255 4.153 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.806 3.193 2.708 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.112 1.564 2.532 1.00 0.00 H new ATOM 507 N GLY A 33 7.164 -0.212 -0.136 1.00 0.00 N ATOM 508 CA GLY A 33 7.878 -0.185 -1.395 1.00 0.00 C ATOM 509 C GLY A 33 6.877 -0.172 -2.538 1.00 0.00 C ATOM 510 O GLY A 33 5.783 -0.723 -2.415 1.00 0.00 O ATOM 0 H GLY A 33 6.874 -1.144 0.160 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.517 0.697 -1.445 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.529 -1.055 -1.476 1.00 0.00 H new ATOM 514 N ILE A 34 7.250 0.461 -3.648 1.00 0.00 N ATOM 515 CA ILE A 34 6.380 0.560 -4.804 1.00 0.00 C ATOM 516 C ILE A 34 7.192 0.210 -6.041 1.00 0.00 C ATOM 517 O ILE A 34 8.380 0.526 -6.117 1.00 0.00 O ATOM 518 CB ILE A 34 5.783 1.974 -4.888 1.00 0.00 C ATOM 519 CG1 ILE A 34 5.069 2.311 -3.572 1.00 0.00 C ATOM 520 CG2 ILE A 34 4.813 2.062 -6.072 1.00 0.00 C ATOM 521 CD1 ILE A 34 4.548 3.744 -3.547 1.00 0.00 C ATOM 0 H ILE A 34 8.156 0.914 -3.765 1.00 0.00 H new ATOM 0 HA ILE A 34 5.545 -0.136 -4.724 1.00 0.00 H new ATOM 0 HB ILE A 34 6.582 2.698 -5.046 1.00 0.00 H new ATOM 0 HG12 ILE A 34 4.237 1.622 -3.426 1.00 0.00 H new ATOM 0 HG13 ILE A 34 5.757 2.162 -2.740 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.394 3.067 -6.125 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.347 1.842 -6.997 1.00 0.00 H new ATOM 0 HG23 ILE A 34 4.008 1.340 -5.937 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.051 3.934 -2.596 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.382 4.436 -3.665 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.839 3.887 -4.362 1.00 0.00 H new ATOM 533 N ASN A 35 6.552 -0.440 -7.010 1.00 0.00 N ATOM 534 CA ASN A 35 7.223 -0.891 -8.212 1.00 0.00 C ATOM 535 C ASN A 35 6.329 -0.608 -9.414 1.00 0.00 C ATOM 536 O ASN A 35 5.356 -1.316 -9.665 1.00 0.00 O ATOM 537 CB ASN A 35 7.552 -2.381 -8.069 1.00 0.00 C ATOM 538 CG ASN A 35 8.441 -2.886 -9.195 1.00 0.00 C ATOM 539 OD1 ASN A 35 8.752 -2.164 -10.134 1.00 0.00 O ATOM 540 ND2 ASN A 35 8.854 -4.147 -9.103 1.00 0.00 N ATOM 0 H ASN A 35 5.558 -0.665 -6.978 1.00 0.00 H new ATOM 0 HA ASN A 35 8.161 -0.357 -8.363 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.048 -2.551 -7.113 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.626 -2.956 -8.055 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.450 -4.543 -9.830 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.574 -4.718 -8.306 1.00 0.00 H new ATOM 547 N ALA A 36 6.680 0.449 -10.144 1.00 0.00 N ATOM 548 CA ALA A 36 5.951 0.902 -11.312 1.00 0.00 C ATOM 549 C ALA A 36 6.943 1.437 -12.346 1.00 0.00 C ATOM 550 O ALA A 36 8.045 1.843 -11.976 1.00 0.00 O ATOM 551 CB ALA A 36 4.980 2.004 -10.865 1.00 0.00 C ATOM 0 H ALA A 36 7.497 1.021 -9.930 1.00 0.00 H new ATOM 0 HA ALA A 36 5.390 0.086 -11.767 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.417 2.364 -11.726 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.290 1.602 -10.123 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.542 2.829 -10.428 1.00 0.00 H new ATOM 557 N PRO A 37 6.581 1.444 -13.636 1.00 0.00 N ATOM 558 CA PRO A 37 7.419 1.989 -14.687 1.00 0.00 C ATOM 559 C PRO A 37 7.484 3.508 -14.562 1.00 0.00 C ATOM 560 O PRO A 37 6.544 4.131 -14.070 1.00 0.00 O ATOM 561 CB PRO A 37 6.736 1.572 -15.989 1.00 0.00 C ATOM 562 CG PRO A 37 5.266 1.432 -15.605 1.00 0.00 C ATOM 563 CD PRO A 37 5.336 0.924 -14.172 1.00 0.00 C ATOM 0 HA PRO A 37 8.446 1.626 -14.640 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.875 2.319 -16.770 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.140 0.634 -16.370 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.739 2.384 -15.671 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.743 0.732 -16.257 1.00 0.00 H new ATOM 0 HD2 PRO A 37 4.483 1.272 -13.590 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.320 -0.165 -14.141 1.00 0.00 H new ATOM 571 N LYS A 38 8.589 4.112 -15.010 1.00 0.00 N ATOM 572 CA LYS A 38 8.717 5.565 -15.018 1.00 0.00 C ATOM 573 C LYS A 38 7.731 6.185 -16.009 1.00 0.00 C ATOM 574 O LYS A 38 7.666 7.404 -16.145 1.00 0.00 O ATOM 575 CB LYS A 38 10.167 5.956 -15.325 1.00 0.00 C ATOM 576 CG LYS A 38 11.106 5.493 -14.205 1.00 0.00 C ATOM 577 CD LYS A 38 10.934 6.330 -12.933 1.00 0.00 C ATOM 578 CE LYS A 38 11.781 7.601 -13.000 1.00 0.00 C ATOM 579 NZ LYS A 38 11.473 8.517 -11.885 1.00 0.00 N ATOM 0 H LYS A 38 9.404 3.615 -15.370 1.00 0.00 H new ATOM 0 HA LYS A 38 8.467 5.958 -14.032 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.476 5.511 -16.271 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.240 7.037 -15.442 1.00 0.00 H new ATOM 0 HG2 LYS A 38 10.912 4.445 -13.979 1.00 0.00 H new ATOM 0 HG3 LYS A 38 12.139 5.560 -14.547 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.884 6.594 -12.805 1.00 0.00 H new ATOM 0 HD3 LYS A 38 11.223 5.741 -12.063 1.00 0.00 H new ATOM 0 HE2 LYS A 38 12.838 7.337 -12.973 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.603 8.108 -13.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 12.065 9.368 -11.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.470 8.788 -11.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 11.666 8.041 -10.981 1.00 0.00 H new ATOM 593 N ASP A 39 6.966 5.334 -16.700 1.00 0.00 N ATOM 594 CA ASP A 39 5.875 5.738 -17.569 1.00 0.00 C ATOM 595 C ASP A 39 4.712 6.309 -16.753 1.00 0.00 C ATOM 596 O ASP A 39 3.783 6.884 -17.317 1.00 0.00 O ATOM 597 CB ASP A 39 5.407 4.514 -18.359 1.00 0.00 C ATOM 598 CG ASP A 39 4.455 4.901 -19.490 1.00 0.00 C ATOM 599 OD1 ASP A 39 4.878 5.698 -20.357 1.00 0.00 O ATOM 600 OD2 ASP A 39 3.311 4.393 -19.479 1.00 0.00 O ATOM 0 H ASP A 39 7.098 4.323 -16.664 1.00 0.00 H new ATOM 0 HA ASP A 39 6.222 6.517 -18.248 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.272 3.996 -18.773 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.908 3.816 -17.687 1.00 0.00 H new ATOM 605 N VAL A 40 4.764 6.153 -15.423 1.00 0.00 N ATOM 606 CA VAL A 40 3.749 6.651 -14.508 1.00 0.00 C ATOM 607 C VAL A 40 4.420 7.241 -13.271 1.00 0.00 C ATOM 608 O VAL A 40 5.580 6.940 -12.984 1.00 0.00 O ATOM 609 CB VAL A 40 2.761 5.540 -14.115 1.00 0.00 C ATOM 610 CG1 VAL A 40 2.136 4.900 -15.356 1.00 0.00 C ATOM 611 CG2 VAL A 40 3.428 4.441 -13.288 1.00 0.00 C ATOM 0 H VAL A 40 5.529 5.668 -14.953 1.00 0.00 H new ATOM 0 HA VAL A 40 3.179 7.432 -15.011 1.00 0.00 H new ATOM 0 HB VAL A 40 1.990 6.017 -13.510 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.441 4.117 -15.051 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.600 5.659 -15.926 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.921 4.467 -15.976 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.691 3.679 -13.034 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.234 3.989 -13.866 1.00 0.00 H new ATOM 0 HG23 VAL A 40 3.835 4.871 -12.373 1.00 0.00 H new ATOM 621 N ALA A 41 3.690 8.077 -12.531 1.00 0.00 N ATOM 622 CA ALA A 41 4.234 8.774 -11.378 1.00 0.00 C ATOM 623 C ALA A 41 3.862 8.084 -10.070 1.00 0.00 C ATOM 624 O ALA A 41 2.881 7.344 -10.002 1.00 0.00 O ATOM 625 CB ALA A 41 3.698 10.203 -11.389 1.00 0.00 C ATOM 0 H ALA A 41 2.709 8.285 -12.718 1.00 0.00 H new ATOM 0 HA ALA A 41 5.322 8.769 -11.442 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.094 10.747 -10.531 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.008 10.701 -12.308 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.609 10.184 -11.336 1.00 0.00 H new ATOM 631 N VAL A 42 4.653 8.330 -9.020 1.00 0.00 N ATOM 632 CA VAL A 42 4.345 7.865 -7.673 1.00 0.00 C ATOM 633 C VAL A 42 4.996 8.811 -6.666 1.00 0.00 C ATOM 634 O VAL A 42 6.165 9.153 -6.814 1.00 0.00 O ATOM 635 CB VAL A 42 4.830 6.416 -7.498 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.252 6.204 -8.015 1.00 0.00 C ATOM 637 CG2 VAL A 42 4.804 5.981 -6.040 1.00 0.00 C ATOM 0 H VAL A 42 5.524 8.857 -9.085 1.00 0.00 H new ATOM 0 HA VAL A 42 3.268 7.869 -7.503 1.00 0.00 H new ATOM 0 HB VAL A 42 4.136 5.815 -8.085 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.542 5.164 -7.866 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.292 6.443 -9.078 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.938 6.853 -7.471 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.154 4.952 -5.961 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.454 6.631 -5.455 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.785 6.048 -5.658 1.00 0.00 H new ATOM 647 N HIS A 43 4.245 9.237 -5.642 1.00 0.00 N ATOM 648 CA HIS A 43 4.739 10.200 -4.660 1.00 0.00 C ATOM 649 C HIS A 43 3.976 10.105 -3.346 1.00 0.00 C ATOM 650 O HIS A 43 2.930 9.460 -3.269 1.00 0.00 O ATOM 651 CB HIS A 43 4.538 11.624 -5.186 1.00 0.00 C ATOM 652 CG HIS A 43 5.125 11.881 -6.545 1.00 0.00 C ATOM 653 ND1 HIS A 43 6.456 12.215 -6.800 1.00 0.00 N ATOM 654 CD2 HIS A 43 4.435 11.821 -7.722 1.00 0.00 C ATOM 655 CE1 HIS A 43 6.536 12.351 -8.134 1.00 0.00 C ATOM 656 NE2 HIS A 43 5.341 12.122 -8.711 1.00 0.00 N ATOM 0 H HIS A 43 3.288 8.925 -5.475 1.00 0.00 H new ATOM 0 HA HIS A 43 5.792 9.974 -4.495 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.469 11.836 -5.221 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.979 12.324 -4.477 1.00 0.00 H new ATOM 0 HD1 HIS A 43 7.207 12.331 -6.119 1.00 0.00 H new ATOM 0 HD2 HIS A 43 3.389 11.585 -7.850 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.437 12.609 -8.671 1.00 0.00 H new ATOM 664 N ARG A 44 4.510 10.754 -2.308 1.00 0.00 N ATOM 665 CA ARG A 44 3.801 10.946 -1.051 1.00 0.00 C ATOM 666 C ARG A 44 2.672 11.944 -1.265 1.00 0.00 C ATOM 667 O ARG A 44 2.675 12.689 -2.241 1.00 0.00 O ATOM 668 CB ARG A 44 4.769 11.487 -0.001 1.00 0.00 C ATOM 669 CG ARG A 44 5.739 10.392 0.425 1.00 0.00 C ATOM 670 CD ARG A 44 6.874 10.990 1.251 1.00 0.00 C ATOM 671 NE ARG A 44 7.783 11.746 0.385 1.00 0.00 N ATOM 672 CZ ARG A 44 8.276 12.962 0.637 1.00 0.00 C ATOM 673 NH1 ARG A 44 7.934 13.643 1.726 1.00 0.00 N ATOM 674 NH2 ARG A 44 9.128 13.500 -0.223 1.00 0.00 N ATOM 0 H ARG A 44 5.446 11.159 -2.320 1.00 0.00 H new ATOM 0 HA ARG A 44 3.391 9.996 -0.709 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.320 12.336 -0.405 1.00 0.00 H new ATOM 0 HB3 ARG A 44 4.214 11.850 0.864 1.00 0.00 H new ATOM 0 HG2 ARG A 44 5.213 9.636 1.008 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.144 9.891 -0.455 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.467 11.643 2.023 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.421 10.196 1.761 1.00 0.00 H new ATOM 0 HE ARG A 44 8.065 11.304 -0.490 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.279 13.239 2.395 1.00 0.00 H new ATOM 0 HH12 ARG A 44 8.327 14.570 1.892 1.00 0.00 H new ATOM 0 HH21 ARG A 44 9.398 12.987 -1.062 1.00 0.00 H new ATOM 0 HH22 ARG A 44 9.514 14.427 -0.046 1.00 0.00 H new ATOM 688 N GLU A 45 1.705 11.971 -0.352 1.00 0.00 N ATOM 689 CA GLU A 45 0.575 12.882 -0.457 1.00 0.00 C ATOM 690 C GLU A 45 1.033 14.333 -0.286 1.00 0.00 C ATOM 691 O GLU A 45 0.366 15.254 -0.755 1.00 0.00 O ATOM 692 CB GLU A 45 -0.470 12.461 0.582 1.00 0.00 C ATOM 693 CG GLU A 45 -1.818 13.165 0.400 1.00 0.00 C ATOM 694 CD GLU A 45 -1.906 14.523 1.092 1.00 0.00 C ATOM 695 OE1 GLU A 45 -1.004 14.847 1.896 1.00 0.00 O ATOM 696 OE2 GLU A 45 -2.892 15.236 0.806 1.00 0.00 O ATOM 0 H GLU A 45 1.684 11.369 0.471 1.00 0.00 H new ATOM 0 HA GLU A 45 0.123 12.828 -1.447 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -0.619 11.383 0.522 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.087 12.675 1.580 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.006 13.298 -0.665 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.608 12.520 0.785 1.00 0.00 H new ATOM 703 N GLU A 46 2.173 14.550 0.381 1.00 0.00 N ATOM 704 CA GLU A 46 2.721 15.887 0.598 1.00 0.00 C ATOM 705 C GLU A 46 3.561 16.362 -0.592 1.00 0.00 C ATOM 706 O GLU A 46 4.006 17.509 -0.609 1.00 0.00 O ATOM 707 CB GLU A 46 3.551 15.898 1.890 1.00 0.00 C ATOM 708 CG GLU A 46 4.801 15.024 1.773 1.00 0.00 C ATOM 709 CD GLU A 46 5.559 14.941 3.096 1.00 0.00 C ATOM 710 OE1 GLU A 46 5.994 16.003 3.596 1.00 0.00 O ATOM 711 OE2 GLU A 46 5.702 13.806 3.605 1.00 0.00 O ATOM 0 H GLU A 46 2.738 13.802 0.784 1.00 0.00 H new ATOM 0 HA GLU A 46 1.889 16.584 0.696 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.844 16.921 2.124 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.937 15.545 2.719 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.515 14.022 1.454 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.457 15.429 1.003 1.00 0.00 H new ATOM 718 N ILE A 47 3.782 15.490 -1.582 1.00 0.00 N ATOM 719 CA ILE A 47 4.562 15.796 -2.780 1.00 0.00 C ATOM 720 C ILE A 47 3.679 15.704 -4.017 1.00 0.00 C ATOM 721 O ILE A 47 3.881 16.451 -4.971 1.00 0.00 O ATOM 722 CB ILE A 47 5.732 14.812 -2.879 1.00 0.00 C ATOM 723 CG1 ILE A 47 6.775 15.075 -1.787 1.00 0.00 C ATOM 724 CG2 ILE A 47 6.405 14.889 -4.247 1.00 0.00 C ATOM 725 CD1 ILE A 47 7.272 16.521 -1.754 1.00 0.00 C ATOM 0 H ILE A 47 3.417 14.538 -1.570 1.00 0.00 H new ATOM 0 HA ILE A 47 4.952 16.812 -2.716 1.00 0.00 H new ATOM 0 HB ILE A 47 5.319 13.813 -2.741 1.00 0.00 H new ATOM 0 HG12 ILE A 47 6.345 14.825 -0.817 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.625 14.410 -1.940 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.231 14.179 -4.286 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.680 14.645 -5.023 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.785 15.898 -4.409 1.00 0.00 H new ATOM 0 HD11 ILE A 47 8.007 16.635 -0.958 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.732 16.770 -2.711 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.432 17.190 -1.570 1.00 0.00 H new ATOM 737 N TYR A 48 2.702 14.798 -4.016 1.00 0.00 N ATOM 738 CA TYR A 48 1.808 14.632 -5.147 1.00 0.00 C ATOM 739 C TYR A 48 1.107 15.947 -5.488 1.00 0.00 C ATOM 740 O TYR A 48 0.889 16.249 -6.658 1.00 0.00 O ATOM 741 CB TYR A 48 0.773 13.564 -4.805 1.00 0.00 C ATOM 742 CG TYR A 48 -0.372 13.542 -5.785 1.00 0.00 C ATOM 743 CD1 TYR A 48 -0.127 13.370 -7.159 1.00 0.00 C ATOM 744 CD2 TYR A 48 -1.684 13.707 -5.319 1.00 0.00 C ATOM 745 CE1 TYR A 48 -1.194 13.396 -8.066 1.00 0.00 C ATOM 746 CE2 TYR A 48 -2.754 13.724 -6.221 1.00 0.00 C ATOM 747 CZ TYR A 48 -2.514 13.571 -7.600 1.00 0.00 C ATOM 748 OH TYR A 48 -3.551 13.595 -8.484 1.00 0.00 O ATOM 0 H TYR A 48 2.514 14.167 -3.237 1.00 0.00 H new ATOM 0 HA TYR A 48 2.389 14.326 -6.017 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.254 12.586 -4.790 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.386 13.744 -3.802 1.00 0.00 H new ATOM 0 HD1 TYR A 48 0.882 13.218 -7.514 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -1.869 13.821 -4.261 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -1.006 13.282 -9.123 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -3.763 13.854 -5.859 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.392 13.723 -7.998 1.00 0.00 H new ATOM 758 N GLN A 49 0.752 16.731 -4.466 1.00 0.00 N ATOM 759 CA GLN A 49 0.072 17.998 -4.669 1.00 0.00 C ATOM 760 C GLN A 49 0.966 18.990 -5.406 1.00 0.00 C ATOM 761 O GLN A 49 0.471 19.944 -6.005 1.00 0.00 O ATOM 762 CB GLN A 49 -0.328 18.588 -3.315 1.00 0.00 C ATOM 763 CG GLN A 49 -1.290 17.665 -2.569 1.00 0.00 C ATOM 764 CD GLN A 49 -1.634 18.236 -1.198 1.00 0.00 C ATOM 765 OE1 GLN A 49 -2.270 19.281 -1.090 1.00 0.00 O ATOM 766 NE2 GLN A 49 -1.220 17.553 -0.136 1.00 0.00 N ATOM 0 H GLN A 49 0.929 16.502 -3.488 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.815 17.815 -5.275 1.00 0.00 H new ATOM 0 HB2 GLN A 49 0.564 18.753 -2.710 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -0.796 19.561 -3.464 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -2.201 17.534 -3.152 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -0.840 16.679 -2.455 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -0.694 16.688 -0.259 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -1.429 17.894 0.803 1.00 0.00 H new ATOM 775 N ARG A 50 2.285 18.773 -5.367 1.00 0.00 N ATOM 776 CA ARG A 50 3.240 19.678 -5.985 1.00 0.00 C ATOM 777 C ARG A 50 3.470 19.333 -7.452 1.00 0.00 C ATOM 778 O ARG A 50 3.652 20.237 -8.262 1.00 0.00 O ATOM 779 CB ARG A 50 4.547 19.616 -5.197 1.00 0.00 C ATOM 780 CG ARG A 50 5.573 20.566 -5.801 1.00 0.00 C ATOM 781 CD ARG A 50 6.812 20.591 -4.916 1.00 0.00 C ATOM 782 NE ARG A 50 6.572 21.337 -3.675 1.00 0.00 N ATOM 783 CZ ARG A 50 7.038 20.992 -2.471 1.00 0.00 C ATOM 784 NH1 ARG A 50 7.777 19.897 -2.310 1.00 0.00 N ATOM 785 NH2 ARG A 50 6.755 21.741 -1.411 1.00 0.00 N ATOM 0 H ARG A 50 2.711 17.968 -4.907 1.00 0.00 H new ATOM 0 HA ARG A 50 2.841 20.692 -5.961 1.00 0.00 H new ATOM 0 HB2 ARG A 50 4.365 19.881 -4.156 1.00 0.00 H new ATOM 0 HB3 ARG A 50 4.936 18.598 -5.204 1.00 0.00 H new ATOM 0 HG2 ARG A 50 5.837 20.243 -6.808 1.00 0.00 H new ATOM 0 HG3 ARG A 50 5.152 21.568 -5.887 1.00 0.00 H new ATOM 0 HD2 ARG A 50 7.110 19.570 -4.676 1.00 0.00 H new ATOM 0 HD3 ARG A 50 7.640 21.045 -5.460 1.00 0.00 H new ATOM 0 HE ARG A 50 6.006 22.184 -3.736 1.00 0.00 H new ATOM 0 HH11 ARG A 50 7.996 19.307 -3.113 1.00 0.00 H new ATOM 0 HH12 ARG A 50 8.125 19.648 -1.384 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.182 22.579 -1.517 1.00 0.00 H new ATOM 0 HH22 ARG A 50 7.110 21.479 -0.492 1.00 0.00 H new ATOM 799 N ILE A 51 3.467 18.046 -7.812 1.00 0.00 N ATOM 800 CA ILE A 51 3.601 17.645 -9.211 1.00 0.00 C ATOM 801 C ILE A 51 2.387 18.148 -9.998 1.00 0.00 C ATOM 802 O ILE A 51 2.417 18.218 -11.225 1.00 0.00 O ATOM 803 CB ILE A 51 3.826 16.130 -9.337 1.00 0.00 C ATOM 804 CG1 ILE A 51 5.248 15.749 -8.895 1.00 0.00 C ATOM 805 CG2 ILE A 51 3.705 15.674 -10.792 1.00 0.00 C ATOM 806 CD1 ILE A 51 5.428 15.780 -7.381 1.00 0.00 C ATOM 0 H ILE A 51 3.374 17.270 -7.157 1.00 0.00 H new ATOM 0 HA ILE A 51 4.488 18.106 -9.646 1.00 0.00 H new ATOM 0 HB ILE A 51 3.071 15.656 -8.710 1.00 0.00 H new ATOM 0 HG12 ILE A 51 5.482 14.750 -9.263 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.961 16.433 -9.355 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.869 14.598 -10.851 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.709 15.910 -11.166 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.451 16.188 -11.398 1.00 0.00 H new ATOM 0 HD11 ILE A 51 6.452 15.502 -7.131 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.224 16.785 -7.011 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.737 15.075 -6.918 1.00 0.00 H new ATOM 1635 N MET C 1 12.146 -0.047 -7.670 1.00 0.00 N ATOM 1636 CA MET C 1 11.577 0.100 -6.313 1.00 0.00 C ATOM 1637 C MET C 1 11.710 1.533 -5.835 1.00 0.00 C ATOM 1638 O MET C 1 12.786 2.113 -5.920 1.00 0.00 O ATOM 1639 CB MET C 1 12.305 -0.798 -5.310 1.00 0.00 C ATOM 1640 CG MET C 1 11.734 -0.632 -3.898 1.00 0.00 C ATOM 1641 SD MET C 1 10.151 -1.460 -3.625 1.00 0.00 S ATOM 1642 CE MET C 1 10.814 -3.115 -3.331 1.00 0.00 C ATOM 0 H1 MET C 1 12.047 -1.034 -7.983 1.00 0.00 H new ATOM 0 H2 MET C 1 11.638 0.578 -8.329 1.00 0.00 H new ATOM 0 H3 MET C 1 13.153 0.212 -7.654 1.00 0.00 H new ATOM 0 HA MET C 1 10.527 -0.187 -6.372 1.00 0.00 H new ATOM 0 HB2 MET C 1 12.217 -1.839 -5.620 1.00 0.00 H new ATOM 0 HB3 MET C 1 13.368 -0.555 -5.306 1.00 0.00 H new ATOM 0 HG2 MET C 1 12.459 -1.016 -3.180 1.00 0.00 H new ATOM 0 HG3 MET C 1 11.613 0.431 -3.692 1.00 0.00 H new ATOM 0 HE1 MET C 1 10.003 -3.787 -3.049 1.00 0.00 H new ATOM 0 HE2 MET C 1 11.291 -3.483 -4.240 1.00 0.00 H new ATOM 0 HE3 MET C 1 11.549 -3.075 -2.527 1.00 0.00 H new ATOM 1654 N LEU C 2 10.619 2.108 -5.328 1.00 0.00 N ATOM 1655 CA LEU C 2 10.637 3.420 -4.713 1.00 0.00 C ATOM 1656 C LEU C 2 10.018 3.263 -3.327 1.00 0.00 C ATOM 1657 O LEU C 2 8.799 3.151 -3.192 1.00 0.00 O ATOM 1658 CB LEU C 2 9.889 4.409 -5.616 1.00 0.00 C ATOM 1659 CG LEU C 2 10.008 5.889 -5.213 1.00 0.00 C ATOM 1660 CD1 LEU C 2 8.759 6.323 -4.465 1.00 0.00 C ATOM 1661 CD2 LEU C 2 11.207 6.211 -4.323 1.00 0.00 C ATOM 0 H LEU C 2 9.698 1.669 -5.336 1.00 0.00 H new ATOM 0 HA LEU C 2 11.643 3.824 -4.597 1.00 0.00 H new ATOM 0 HB2 LEU C 2 10.259 4.296 -6.635 1.00 0.00 H new ATOM 0 HB3 LEU C 2 8.834 4.137 -5.629 1.00 0.00 H new ATOM 0 HG LEU C 2 10.140 6.427 -6.152 1.00 0.00 H new ATOM 0 HD11 LEU C 2 8.850 7.372 -4.183 1.00 0.00 H new ATOM 0 HD12 LEU C 2 7.887 6.194 -5.107 1.00 0.00 H new ATOM 0 HD13 LEU C 2 8.642 5.715 -3.568 1.00 0.00 H new ATOM 0 HD21 LEU C 2 11.211 7.276 -4.089 1.00 0.00 H new ATOM 0 HD22 LEU C 2 11.139 5.637 -3.399 1.00 0.00 H new ATOM 0 HD23 LEU C 2 12.128 5.951 -4.845 1.00 0.00 H new ATOM 1673 N ILE C 3 10.869 3.246 -2.296 1.00 0.00 N ATOM 1674 CA ILE C 3 10.434 3.118 -0.917 1.00 0.00 C ATOM 1675 C ILE C 3 9.938 4.474 -0.430 1.00 0.00 C ATOM 1676 O ILE C 3 10.462 5.514 -0.824 1.00 0.00 O ATOM 1677 CB ILE C 3 11.575 2.650 0.003 1.00 0.00 C ATOM 1678 CG1 ILE C 3 12.049 1.229 -0.318 1.00 0.00 C ATOM 1679 CG2 ILE C 3 11.050 2.617 1.440 1.00 0.00 C ATOM 1680 CD1 ILE C 3 13.108 1.208 -1.412 1.00 0.00 C ATOM 0 H ILE C 3 11.881 3.321 -2.403 1.00 0.00 H new ATOM 0 HA ILE C 3 9.641 2.371 -0.881 1.00 0.00 H new ATOM 0 HB ILE C 3 12.406 3.341 -0.138 1.00 0.00 H new ATOM 0 HG12 ILE C 3 12.453 0.770 0.585 1.00 0.00 H new ATOM 0 HG13 ILE C 3 11.196 0.625 -0.629 1.00 0.00 H new ATOM 0 HG21 ILE C 3 11.844 2.287 2.110 1.00 0.00 H new ATOM 0 HG22 ILE C 3 10.721 3.615 1.730 1.00 0.00 H new ATOM 0 HG23 ILE C 3 10.210 1.925 1.505 1.00 0.00 H new ATOM 0 HD11 ILE C 3 13.412 0.179 -1.604 1.00 0.00 H new ATOM 0 HD12 ILE C 3 12.698 1.641 -2.324 1.00 0.00 H new ATOM 0 HD13 ILE C 3 13.973 1.789 -1.092 1.00 0.00 H new ATOM 1692 N LEU C 4 8.929 4.443 0.435 1.00 0.00 N ATOM 1693 CA LEU C 4 8.435 5.606 1.144 1.00 0.00 C ATOM 1694 C LEU C 4 8.105 5.166 2.563 1.00 0.00 C ATOM 1695 O LEU C 4 7.892 3.979 2.814 1.00 0.00 O ATOM 1696 CB LEU C 4 7.177 6.148 0.451 1.00 0.00 C ATOM 1697 CG LEU C 4 7.453 6.695 -0.952 1.00 0.00 C ATOM 1698 CD1 LEU C 4 6.128 7.091 -1.601 1.00 0.00 C ATOM 1699 CD2 LEU C 4 8.358 7.924 -0.909 1.00 0.00 C ATOM 0 H LEU C 4 8.424 3.587 0.664 1.00 0.00 H new ATOM 0 HA LEU C 4 9.182 6.400 1.153 1.00 0.00 H new ATOM 0 HB2 LEU C 4 6.435 5.353 0.385 1.00 0.00 H new ATOM 0 HB3 LEU C 4 6.744 6.938 1.064 1.00 0.00 H new ATOM 0 HG LEU C 4 7.955 5.915 -1.525 1.00 0.00 H new ATOM 0 HD11 LEU C 4 6.315 7.482 -2.601 1.00 0.00 H new ATOM 0 HD12 LEU C 4 5.480 6.217 -1.668 1.00 0.00 H new ATOM 0 HD13 LEU C 4 5.642 7.857 -0.997 1.00 0.00 H new ATOM 0 HD21 LEU C 4 8.531 8.284 -1.923 1.00 0.00 H new ATOM 0 HD22 LEU C 4 7.879 8.708 -0.323 1.00 0.00 H new ATOM 0 HD23 LEU C 4 9.311 7.659 -0.450 1.00 0.00 H new ATOM 1711 N THR C 5 8.059 6.117 3.494 1.00 0.00 N ATOM 1712 CA THR C 5 7.632 5.828 4.853 1.00 0.00 C ATOM 1713 C THR C 5 6.440 6.698 5.202 1.00 0.00 C ATOM 1714 O THR C 5 6.346 7.846 4.768 1.00 0.00 O ATOM 1715 CB THR C 5 8.757 6.067 5.858 1.00 0.00 C ATOM 1716 OG1 THR C 5 9.329 7.341 5.665 1.00 0.00 O ATOM 1717 CG2 THR C 5 9.845 5.011 5.708 1.00 0.00 C ATOM 0 H THR C 5 8.312 7.091 3.328 1.00 0.00 H new ATOM 0 HA THR C 5 7.355 4.775 4.906 1.00 0.00 H new ATOM 0 HB THR C 5 8.328 6.006 6.858 1.00 0.00 H new ATOM 0 HG1 THR C 5 10.047 7.480 6.318 1.00 0.00 H new ATOM 0 HG21 THR C 5 10.637 5.199 6.433 1.00 0.00 H new ATOM 0 HG22 THR C 5 9.420 4.023 5.884 1.00 0.00 H new ATOM 0 HG23 THR C 5 10.258 5.054 4.700 1.00 0.00 H new ATOM 1725 N ARG C 6 5.521 6.142 5.994 1.00 0.00 N ATOM 1726 CA ARG C 6 4.350 6.891 6.427 1.00 0.00 C ATOM 1727 C ARG C 6 3.922 6.444 7.820 1.00 0.00 C ATOM 1728 O ARG C 6 4.218 5.320 8.219 1.00 0.00 O ATOM 1729 CB ARG C 6 3.229 6.672 5.402 1.00 0.00 C ATOM 1730 CG ARG C 6 2.408 7.949 5.243 1.00 0.00 C ATOM 1731 CD ARG C 6 3.106 8.929 4.300 1.00 0.00 C ATOM 1732 NE ARG C 6 2.550 10.277 4.437 1.00 0.00 N ATOM 1733 CZ ARG C 6 3.267 11.401 4.362 1.00 0.00 C ATOM 1734 NH1 ARG C 6 4.569 11.368 4.108 1.00 0.00 N ATOM 1735 NH2 ARG C 6 2.670 12.576 4.542 1.00 0.00 N ATOM 0 H ARG C 6 5.568 5.185 6.343 1.00 0.00 H new ATOM 0 HA ARG C 6 4.582 7.955 6.485 1.00 0.00 H new ATOM 0 HB2 ARG C 6 3.655 6.382 4.442 1.00 0.00 H new ATOM 0 HB3 ARG C 6 2.585 5.854 5.725 1.00 0.00 H new ATOM 0 HG2 ARG C 6 1.419 7.705 4.854 1.00 0.00 H new ATOM 0 HG3 ARG C 6 2.261 8.416 6.217 1.00 0.00 H new ATOM 0 HD2 ARG C 6 4.174 8.949 4.516 1.00 0.00 H new ATOM 0 HD3 ARG C 6 2.996 8.589 3.270 1.00 0.00 H new ATOM 0 HE ARG C 6 1.547 10.363 4.601 1.00 0.00 H new ATOM 0 HH11 ARG C 6 5.038 10.474 3.966 1.00 0.00 H new ATOM 0 HH12 ARG C 6 5.100 12.237 4.054 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.669 12.615 4.736 1.00 0.00 H new ATOM 0 HH22 ARG C 6 3.213 13.438 4.486 1.00 0.00 H new ATOM 1749 N LYS C 7 3.226 7.317 8.555 1.00 0.00 N ATOM 1750 CA LYS C 7 2.695 6.993 9.876 1.00 0.00 C ATOM 1751 C LYS C 7 1.220 6.622 9.703 1.00 0.00 C ATOM 1752 O LYS C 7 0.568 7.125 8.789 1.00 0.00 O ATOM 1753 CB LYS C 7 2.835 8.223 10.783 1.00 0.00 C ATOM 1754 CG LYS C 7 3.239 7.915 12.227 1.00 0.00 C ATOM 1755 CD LYS C 7 4.675 7.397 12.330 1.00 0.00 C ATOM 1756 CE LYS C 7 5.126 7.334 13.791 1.00 0.00 C ATOM 1757 NZ LYS C 7 5.132 8.667 14.422 1.00 0.00 N ATOM 0 H LYS C 7 3.017 8.267 8.248 1.00 0.00 H new ATOM 0 HA LYS C 7 3.236 6.163 10.330 1.00 0.00 H new ATOM 0 HB2 LYS C 7 3.576 8.894 10.349 1.00 0.00 H new ATOM 0 HB3 LYS C 7 1.886 8.759 10.793 1.00 0.00 H new ATOM 0 HG2 LYS C 7 3.136 8.817 12.831 1.00 0.00 H new ATOM 0 HG3 LYS C 7 2.557 7.173 12.643 1.00 0.00 H new ATOM 0 HD2 LYS C 7 4.742 6.406 11.881 1.00 0.00 H new ATOM 0 HD3 LYS C 7 5.343 8.048 11.766 1.00 0.00 H new ATOM 0 HE2 LYS C 7 4.463 6.672 14.348 1.00 0.00 H new ATOM 0 HE3 LYS C 7 6.126 6.902 13.844 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 5.769 8.659 15.244 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 5.462 9.375 13.735 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 4.169 8.908 14.733 1.00 0.00 H new ATOM 1771 N VAL C 8 0.678 5.758 10.562 1.00 0.00 N ATOM 1772 CA VAL C 8 -0.722 5.358 10.426 1.00 0.00 C ATOM 1773 C VAL C 8 -1.632 6.589 10.463 1.00 0.00 C ATOM 1774 O VAL C 8 -1.490 7.447 11.333 1.00 0.00 O ATOM 1775 CB VAL C 8 -1.117 4.315 11.479 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -0.196 3.099 11.390 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -1.065 4.849 12.910 1.00 0.00 C ATOM 0 H VAL C 8 1.175 5.330 11.343 1.00 0.00 H new ATOM 0 HA VAL C 8 -0.849 4.878 9.456 1.00 0.00 H new ATOM 0 HB VAL C 8 -2.150 4.045 11.258 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -0.487 2.366 12.143 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -0.277 2.653 10.399 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.834 3.409 11.565 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -1.356 4.060 13.604 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -0.051 5.178 13.139 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -1.751 5.691 13.009 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.566 6.670 9.511 1.00 0.00 N ATOM 1788 CA GLY C 9 -3.493 7.789 9.408 1.00 0.00 C ATOM 1789 C GLY C 9 -3.166 8.716 8.235 1.00 0.00 C ATOM 1790 O GLY C 9 -3.905 9.667 7.987 1.00 0.00 O ATOM 0 H GLY C 9 -2.697 5.959 8.792 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -4.507 7.407 9.293 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -3.471 8.361 10.336 1.00 0.00 H new ATOM 1794 N GLU C 10 -2.074 8.453 7.509 1.00 0.00 N ATOM 1795 CA GLU C 10 -1.641 9.273 6.380 1.00 0.00 C ATOM 1796 C GLU C 10 -1.906 8.574 5.043 1.00 0.00 C ATOM 1797 O GLU C 10 -2.473 7.483 5.009 1.00 0.00 O ATOM 1798 CB GLU C 10 -0.151 9.575 6.545 1.00 0.00 C ATOM 1799 CG GLU C 10 0.096 10.681 7.568 1.00 0.00 C ATOM 1800 CD GLU C 10 -0.338 12.037 7.010 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.179 12.405 5.930 1.00 0.00 O ATOM 1802 OE2 GLU C 10 -1.178 12.693 7.666 1.00 0.00 O ATOM 0 H GLU C 10 -1.463 7.657 7.693 1.00 0.00 H new ATOM 0 HA GLU C 10 -2.212 10.201 6.371 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.371 8.670 6.856 1.00 0.00 H new ATOM 0 HB3 GLU C 10 0.268 9.870 5.583 1.00 0.00 H new ATOM 0 HG2 GLU C 10 -0.454 10.466 8.484 1.00 0.00 H new ATOM 0 HG3 GLU C 10 1.153 10.711 7.831 1.00 0.00 H new ATOM 1809 N SER C 11 -1.487 9.202 3.940 1.00 0.00 N ATOM 1810 CA SER C 11 -1.763 8.715 2.596 1.00 0.00 C ATOM 1811 C SER C 11 -0.564 8.863 1.662 1.00 0.00 C ATOM 1812 O SER C 11 0.425 9.512 1.998 1.00 0.00 O ATOM 1813 CB SER C 11 -2.955 9.484 2.017 1.00 0.00 C ATOM 1814 OG SER C 11 -4.110 9.274 2.801 1.00 0.00 O ATOM 0 H SER C 11 -0.945 10.066 3.961 1.00 0.00 H new ATOM 0 HA SER C 11 -1.987 7.651 2.672 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.724 10.548 1.978 1.00 0.00 H new ATOM 0 HB3 SER C 11 -3.140 9.161 0.993 1.00 0.00 H new ATOM 0 HG SER C 11 -4.570 8.465 2.495 1.00 0.00 H new ATOM 1820 N ILE C 12 -0.675 8.247 0.477 1.00 0.00 N ATOM 1821 CA ILE C 12 0.343 8.203 -0.569 1.00 0.00 C ATOM 1822 C ILE C 12 -0.392 8.196 -1.919 1.00 0.00 C ATOM 1823 O ILE C 12 -1.601 7.964 -1.949 1.00 0.00 O ATOM 1824 CB ILE C 12 1.234 6.955 -0.395 1.00 0.00 C ATOM 1825 CG1 ILE C 12 1.727 6.846 1.059 1.00 0.00 C ATOM 1826 CG2 ILE C 12 2.451 6.999 -1.328 1.00 0.00 C ATOM 1827 CD1 ILE C 12 2.661 5.653 1.267 1.00 0.00 C ATOM 0 H ILE C 12 -1.521 7.742 0.214 1.00 0.00 H new ATOM 0 HA ILE C 12 1.004 9.068 -0.515 1.00 0.00 H new ATOM 0 HB ILE C 12 0.626 6.086 -0.649 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.247 7.764 1.334 1.00 0.00 H new ATOM 0 HG13 ILE C 12 0.869 6.754 1.725 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.056 6.105 -1.179 1.00 0.00 H new ATOM 0 HG22 ILE C 12 2.114 7.040 -2.364 1.00 0.00 H new ATOM 0 HG23 ILE C 12 3.048 7.883 -1.105 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.982 5.619 2.308 1.00 0.00 H new ATOM 0 HD12 ILE C 12 2.135 4.731 1.019 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.533 5.757 0.622 1.00 0.00 H new ATOM 1839 N ASN C 13 0.299 8.445 -3.035 1.00 0.00 N ATOM 1840 CA ASN C 13 -0.344 8.565 -4.339 1.00 0.00 C ATOM 1841 C ASN C 13 0.407 7.816 -5.436 1.00 0.00 C ATOM 1842 O ASN C 13 1.618 7.616 -5.353 1.00 0.00 O ATOM 1843 CB ASN C 13 -0.447 10.049 -4.704 1.00 0.00 C ATOM 1844 CG ASN C 13 -1.539 10.739 -3.898 1.00 0.00 C ATOM 1845 OD1 ASN C 13 -1.259 11.415 -2.912 1.00 0.00 O ATOM 1846 ND2 ASN C 13 -2.789 10.572 -4.310 1.00 0.00 N ATOM 0 H ASN C 13 1.311 8.568 -3.057 1.00 0.00 H new ATOM 0 HA ASN C 13 -1.333 8.113 -4.267 1.00 0.00 H new ATOM 0 HB2 ASN C 13 0.509 10.539 -4.520 1.00 0.00 H new ATOM 0 HB3 ASN C 13 -0.658 10.151 -5.769 1.00 0.00 H new ATOM 0 HD21 ASN C 13 -3.556 11.013 -3.803 1.00 0.00 H new ATOM 0 HD22 ASN C 13 -2.983 10.003 -5.134 1.00 0.00 H new ATOM 1853 N ILE C 14 -0.334 7.406 -6.471 1.00 0.00 N ATOM 1854 CA ILE C 14 0.194 6.681 -7.618 1.00 0.00 C ATOM 1855 C ILE C 14 -0.563 7.124 -8.867 1.00 0.00 C ATOM 1856 O ILE C 14 -1.766 7.390 -8.816 1.00 0.00 O ATOM 1857 CB ILE C 14 0.034 5.165 -7.408 1.00 0.00 C ATOM 1858 CG1 ILE C 14 0.703 4.717 -6.098 1.00 0.00 C ATOM 1859 CG2 ILE C 14 0.634 4.397 -8.595 1.00 0.00 C ATOM 1860 CD1 ILE C 14 0.544 3.219 -5.839 1.00 0.00 C ATOM 0 H ILE C 14 -1.338 7.575 -6.530 1.00 0.00 H new ATOM 0 HA ILE C 14 1.256 6.898 -7.735 1.00 0.00 H new ATOM 0 HB ILE C 14 -1.031 4.943 -7.342 1.00 0.00 H new ATOM 0 HG12 ILE C 14 1.764 4.965 -6.133 1.00 0.00 H new ATOM 0 HG13 ILE C 14 0.272 5.274 -5.266 1.00 0.00 H new ATOM 0 HG21 ILE C 14 0.514 3.326 -8.433 1.00 0.00 H new ATOM 0 HG22 ILE C 14 0.120 4.685 -9.512 1.00 0.00 H new ATOM 0 HG23 ILE C 14 1.694 4.634 -8.683 1.00 0.00 H new ATOM 0 HD11 ILE C 14 1.035 2.958 -4.902 1.00 0.00 H new ATOM 0 HD12 ILE C 14 -0.516 2.971 -5.775 1.00 0.00 H new ATOM 0 HD13 ILE C 14 0.999 2.658 -6.655 1.00 0.00 H new ATOM 1872 N GLY C 15 0.144 7.204 -9.996 1.00 0.00 N ATOM 1873 CA GLY C 15 -0.442 7.638 -11.252 1.00 0.00 C ATOM 1874 C GLY C 15 -1.094 9.006 -11.092 1.00 0.00 C ATOM 1875 O GLY C 15 -0.570 9.879 -10.398 1.00 0.00 O ATOM 0 H GLY C 15 1.135 6.969 -10.059 1.00 0.00 H new ATOM 0 HA2 GLY C 15 0.327 7.683 -12.023 1.00 0.00 H new ATOM 0 HA3 GLY C 15 -1.184 6.912 -11.584 1.00 0.00 H new ATOM 1879 N ASP C 16 -2.243 9.181 -11.742 1.00 0.00 N ATOM 1880 CA ASP C 16 -3.032 10.402 -11.659 1.00 0.00 C ATOM 1881 C ASP C 16 -4.483 10.062 -11.312 1.00 0.00 C ATOM 1882 O ASP C 16 -5.359 10.920 -11.388 1.00 0.00 O ATOM 1883 CB ASP C 16 -2.939 11.159 -12.986 1.00 0.00 C ATOM 1884 CG ASP C 16 -1.504 11.585 -13.290 1.00 0.00 C ATOM 1885 OD1 ASP C 16 -1.077 12.621 -12.739 1.00 0.00 O ATOM 1886 OD2 ASP C 16 -0.839 10.866 -14.075 1.00 0.00 O ATOM 0 H ASP C 16 -2.654 8.470 -12.347 1.00 0.00 H new ATOM 0 HA ASP C 16 -2.641 11.043 -10.869 1.00 0.00 H new ATOM 0 HB2 ASP C 16 -3.310 10.527 -13.793 1.00 0.00 H new ATOM 0 HB3 ASP C 16 -3.581 12.039 -12.949 1.00 0.00 H new ATOM 1891 N ASP C 17 -4.731 8.803 -10.936 1.00 0.00 N ATOM 1892 CA ASP C 17 -6.068 8.298 -10.656 1.00 0.00 C ATOM 1893 C ASP C 17 -6.075 7.323 -9.476 1.00 0.00 C ATOM 1894 O ASP C 17 -7.096 6.685 -9.232 1.00 0.00 O ATOM 1895 CB ASP C 17 -6.617 7.600 -11.902 1.00 0.00 C ATOM 1896 CG ASP C 17 -6.731 8.554 -13.089 1.00 0.00 C ATOM 1897 OD1 ASP C 17 -7.737 9.297 -13.133 1.00 0.00 O ATOM 1898 OD2 ASP C 17 -5.816 8.528 -13.944 1.00 0.00 O ATOM 0 H ASP C 17 -3.998 8.104 -10.818 1.00 0.00 H new ATOM 0 HA ASP C 17 -6.698 9.146 -10.388 1.00 0.00 H new ATOM 0 HB2 ASP C 17 -5.966 6.767 -12.168 1.00 0.00 H new ATOM 0 HB3 ASP C 17 -7.598 7.179 -11.679 1.00 0.00 H new ATOM 1903 N ILE C 18 -4.963 7.194 -8.739 1.00 0.00 N ATOM 1904 CA ILE C 18 -4.908 6.267 -7.617 1.00 0.00 C ATOM 1905 C ILE C 18 -4.349 6.956 -6.372 1.00 0.00 C ATOM 1906 O ILE C 18 -3.488 7.831 -6.454 1.00 0.00 O ATOM 1907 CB ILE C 18 -4.082 5.019 -7.972 1.00 0.00 C ATOM 1908 CG1 ILE C 18 -4.627 4.293 -9.206 1.00 0.00 C ATOM 1909 CG2 ILE C 18 -4.097 4.034 -6.800 1.00 0.00 C ATOM 1910 CD1 ILE C 18 -3.958 4.797 -10.487 1.00 0.00 C ATOM 0 H ILE C 18 -4.102 7.716 -8.902 1.00 0.00 H new ATOM 0 HA ILE C 18 -5.925 5.943 -7.397 1.00 0.00 H new ATOM 0 HB ILE C 18 -3.070 5.362 -8.186 1.00 0.00 H new ATOM 0 HG12 ILE C 18 -4.460 3.221 -9.103 1.00 0.00 H new ATOM 0 HG13 ILE C 18 -5.705 4.443 -9.273 1.00 0.00 H new ATOM 0 HG21 ILE C 18 -3.510 3.152 -7.058 1.00 0.00 H new ATOM 0 HG22 ILE C 18 -3.668 4.511 -5.919 1.00 0.00 H new ATOM 0 HG23 ILE C 18 -5.124 3.737 -6.588 1.00 0.00 H new ATOM 0 HD11 ILE C 18 -4.366 4.263 -11.345 1.00 0.00 H new ATOM 0 HD12 ILE C 18 -4.147 5.864 -10.601 1.00 0.00 H new ATOM 0 HD13 ILE C 18 -2.883 4.623 -10.429 1.00 0.00 H new ATOM 1922 N THR C 19 -4.857 6.534 -5.209 1.00 0.00 N ATOM 1923 CA THR C 19 -4.428 7.024 -3.910 1.00 0.00 C ATOM 1924 C THR C 19 -4.378 5.845 -2.947 1.00 0.00 C ATOM 1925 O THR C 19 -5.074 4.850 -3.146 1.00 0.00 O ATOM 1926 CB THR C 19 -5.404 8.102 -3.420 1.00 0.00 C ATOM 1927 OG1 THR C 19 -5.503 9.129 -4.382 1.00 0.00 O ATOM 1928 CG2 THR C 19 -4.948 8.725 -2.101 1.00 0.00 C ATOM 0 H THR C 19 -5.592 5.829 -5.151 1.00 0.00 H new ATOM 0 HA THR C 19 -3.438 7.475 -3.974 1.00 0.00 H new ATOM 0 HB THR C 19 -6.369 7.619 -3.266 1.00 0.00 H new ATOM 0 HG1 THR C 19 -6.128 9.814 -4.066 1.00 0.00 H new ATOM 0 HG21 THR C 19 -5.666 9.483 -1.789 1.00 0.00 H new ATOM 0 HG22 THR C 19 -4.882 7.951 -1.336 1.00 0.00 H new ATOM 0 HG23 THR C 19 -3.969 9.186 -2.235 1.00 0.00 H new ATOM 1936 N ILE C 20 -3.559 5.959 -1.899 1.00 0.00 N ATOM 1937 CA ILE C 20 -3.336 4.903 -0.926 1.00 0.00 C ATOM 1938 C ILE C 20 -3.422 5.523 0.463 1.00 0.00 C ATOM 1939 O ILE C 20 -3.095 6.693 0.634 1.00 0.00 O ATOM 1940 CB ILE C 20 -1.934 4.302 -1.148 1.00 0.00 C ATOM 1941 CG1 ILE C 20 -1.704 3.825 -2.589 1.00 0.00 C ATOM 1942 CG2 ILE C 20 -1.688 3.155 -0.166 1.00 0.00 C ATOM 1943 CD1 ILE C 20 -2.584 2.633 -2.962 1.00 0.00 C ATOM 0 H ILE C 20 -3.025 6.806 -1.705 1.00 0.00 H new ATOM 0 HA ILE C 20 -4.079 4.113 -1.030 1.00 0.00 H new ATOM 0 HB ILE C 20 -1.218 5.103 -0.965 1.00 0.00 H new ATOM 0 HG12 ILE C 20 -1.903 4.648 -3.276 1.00 0.00 H new ATOM 0 HG13 ILE C 20 -0.656 3.551 -2.714 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -0.694 2.739 -0.334 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.757 3.529 0.855 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -2.437 2.378 -0.319 1.00 0.00 H new ATOM 0 HD11 ILE C 20 -2.380 2.338 -3.991 1.00 0.00 H new ATOM 0 HD12 ILE C 20 -2.368 1.798 -2.295 1.00 0.00 H new ATOM 0 HD13 ILE C 20 -3.633 2.911 -2.866 1.00 0.00 H new ATOM 1955 N THR C 21 -3.864 4.749 1.460 1.00 0.00 N ATOM 1956 CA THR C 21 -4.001 5.252 2.820 1.00 0.00 C ATOM 1957 C THR C 21 -3.599 4.168 3.808 1.00 0.00 C ATOM 1958 O THR C 21 -4.187 3.086 3.823 1.00 0.00 O ATOM 1959 CB THR C 21 -5.451 5.685 3.069 1.00 0.00 C ATOM 1960 OG1 THR C 21 -5.874 6.583 2.066 1.00 0.00 O ATOM 1961 CG2 THR C 21 -5.584 6.376 4.424 1.00 0.00 C ATOM 0 H THR C 21 -4.132 3.772 1.345 1.00 0.00 H new ATOM 0 HA THR C 21 -3.348 6.114 2.955 1.00 0.00 H new ATOM 0 HB THR C 21 -6.072 4.789 3.053 1.00 0.00 H new ATOM 0 HG1 THR C 21 -6.801 6.850 2.236 1.00 0.00 H new ATOM 0 HG21 THR C 21 -6.621 6.675 4.580 1.00 0.00 H new ATOM 0 HG22 THR C 21 -5.282 5.689 5.214 1.00 0.00 H new ATOM 0 HG23 THR C 21 -4.945 7.259 4.447 1.00 0.00 H new ATOM 1969 N ILE C 22 -2.595 4.458 4.639 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.147 3.541 5.679 1.00 0.00 C ATOM 1971 C ILE C 22 -3.135 3.607 6.845 1.00 0.00 C ATOM 1972 O ILE C 22 -2.998 4.424 7.757 1.00 0.00 O ATOM 1973 CB ILE C 22 -0.691 3.851 6.078 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -0.257 3.053 7.311 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -0.445 5.341 6.336 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -0.448 1.557 7.113 1.00 0.00 C ATOM 0 H ILE C 22 -2.074 5.334 4.607 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.137 2.513 5.317 1.00 0.00 H new ATOM 0 HB ILE C 22 -0.090 3.550 5.220 1.00 0.00 H new ATOM 0 HG12 ILE C 22 0.791 3.260 7.527 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -0.832 3.381 8.177 1.00 0.00 H new ATOM 0 HG21 ILE C 22 0.598 5.495 6.613 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.668 5.908 5.432 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.090 5.681 7.147 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -0.128 1.027 8.010 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -1.500 1.347 6.923 1.00 0.00 H new ATOM 0 HD13 ILE C 22 0.148 1.223 6.263 1.00 0.00 H new ATOM 1988 N LEU C 23 -4.145 2.732 6.812 1.00 0.00 N ATOM 1989 CA LEU C 23 -5.212 2.742 7.800 1.00 0.00 C ATOM 1990 C LEU C 23 -4.693 2.343 9.178 1.00 0.00 C ATOM 1991 O LEU C 23 -5.207 2.829 10.186 1.00 0.00 O ATOM 1992 CB LEU C 23 -6.322 1.783 7.366 1.00 0.00 C ATOM 1993 CG LEU C 23 -6.800 2.048 5.938 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -7.927 1.084 5.595 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -7.329 3.467 5.767 1.00 0.00 C ATOM 0 H LEU C 23 -4.240 2.005 6.103 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.606 3.756 7.868 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -5.961 0.757 7.440 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -7.165 1.875 8.051 1.00 0.00 H new ATOM 0 HG LEU C 23 -5.943 1.910 5.278 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -8.269 1.272 4.577 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -7.565 0.059 5.673 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -8.755 1.230 6.289 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -7.658 3.611 4.738 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -8.170 3.626 6.442 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -6.538 4.180 5.999 1.00 0.00 H new ATOM 2007 N GLY C 24 -3.683 1.470 9.239 1.00 0.00 N ATOM 2008 CA GLY C 24 -3.083 1.113 10.517 1.00 0.00 C ATOM 2009 C GLY C 24 -2.328 -0.207 10.462 1.00 0.00 C ATOM 2010 O GLY C 24 -2.110 -0.752 9.382 1.00 0.00 O ATOM 0 H GLY C 24 -3.272 1.006 8.429 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -2.401 1.905 10.827 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -3.863 1.049 11.275 1.00 0.00 H new ATOM 2014 N VAL C 25 -1.930 -0.720 11.632 1.00 0.00 N ATOM 2015 CA VAL C 25 -1.218 -1.991 11.730 1.00 0.00 C ATOM 2016 C VAL C 25 -1.784 -2.839 12.869 1.00 0.00 C ATOM 2017 O VAL C 25 -2.528 -2.338 13.714 1.00 0.00 O ATOM 2018 CB VAL C 25 0.294 -1.761 11.925 1.00 0.00 C ATOM 2019 CG1 VAL C 25 0.834 -0.733 10.927 1.00 0.00 C ATOM 2020 CG2 VAL C 25 0.632 -1.310 13.346 1.00 0.00 C ATOM 0 H VAL C 25 -2.093 -0.266 12.531 1.00 0.00 H new ATOM 0 HA VAL C 25 -1.361 -2.532 10.794 1.00 0.00 H new ATOM 0 HB VAL C 25 0.773 -2.724 11.747 1.00 0.00 H new ATOM 0 HG11 VAL C 25 1.903 -0.593 11.091 1.00 0.00 H new ATOM 0 HG12 VAL C 25 0.666 -1.090 9.911 1.00 0.00 H new ATOM 0 HG13 VAL C 25 0.318 0.217 11.068 1.00 0.00 H new ATOM 0 HG21 VAL C 25 1.708 -1.161 13.434 1.00 0.00 H new ATOM 0 HG22 VAL C 25 0.117 -0.374 13.563 1.00 0.00 H new ATOM 0 HG23 VAL C 25 0.312 -2.073 14.056 1.00 0.00 H new ATOM 2030 N SER C 26 -1.431 -4.128 12.889 1.00 0.00 N ATOM 2031 CA SER C 26 -1.841 -5.059 13.933 1.00 0.00 C ATOM 2032 C SER C 26 -0.769 -6.132 14.057 1.00 0.00 C ATOM 2033 O SER C 26 -0.699 -7.035 13.225 1.00 0.00 O ATOM 2034 CB SER C 26 -3.187 -5.701 13.577 1.00 0.00 C ATOM 2035 OG SER C 26 -3.677 -6.420 14.689 1.00 0.00 O ATOM 0 H SER C 26 -0.846 -4.554 12.171 1.00 0.00 H new ATOM 0 HA SER C 26 -1.959 -4.530 14.879 1.00 0.00 H new ATOM 0 HB2 SER C 26 -3.902 -4.932 13.284 1.00 0.00 H new ATOM 0 HB3 SER C 26 -3.069 -6.368 12.723 1.00 0.00 H new ATOM 0 HG SER C 26 -4.538 -6.829 14.461 1.00 0.00 H new ATOM 2041 N GLY C 27 0.077 -6.042 15.086 1.00 0.00 N ATOM 2042 CA GLY C 27 1.225 -6.922 15.205 1.00 0.00 C ATOM 2043 C GLY C 27 2.211 -6.612 14.091 1.00 0.00 C ATOM 2044 O GLY C 27 3.023 -5.699 14.215 1.00 0.00 O ATOM 0 H GLY C 27 -0.018 -5.367 15.845 1.00 0.00 H new ATOM 0 HA2 GLY C 27 1.702 -6.788 16.176 1.00 0.00 H new ATOM 0 HA3 GLY C 27 0.908 -7.963 15.146 1.00 0.00 H new ATOM 2048 N GLN C 28 2.131 -7.376 13.003 1.00 0.00 N ATOM 2049 CA GLN C 28 2.919 -7.143 11.799 1.00 0.00 C ATOM 2050 C GLN C 28 2.011 -7.005 10.583 1.00 0.00 C ATOM 2051 O GLN C 28 2.501 -6.833 9.470 1.00 0.00 O ATOM 2052 CB GLN C 28 3.927 -8.274 11.584 1.00 0.00 C ATOM 2053 CG GLN C 28 5.083 -8.257 12.581 1.00 0.00 C ATOM 2054 CD GLN C 28 5.929 -6.988 12.466 1.00 0.00 C ATOM 2055 OE1 GLN C 28 6.936 -6.965 11.768 1.00 0.00 O ATOM 2056 NE2 GLN C 28 5.527 -5.920 13.152 1.00 0.00 N ATOM 0 H GLN C 28 1.510 -8.182 12.934 1.00 0.00 H new ATOM 0 HA GLN C 28 3.470 -6.211 11.929 1.00 0.00 H new ATOM 0 HB2 GLN C 28 3.409 -9.230 11.657 1.00 0.00 H new ATOM 0 HB3 GLN C 28 4.328 -8.205 10.573 1.00 0.00 H new ATOM 0 HG2 GLN C 28 4.688 -8.337 13.594 1.00 0.00 H new ATOM 0 HG3 GLN C 28 5.716 -9.129 12.416 1.00 0.00 H new ATOM 0 HE21 GLN C 28 4.684 -5.969 13.725 1.00 0.00 H new ATOM 0 HE22 GLN C 28 6.062 -5.053 13.105 1.00 0.00 H new ATOM 2065 N GLN C 29 0.692 -7.078 10.782 1.00 0.00 N ATOM 2066 CA GLN C 29 -0.256 -6.787 9.726 1.00 0.00 C ATOM 2067 C GLN C 29 -0.261 -5.296 9.450 1.00 0.00 C ATOM 2068 O GLN C 29 0.170 -4.502 10.285 1.00 0.00 O ATOM 2069 CB GLN C 29 -1.678 -7.165 10.126 1.00 0.00 C ATOM 2070 CG GLN C 29 -1.917 -8.665 10.179 1.00 0.00 C ATOM 2071 CD GLN C 29 -3.407 -8.900 10.344 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -3.952 -8.791 11.436 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -4.083 -9.226 9.250 1.00 0.00 N ATOM 0 H GLN C 29 0.265 -7.338 11.671 1.00 0.00 H new ATOM 0 HA GLN C 29 0.048 -7.364 8.853 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -1.898 -6.736 11.104 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -2.376 -6.719 9.418 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -1.556 -9.140 9.267 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -1.368 -9.109 11.009 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -3.598 -9.308 8.356 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -5.088 -9.394 9.302 1.00 0.00 H new ATOM 2082 N VAL C 30 -0.761 -4.924 8.276 1.00 0.00 N ATOM 2083 CA VAL C 30 -0.947 -3.542 7.901 1.00 0.00 C ATOM 2084 C VAL C 30 -2.265 -3.452 7.147 1.00 0.00 C ATOM 2085 O VAL C 30 -2.416 -4.094 6.109 1.00 0.00 O ATOM 2086 CB VAL C 30 0.222 -3.090 7.017 1.00 0.00 C ATOM 2087 CG1 VAL C 30 0.054 -1.613 6.675 1.00 0.00 C ATOM 2088 CG2 VAL C 30 1.559 -3.266 7.735 1.00 0.00 C ATOM 0 H VAL C 30 -1.049 -5.587 7.556 1.00 0.00 H new ATOM 0 HA VAL C 30 -0.973 -2.892 8.776 1.00 0.00 H new ATOM 0 HB VAL C 30 0.219 -3.702 6.115 1.00 0.00 H new ATOM 0 HG11 VAL C 30 0.883 -1.288 6.047 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -0.885 -1.468 6.140 1.00 0.00 H new ATOM 0 HG13 VAL C 30 0.043 -1.026 7.593 1.00 0.00 H new ATOM 0 HG21 VAL C 30 2.368 -2.937 7.083 1.00 0.00 H new ATOM 0 HG22 VAL C 30 1.563 -2.670 8.648 1.00 0.00 H new ATOM 0 HG23 VAL C 30 1.701 -4.317 7.987 1.00 0.00 H new ATOM 2098 N ARG C 31 -3.210 -2.662 7.666 1.00 0.00 N ATOM 2099 CA ARG C 31 -4.420 -2.343 6.926 1.00 0.00 C ATOM 2100 C ARG C 31 -4.048 -1.243 5.953 1.00 0.00 C ATOM 2101 O ARG C 31 -3.620 -0.164 6.365 1.00 0.00 O ATOM 2102 CB ARG C 31 -5.542 -1.845 7.837 1.00 0.00 C ATOM 2103 CG ARG C 31 -6.288 -2.991 8.518 1.00 0.00 C ATOM 2104 CD ARG C 31 -7.711 -2.545 8.871 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.725 -1.416 9.804 1.00 0.00 N ATOM 2106 CZ ARG C 31 -8.842 -0.758 10.142 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -10.023 -1.121 9.641 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.784 0.266 10.989 1.00 0.00 N ATOM 0 H ARG C 31 -3.155 -2.237 8.592 1.00 0.00 H new ATOM 0 HA ARG C 31 -4.790 -3.239 6.428 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -5.124 -1.184 8.597 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.246 -1.253 7.252 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -6.322 -3.858 7.859 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -5.758 -3.297 9.420 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -8.239 -2.266 7.959 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -8.253 -3.383 9.310 1.00 0.00 H new ATOM 0 HE ARG C 31 -6.842 -1.116 10.216 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -10.082 -1.907 8.993 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -10.867 -0.613 9.905 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -7.888 0.552 11.383 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -9.636 0.765 11.245 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.220 -1.529 4.664 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.912 -0.597 3.599 1.00 0.00 C ATOM 2124 C ILE C 32 -5.182 -0.345 2.804 1.00 0.00 C ATOM 2125 O ILE C 32 -5.771 -1.280 2.264 1.00 0.00 O ATOM 2126 CB ILE C 32 -2.816 -1.178 2.687 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -1.653 -1.747 3.512 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -2.332 -0.082 1.733 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -0.519 -2.270 2.629 1.00 0.00 C ATOM 0 H ILE C 32 -4.581 -2.424 4.334 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.543 0.340 4.016 1.00 0.00 H new ATOM 0 HB ILE C 32 -3.229 -2.004 2.108 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -1.267 -0.973 4.175 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -2.020 -2.555 4.145 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -1.555 -0.483 1.082 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.168 0.268 1.127 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -1.928 0.750 2.310 1.00 0.00 H new ATOM 0 HD11 ILE C 32 0.280 -2.662 3.258 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -0.896 -3.064 1.984 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -0.132 -1.457 2.015 1.00 0.00 H new ATOM 2141 N GLY C 33 -5.601 0.918 2.737 1.00 0.00 N ATOM 2142 CA GLY C 33 -6.760 1.327 1.963 1.00 0.00 C ATOM 2143 C GLY C 33 -6.282 1.797 0.599 1.00 0.00 C ATOM 2144 O GLY C 33 -5.170 2.306 0.467 1.00 0.00 O ATOM 0 H GLY C 33 -5.139 1.687 3.223 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -7.457 0.496 1.855 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -7.295 2.127 2.474 1.00 0.00 H new ATOM 2148 N ILE C 34 -7.125 1.631 -0.421 1.00 0.00 N ATOM 2149 CA ILE C 34 -6.792 2.043 -1.770 1.00 0.00 C ATOM 2150 C ILE C 34 -8.008 2.737 -2.361 1.00 0.00 C ATOM 2151 O ILE C 34 -9.144 2.358 -2.075 1.00 0.00 O ATOM 2152 CB ILE C 34 -6.375 0.818 -2.600 1.00 0.00 C ATOM 2153 CG1 ILE C 34 -5.184 0.117 -1.927 1.00 0.00 C ATOM 2154 CG2 ILE C 34 -6.015 1.263 -4.023 1.00 0.00 C ATOM 2155 CD1 ILE C 34 -4.742 -1.143 -2.668 1.00 0.00 C ATOM 0 H ILE C 34 -8.049 1.210 -0.329 1.00 0.00 H new ATOM 0 HA ILE C 34 -5.950 2.736 -1.772 1.00 0.00 H new ATOM 0 HB ILE C 34 -7.203 0.111 -2.656 1.00 0.00 H new ATOM 0 HG12 ILE C 34 -4.346 0.811 -1.868 1.00 0.00 H new ATOM 0 HG13 ILE C 34 -5.453 -0.145 -0.904 1.00 0.00 H new ATOM 0 HG21 ILE C 34 -5.719 0.395 -4.612 1.00 0.00 H new ATOM 0 HG22 ILE C 34 -6.880 1.738 -4.486 1.00 0.00 H new ATOM 0 HG23 ILE C 34 -5.189 1.973 -3.984 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -3.898 -1.595 -2.147 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -5.568 -1.853 -2.704 1.00 0.00 H new ATOM 0 HD13 ILE C 34 -4.444 -0.882 -3.683 1.00 0.00 H new ATOM 2167 N ASN C 35 -7.767 3.759 -3.182 1.00 0.00 N ATOM 2168 CA ASN C 35 -8.827 4.539 -3.781 1.00 0.00 C ATOM 2169 C ASN C 35 -8.504 4.741 -5.255 1.00 0.00 C ATOM 2170 O ASN C 35 -7.651 5.550 -5.613 1.00 0.00 O ATOM 2171 CB ASN C 35 -8.959 5.863 -3.024 1.00 0.00 C ATOM 2172 CG ASN C 35 -10.202 6.641 -3.429 1.00 0.00 C ATOM 2173 OD1 ASN C 35 -10.895 6.285 -4.376 1.00 0.00 O ATOM 2174 ND2 ASN C 35 -10.493 7.716 -2.706 1.00 0.00 N ATOM 0 H ASN C 35 -6.829 4.062 -3.445 1.00 0.00 H new ATOM 0 HA ASN C 35 -9.787 4.027 -3.715 1.00 0.00 H new ATOM 0 HB2 ASN C 35 -8.991 5.664 -1.953 1.00 0.00 H new ATOM 0 HB3 ASN C 35 -8.075 6.474 -3.209 1.00 0.00 H new ATOM 0 HD21 ASN C 35 -11.316 8.275 -2.932 1.00 0.00 H new ATOM 0 HD22 ASN C 35 -9.894 7.983 -1.925 1.00 0.00 H new ATOM 2181 N ALA C 36 -9.208 3.989 -6.102 1.00 0.00 N ATOM 2182 CA ALA C 36 -9.022 4.015 -7.541 1.00 0.00 C ATOM 2183 C ALA C 36 -10.380 3.796 -8.212 1.00 0.00 C ATOM 2184 O ALA C 36 -11.273 3.201 -7.605 1.00 0.00 O ATOM 2185 CB ALA C 36 -8.043 2.895 -7.906 1.00 0.00 C ATOM 0 H ALA C 36 -9.932 3.338 -5.797 1.00 0.00 H new ATOM 0 HA ALA C 36 -8.619 4.970 -7.878 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -7.883 2.889 -8.984 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -7.093 3.063 -7.399 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -8.456 1.935 -7.595 1.00 0.00 H new ATOM 2191 N PRO C 37 -10.559 4.268 -9.451 1.00 0.00 N ATOM 2192 CA PRO C 37 -11.777 4.058 -10.211 1.00 0.00 C ATOM 2193 C PRO C 37 -11.886 2.603 -10.652 1.00 0.00 C ATOM 2194 O PRO C 37 -10.876 1.924 -10.820 1.00 0.00 O ATOM 2195 CB PRO C 37 -11.651 4.980 -11.427 1.00 0.00 C ATOM 2196 CG PRO C 37 -10.143 5.108 -11.629 1.00 0.00 C ATOM 2197 CD PRO C 37 -9.591 5.040 -10.207 1.00 0.00 C ATOM 0 HA PRO C 37 -12.669 4.276 -9.624 1.00 0.00 H new ATOM 0 HB2 PRO C 37 -12.138 4.554 -12.304 1.00 0.00 H new ATOM 0 HB3 PRO C 37 -12.114 5.950 -11.244 1.00 0.00 H new ATOM 0 HG2 PRO C 37 -9.751 4.304 -12.252 1.00 0.00 H new ATOM 0 HG3 PRO C 37 -9.881 6.046 -12.118 1.00 0.00 H new ATOM 0 HD2 PRO C 37 -8.610 4.565 -10.189 1.00 0.00 H new ATOM 0 HD3 PRO C 37 -9.469 6.038 -9.785 1.00 0.00 H new ATOM 2205 N LYS C 38 -13.116 2.115 -10.840 1.00 0.00 N ATOM 2206 CA LYS C 38 -13.337 0.770 -11.357 1.00 0.00 C ATOM 2207 C LYS C 38 -12.848 0.660 -12.801 1.00 0.00 C ATOM 2208 O LYS C 38 -12.909 -0.412 -13.395 1.00 0.00 O ATOM 2209 CB LYS C 38 -14.824 0.411 -11.235 1.00 0.00 C ATOM 2210 CG LYS C 38 -15.248 0.228 -9.776 1.00 0.00 C ATOM 2211 CD LYS C 38 -14.578 -0.947 -9.047 1.00 0.00 C ATOM 2212 CE LYS C 38 -15.083 -2.317 -9.502 1.00 0.00 C ATOM 2213 NZ LYS C 38 -14.520 -2.722 -10.804 1.00 0.00 N ATOM 0 H LYS C 38 -13.971 2.635 -10.641 1.00 0.00 H new ATOM 0 HA LYS C 38 -12.762 0.057 -10.767 1.00 0.00 H new ATOM 0 HB2 LYS C 38 -15.426 1.196 -11.692 1.00 0.00 H new ATOM 0 HB3 LYS C 38 -15.023 -0.507 -11.789 1.00 0.00 H new ATOM 0 HG2 LYS C 38 -15.028 1.146 -9.232 1.00 0.00 H new ATOM 0 HG3 LYS C 38 -16.328 0.088 -9.742 1.00 0.00 H new ATOM 0 HD2 LYS C 38 -13.501 -0.895 -9.205 1.00 0.00 H new ATOM 0 HD3 LYS C 38 -14.748 -0.844 -7.975 1.00 0.00 H new ATOM 0 HE2 LYS C 38 -14.826 -3.063 -8.750 1.00 0.00 H new ATOM 0 HE3 LYS C 38 -16.171 -2.295 -9.571 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 -15.263 -2.684 -11.530 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 -13.748 -2.076 -11.064 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 -14.151 -3.692 -10.736 1.00 0.00 H new ATOM 2227 N ASP C 39 -12.359 1.772 -13.359 1.00 0.00 N ATOM 2228 CA ASP C 39 -11.704 1.808 -14.655 1.00 0.00 C ATOM 2229 C ASP C 39 -10.364 1.067 -14.604 1.00 0.00 C ATOM 2230 O ASP C 39 -9.761 0.804 -15.643 1.00 0.00 O ATOM 2231 CB ASP C 39 -11.483 3.274 -15.035 1.00 0.00 C ATOM 2232 CG ASP C 39 -11.042 3.421 -16.493 1.00 0.00 C ATOM 2233 OD1 ASP C 39 -11.830 3.011 -17.376 1.00 0.00 O ATOM 2234 OD2 ASP C 39 -9.926 3.940 -16.716 1.00 0.00 O ATOM 0 H ASP C 39 -12.412 2.685 -12.908 1.00 0.00 H new ATOM 0 HA ASP C 39 -12.328 1.314 -15.399 1.00 0.00 H new ATOM 0 HB2 ASP C 39 -12.404 3.834 -14.875 1.00 0.00 H new ATOM 0 HB3 ASP C 39 -10.728 3.710 -14.381 1.00 0.00 H new ATOM 2239 N VAL C 40 -9.898 0.729 -13.396 1.00 0.00 N ATOM 2240 CA VAL C 40 -8.651 0.008 -13.181 1.00 0.00 C ATOM 2241 C VAL C 40 -8.842 -1.045 -12.096 1.00 0.00 C ATOM 2242 O VAL C 40 -9.786 -0.974 -11.307 1.00 0.00 O ATOM 2243 CB VAL C 40 -7.512 0.967 -12.808 1.00 0.00 C ATOM 2244 CG1 VAL C 40 -7.359 2.067 -13.861 1.00 0.00 C ATOM 2245 CG2 VAL C 40 -7.731 1.631 -11.449 1.00 0.00 C ATOM 0 H VAL C 40 -10.389 0.955 -12.531 1.00 0.00 H new ATOM 0 HA VAL C 40 -8.375 -0.487 -14.112 1.00 0.00 H new ATOM 0 HB VAL C 40 -6.609 0.359 -12.760 1.00 0.00 H new ATOM 0 HG11 VAL C 40 -6.546 2.734 -13.575 1.00 0.00 H new ATOM 0 HG12 VAL C 40 -7.135 1.616 -14.828 1.00 0.00 H new ATOM 0 HG13 VAL C 40 -8.287 2.635 -13.931 1.00 0.00 H new ATOM 0 HG21 VAL C 40 -6.898 2.299 -11.232 1.00 0.00 H new ATOM 0 HG22 VAL C 40 -8.659 2.202 -11.469 1.00 0.00 H new ATOM 0 HG23 VAL C 40 -7.793 0.865 -10.676 1.00 0.00 H new ATOM 2255 N ALA C 41 -7.945 -2.031 -12.052 1.00 0.00 N ATOM 2256 CA ALA C 41 -8.057 -3.141 -11.129 1.00 0.00 C ATOM 2257 C ALA C 41 -7.123 -2.973 -9.931 1.00 0.00 C ATOM 2258 O ALA C 41 -6.127 -2.253 -10.010 1.00 0.00 O ATOM 2259 CB ALA C 41 -7.718 -4.430 -11.881 1.00 0.00 C ATOM 0 H ALA C 41 -7.125 -2.075 -12.657 1.00 0.00 H new ATOM 0 HA ALA C 41 -9.076 -3.179 -10.743 1.00 0.00 H new ATOM 0 HB1 ALA C 41 -7.797 -5.279 -11.202 1.00 0.00 H new ATOM 0 HB2 ALA C 41 -8.414 -4.562 -12.709 1.00 0.00 H new ATOM 0 HB3 ALA C 41 -6.701 -4.368 -12.268 1.00 0.00 H new ATOM 2265 N VAL C 42 -7.450 -3.643 -8.826 1.00 0.00 N ATOM 2266 CA VAL C 42 -6.591 -3.685 -7.643 1.00 0.00 C ATOM 2267 C VAL C 42 -6.866 -4.978 -6.884 1.00 0.00 C ATOM 2268 O VAL C 42 -8.021 -5.341 -6.674 1.00 0.00 O ATOM 2269 CB VAL C 42 -6.835 -2.440 -6.778 1.00 0.00 C ATOM 2270 CG1 VAL C 42 -8.316 -2.182 -6.529 1.00 0.00 C ATOM 2271 CG2 VAL C 42 -6.156 -2.544 -5.420 1.00 0.00 C ATOM 0 H VAL C 42 -8.317 -4.171 -8.726 1.00 0.00 H new ATOM 0 HA VAL C 42 -5.539 -3.675 -7.929 1.00 0.00 H new ATOM 0 HB VAL C 42 -6.409 -1.616 -7.350 1.00 0.00 H new ATOM 0 HG11 VAL C 42 -8.431 -1.291 -5.912 1.00 0.00 H new ATOM 0 HG12 VAL C 42 -8.825 -2.033 -7.482 1.00 0.00 H new ATOM 0 HG13 VAL C 42 -8.753 -3.038 -6.015 1.00 0.00 H new ATOM 0 HG21 VAL C 42 -6.356 -1.641 -4.843 1.00 0.00 H new ATOM 0 HG22 VAL C 42 -6.544 -3.410 -4.884 1.00 0.00 H new ATOM 0 HG23 VAL C 42 -5.081 -2.655 -5.558 1.00 0.00 H new ATOM 2281 N HIS C 43 -5.807 -5.683 -6.466 1.00 0.00 N ATOM 2282 CA HIS C 43 -5.932 -6.987 -5.818 1.00 0.00 C ATOM 2283 C HIS C 43 -4.715 -7.300 -4.953 1.00 0.00 C ATOM 2284 O HIS C 43 -3.707 -6.598 -5.014 1.00 0.00 O ATOM 2285 CB HIS C 43 -6.029 -8.084 -6.874 1.00 0.00 C ATOM 2286 CG HIS C 43 -7.137 -7.886 -7.869 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -8.472 -8.246 -7.669 1.00 0.00 N ATOM 2288 CD2 HIS C 43 -6.996 -7.325 -9.105 1.00 0.00 C ATOM 2289 CE1 HIS C 43 -9.107 -7.883 -8.793 1.00 0.00 C ATOM 2290 NE2 HIS C 43 -8.250 -7.331 -9.674 1.00 0.00 N ATOM 0 H HIS C 43 -4.844 -5.363 -6.569 1.00 0.00 H new ATOM 0 HA HIS C 43 -6.827 -6.952 -5.197 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -5.081 -8.142 -7.409 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -6.172 -9.042 -6.374 1.00 0.00 H new ATOM 0 HD1 HIS C 43 -8.877 -8.690 -6.845 1.00 0.00 H new ATOM 0 HD2 HIS C 43 -6.084 -6.952 -9.548 1.00 0.00 H new ATOM 0 HE1 HIS C 43 -10.164 -8.015 -8.969 1.00 0.00 H new ATOM 2298 N ARG C 44 -4.807 -8.361 -4.145 1.00 0.00 N ATOM 2299 CA ARG C 44 -3.643 -8.867 -3.432 1.00 0.00 C ATOM 2300 C ARG C 44 -2.722 -9.543 -4.448 1.00 0.00 C ATOM 2301 O ARG C 44 -3.174 -9.931 -5.521 1.00 0.00 O ATOM 2302 CB ARG C 44 -4.058 -9.863 -2.347 1.00 0.00 C ATOM 2303 CG ARG C 44 -5.115 -9.257 -1.424 1.00 0.00 C ATOM 2304 CD ARG C 44 -5.288 -10.066 -0.137 1.00 0.00 C ATOM 2305 NE ARG C 44 -5.493 -11.503 -0.371 1.00 0.00 N ATOM 2306 CZ ARG C 44 -6.624 -12.057 -0.812 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -7.685 -11.318 -1.122 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -6.703 -13.376 -0.954 1.00 0.00 N ATOM 0 H ARG C 44 -5.669 -8.878 -3.973 1.00 0.00 H new ATOM 0 HA ARG C 44 -3.126 -8.043 -2.940 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -4.450 -10.768 -2.810 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -3.185 -10.156 -1.764 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -4.833 -8.234 -1.174 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.068 -9.205 -1.950 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -4.406 -9.930 0.490 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -6.138 -9.672 0.419 1.00 0.00 H new ATOM 0 HE ARG C 44 -4.708 -12.126 -0.181 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -7.646 -10.303 -1.025 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -8.538 -11.766 -1.457 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -5.900 -13.962 -0.726 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -7.566 -13.802 -1.291 1.00 0.00 H new ATOM 2322 N GLU C 45 -1.437 -9.694 -4.129 1.00 0.00 N ATOM 2323 CA GLU C 45 -0.503 -10.350 -5.039 1.00 0.00 C ATOM 2324 C GLU C 45 -0.880 -11.823 -5.234 1.00 0.00 C ATOM 2325 O GLU C 45 -0.523 -12.424 -6.246 1.00 0.00 O ATOM 2326 CB GLU C 45 0.916 -10.172 -4.482 1.00 0.00 C ATOM 2327 CG GLU C 45 1.999 -10.653 -5.452 1.00 0.00 C ATOM 2328 CD GLU C 45 2.342 -12.136 -5.315 1.00 0.00 C ATOM 2329 OE1 GLU C 45 1.829 -12.788 -4.379 1.00 0.00 O ATOM 2330 OE2 GLU C 45 3.126 -12.618 -6.163 1.00 0.00 O ATOM 0 H GLU C 45 -1.023 -9.373 -3.254 1.00 0.00 H new ATOM 0 HA GLU C 45 -0.548 -9.895 -6.028 1.00 0.00 H new ATOM 0 HB2 GLU C 45 1.082 -9.119 -4.252 1.00 0.00 H new ATOM 0 HB3 GLU C 45 1.005 -10.721 -3.544 1.00 0.00 H new ATOM 0 HG2 GLU C 45 1.670 -10.460 -6.473 1.00 0.00 H new ATOM 0 HG3 GLU C 45 2.903 -10.065 -5.292 1.00 0.00 H new ATOM 2337 N GLU C 46 -1.607 -12.403 -4.273 1.00 0.00 N ATOM 2338 CA GLU C 46 -2.072 -13.786 -4.331 1.00 0.00 C ATOM 2339 C GLU C 46 -3.397 -13.915 -5.097 1.00 0.00 C ATOM 2340 O GLU C 46 -3.893 -15.026 -5.272 1.00 0.00 O ATOM 2341 CB GLU C 46 -2.221 -14.329 -2.903 1.00 0.00 C ATOM 2342 CG GLU C 46 -3.246 -13.525 -2.097 1.00 0.00 C ATOM 2343 CD GLU C 46 -3.288 -13.961 -0.640 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -2.330 -13.622 0.090 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -4.275 -14.633 -0.263 1.00 0.00 O ATOM 0 H GLU C 46 -1.891 -11.915 -3.423 1.00 0.00 H new ATOM 0 HA GLU C 46 -1.332 -14.374 -4.875 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -2.527 -15.375 -2.941 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -1.255 -14.297 -2.399 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -3.000 -12.464 -2.152 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -4.234 -13.647 -2.541 1.00 0.00 H new ATOM 2352 N ILE C 47 -3.960 -12.791 -5.556 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.212 -12.758 -6.305 1.00 0.00 C ATOM 2354 C ILE C 47 -4.965 -12.171 -7.688 1.00 0.00 C ATOM 2355 O ILE C 47 -5.588 -12.597 -8.655 1.00 0.00 O ATOM 2356 CB ILE C 47 -6.247 -11.936 -5.528 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.673 -12.646 -4.233 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -7.481 -11.665 -6.382 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -7.223 -14.055 -4.463 1.00 0.00 C ATOM 0 H ILE C 47 -3.549 -11.868 -5.413 1.00 0.00 H new ATOM 0 HA ILE C 47 -5.600 -13.769 -6.431 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.772 -10.989 -5.269 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -5.817 -12.704 -3.561 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.432 -12.046 -3.731 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -8.200 -11.080 -5.808 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -7.191 -11.109 -7.274 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -7.935 -12.611 -6.676 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.504 -14.497 -3.507 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -8.099 -14.003 -5.110 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.459 -14.671 -4.937 1.00 0.00 H new ATOM 2371 N TYR C 48 -4.062 -11.194 -7.795 1.00 0.00 N ATOM 2372 CA TYR C 48 -3.756 -10.565 -9.067 1.00 0.00 C ATOM 2373 C TYR C 48 -3.343 -11.604 -10.109 1.00 0.00 C ATOM 2374 O TYR C 48 -3.700 -11.485 -11.280 1.00 0.00 O ATOM 2375 CB TYR C 48 -2.626 -9.558 -8.859 1.00 0.00 C ATOM 2376 CG TYR C 48 -2.009 -9.102 -10.158 1.00 0.00 C ATOM 2377 CD1 TYR C 48 -2.816 -8.595 -11.188 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.621 -9.193 -10.332 1.00 0.00 C ATOM 2379 CE1 TYR C 48 -2.240 -8.210 -12.406 1.00 0.00 C ATOM 2380 CE2 TYR C 48 -0.037 -8.802 -11.539 1.00 0.00 C ATOM 2381 CZ TYR C 48 -0.845 -8.309 -12.585 1.00 0.00 C ATOM 2382 OH TYR C 48 -0.277 -7.929 -13.766 1.00 0.00 O ATOM 0 H TYR C 48 -3.531 -10.824 -7.007 1.00 0.00 H new ATOM 0 HA TYR C 48 -4.648 -10.058 -9.436 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -3.011 -8.692 -8.320 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -1.855 -10.007 -8.233 1.00 0.00 H new ATOM 0 HD1 TYR C 48 -3.882 -8.501 -11.042 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.001 -9.567 -9.530 1.00 0.00 H new ATOM 0 HE1 TYR C 48 -2.863 -7.838 -13.206 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.032 -8.877 -11.671 1.00 0.00 H new ATOM 0 HH TYR C 48 0.693 -8.061 -13.720 1.00 0.00 H new ATOM 2392 N GLN C 49 -2.591 -12.628 -9.691 1.00 0.00 N ATOM 2393 CA GLN C 49 -2.126 -13.659 -10.605 1.00 0.00 C ATOM 2394 C GLN C 49 -3.295 -14.464 -11.169 1.00 0.00 C ATOM 2395 O GLN C 49 -3.159 -15.097 -12.214 1.00 0.00 O ATOM 2396 CB GLN C 49 -1.174 -14.606 -9.870 1.00 0.00 C ATOM 2397 CG GLN C 49 0.043 -13.863 -9.332 1.00 0.00 C ATOM 2398 CD GLN C 49 0.944 -14.812 -8.555 1.00 0.00 C ATOM 2399 OE1 GLN C 49 1.525 -15.733 -9.119 1.00 0.00 O ATOM 2400 NE2 GLN C 49 1.069 -14.592 -7.249 1.00 0.00 N ATOM 0 H GLN C 49 -2.295 -12.759 -8.724 1.00 0.00 H new ATOM 0 HA GLN C 49 -1.608 -13.171 -11.431 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -1.701 -15.088 -9.047 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -0.850 -15.396 -10.547 1.00 0.00 H new ATOM 0 HG2 GLN C 49 0.599 -13.418 -10.157 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -0.278 -13.046 -8.686 1.00 0.00 H new ATOM 0 HE21 GLN C 49 0.571 -13.816 -6.813 1.00 0.00 H new ATOM 0 HE22 GLN C 49 1.663 -15.199 -6.684 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.442 -14.439 -10.485 1.00 0.00 N ATOM 2410 CA ARG C 50 -5.623 -15.188 -10.891 1.00 0.00 C ATOM 2411 C ARG C 50 -6.473 -14.394 -11.876 1.00 0.00 C ATOM 2412 O ARG C 50 -7.113 -14.992 -12.739 1.00 0.00 O ATOM 2413 CB ARG C 50 -6.415 -15.550 -9.634 1.00 0.00 C ATOM 2414 CG ARG C 50 -7.649 -16.366 -9.993 1.00 0.00 C ATOM 2415 CD ARG C 50 -8.361 -16.765 -8.701 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.624 -17.815 -7.990 1.00 0.00 N ATOM 2417 CZ ARG C 50 -7.593 -17.959 -6.661 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.265 -17.128 -5.863 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -6.885 -18.944 -6.120 1.00 0.00 N ATOM 0 H ARG C 50 -4.573 -13.895 -9.632 1.00 0.00 H new ATOM 0 HA ARG C 50 -5.321 -16.098 -11.409 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -5.783 -16.118 -8.951 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.713 -14.641 -9.111 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -8.316 -15.784 -10.629 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -7.365 -17.254 -10.558 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -8.467 -15.892 -8.057 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -9.367 -17.116 -8.931 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.096 -18.484 -8.550 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.814 -16.368 -6.264 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -8.230 -17.253 -4.851 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -6.367 -19.588 -6.718 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -6.859 -19.057 -5.107 1.00 0.00 H new ATOM 2433 N ILE C 51 -6.487 -13.063 -11.763 1.00 0.00 N ATOM 2434 CA ILE C 51 -7.238 -12.238 -12.702 1.00 0.00 C ATOM 2435 C ILE C 51 -6.627 -12.354 -14.101 1.00 0.00 C ATOM 2436 O ILE C 51 -7.270 -12.020 -15.094 1.00 0.00 O ATOM 2437 CB ILE C 51 -7.362 -10.784 -12.210 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -8.400 -10.681 -11.083 1.00 0.00 C ATOM 2439 CG2 ILE C 51 -7.890 -9.862 -13.313 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -7.914 -11.278 -9.768 1.00 0.00 C ATOM 0 H ILE C 51 -5.992 -12.542 -11.039 1.00 0.00 H new ATOM 0 HA ILE C 51 -8.261 -12.609 -12.763 1.00 0.00 H new ATOM 0 HB ILE C 51 -6.363 -10.492 -11.885 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -8.656 -9.633 -10.927 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -9.314 -11.190 -11.391 1.00 0.00 H new ATOM 0 HG21 ILE C 51 -7.965 -8.844 -12.931 1.00 0.00 H new ATOM 0 HG22 ILE C 51 -7.207 -9.882 -14.162 1.00 0.00 H new ATOM 0 HG23 ILE C 51 -8.875 -10.203 -13.632 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -8.692 -11.174 -9.012 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -7.685 -12.334 -9.911 1.00 0.00 H new ATOM 0 HD13 ILE C 51 -7.017 -10.753 -9.440 1.00 0.00 H new