USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 759 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 47 SER OG : rot 180:sc= 0.234 USER MOD Set 1.2: A 76 ASN : amide:sc= -0.732 K(o=-0.5,f=-2.5!) USER MOD Single : A 1 GLY N :NH3+ -116:sc= 0.0844 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0044 USER MOD Single : A 8 THR OG1 : rot -36:sc= 0.22 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= 1 K(o=1,f=0) USER MOD Single : A 24 THR OG1 : rot -79:sc= 1.21 USER MOD Single : A 25 SER OG : rot -14:sc= 0.568 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.0108 USER MOD Single : A 40 TYR OH : rot 27:sc= -4.27! USER MOD Single : A 44 TYR OH : rot 180:sc= -2.84! USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot -138:sc= 1.29 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0528 USER MOD Single : A 56 ASN : amide:sc= 0.957 K(o=0.96,f=-4.1!) USER MOD Single : A 60 THR OG1 : rot -41:sc= 0.582 USER MOD Single : A 62 ASN : amide:sc= -0.0117 X(o=-0.012,f=0) USER MOD Single : A 63 SER OG : rot 34:sc= 0.0465 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -1.42 K(o=-1.4,f=-2) USER MOD Single : A 74 GLN : amide:sc= -0.793 K(o=-0.79,f=-0.063) USER MOD Single : A 75 TYR OH : rot -141:sc= -1.23 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 GLN : amide:sc= 1.27 K(o=1.3,f=0) USER MOD Single : A 88 SER OG : rot 87:sc= -0.211 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0338 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 GLN : amide:sc= -1.56 K(o=-1.6,f=-0.095) USER MOD Single : A 97 THR OG1 : rot -158:sc= 2.05 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.365 -38.472 7.486 1.00 0.00 N ATOM 2 CA GLY A 1 10.932 -37.187 8.087 1.00 0.00 C ATOM 3 C GLY A 1 9.746 -36.594 7.356 1.00 0.00 C ATOM 4 O GLY A 1 9.336 -37.100 6.311 1.00 0.00 O ATOM 0 H1 GLY A 1 11.231 -39.240 8.174 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.798 -38.666 6.636 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.370 -38.412 7.226 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.672 -37.345 9.134 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.761 -36.480 8.068 1.00 0.00 H new ATOM 10 N SER A 2 9.195 -35.520 7.899 1.00 0.00 N ATOM 11 CA SER A 2 8.043 -34.868 7.304 1.00 0.00 C ATOM 12 C SER A 2 7.994 -33.409 7.744 1.00 0.00 C ATOM 13 O SER A 2 8.546 -33.051 8.783 1.00 0.00 O ATOM 14 CB SER A 2 6.760 -35.599 7.715 1.00 0.00 C ATOM 15 OG SER A 2 5.633 -35.117 7.001 1.00 0.00 O ATOM 0 H SER A 2 9.531 -35.080 8.756 1.00 0.00 H new ATOM 0 HA SER A 2 8.128 -34.903 6.218 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.876 -36.668 7.535 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.595 -35.472 8.785 1.00 0.00 H new ATOM 0 HG SER A 2 4.832 -35.605 7.286 1.00 0.00 H new ATOM 21 N HIS A 3 7.349 -32.567 6.945 1.00 0.00 N ATOM 22 CA HIS A 3 7.239 -31.147 7.259 1.00 0.00 C ATOM 23 C HIS A 3 5.781 -30.719 7.267 1.00 0.00 C ATOM 24 O HIS A 3 4.887 -31.514 6.972 1.00 0.00 O ATOM 25 CB HIS A 3 8.009 -30.289 6.244 1.00 0.00 C ATOM 26 CG HIS A 3 9.491 -30.508 6.237 1.00 0.00 C ATOM 27 ND1 HIS A 3 10.353 -29.881 7.111 1.00 0.00 N ATOM 28 CD2 HIS A 3 10.265 -31.280 5.440 1.00 0.00 C ATOM 29 CE1 HIS A 3 11.590 -30.256 6.848 1.00 0.00 C ATOM 30 NE2 HIS A 3 11.565 -31.106 5.839 1.00 0.00 N ATOM 0 H HIS A 3 6.894 -32.843 6.075 1.00 0.00 H new ATOM 0 HA HIS A 3 7.673 -30.996 8.247 1.00 0.00 H new ATOM 0 HB2 HIS A 3 7.620 -30.494 5.246 1.00 0.00 H new ATOM 0 HB3 HIS A 3 7.812 -29.238 6.453 1.00 0.00 H new ATOM 0 HD2 HIS A 3 9.922 -31.916 4.637 1.00 0.00 H new ATOM 0 HE1 HIS A 3 12.475 -29.923 7.371 1.00 0.00 H new ATOM 0 HE2 HIS A 3 12.379 -31.559 5.424 1.00 0.00 H new ATOM 39 N MET A 4 5.547 -29.461 7.604 1.00 0.00 N ATOM 40 CA MET A 4 4.210 -28.895 7.579 1.00 0.00 C ATOM 41 C MET A 4 4.261 -27.513 6.934 1.00 0.00 C ATOM 42 O MET A 4 3.831 -26.515 7.517 1.00 0.00 O ATOM 43 CB MET A 4 3.632 -28.817 8.997 1.00 0.00 C ATOM 44 CG MET A 4 2.152 -28.468 9.039 1.00 0.00 C ATOM 45 SD MET A 4 1.505 -28.381 10.719 1.00 0.00 S ATOM 46 CE MET A 4 -0.212 -27.987 10.401 1.00 0.00 C ATOM 0 H MET A 4 6.273 -28.809 7.900 1.00 0.00 H new ATOM 0 HA MET A 4 3.556 -29.538 6.990 1.00 0.00 H new ATOM 0 HB2 MET A 4 3.784 -29.775 9.494 1.00 0.00 H new ATOM 0 HB3 MET A 4 4.188 -28.071 9.565 1.00 0.00 H new ATOM 0 HG2 MET A 4 1.995 -27.510 8.543 1.00 0.00 H new ATOM 0 HG3 MET A 4 1.591 -29.214 8.476 1.00 0.00 H new ATOM 0 HE1 MET A 4 -0.747 -27.900 11.347 1.00 0.00 H new ATOM 0 HE2 MET A 4 -0.275 -27.042 9.861 1.00 0.00 H new ATOM 0 HE3 MET A 4 -0.662 -28.778 9.801 1.00 0.00 H new ATOM 56 N GLY A 5 4.818 -27.469 5.730 1.00 0.00 N ATOM 57 CA GLY A 5 4.956 -26.217 5.016 1.00 0.00 C ATOM 58 C GLY A 5 3.657 -25.784 4.375 1.00 0.00 C ATOM 59 O GLY A 5 3.370 -26.136 3.230 1.00 0.00 O ATOM 0 H GLY A 5 5.178 -28.284 5.234 1.00 0.00 H new ATOM 0 HA2 GLY A 5 5.296 -25.443 5.704 1.00 0.00 H new ATOM 0 HA3 GLY A 5 5.722 -26.320 4.248 1.00 0.00 H new ATOM 63 N THR A 6 2.867 -25.029 5.119 1.00 0.00 N ATOM 64 CA THR A 6 1.579 -24.567 4.634 1.00 0.00 C ATOM 65 C THR A 6 1.742 -23.286 3.818 1.00 0.00 C ATOM 66 O THR A 6 1.482 -22.182 4.303 1.00 0.00 O ATOM 67 CB THR A 6 0.608 -24.331 5.807 1.00 0.00 C ATOM 68 OG1 THR A 6 0.653 -25.456 6.699 1.00 0.00 O ATOM 69 CG2 THR A 6 -0.818 -24.143 5.311 1.00 0.00 C ATOM 0 H THR A 6 3.097 -24.722 6.064 1.00 0.00 H new ATOM 0 HA THR A 6 1.161 -25.341 3.990 1.00 0.00 H new ATOM 0 HB THR A 6 0.916 -23.424 6.327 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.037 -25.306 7.446 1.00 0.00 H new ATOM 0 HG21 THR A 6 -1.480 -23.979 6.161 1.00 0.00 H new ATOM 0 HG22 THR A 6 -0.861 -23.281 4.645 1.00 0.00 H new ATOM 0 HG23 THR A 6 -1.136 -25.035 4.771 1.00 0.00 H new ATOM 77 N THR A 7 2.178 -23.445 2.575 1.00 0.00 N ATOM 78 CA THR A 7 2.408 -22.312 1.693 1.00 0.00 C ATOM 79 C THR A 7 1.112 -21.867 1.025 1.00 0.00 C ATOM 80 O THR A 7 1.067 -20.837 0.355 1.00 0.00 O ATOM 81 CB THR A 7 3.463 -22.646 0.621 1.00 0.00 C ATOM 82 OG1 THR A 7 3.131 -23.877 -0.035 1.00 0.00 O ATOM 83 CG2 THR A 7 4.848 -22.752 1.243 1.00 0.00 C ATOM 0 H THR A 7 2.380 -24.352 2.155 1.00 0.00 H new ATOM 0 HA THR A 7 2.784 -21.493 2.306 1.00 0.00 H new ATOM 0 HB THR A 7 3.470 -21.840 -0.112 1.00 0.00 H new ATOM 0 HG1 THR A 7 3.807 -24.078 -0.715 1.00 0.00 H new ATOM 0 HG21 THR A 7 5.578 -22.988 0.468 1.00 0.00 H new ATOM 0 HG22 THR A 7 5.110 -21.803 1.711 1.00 0.00 H new ATOM 0 HG23 THR A 7 4.849 -23.540 1.996 1.00 0.00 H new ATOM 91 N THR A 8 0.051 -22.646 1.226 1.00 0.00 N ATOM 92 CA THR A 8 -1.275 -22.272 0.753 1.00 0.00 C ATOM 93 C THR A 8 -1.849 -21.179 1.645 1.00 0.00 C ATOM 94 O THR A 8 -2.900 -20.594 1.371 1.00 0.00 O ATOM 95 CB THR A 8 -2.226 -23.490 0.709 1.00 0.00 C ATOM 96 OG1 THR A 8 -3.480 -23.133 0.112 1.00 0.00 O ATOM 97 CG2 THR A 8 -2.465 -24.039 2.106 1.00 0.00 C ATOM 0 H THR A 8 0.087 -23.541 1.714 1.00 0.00 H new ATOM 0 HA THR A 8 -1.181 -21.894 -0.265 1.00 0.00 H new ATOM 0 HB THR A 8 -1.751 -24.261 0.103 1.00 0.00 H new ATOM 0 HG1 THR A 8 -3.716 -22.217 0.369 1.00 0.00 H new ATOM 0 HG21 THR A 8 -3.137 -24.895 2.050 1.00 0.00 H new ATOM 0 HG22 THR A 8 -1.516 -24.350 2.542 1.00 0.00 H new ATOM 0 HG23 THR A 8 -2.914 -23.265 2.729 1.00 0.00 H new ATOM 105 N ALA A 9 -1.118 -20.913 2.703 1.00 0.00 N ATOM 106 CA ALA A 9 -1.413 -19.822 3.611 1.00 0.00 C ATOM 107 C ALA A 9 -0.312 -18.774 3.506 1.00 0.00 C ATOM 108 O ALA A 9 0.686 -18.825 4.229 1.00 0.00 O ATOM 109 CB ALA A 9 -1.548 -20.332 5.037 1.00 0.00 C ATOM 0 H ALA A 9 -0.292 -21.452 2.963 1.00 0.00 H new ATOM 0 HA ALA A 9 -2.364 -19.367 3.335 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.769 -19.498 5.702 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.357 -21.061 5.088 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.615 -20.804 5.345 1.00 0.00 H new ATOM 115 N PRO A 10 -0.471 -17.827 2.578 1.00 0.00 N ATOM 116 CA PRO A 10 0.549 -16.825 2.283 1.00 0.00 C ATOM 117 C PRO A 10 0.564 -15.694 3.302 1.00 0.00 C ATOM 118 O PRO A 10 -0.427 -15.451 3.999 1.00 0.00 O ATOM 119 CB PRO A 10 0.124 -16.312 0.914 1.00 0.00 C ATOM 120 CG PRO A 10 -1.355 -16.426 0.927 1.00 0.00 C ATOM 121 CD PRO A 10 -1.673 -17.643 1.746 1.00 0.00 C ATOM 0 HA PRO A 10 1.558 -17.235 2.312 1.00 0.00 H new ATOM 0 HB2 PRO A 10 0.443 -15.281 0.758 1.00 0.00 H new ATOM 0 HB3 PRO A 10 0.562 -16.906 0.112 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -1.810 -15.535 1.360 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -1.747 -16.524 -0.085 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -2.564 -17.494 2.356 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -1.861 -18.512 1.116 1.00 0.00 H new ATOM 129 N ASP A 11 1.686 -15.006 3.386 1.00 0.00 N ATOM 130 CA ASP A 11 1.830 -13.908 4.322 1.00 0.00 C ATOM 131 C ASP A 11 2.033 -12.613 3.552 1.00 0.00 C ATOM 132 O ASP A 11 2.205 -12.630 2.335 1.00 0.00 O ATOM 133 CB ASP A 11 3.016 -14.159 5.253 1.00 0.00 C ATOM 134 CG ASP A 11 2.796 -13.604 6.645 1.00 0.00 C ATOM 135 OD1 ASP A 11 2.212 -14.318 7.488 1.00 0.00 O ATOM 136 OD2 ASP A 11 3.218 -12.461 6.914 1.00 0.00 O ATOM 0 H ASP A 11 2.512 -15.188 2.817 1.00 0.00 H new ATOM 0 HA ASP A 11 0.927 -13.830 4.927 1.00 0.00 H new ATOM 0 HB2 ASP A 11 3.200 -15.231 5.319 1.00 0.00 H new ATOM 0 HB3 ASP A 11 3.911 -13.708 4.824 1.00 0.00 H new ATOM 141 N ALA A 12 1.998 -11.502 4.257 1.00 0.00 N ATOM 142 CA ALA A 12 2.199 -10.200 3.646 1.00 0.00 C ATOM 143 C ALA A 12 3.645 -9.772 3.803 1.00 0.00 C ATOM 144 O ALA A 12 4.385 -10.353 4.595 1.00 0.00 O ATOM 145 CB ALA A 12 1.291 -9.174 4.303 1.00 0.00 C ATOM 0 H ALA A 12 1.831 -11.473 5.263 1.00 0.00 H new ATOM 0 HA ALA A 12 1.958 -10.268 2.585 1.00 0.00 H new ATOM 0 HB1 ALA A 12 1.447 -8.200 3.839 1.00 0.00 H new ATOM 0 HB2 ALA A 12 0.251 -9.474 4.175 1.00 0.00 H new ATOM 0 HB3 ALA A 12 1.522 -9.111 5.366 1.00 0.00 H new ATOM 151 N PRO A 13 4.078 -8.753 3.055 1.00 0.00 N ATOM 152 CA PRO A 13 5.391 -8.156 3.257 1.00 0.00 C ATOM 153 C PRO A 13 5.486 -7.492 4.626 1.00 0.00 C ATOM 154 O PRO A 13 4.580 -6.760 5.025 1.00 0.00 O ATOM 155 CB PRO A 13 5.479 -7.094 2.155 1.00 0.00 C ATOM 156 CG PRO A 13 4.436 -7.468 1.162 1.00 0.00 C ATOM 157 CD PRO A 13 3.343 -8.111 1.953 1.00 0.00 C ATOM 0 HA PRO A 13 6.193 -8.893 3.216 1.00 0.00 H new ATOM 0 HB2 PRO A 13 5.300 -6.096 2.556 1.00 0.00 H new ATOM 0 HB3 PRO A 13 6.469 -7.082 1.699 1.00 0.00 H new ATOM 0 HG2 PRO A 13 4.070 -6.591 0.628 1.00 0.00 H new ATOM 0 HG3 PRO A 13 4.834 -8.153 0.414 1.00 0.00 H new ATOM 0 HD2 PRO A 13 2.623 -7.379 2.319 1.00 0.00 H new ATOM 0 HD3 PRO A 13 2.787 -8.837 1.360 1.00 0.00 H new ATOM 165 N PRO A 14 6.554 -7.785 5.388 1.00 0.00 N ATOM 166 CA PRO A 14 6.850 -7.076 6.635 1.00 0.00 C ATOM 167 C PRO A 14 6.824 -5.566 6.441 1.00 0.00 C ATOM 168 O PRO A 14 7.050 -5.083 5.327 1.00 0.00 O ATOM 169 CB PRO A 14 8.259 -7.551 6.982 1.00 0.00 C ATOM 170 CG PRO A 14 8.362 -8.901 6.368 1.00 0.00 C ATOM 171 CD PRO A 14 7.532 -8.850 5.112 1.00 0.00 C ATOM 0 HA PRO A 14 6.118 -7.280 7.417 1.00 0.00 H new ATOM 0 HB2 PRO A 14 9.015 -6.875 6.582 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.408 -7.594 8.061 1.00 0.00 H new ATOM 0 HG2 PRO A 14 9.399 -9.148 6.141 1.00 0.00 H new ATOM 0 HG3 PRO A 14 7.993 -9.668 7.049 1.00 0.00 H new ATOM 0 HD2 PRO A 14 8.141 -8.619 4.238 1.00 0.00 H new ATOM 0 HD3 PRO A 14 7.042 -9.804 4.916 1.00 0.00 H new ATOM 179 N ASP A 15 6.574 -4.850 7.541 1.00 0.00 N ATOM 180 CA ASP A 15 6.320 -3.400 7.538 1.00 0.00 C ATOM 181 C ASP A 15 7.151 -2.665 6.489 1.00 0.00 C ATOM 182 O ASP A 15 8.363 -2.512 6.642 1.00 0.00 O ATOM 183 CB ASP A 15 6.631 -2.834 8.927 1.00 0.00 C ATOM 184 CG ASP A 15 6.282 -1.365 9.072 1.00 0.00 C ATOM 185 OD1 ASP A 15 7.148 -0.506 8.806 1.00 0.00 O ATOM 186 OD2 ASP A 15 5.142 -1.063 9.488 1.00 0.00 O ATOM 0 H ASP A 15 6.541 -5.263 8.473 1.00 0.00 H new ATOM 0 HA ASP A 15 5.271 -3.247 7.285 1.00 0.00 H new ATOM 0 HB2 ASP A 15 6.082 -3.406 9.675 1.00 0.00 H new ATOM 0 HB3 ASP A 15 7.692 -2.970 9.137 1.00 0.00 H new ATOM 191 N PRO A 16 6.509 -2.230 5.394 1.00 0.00 N ATOM 192 CA PRO A 16 7.168 -1.462 4.327 1.00 0.00 C ATOM 193 C PRO A 16 7.532 -0.050 4.767 1.00 0.00 C ATOM 194 O PRO A 16 6.806 0.589 5.530 1.00 0.00 O ATOM 195 CB PRO A 16 6.115 -1.423 3.202 1.00 0.00 C ATOM 196 CG PRO A 16 5.159 -2.504 3.558 1.00 0.00 C ATOM 197 CD PRO A 16 5.104 -2.495 5.058 1.00 0.00 C ATOM 0 HA PRO A 16 8.112 -1.917 4.026 1.00 0.00 H new ATOM 0 HB2 PRO A 16 5.619 -0.453 3.154 1.00 0.00 H new ATOM 0 HB3 PRO A 16 6.568 -1.598 2.226 1.00 0.00 H new ATOM 0 HG2 PRO A 16 4.176 -2.319 3.126 1.00 0.00 H new ATOM 0 HG3 PRO A 16 5.497 -3.469 3.181 1.00 0.00 H new ATOM 0 HD2 PRO A 16 4.437 -1.723 5.441 1.00 0.00 H new ATOM 0 HD3 PRO A 16 4.756 -3.446 5.463 1.00 0.00 H new ATOM 205 N THR A 17 8.652 0.435 4.264 1.00 0.00 N ATOM 206 CA THR A 17 9.156 1.745 4.630 1.00 0.00 C ATOM 207 C THR A 17 8.853 2.758 3.550 1.00 0.00 C ATOM 208 O THR A 17 9.077 2.521 2.363 1.00 0.00 O ATOM 209 CB THR A 17 10.676 1.709 4.874 1.00 0.00 C ATOM 210 OG1 THR A 17 11.017 0.568 5.677 1.00 0.00 O ATOM 211 CG2 THR A 17 11.148 2.979 5.569 1.00 0.00 C ATOM 0 H THR A 17 9.235 -0.065 3.593 1.00 0.00 H new ATOM 0 HA THR A 17 8.655 2.037 5.553 1.00 0.00 H new ATOM 0 HB THR A 17 11.173 1.638 3.906 1.00 0.00 H new ATOM 0 HG1 THR A 17 11.985 0.551 5.827 1.00 0.00 H new ATOM 0 HG21 THR A 17 12.225 2.927 5.729 1.00 0.00 H new ATOM 0 HG22 THR A 17 10.915 3.843 4.946 1.00 0.00 H new ATOM 0 HG23 THR A 17 10.643 3.077 6.530 1.00 0.00 H new ATOM 219 N VAL A 18 8.314 3.872 3.981 1.00 0.00 N ATOM 220 CA VAL A 18 8.052 4.994 3.093 1.00 0.00 C ATOM 221 C VAL A 18 9.332 5.800 2.875 1.00 0.00 C ATOM 222 O VAL A 18 9.910 6.344 3.815 1.00 0.00 O ATOM 223 CB VAL A 18 6.931 5.905 3.641 1.00 0.00 C ATOM 224 CG1 VAL A 18 6.776 7.157 2.781 1.00 0.00 C ATOM 225 CG2 VAL A 18 5.615 5.142 3.724 1.00 0.00 C ATOM 0 H VAL A 18 8.043 4.033 4.951 1.00 0.00 H new ATOM 0 HA VAL A 18 7.713 4.593 2.138 1.00 0.00 H new ATOM 0 HB VAL A 18 7.210 6.220 4.646 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.981 7.782 3.188 1.00 0.00 H new ATOM 0 HG12 VAL A 18 7.712 7.716 2.780 1.00 0.00 H new ATOM 0 HG13 VAL A 18 6.525 6.869 1.760 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.837 5.800 4.112 1.00 0.00 H new ATOM 0 HG22 VAL A 18 5.333 4.793 2.730 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.732 4.286 4.389 1.00 0.00 H new ATOM 235 N ASP A 19 9.763 5.852 1.623 1.00 0.00 N ATOM 236 CA ASP A 19 11.018 6.497 1.248 1.00 0.00 C ATOM 237 C ASP A 19 10.871 8.010 1.206 1.00 0.00 C ATOM 238 O ASP A 19 11.705 8.740 1.738 1.00 0.00 O ATOM 239 CB ASP A 19 11.480 5.985 -0.119 1.00 0.00 C ATOM 240 CG ASP A 19 12.712 6.709 -0.634 1.00 0.00 C ATOM 241 OD1 ASP A 19 13.815 6.475 -0.097 1.00 0.00 O ATOM 242 OD2 ASP A 19 12.586 7.503 -1.588 1.00 0.00 O ATOM 0 H ASP A 19 9.254 5.449 0.836 1.00 0.00 H new ATOM 0 HA ASP A 19 11.763 6.248 2.004 1.00 0.00 H new ATOM 0 HB2 ASP A 19 11.694 4.918 -0.049 1.00 0.00 H new ATOM 0 HB3 ASP A 19 10.669 6.101 -0.838 1.00 0.00 H new ATOM 247 N GLN A 20 9.806 8.474 0.574 1.00 0.00 N ATOM 248 CA GLN A 20 9.564 9.901 0.426 1.00 0.00 C ATOM 249 C GLN A 20 8.110 10.227 0.692 1.00 0.00 C ATOM 250 O GLN A 20 7.210 9.471 0.314 1.00 0.00 O ATOM 251 CB GLN A 20 9.967 10.374 -0.969 1.00 0.00 C ATOM 252 CG GLN A 20 11.460 10.597 -1.121 1.00 0.00 C ATOM 253 CD GLN A 20 11.868 10.831 -2.558 1.00 0.00 C ATOM 254 OE1 GLN A 20 11.864 11.963 -3.044 1.00 0.00 O ATOM 255 NE2 GLN A 20 12.235 9.762 -3.241 1.00 0.00 N ATOM 0 H GLN A 20 9.091 7.880 0.153 1.00 0.00 H new ATOM 0 HA GLN A 20 10.176 10.426 1.159 1.00 0.00 H new ATOM 0 HB2 GLN A 20 9.641 9.637 -1.703 1.00 0.00 H new ATOM 0 HB3 GLN A 20 9.443 11.303 -1.195 1.00 0.00 H new ATOM 0 HG2 GLN A 20 11.759 11.454 -0.518 1.00 0.00 H new ATOM 0 HG3 GLN A 20 11.995 9.731 -0.731 1.00 0.00 H new ATOM 0 HE21 GLN A 20 12.222 8.844 -2.797 1.00 0.00 H new ATOM 0 HE22 GLN A 20 12.531 9.854 -4.213 1.00 0.00 H new ATOM 264 N VAL A 21 7.893 11.345 1.363 1.00 0.00 N ATOM 265 CA VAL A 21 6.557 11.772 1.731 1.00 0.00 C ATOM 266 C VAL A 21 6.302 13.204 1.269 1.00 0.00 C ATOM 267 O VAL A 21 6.935 14.141 1.753 1.00 0.00 O ATOM 268 CB VAL A 21 6.339 11.697 3.257 1.00 0.00 C ATOM 269 CG1 VAL A 21 4.866 11.826 3.589 1.00 0.00 C ATOM 270 CG2 VAL A 21 6.908 10.411 3.836 1.00 0.00 C ATOM 0 H VAL A 21 8.634 11.978 1.666 1.00 0.00 H new ATOM 0 HA VAL A 21 5.859 11.094 1.239 1.00 0.00 H new ATOM 0 HB VAL A 21 6.874 12.531 3.712 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.730 11.771 4.669 1.00 0.00 H new ATOM 0 HG12 VAL A 21 4.493 12.783 3.225 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.313 11.016 3.112 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.738 10.390 4.912 1.00 0.00 H new ATOM 0 HG22 VAL A 21 6.416 9.555 3.374 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.979 10.365 3.637 1.00 0.00 H new ATOM 280 N ASP A 22 5.376 13.369 0.334 1.00 0.00 N ATOM 281 CA ASP A 22 5.031 14.691 -0.184 1.00 0.00 C ATOM 282 C ASP A 22 3.534 14.941 -0.031 1.00 0.00 C ATOM 283 O ASP A 22 2.862 14.239 0.721 1.00 0.00 O ATOM 284 CB ASP A 22 5.449 14.827 -1.653 1.00 0.00 C ATOM 285 CG ASP A 22 6.953 14.917 -1.827 1.00 0.00 C ATOM 286 OD1 ASP A 22 7.611 13.863 -1.960 1.00 0.00 O ATOM 287 OD2 ASP A 22 7.487 16.047 -1.837 1.00 0.00 O ATOM 0 H ASP A 22 4.848 12.603 -0.084 1.00 0.00 H new ATOM 0 HA ASP A 22 5.573 15.440 0.394 1.00 0.00 H new ATOM 0 HB2 ASP A 22 5.073 13.972 -2.214 1.00 0.00 H new ATOM 0 HB3 ASP A 22 4.984 15.717 -2.078 1.00 0.00 H new ATOM 292 N ASP A 23 3.019 15.953 -0.724 1.00 0.00 N ATOM 293 CA ASP A 23 1.607 16.320 -0.632 1.00 0.00 C ATOM 294 C ASP A 23 0.701 15.290 -1.292 1.00 0.00 C ATOM 295 O ASP A 23 -0.069 14.606 -0.627 1.00 0.00 O ATOM 296 CB ASP A 23 1.370 17.698 -1.268 1.00 0.00 C ATOM 297 CG ASP A 23 2.012 17.850 -2.634 1.00 0.00 C ATOM 298 OD1 ASP A 23 3.245 18.015 -2.693 1.00 0.00 O ATOM 299 OD2 ASP A 23 1.291 17.802 -3.651 1.00 0.00 O ATOM 0 H ASP A 23 3.562 16.538 -1.360 1.00 0.00 H new ATOM 0 HA ASP A 23 1.355 16.356 0.428 1.00 0.00 H new ATOM 0 HB2 ASP A 23 0.297 17.869 -1.358 1.00 0.00 H new ATOM 0 HB3 ASP A 23 1.761 18.469 -0.603 1.00 0.00 H new ATOM 304 N THR A 24 0.810 15.191 -2.598 1.00 0.00 N ATOM 305 CA THR A 24 -0.069 14.367 -3.400 1.00 0.00 C ATOM 306 C THR A 24 0.698 13.168 -3.951 1.00 0.00 C ATOM 307 O THR A 24 0.398 12.662 -5.029 1.00 0.00 O ATOM 308 CB THR A 24 -0.621 15.220 -4.553 1.00 0.00 C ATOM 309 OG1 THR A 24 0.466 15.847 -5.252 1.00 0.00 O ATOM 310 CG2 THR A 24 -1.545 16.298 -4.014 1.00 0.00 C ATOM 0 H THR A 24 1.519 15.685 -3.140 1.00 0.00 H new ATOM 0 HA THR A 24 -0.892 13.996 -2.789 1.00 0.00 H new ATOM 0 HB THR A 24 -1.177 14.572 -5.231 1.00 0.00 H new ATOM 0 HG1 THR A 24 0.767 16.633 -4.750 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.929 16.895 -4.841 1.00 0.00 H new ATOM 0 HG22 THR A 24 -2.377 15.833 -3.485 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.993 16.941 -3.328 1.00 0.00 H new ATOM 318 N SER A 25 1.671 12.706 -3.177 1.00 0.00 N ATOM 319 CA SER A 25 2.619 11.686 -3.617 1.00 0.00 C ATOM 320 C SER A 25 3.412 11.151 -2.422 1.00 0.00 C ATOM 321 O SER A 25 3.954 11.923 -1.633 1.00 0.00 O ATOM 322 CB SER A 25 3.601 12.257 -4.656 1.00 0.00 C ATOM 323 OG SER A 25 2.924 12.797 -5.782 1.00 0.00 O ATOM 0 H SER A 25 1.827 13.028 -2.222 1.00 0.00 H new ATOM 0 HA SER A 25 2.049 10.877 -4.074 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.210 13.033 -4.192 1.00 0.00 H new ATOM 0 HB3 SER A 25 4.281 11.471 -4.984 1.00 0.00 H new ATOM 0 HG SER A 25 1.990 12.501 -5.775 1.00 0.00 H new ATOM 329 N ILE A 26 3.470 9.835 -2.294 1.00 0.00 N ATOM 330 CA ILE A 26 4.246 9.182 -1.222 1.00 0.00 C ATOM 331 C ILE A 26 4.789 7.859 -1.745 1.00 0.00 C ATOM 332 O ILE A 26 4.133 7.215 -2.534 1.00 0.00 O ATOM 333 CB ILE A 26 3.384 8.924 0.050 1.00 0.00 C ATOM 334 CG1 ILE A 26 3.104 10.222 0.809 1.00 0.00 C ATOM 335 CG2 ILE A 26 4.049 7.924 0.982 1.00 0.00 C ATOM 336 CD1 ILE A 26 2.239 10.025 2.037 1.00 0.00 C ATOM 0 H ILE A 26 2.990 9.185 -2.917 1.00 0.00 H new ATOM 0 HA ILE A 26 5.060 9.849 -0.937 1.00 0.00 H new ATOM 0 HB ILE A 26 2.438 8.506 -0.293 1.00 0.00 H new ATOM 0 HG12 ILE A 26 4.051 10.671 1.109 1.00 0.00 H new ATOM 0 HG13 ILE A 26 2.615 10.928 0.138 1.00 0.00 H new ATOM 0 HG21 ILE A 26 3.419 7.769 1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 26 4.186 6.976 0.461 1.00 0.00 H new ATOM 0 HG23 ILE A 26 5.019 8.309 1.296 1.00 0.00 H new ATOM 0 HD11 ILE A 26 2.080 10.985 2.528 1.00 0.00 H new ATOM 0 HD12 ILE A 26 1.278 9.605 1.741 1.00 0.00 H new ATOM 0 HD13 ILE A 26 2.736 9.343 2.727 1.00 0.00 H new ATOM 348 N VAL A 27 5.972 7.438 -1.331 1.00 0.00 N ATOM 349 CA VAL A 27 6.528 6.212 -1.878 1.00 0.00 C ATOM 350 C VAL A 27 6.731 5.195 -0.781 1.00 0.00 C ATOM 351 O VAL A 27 7.309 5.512 0.249 1.00 0.00 O ATOM 352 CB VAL A 27 7.875 6.446 -2.569 1.00 0.00 C ATOM 353 CG1 VAL A 27 8.356 5.150 -3.205 1.00 0.00 C ATOM 354 CG2 VAL A 27 7.769 7.554 -3.604 1.00 0.00 C ATOM 0 H VAL A 27 6.552 7.911 -0.638 1.00 0.00 H new ATOM 0 HA VAL A 27 5.814 5.847 -2.616 1.00 0.00 H new ATOM 0 HB VAL A 27 8.604 6.763 -1.823 1.00 0.00 H new ATOM 0 HG11 VAL A 27 9.314 5.319 -3.696 1.00 0.00 H new ATOM 0 HG12 VAL A 27 8.473 4.388 -2.434 1.00 0.00 H new ATOM 0 HG13 VAL A 27 7.626 4.813 -3.941 1.00 0.00 H new ATOM 0 HG21 VAL A 27 8.738 7.701 -4.080 1.00 0.00 H new ATOM 0 HG22 VAL A 27 7.032 7.278 -4.358 1.00 0.00 H new ATOM 0 HG23 VAL A 27 7.460 8.479 -3.117 1.00 0.00 H new ATOM 364 N VAL A 28 6.278 3.972 -0.993 1.00 0.00 N ATOM 365 CA VAL A 28 6.427 2.954 0.029 1.00 0.00 C ATOM 366 C VAL A 28 7.081 1.709 -0.556 1.00 0.00 C ATOM 367 O VAL A 28 6.860 1.380 -1.718 1.00 0.00 O ATOM 368 CB VAL A 28 5.077 2.601 0.703 1.00 0.00 C ATOM 369 CG1 VAL A 28 4.068 3.718 0.560 1.00 0.00 C ATOM 370 CG2 VAL A 28 4.516 1.297 0.193 1.00 0.00 C ATOM 0 H VAL A 28 5.813 3.664 -1.847 1.00 0.00 H new ATOM 0 HA VAL A 28 7.074 3.362 0.806 1.00 0.00 H new ATOM 0 HB VAL A 28 5.283 2.476 1.766 1.00 0.00 H new ATOM 0 HG11 VAL A 28 3.136 3.431 1.046 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.457 4.622 1.028 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.883 3.908 -0.497 1.00 0.00 H new ATOM 0 HG21 VAL A 28 3.570 1.088 0.692 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.352 1.367 -0.882 1.00 0.00 H new ATOM 0 HG23 VAL A 28 5.221 0.492 0.400 1.00 0.00 H new ATOM 380 N ARG A 29 7.889 1.034 0.254 1.00 0.00 N ATOM 381 CA ARG A 29 8.661 -0.126 -0.192 1.00 0.00 C ATOM 382 C ARG A 29 8.466 -1.286 0.763 1.00 0.00 C ATOM 383 O ARG A 29 8.803 -1.192 1.940 1.00 0.00 O ATOM 384 CB ARG A 29 10.156 0.199 -0.245 1.00 0.00 C ATOM 385 CG ARG A 29 10.502 1.533 -0.880 1.00 0.00 C ATOM 386 CD ARG A 29 11.985 1.835 -0.728 1.00 0.00 C ATOM 387 NE ARG A 29 12.428 1.682 0.662 1.00 0.00 N ATOM 388 CZ ARG A 29 13.188 2.562 1.314 1.00 0.00 C ATOM 389 NH1 ARG A 29 13.635 3.649 0.701 1.00 0.00 N ATOM 390 NH2 ARG A 29 13.522 2.340 2.579 1.00 0.00 N ATOM 0 H ARG A 29 8.029 1.272 1.236 1.00 0.00 H new ATOM 0 HA ARG A 29 8.307 -0.391 -1.188 1.00 0.00 H new ATOM 0 HB2 ARG A 29 10.552 0.184 0.771 1.00 0.00 H new ATOM 0 HB3 ARG A 29 10.665 -0.591 -0.797 1.00 0.00 H new ATOM 0 HG2 ARG A 29 10.236 1.518 -1.937 1.00 0.00 H new ATOM 0 HG3 ARG A 29 9.915 2.325 -0.415 1.00 0.00 H new ATOM 0 HD2 ARG A 29 12.560 1.167 -1.369 1.00 0.00 H new ATOM 0 HD3 ARG A 29 12.186 2.852 -1.065 1.00 0.00 H new ATOM 0 HE ARG A 29 12.134 0.844 1.164 1.00 0.00 H new ATOM 0 HH11 ARG A 29 13.398 3.817 -0.277 1.00 0.00 H new ATOM 0 HH12 ARG A 29 14.216 4.317 1.207 1.00 0.00 H new ATOM 0 HH21 ARG A 29 13.197 1.497 3.052 1.00 0.00 H new ATOM 0 HH22 ARG A 29 14.103 3.013 3.079 1.00 0.00 H new ATOM 404 N TRP A 30 7.977 -2.388 0.234 1.00 0.00 N ATOM 405 CA TRP A 30 7.640 -3.554 1.042 1.00 0.00 C ATOM 406 C TRP A 30 8.584 -4.719 0.760 1.00 0.00 C ATOM 407 O TRP A 30 9.052 -4.897 -0.368 1.00 0.00 O ATOM 408 CB TRP A 30 6.183 -3.974 0.785 1.00 0.00 C ATOM 409 CG TRP A 30 5.854 -4.180 -0.654 1.00 0.00 C ATOM 410 CD1 TRP A 30 6.087 -5.292 -1.390 1.00 0.00 C ATOM 411 CD2 TRP A 30 5.193 -3.258 -1.516 1.00 0.00 C ATOM 412 NE1 TRP A 30 5.660 -5.106 -2.678 1.00 0.00 N ATOM 413 CE2 TRP A 30 5.088 -3.869 -2.776 1.00 0.00 C ATOM 414 CE3 TRP A 30 4.689 -1.974 -1.346 1.00 0.00 C ATOM 415 CZ2 TRP A 30 4.495 -3.237 -3.859 1.00 0.00 C ATOM 416 CZ3 TRP A 30 4.094 -1.354 -2.419 1.00 0.00 C ATOM 417 CH2 TRP A 30 4.000 -1.982 -3.658 1.00 0.00 C ATOM 0 H TRP A 30 7.800 -2.506 -0.764 1.00 0.00 H new ATOM 0 HA TRP A 30 7.753 -3.280 2.091 1.00 0.00 H new ATOM 0 HB2 TRP A 30 5.981 -4.897 1.329 1.00 0.00 H new ATOM 0 HB3 TRP A 30 5.519 -3.212 1.193 1.00 0.00 H new ATOM 0 HD1 TRP A 30 6.544 -6.196 -1.015 1.00 0.00 H new ATOM 0 HE1 TRP A 30 5.754 -5.780 -3.438 1.00 0.00 H new ATOM 0 HE3 TRP A 30 4.763 -1.474 -0.392 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 4.428 -3.719 -4.823 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 3.691 -0.359 -2.298 1.00 0.00 H new ATOM 0 HH2 TRP A 30 3.525 -1.464 -4.478 1.00 0.00 H new ATOM 428 N SER A 31 8.874 -5.502 1.791 1.00 0.00 N ATOM 429 CA SER A 31 9.675 -6.701 1.629 1.00 0.00 C ATOM 430 C SER A 31 8.755 -7.882 1.335 1.00 0.00 C ATOM 431 O SER A 31 8.252 -8.537 2.244 1.00 0.00 O ATOM 432 CB SER A 31 10.517 -6.964 2.881 1.00 0.00 C ATOM 433 OG SER A 31 11.484 -7.979 2.649 1.00 0.00 O ATOM 0 H SER A 31 8.565 -5.326 2.747 1.00 0.00 H new ATOM 0 HA SER A 31 10.362 -6.565 0.793 1.00 0.00 H new ATOM 0 HB2 SER A 31 11.017 -6.045 3.185 1.00 0.00 H new ATOM 0 HB3 SER A 31 9.866 -7.260 3.704 1.00 0.00 H new ATOM 0 HG SER A 31 12.008 -8.125 3.465 1.00 0.00 H new ATOM 439 N ARG A 32 8.539 -8.119 0.048 1.00 0.00 N ATOM 440 CA ARG A 32 7.598 -9.127 -0.458 1.00 0.00 C ATOM 441 C ARG A 32 7.715 -10.490 0.254 1.00 0.00 C ATOM 442 O ARG A 32 8.764 -10.840 0.801 1.00 0.00 O ATOM 443 CB ARG A 32 7.812 -9.292 -1.966 1.00 0.00 C ATOM 444 CG ARG A 32 9.255 -9.100 -2.388 1.00 0.00 C ATOM 445 CD ARG A 32 9.504 -7.700 -2.932 1.00 0.00 C ATOM 446 NE ARG A 32 10.929 -7.450 -3.146 1.00 0.00 N ATOM 447 CZ ARG A 32 11.495 -7.284 -4.343 1.00 0.00 C ATOM 448 NH1 ARG A 32 10.768 -7.377 -5.449 1.00 0.00 N ATOM 449 NH2 ARG A 32 12.792 -7.027 -4.428 1.00 0.00 N ATOM 0 H ARG A 32 9.019 -7.609 -0.694 1.00 0.00 H new ATOM 0 HA ARG A 32 6.590 -8.768 -0.248 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.481 -10.286 -2.267 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.186 -8.574 -2.496 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.910 -9.280 -1.536 1.00 0.00 H new ATOM 0 HG3 ARG A 32 9.512 -9.837 -3.149 1.00 0.00 H new ATOM 0 HD2 ARG A 32 8.967 -7.574 -3.872 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.105 -6.962 -2.235 1.00 0.00 H new ATOM 0 HE ARG A 32 11.531 -7.399 -2.324 1.00 0.00 H new ATOM 0 HH11 ARG A 32 9.770 -7.577 -5.388 1.00 0.00 H new ATOM 0 HH12 ARG A 32 11.208 -7.249 -6.360 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.355 -6.957 -3.580 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.228 -6.900 -5.341 1.00 0.00 H new ATOM 463 N PRO A 33 6.623 -11.286 0.224 1.00 0.00 N ATOM 464 CA PRO A 33 6.514 -12.549 0.956 1.00 0.00 C ATOM 465 C PRO A 33 7.290 -13.681 0.303 1.00 0.00 C ATOM 466 O PRO A 33 7.774 -13.560 -0.825 1.00 0.00 O ATOM 467 CB PRO A 33 5.008 -12.878 0.910 1.00 0.00 C ATOM 468 CG PRO A 33 4.346 -11.719 0.245 1.00 0.00 C ATOM 469 CD PRO A 33 5.407 -11.036 -0.552 1.00 0.00 C ATOM 0 HA PRO A 33 6.924 -12.449 1.961 1.00 0.00 H new ATOM 0 HB2 PRO A 33 4.828 -13.799 0.356 1.00 0.00 H new ATOM 0 HB3 PRO A 33 4.612 -13.028 1.914 1.00 0.00 H new ATOM 0 HG2 PRO A 33 3.530 -12.052 -0.397 1.00 0.00 H new ATOM 0 HG3 PRO A 33 3.915 -11.041 0.982 1.00 0.00 H new ATOM 0 HD2 PRO A 33 5.481 -11.446 -1.559 1.00 0.00 H new ATOM 0 HD3 PRO A 33 5.208 -9.969 -0.656 1.00 0.00 H new ATOM 477 N GLN A 34 7.402 -14.781 1.036 1.00 0.00 N ATOM 478 CA GLN A 34 8.006 -16.000 0.524 1.00 0.00 C ATOM 479 C GLN A 34 6.961 -16.793 -0.256 1.00 0.00 C ATOM 480 O GLN A 34 7.282 -17.705 -1.022 1.00 0.00 O ATOM 481 CB GLN A 34 8.570 -16.819 1.687 1.00 0.00 C ATOM 482 CG GLN A 34 9.153 -18.164 1.287 1.00 0.00 C ATOM 483 CD GLN A 34 9.720 -18.928 2.469 1.00 0.00 C ATOM 484 OE1 GLN A 34 10.900 -18.806 2.791 1.00 0.00 O ATOM 485 NE2 GLN A 34 8.880 -19.712 3.125 1.00 0.00 N ATOM 0 H GLN A 34 7.077 -14.852 2.000 1.00 0.00 H new ATOM 0 HA GLN A 34 8.827 -15.757 -0.151 1.00 0.00 H new ATOM 0 HB2 GLN A 34 9.345 -16.235 2.184 1.00 0.00 H new ATOM 0 HB3 GLN A 34 7.777 -16.984 2.417 1.00 0.00 H new ATOM 0 HG2 GLN A 34 8.379 -18.764 0.809 1.00 0.00 H new ATOM 0 HG3 GLN A 34 9.939 -18.010 0.548 1.00 0.00 H new ATOM 0 HE21 GLN A 34 7.908 -19.784 2.823 1.00 0.00 H new ATOM 0 HE22 GLN A 34 9.204 -20.245 3.932 1.00 0.00 H new ATOM 494 N ALA A 35 5.702 -16.423 -0.049 1.00 0.00 N ATOM 495 CA ALA A 35 4.585 -17.030 -0.753 1.00 0.00 C ATOM 496 C ALA A 35 4.644 -16.739 -2.243 1.00 0.00 C ATOM 497 O ALA A 35 5.088 -15.665 -2.654 1.00 0.00 O ATOM 498 CB ALA A 35 3.277 -16.490 -0.210 1.00 0.00 C ATOM 0 H ALA A 35 5.430 -15.695 0.611 1.00 0.00 H new ATOM 0 HA ALA A 35 4.647 -18.107 -0.599 1.00 0.00 H new ATOM 0 HB1 ALA A 35 2.444 -16.950 -0.743 1.00 0.00 H new ATOM 0 HB2 ALA A 35 3.201 -16.722 0.852 1.00 0.00 H new ATOM 0 HB3 ALA A 35 3.244 -15.409 -0.349 1.00 0.00 H new ATOM 504 N PRO A 36 4.221 -17.694 -3.080 1.00 0.00 N ATOM 505 CA PRO A 36 3.981 -17.422 -4.487 1.00 0.00 C ATOM 506 C PRO A 36 2.769 -16.508 -4.638 1.00 0.00 C ATOM 507 O PRO A 36 1.648 -16.882 -4.288 1.00 0.00 O ATOM 508 CB PRO A 36 3.698 -18.803 -5.094 1.00 0.00 C ATOM 509 CG PRO A 36 4.137 -19.789 -4.063 1.00 0.00 C ATOM 510 CD PRO A 36 3.974 -19.102 -2.738 1.00 0.00 C ATOM 0 HA PRO A 36 4.817 -16.921 -4.974 1.00 0.00 H new ATOM 0 HB2 PRO A 36 2.639 -18.921 -5.324 1.00 0.00 H new ATOM 0 HB3 PRO A 36 4.244 -18.941 -6.027 1.00 0.00 H new ATOM 0 HG2 PRO A 36 3.534 -20.696 -4.109 1.00 0.00 H new ATOM 0 HG3 PRO A 36 5.173 -20.086 -4.224 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.977 -19.250 -2.323 1.00 0.00 H new ATOM 0 HD3 PRO A 36 4.685 -19.471 -1.999 1.00 0.00 H new ATOM 518 N ILE A 37 3.011 -15.313 -5.146 1.00 0.00 N ATOM 519 CA ILE A 37 1.974 -14.304 -5.310 1.00 0.00 C ATOM 520 C ILE A 37 1.883 -13.922 -6.792 1.00 0.00 C ATOM 521 O ILE A 37 2.843 -14.115 -7.533 1.00 0.00 O ATOM 522 CB ILE A 37 2.302 -13.053 -4.449 1.00 0.00 C ATOM 523 CG1 ILE A 37 3.673 -12.504 -4.856 1.00 0.00 C ATOM 524 CG2 ILE A 37 2.248 -13.368 -2.940 1.00 0.00 C ATOM 525 CD1 ILE A 37 4.373 -11.710 -3.781 1.00 0.00 C ATOM 0 H ILE A 37 3.934 -15.012 -5.458 1.00 0.00 H new ATOM 0 HA ILE A 37 1.016 -14.705 -4.978 1.00 0.00 H new ATOM 0 HB ILE A 37 1.544 -12.292 -4.634 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.312 -13.337 -5.149 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.551 -11.872 -5.736 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.483 -12.468 -2.372 1.00 0.00 H new ATOM 0 HG22 ILE A 37 1.248 -13.713 -2.676 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.974 -14.146 -2.704 1.00 0.00 H new ATOM 0 HD11 ILE A 37 5.335 -11.360 -4.155 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.759 -10.854 -3.503 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.532 -12.342 -2.907 1.00 0.00 H new ATOM 537 N THR A 38 0.731 -13.422 -7.230 1.00 0.00 N ATOM 538 CA THR A 38 0.524 -13.069 -8.633 1.00 0.00 C ATOM 539 C THR A 38 0.570 -11.560 -8.877 1.00 0.00 C ATOM 540 O THR A 38 0.949 -11.114 -9.960 1.00 0.00 O ATOM 541 CB THR A 38 -0.810 -13.625 -9.162 1.00 0.00 C ATOM 542 OG1 THR A 38 -1.875 -13.305 -8.258 1.00 0.00 O ATOM 543 CG2 THR A 38 -0.724 -15.122 -9.359 1.00 0.00 C ATOM 0 H THR A 38 -0.077 -13.251 -6.631 1.00 0.00 H new ATOM 0 HA THR A 38 1.351 -13.526 -9.176 1.00 0.00 H new ATOM 0 HB THR A 38 -1.016 -13.162 -10.127 1.00 0.00 H new ATOM 0 HG1 THR A 38 -2.718 -13.663 -8.606 1.00 0.00 H new ATOM 0 HG21 THR A 38 -1.677 -15.495 -9.733 1.00 0.00 H new ATOM 0 HG22 THR A 38 0.063 -15.350 -10.078 1.00 0.00 H new ATOM 0 HG23 THR A 38 -0.495 -15.602 -8.407 1.00 0.00 H new ATOM 551 N GLY A 39 0.191 -10.770 -7.883 1.00 0.00 N ATOM 552 CA GLY A 39 0.213 -9.336 -8.045 1.00 0.00 C ATOM 553 C GLY A 39 0.183 -8.622 -6.719 1.00 0.00 C ATOM 554 O GLY A 39 0.362 -9.251 -5.684 1.00 0.00 O ATOM 0 H GLY A 39 -0.130 -11.097 -6.972 1.00 0.00 H new ATOM 0 HA2 GLY A 39 1.109 -9.046 -8.594 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -0.642 -9.025 -8.645 1.00 0.00 H new ATOM 558 N TYR A 40 -0.049 -7.318 -6.748 1.00 0.00 N ATOM 559 CA TYR A 40 -0.223 -6.534 -5.532 1.00 0.00 C ATOM 560 C TYR A 40 -1.323 -5.509 -5.692 1.00 0.00 C ATOM 561 O TYR A 40 -1.364 -4.781 -6.677 1.00 0.00 O ATOM 562 CB TYR A 40 1.051 -5.787 -5.157 1.00 0.00 C ATOM 563 CG TYR A 40 1.983 -6.564 -4.265 1.00 0.00 C ATOM 564 CD1 TYR A 40 2.457 -7.807 -4.637 1.00 0.00 C ATOM 565 CD2 TYR A 40 2.408 -6.038 -3.057 1.00 0.00 C ATOM 566 CE1 TYR A 40 3.327 -8.503 -3.837 1.00 0.00 C ATOM 567 CE2 TYR A 40 3.270 -6.734 -2.248 1.00 0.00 C ATOM 568 CZ TYR A 40 3.727 -7.963 -2.641 1.00 0.00 C ATOM 569 OH TYR A 40 4.601 -8.645 -1.847 1.00 0.00 O ATOM 0 H TYR A 40 -0.122 -6.775 -7.609 1.00 0.00 H new ATOM 0 HA TYR A 40 -0.481 -7.246 -4.748 1.00 0.00 H new ATOM 0 HB2 TYR A 40 1.582 -5.516 -6.070 1.00 0.00 H new ATOM 0 HB3 TYR A 40 0.780 -4.857 -4.658 1.00 0.00 H new ATOM 0 HD1 TYR A 40 2.137 -8.238 -5.574 1.00 0.00 H new ATOM 0 HD2 TYR A 40 2.056 -5.065 -2.747 1.00 0.00 H new ATOM 0 HE1 TYR A 40 3.695 -9.470 -4.147 1.00 0.00 H new ATOM 0 HE2 TYR A 40 3.587 -6.314 -1.305 1.00 0.00 H new ATOM 0 HH TYR A 40 5.158 -9.231 -2.401 1.00 0.00 H new ATOM 579 N ARG A 41 -2.209 -5.463 -4.723 1.00 0.00 N ATOM 580 CA ARG A 41 -3.168 -4.383 -4.625 1.00 0.00 C ATOM 581 C ARG A 41 -2.665 -3.398 -3.604 1.00 0.00 C ATOM 582 O ARG A 41 -1.975 -3.780 -2.678 1.00 0.00 O ATOM 583 CB ARG A 41 -4.511 -4.881 -4.169 1.00 0.00 C ATOM 584 CG ARG A 41 -4.826 -6.298 -4.612 1.00 0.00 C ATOM 585 CD ARG A 41 -5.300 -6.362 -6.050 1.00 0.00 C ATOM 586 NE ARG A 41 -4.225 -6.576 -7.017 1.00 0.00 N ATOM 587 CZ ARG A 41 -4.242 -7.552 -7.929 1.00 0.00 C ATOM 588 NH1 ARG A 41 -5.212 -8.461 -7.918 1.00 0.00 N ATOM 589 NH2 ARG A 41 -3.286 -7.629 -8.842 1.00 0.00 N ATOM 0 H ARG A 41 -2.286 -6.165 -3.987 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.279 -3.928 -5.609 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -4.555 -4.833 -3.081 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -5.283 -4.212 -4.549 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -3.937 -6.918 -4.498 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.593 -6.717 -3.961 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -6.029 -7.167 -6.147 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -5.816 -5.434 -6.294 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.421 -5.948 -6.994 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -5.946 -8.415 -7.212 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -5.222 -9.205 -8.616 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.533 -6.941 -8.851 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -3.303 -8.376 -9.536 1.00 0.00 H new ATOM 603 N ILE A 42 -2.951 -2.139 -3.782 1.00 0.00 N ATOM 604 CA ILE A 42 -2.479 -1.145 -2.826 1.00 0.00 C ATOM 605 C ILE A 42 -3.518 -0.085 -2.535 1.00 0.00 C ATOM 606 O ILE A 42 -3.723 0.802 -3.342 1.00 0.00 O ATOM 607 CB ILE A 42 -1.196 -0.474 -3.345 1.00 0.00 C ATOM 608 CG1 ILE A 42 -0.203 -1.538 -3.794 1.00 0.00 C ATOM 609 CG2 ILE A 42 -0.585 0.411 -2.268 1.00 0.00 C ATOM 610 CD1 ILE A 42 0.962 -1.004 -4.574 1.00 0.00 C ATOM 0 H ILE A 42 -3.497 -1.769 -4.560 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.274 -1.674 -1.895 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.446 0.156 -4.199 1.00 0.00 H new ATOM 0 HG12 ILE A 42 0.173 -2.062 -2.915 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.727 -2.274 -4.404 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.322 0.878 -2.652 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.299 1.184 -1.984 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.340 -0.194 -1.395 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.620 -1.827 -4.855 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.600 -0.506 -5.473 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.514 -0.291 -3.961 1.00 0.00 H new ATOM 622 N VAL A 43 -4.106 -0.130 -1.349 1.00 0.00 N ATOM 623 CA VAL A 43 -5.141 0.828 -0.990 1.00 0.00 C ATOM 624 C VAL A 43 -4.629 1.813 0.040 1.00 0.00 C ATOM 625 O VAL A 43 -4.384 1.460 1.187 1.00 0.00 O ATOM 626 CB VAL A 43 -6.415 0.150 -0.439 1.00 0.00 C ATOM 627 CG1 VAL A 43 -7.409 1.188 0.040 1.00 0.00 C ATOM 628 CG2 VAL A 43 -7.050 -0.737 -1.489 1.00 0.00 C ATOM 0 H VAL A 43 -3.887 -0.813 -0.624 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.403 1.349 -1.911 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.125 -0.471 0.408 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -8.299 0.690 0.424 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.958 1.786 0.832 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -7.687 1.837 -0.791 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.945 -1.204 -1.078 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.320 -0.136 -2.358 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.343 -1.510 -1.788 1.00 0.00 H new ATOM 638 N TYR A 44 -4.467 3.046 -0.377 1.00 0.00 N ATOM 639 CA TYR A 44 -4.064 4.102 0.517 1.00 0.00 C ATOM 640 C TYR A 44 -5.181 5.098 0.673 1.00 0.00 C ATOM 641 O TYR A 44 -5.732 5.614 -0.312 1.00 0.00 O ATOM 642 CB TYR A 44 -2.762 4.770 0.057 1.00 0.00 C ATOM 643 CG TYR A 44 -2.596 4.861 -1.441 1.00 0.00 C ATOM 644 CD1 TYR A 44 -2.270 3.735 -2.184 1.00 0.00 C ATOM 645 CD2 TYR A 44 -2.751 6.066 -2.110 1.00 0.00 C ATOM 646 CE1 TYR A 44 -2.100 3.800 -3.546 1.00 0.00 C ATOM 647 CE2 TYR A 44 -2.585 6.144 -3.476 1.00 0.00 C ATOM 648 CZ TYR A 44 -2.260 5.009 -4.190 1.00 0.00 C ATOM 649 OH TYR A 44 -2.093 5.090 -5.547 1.00 0.00 O ATOM 0 H TYR A 44 -4.610 3.344 -1.342 1.00 0.00 H new ATOM 0 HA TYR A 44 -3.857 3.666 1.494 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -2.717 5.775 0.476 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -1.919 4.215 0.469 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -2.147 2.787 -1.681 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -3.005 6.956 -1.553 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -1.844 2.913 -4.107 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -2.709 7.089 -3.985 1.00 0.00 H new ATOM 0 HH TYR A 44 -2.243 6.013 -5.841 1.00 0.00 H new ATOM 659 N SER A 45 -5.526 5.316 1.927 1.00 0.00 N ATOM 660 CA SER A 45 -6.658 6.152 2.282 1.00 0.00 C ATOM 661 C SER A 45 -6.332 7.013 3.505 1.00 0.00 C ATOM 662 O SER A 45 -5.677 6.551 4.442 1.00 0.00 O ATOM 663 CB SER A 45 -7.879 5.267 2.560 1.00 0.00 C ATOM 664 OG SER A 45 -9.064 6.035 2.679 1.00 0.00 O ATOM 0 H SER A 45 -5.032 4.920 2.727 1.00 0.00 H new ATOM 0 HA SER A 45 -6.880 6.820 1.450 1.00 0.00 H new ATOM 0 HB2 SER A 45 -7.994 4.542 1.755 1.00 0.00 H new ATOM 0 HB3 SER A 45 -7.718 4.701 3.478 1.00 0.00 H new ATOM 0 HG SER A 45 -9.823 5.440 2.854 1.00 0.00 H new ATOM 670 N PRO A 46 -6.779 8.278 3.509 1.00 0.00 N ATOM 671 CA PRO A 46 -6.571 9.206 4.619 1.00 0.00 C ATOM 672 C PRO A 46 -7.571 8.972 5.742 1.00 0.00 C ATOM 673 O PRO A 46 -8.708 8.559 5.509 1.00 0.00 O ATOM 674 CB PRO A 46 -6.808 10.579 3.991 1.00 0.00 C ATOM 675 CG PRO A 46 -7.158 10.345 2.559 1.00 0.00 C ATOM 676 CD PRO A 46 -7.559 8.912 2.445 1.00 0.00 C ATOM 0 HA PRO A 46 -5.584 9.092 5.066 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -7.613 11.105 4.504 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -5.917 11.201 4.074 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -7.971 11.001 2.247 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -6.308 10.562 1.912 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -8.631 8.778 2.593 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -7.318 8.500 1.465 1.00 0.00 H new ATOM 684 N SER A 47 -7.129 9.233 6.963 1.00 0.00 N ATOM 685 CA SER A 47 -7.968 9.061 8.138 1.00 0.00 C ATOM 686 C SER A 47 -9.063 10.130 8.210 1.00 0.00 C ATOM 687 O SER A 47 -10.139 9.886 8.751 1.00 0.00 O ATOM 688 CB SER A 47 -7.100 9.102 9.396 1.00 0.00 C ATOM 689 OG SER A 47 -6.007 8.203 9.283 1.00 0.00 O ATOM 0 H SER A 47 -6.187 9.567 7.166 1.00 0.00 H new ATOM 0 HA SER A 47 -8.462 8.092 8.067 1.00 0.00 H new ATOM 0 HB2 SER A 47 -6.729 10.115 9.555 1.00 0.00 H new ATOM 0 HB3 SER A 47 -7.702 8.843 10.267 1.00 0.00 H new ATOM 0 HG SER A 47 -5.463 8.245 10.097 1.00 0.00 H new ATOM 695 N VAL A 48 -8.782 11.317 7.677 1.00 0.00 N ATOM 696 CA VAL A 48 -9.765 12.397 7.683 1.00 0.00 C ATOM 697 C VAL A 48 -10.153 12.829 6.263 1.00 0.00 C ATOM 698 O VAL A 48 -11.324 13.081 5.980 1.00 0.00 O ATOM 699 CB VAL A 48 -9.253 13.616 8.485 1.00 0.00 C ATOM 700 CG1 VAL A 48 -7.863 14.019 8.027 1.00 0.00 C ATOM 701 CG2 VAL A 48 -10.213 14.789 8.365 1.00 0.00 C ATOM 0 H VAL A 48 -7.891 11.554 7.240 1.00 0.00 H new ATOM 0 HA VAL A 48 -10.657 12.005 8.171 1.00 0.00 H new ATOM 0 HB VAL A 48 -9.198 13.326 9.534 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.524 14.878 8.606 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -7.175 13.187 8.177 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -7.890 14.282 6.969 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.830 15.633 8.938 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -10.309 15.075 7.318 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -11.190 14.501 8.753 1.00 0.00 H new ATOM 711 N GLU A 49 -9.171 12.893 5.372 1.00 0.00 N ATOM 712 CA GLU A 49 -9.408 13.304 3.992 1.00 0.00 C ATOM 713 C GLU A 49 -10.049 12.163 3.201 1.00 0.00 C ATOM 714 O GLU A 49 -10.067 11.021 3.659 1.00 0.00 O ATOM 715 CB GLU A 49 -8.088 13.749 3.347 1.00 0.00 C ATOM 716 CG GLU A 49 -8.230 14.305 1.940 1.00 0.00 C ATOM 717 CD GLU A 49 -9.186 15.471 1.872 1.00 0.00 C ATOM 718 OE1 GLU A 49 -8.758 16.612 2.112 1.00 0.00 O ATOM 719 OE2 GLU A 49 -10.379 15.243 1.583 1.00 0.00 O ATOM 0 H GLU A 49 -8.199 12.665 5.581 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.098 14.148 3.983 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -7.627 14.508 3.979 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -7.406 12.899 3.321 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -7.252 14.620 1.577 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -8.578 13.515 1.274 1.00 0.00 H new ATOM 726 N GLY A 50 -10.572 12.467 2.021 1.00 0.00 N ATOM 727 CA GLY A 50 -11.294 11.471 1.263 1.00 0.00 C ATOM 728 C GLY A 50 -10.652 11.097 -0.061 1.00 0.00 C ATOM 729 O GLY A 50 -11.325 10.527 -0.919 1.00 0.00 O ATOM 0 H GLY A 50 -10.508 13.384 1.578 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -11.393 10.572 1.871 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -12.302 11.839 1.072 1.00 0.00 H new ATOM 733 N SER A 51 -9.369 11.400 -0.265 1.00 0.00 N ATOM 734 CA SER A 51 -8.725 10.928 -1.486 1.00 0.00 C ATOM 735 C SER A 51 -8.046 9.590 -1.206 1.00 0.00 C ATOM 736 O SER A 51 -7.056 9.520 -0.480 1.00 0.00 O ATOM 737 CB SER A 51 -7.708 11.966 -2.016 1.00 0.00 C ATOM 738 OG SER A 51 -7.460 11.772 -3.401 1.00 0.00 O ATOM 0 H SER A 51 -8.781 11.944 0.367 1.00 0.00 H new ATOM 0 HA SER A 51 -9.480 10.793 -2.260 1.00 0.00 H new ATOM 0 HB2 SER A 51 -8.090 12.973 -1.849 1.00 0.00 H new ATOM 0 HB3 SER A 51 -6.774 11.883 -1.460 1.00 0.00 H new ATOM 0 HG SER A 51 -6.501 11.871 -3.579 1.00 0.00 H new ATOM 744 N SER A 52 -8.586 8.540 -1.807 1.00 0.00 N ATOM 745 CA SER A 52 -8.063 7.190 -1.660 1.00 0.00 C ATOM 746 C SER A 52 -7.722 6.613 -3.020 1.00 0.00 C ATOM 747 O SER A 52 -8.356 6.963 -4.017 1.00 0.00 O ATOM 748 CB SER A 52 -9.079 6.301 -0.937 1.00 0.00 C ATOM 749 OG SER A 52 -10.358 6.397 -1.544 1.00 0.00 O ATOM 0 H SER A 52 -9.404 8.601 -2.414 1.00 0.00 H new ATOM 0 HA SER A 52 -7.153 7.228 -1.061 1.00 0.00 H new ATOM 0 HB2 SER A 52 -8.740 5.265 -0.956 1.00 0.00 H new ATOM 0 HB3 SER A 52 -9.146 6.596 0.110 1.00 0.00 H new ATOM 0 HG SER A 52 -10.991 5.820 -1.067 1.00 0.00 H new ATOM 755 N THR A 53 -6.715 5.765 -3.087 1.00 0.00 N ATOM 756 CA THR A 53 -6.385 5.128 -4.354 1.00 0.00 C ATOM 757 C THR A 53 -5.844 3.712 -4.148 1.00 0.00 C ATOM 758 O THR A 53 -5.190 3.430 -3.146 1.00 0.00 O ATOM 759 CB THR A 53 -5.376 5.983 -5.150 1.00 0.00 C ATOM 760 OG1 THR A 53 -5.907 7.304 -5.345 1.00 0.00 O ATOM 761 CG2 THR A 53 -5.069 5.359 -6.501 1.00 0.00 C ATOM 0 H THR A 53 -6.121 5.503 -2.301 1.00 0.00 H new ATOM 0 HA THR A 53 -7.306 5.050 -4.931 1.00 0.00 H new ATOM 0 HB THR A 53 -4.451 6.034 -4.576 1.00 0.00 H new ATOM 0 HG1 THR A 53 -5.263 7.844 -5.849 1.00 0.00 H new ATOM 0 HG21 THR A 53 -4.356 5.985 -7.037 1.00 0.00 H new ATOM 0 HG22 THR A 53 -4.643 4.366 -6.355 1.00 0.00 H new ATOM 0 HG23 THR A 53 -5.988 5.278 -7.081 1.00 0.00 H new ATOM 769 N GLU A 54 -6.165 2.826 -5.087 1.00 0.00 N ATOM 770 CA GLU A 54 -5.642 1.478 -5.105 1.00 0.00 C ATOM 771 C GLU A 54 -4.796 1.265 -6.356 1.00 0.00 C ATOM 772 O GLU A 54 -5.306 1.336 -7.478 1.00 0.00 O ATOM 773 CB GLU A 54 -6.782 0.453 -5.064 1.00 0.00 C ATOM 774 CG GLU A 54 -6.304 -0.994 -5.019 1.00 0.00 C ATOM 775 CD GLU A 54 -7.445 -1.992 -5.081 1.00 0.00 C ATOM 776 OE1 GLU A 54 -8.049 -2.135 -6.163 1.00 0.00 O ATOM 777 OE2 GLU A 54 -7.745 -2.639 -4.057 1.00 0.00 O ATOM 0 H GLU A 54 -6.800 3.032 -5.858 1.00 0.00 H new ATOM 0 HA GLU A 54 -5.019 1.338 -4.221 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -7.403 0.648 -4.190 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -7.414 0.590 -5.941 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.625 -1.174 -5.852 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -5.735 -1.156 -4.103 1.00 0.00 H new ATOM 784 N LEU A 55 -3.504 1.026 -6.171 1.00 0.00 N ATOM 785 CA LEU A 55 -2.632 0.721 -7.298 1.00 0.00 C ATOM 786 C LEU A 55 -2.454 -0.778 -7.425 1.00 0.00 C ATOM 787 O LEU A 55 -2.758 -1.527 -6.498 1.00 0.00 O ATOM 788 CB LEU A 55 -1.265 1.435 -7.204 1.00 0.00 C ATOM 789 CG LEU A 55 -1.343 2.953 -7.344 1.00 0.00 C ATOM 790 CD1 LEU A 55 0.029 3.561 -7.570 1.00 0.00 C ATOM 791 CD2 LEU A 55 -2.292 3.357 -8.465 1.00 0.00 C ATOM 0 H LEU A 55 -3.041 1.037 -5.262 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.116 1.102 -8.197 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.806 1.193 -6.246 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.608 1.043 -7.980 1.00 0.00 H new ATOM 0 HG LEU A 55 -1.736 3.342 -6.405 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -0.064 4.643 -7.665 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.675 3.325 -6.724 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.462 3.152 -8.483 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -2.326 4.444 -8.539 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.940 2.940 -9.408 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.291 2.977 -8.251 1.00 0.00 H new ATOM 803 N ASN A 56 -2.017 -1.215 -8.589 1.00 0.00 N ATOM 804 CA ASN A 56 -1.758 -2.622 -8.820 1.00 0.00 C ATOM 805 C ASN A 56 -0.345 -2.802 -9.335 1.00 0.00 C ATOM 806 O ASN A 56 0.014 -2.275 -10.387 1.00 0.00 O ATOM 807 CB ASN A 56 -2.764 -3.214 -9.812 1.00 0.00 C ATOM 808 CG ASN A 56 -2.488 -4.678 -10.110 1.00 0.00 C ATOM 809 OD1 ASN A 56 -1.917 -5.399 -9.292 1.00 0.00 O ATOM 810 ND2 ASN A 56 -2.902 -5.134 -11.278 1.00 0.00 N ATOM 0 H ASN A 56 -1.833 -0.614 -9.392 1.00 0.00 H new ATOM 0 HA ASN A 56 -1.869 -3.153 -7.875 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -3.771 -3.111 -9.409 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -2.733 -2.644 -10.741 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -2.752 -6.112 -11.526 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -3.372 -4.508 -11.932 1.00 0.00 H new ATOM 817 N LEU A 57 0.451 -3.542 -8.591 1.00 0.00 N ATOM 818 CA LEU A 57 1.837 -3.749 -8.937 1.00 0.00 C ATOM 819 C LEU A 57 2.036 -5.209 -9.277 1.00 0.00 C ATOM 820 O LEU A 57 1.206 -6.045 -8.933 1.00 0.00 O ATOM 821 CB LEU A 57 2.769 -3.326 -7.784 1.00 0.00 C ATOM 822 CG LEU A 57 2.843 -1.829 -7.487 1.00 0.00 C ATOM 823 CD1 LEU A 57 4.190 -1.490 -6.893 1.00 0.00 C ATOM 824 CD2 LEU A 57 2.596 -0.998 -8.724 1.00 0.00 C ATOM 0 H LEU A 57 0.156 -4.013 -7.736 1.00 0.00 H new ATOM 0 HA LEU A 57 2.090 -3.131 -9.798 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.447 -3.839 -6.878 1.00 0.00 H new ATOM 0 HB3 LEU A 57 3.775 -3.680 -8.010 1.00 0.00 H new ATOM 0 HG LEU A 57 2.057 -1.592 -6.770 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.237 -0.421 -6.683 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.330 -2.048 -5.967 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.976 -1.756 -7.599 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.657 0.060 -8.470 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.348 -1.234 -9.477 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.604 -1.219 -9.119 1.00 0.00 H new ATOM 836 N PRO A 58 3.099 -5.533 -10.005 1.00 0.00 N ATOM 837 CA PRO A 58 3.435 -6.918 -10.284 1.00 0.00 C ATOM 838 C PRO A 58 3.854 -7.646 -9.011 1.00 0.00 C ATOM 839 O PRO A 58 4.340 -7.035 -8.059 1.00 0.00 O ATOM 840 CB PRO A 58 4.599 -6.827 -11.277 1.00 0.00 C ATOM 841 CG PRO A 58 5.149 -5.448 -11.135 1.00 0.00 C ATOM 842 CD PRO A 58 4.029 -4.580 -10.630 1.00 0.00 C ATOM 0 HA PRO A 58 2.591 -7.481 -10.682 1.00 0.00 H new ATOM 0 HB2 PRO A 58 5.360 -7.576 -11.057 1.00 0.00 H new ATOM 0 HB3 PRO A 58 4.258 -7.009 -12.296 1.00 0.00 H new ATOM 0 HG2 PRO A 58 5.989 -5.437 -10.441 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.521 -5.080 -12.091 1.00 0.00 H new ATOM 0 HD2 PRO A 58 4.388 -3.842 -9.912 1.00 0.00 H new ATOM 0 HD3 PRO A 58 3.552 -4.030 -11.441 1.00 0.00 H new ATOM 850 N GLU A 59 3.623 -8.952 -9.008 1.00 0.00 N ATOM 851 CA GLU A 59 3.999 -9.847 -7.904 1.00 0.00 C ATOM 852 C GLU A 59 5.437 -9.634 -7.439 1.00 0.00 C ATOM 853 O GLU A 59 5.787 -9.940 -6.301 1.00 0.00 O ATOM 854 CB GLU A 59 3.855 -11.297 -8.356 1.00 0.00 C ATOM 855 CG GLU A 59 4.602 -11.599 -9.646 1.00 0.00 C ATOM 856 CD GLU A 59 4.696 -13.080 -9.936 1.00 0.00 C ATOM 857 OE1 GLU A 59 3.711 -13.660 -10.426 1.00 0.00 O ATOM 858 OE2 GLU A 59 5.766 -13.672 -9.671 1.00 0.00 O ATOM 0 H GLU A 59 3.163 -9.434 -9.780 1.00 0.00 H new ATOM 0 HA GLU A 59 3.334 -9.620 -7.070 1.00 0.00 H new ATOM 0 HB2 GLU A 59 4.223 -11.955 -7.568 1.00 0.00 H new ATOM 0 HB3 GLU A 59 2.798 -11.525 -8.494 1.00 0.00 H new ATOM 0 HG2 GLU A 59 4.100 -11.102 -10.476 1.00 0.00 H new ATOM 0 HG3 GLU A 59 5.607 -11.181 -9.585 1.00 0.00 H new ATOM 865 N THR A 60 6.255 -9.120 -8.333 1.00 0.00 N ATOM 866 CA THR A 60 7.674 -8.967 -8.081 1.00 0.00 C ATOM 867 C THR A 60 8.029 -7.503 -7.796 1.00 0.00 C ATOM 868 O THR A 60 9.195 -7.112 -7.823 1.00 0.00 O ATOM 869 CB THR A 60 8.492 -9.504 -9.278 1.00 0.00 C ATOM 870 OG1 THR A 60 9.888 -9.543 -8.964 1.00 0.00 O ATOM 871 CG2 THR A 60 8.263 -8.654 -10.519 1.00 0.00 C ATOM 0 H THR A 60 5.957 -8.797 -9.253 1.00 0.00 H new ATOM 0 HA THR A 60 7.928 -9.550 -7.196 1.00 0.00 H new ATOM 0 HB THR A 60 8.151 -10.519 -9.483 1.00 0.00 H new ATOM 0 HG1 THR A 60 10.135 -8.733 -8.471 1.00 0.00 H new ATOM 0 HG21 THR A 60 8.850 -9.053 -11.347 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.205 -8.672 -10.782 1.00 0.00 H new ATOM 0 HG23 THR A 60 8.570 -7.627 -10.319 1.00 0.00 H new ATOM 879 N ALA A 61 7.018 -6.696 -7.500 1.00 0.00 N ATOM 880 CA ALA A 61 7.243 -5.297 -7.171 1.00 0.00 C ATOM 881 C ALA A 61 7.529 -5.155 -5.689 1.00 0.00 C ATOM 882 O ALA A 61 7.227 -6.058 -4.904 1.00 0.00 O ATOM 883 CB ALA A 61 6.046 -4.449 -7.559 1.00 0.00 C ATOM 0 H ALA A 61 6.040 -6.985 -7.481 1.00 0.00 H new ATOM 0 HA ALA A 61 8.105 -4.944 -7.737 1.00 0.00 H new ATOM 0 HB1 ALA A 61 6.240 -3.407 -7.303 1.00 0.00 H new ATOM 0 HB2 ALA A 61 5.873 -4.533 -8.632 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.164 -4.797 -7.022 1.00 0.00 H new ATOM 889 N ASN A 62 8.111 -4.035 -5.300 1.00 0.00 N ATOM 890 CA ASN A 62 8.461 -3.827 -3.907 1.00 0.00 C ATOM 891 C ASN A 62 8.306 -2.372 -3.493 1.00 0.00 C ATOM 892 O ASN A 62 8.806 -1.978 -2.448 1.00 0.00 O ATOM 893 CB ASN A 62 9.897 -4.290 -3.644 1.00 0.00 C ATOM 894 CG ASN A 62 10.947 -3.368 -4.240 1.00 0.00 C ATOM 895 OD1 ASN A 62 11.271 -3.456 -5.426 1.00 0.00 O ATOM 896 ND2 ASN A 62 11.510 -2.498 -3.416 1.00 0.00 N ATOM 0 H ASN A 62 8.349 -3.263 -5.922 1.00 0.00 H new ATOM 0 HA ASN A 62 7.771 -4.421 -3.308 1.00 0.00 H new ATOM 0 HB2 ASN A 62 10.056 -4.362 -2.568 1.00 0.00 H new ATOM 0 HB3 ASN A 62 10.029 -5.291 -4.054 1.00 0.00 H new ATOM 0 HD21 ASN A 62 12.239 -1.871 -3.757 1.00 0.00 H new ATOM 0 HD22 ASN A 62 11.215 -2.455 -2.441 1.00 0.00 H new ATOM 903 N SER A 63 7.607 -1.574 -4.290 1.00 0.00 N ATOM 904 CA SER A 63 7.442 -0.167 -3.958 1.00 0.00 C ATOM 905 C SER A 63 6.393 0.502 -4.842 1.00 0.00 C ATOM 906 O SER A 63 6.404 0.334 -6.059 1.00 0.00 O ATOM 907 CB SER A 63 8.784 0.559 -4.106 1.00 0.00 C ATOM 908 OG SER A 63 9.363 0.301 -5.376 1.00 0.00 O ATOM 0 H SER A 63 7.154 -1.870 -5.154 1.00 0.00 H new ATOM 0 HA SER A 63 7.098 -0.104 -2.926 1.00 0.00 H new ATOM 0 HB2 SER A 63 8.637 1.632 -3.980 1.00 0.00 H new ATOM 0 HB3 SER A 63 9.465 0.236 -3.319 1.00 0.00 H new ATOM 0 HG SER A 63 8.654 0.216 -6.047 1.00 0.00 H new ATOM 914 N VAL A 64 5.502 1.270 -4.227 1.00 0.00 N ATOM 915 CA VAL A 64 4.483 2.013 -4.967 1.00 0.00 C ATOM 916 C VAL A 64 4.666 3.514 -4.766 1.00 0.00 C ATOM 917 O VAL A 64 5.002 3.970 -3.658 1.00 0.00 O ATOM 918 CB VAL A 64 3.038 1.632 -4.550 1.00 0.00 C ATOM 919 CG1 VAL A 64 2.867 1.715 -3.061 1.00 0.00 C ATOM 920 CG2 VAL A 64 2.033 2.510 -5.239 1.00 0.00 C ATOM 0 H VAL A 64 5.462 1.396 -3.216 1.00 0.00 H new ATOM 0 HA VAL A 64 4.615 1.747 -6.016 1.00 0.00 H new ATOM 0 HB VAL A 64 2.865 0.601 -4.858 1.00 0.00 H new ATOM 0 HG11 VAL A 64 1.845 1.443 -2.796 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.562 1.030 -2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 64 3.069 2.733 -2.728 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.028 2.224 -4.931 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.213 3.550 -4.969 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.128 2.394 -6.319 1.00 0.00 H new ATOM 930 N THR A 65 4.479 4.266 -5.846 1.00 0.00 N ATOM 931 CA THR A 65 4.372 5.697 -5.782 1.00 0.00 C ATOM 932 C THR A 65 2.896 6.101 -5.773 1.00 0.00 C ATOM 933 O THR A 65 2.219 6.087 -6.801 1.00 0.00 O ATOM 934 CB THR A 65 5.078 6.312 -6.994 1.00 0.00 C ATOM 935 OG1 THR A 65 6.489 6.060 -6.915 1.00 0.00 O ATOM 936 CG2 THR A 65 4.825 7.812 -7.099 1.00 0.00 C ATOM 0 H THR A 65 4.399 3.886 -6.789 1.00 0.00 H new ATOM 0 HA THR A 65 4.844 6.061 -4.869 1.00 0.00 H new ATOM 0 HB THR A 65 4.668 5.844 -7.889 1.00 0.00 H new ATOM 0 HG1 THR A 65 6.936 6.454 -7.693 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.344 8.208 -7.972 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.755 7.994 -7.199 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.195 8.307 -6.201 1.00 0.00 H new ATOM 944 N LEU A 66 2.404 6.419 -4.594 1.00 0.00 N ATOM 945 CA LEU A 66 1.038 6.867 -4.407 1.00 0.00 C ATOM 946 C LEU A 66 0.908 8.303 -4.864 1.00 0.00 C ATOM 947 O LEU A 66 1.803 9.119 -4.606 1.00 0.00 O ATOM 948 CB LEU A 66 0.644 6.791 -2.940 1.00 0.00 C ATOM 949 CG LEU A 66 1.478 5.864 -2.072 1.00 0.00 C ATOM 950 CD1 LEU A 66 1.233 6.170 -0.623 1.00 0.00 C ATOM 951 CD2 LEU A 66 1.139 4.420 -2.375 1.00 0.00 C ATOM 0 H LEU A 66 2.945 6.374 -3.730 1.00 0.00 H new ATOM 0 HA LEU A 66 0.384 6.220 -4.991 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.696 7.795 -2.518 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.397 6.473 -2.880 1.00 0.00 H new ATOM 0 HG LEU A 66 2.534 6.022 -2.291 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.833 5.503 -0.004 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.511 7.204 -0.417 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.177 6.026 -0.394 1.00 0.00 H new ATOM 0 HD21 LEU A 66 1.743 3.765 -1.747 1.00 0.00 H new ATOM 0 HD22 LEU A 66 0.083 4.244 -2.172 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.347 4.210 -3.424 1.00 0.00 H new ATOM 963 N SER A 67 -0.217 8.616 -5.487 1.00 0.00 N ATOM 964 CA SER A 67 -0.432 9.922 -6.072 1.00 0.00 C ATOM 965 C SER A 67 -1.838 10.414 -5.749 1.00 0.00 C ATOM 966 O SER A 67 -2.679 9.632 -5.296 1.00 0.00 O ATOM 967 CB SER A 67 -0.214 9.851 -7.586 1.00 0.00 C ATOM 968 OG SER A 67 -0.976 8.801 -8.164 1.00 0.00 O ATOM 0 H SER A 67 -1.001 7.973 -5.599 1.00 0.00 H new ATOM 0 HA SER A 67 0.282 10.630 -5.651 1.00 0.00 H new ATOM 0 HB2 SER A 67 -0.494 10.801 -8.042 1.00 0.00 H new ATOM 0 HB3 SER A 67 0.844 9.695 -7.797 1.00 0.00 H new ATOM 0 HG SER A 67 -0.820 8.778 -9.131 1.00 0.00 H new ATOM 974 N ASP A 68 -2.076 11.705 -5.976 1.00 0.00 N ATOM 975 CA ASP A 68 -3.370 12.331 -5.701 1.00 0.00 C ATOM 976 C ASP A 68 -3.720 12.258 -4.221 1.00 0.00 C ATOM 977 O ASP A 68 -4.874 12.040 -3.852 1.00 0.00 O ATOM 978 CB ASP A 68 -4.487 11.701 -6.542 1.00 0.00 C ATOM 979 CG ASP A 68 -4.441 12.136 -7.992 1.00 0.00 C ATOM 980 OD1 ASP A 68 -4.930 13.245 -8.294 1.00 0.00 O ATOM 981 OD2 ASP A 68 -3.929 11.372 -8.837 1.00 0.00 O ATOM 0 H ASP A 68 -1.379 12.346 -6.355 1.00 0.00 H new ATOM 0 HA ASP A 68 -3.282 13.381 -5.980 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.408 10.615 -6.490 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -5.453 11.971 -6.116 1.00 0.00 H new ATOM 986 N LEU A 69 -2.715 12.435 -3.374 1.00 0.00 N ATOM 987 CA LEU A 69 -2.935 12.486 -1.933 1.00 0.00 C ATOM 988 C LEU A 69 -3.318 13.906 -1.524 1.00 0.00 C ATOM 989 O LEU A 69 -3.484 14.784 -2.369 1.00 0.00 O ATOM 990 CB LEU A 69 -1.691 12.067 -1.143 1.00 0.00 C ATOM 991 CG LEU A 69 -0.857 10.933 -1.714 1.00 0.00 C ATOM 992 CD1 LEU A 69 0.364 10.728 -0.850 1.00 0.00 C ATOM 993 CD2 LEU A 69 -1.683 9.666 -1.755 1.00 0.00 C ATOM 0 H LEU A 69 -1.741 12.546 -3.658 1.00 0.00 H new ATOM 0 HA LEU A 69 -3.737 11.785 -1.703 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.047 12.940 -1.038 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.008 11.782 -0.140 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.542 11.182 -2.727 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.965 9.915 -1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.956 11.643 -0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.054 10.478 0.165 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.083 8.854 -2.165 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.003 9.407 -0.746 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.559 9.823 -2.384 1.00 0.00 H new ATOM 1005 N GLN A 70 -3.475 14.125 -0.232 1.00 0.00 N ATOM 1006 CA GLN A 70 -3.764 15.448 0.281 1.00 0.00 C ATOM 1007 C GLN A 70 -2.755 15.816 1.366 1.00 0.00 C ATOM 1008 O GLN A 70 -2.580 15.070 2.328 1.00 0.00 O ATOM 1009 CB GLN A 70 -5.185 15.484 0.834 1.00 0.00 C ATOM 1010 CG GLN A 70 -5.628 16.856 1.313 1.00 0.00 C ATOM 1011 CD GLN A 70 -5.743 17.861 0.186 1.00 0.00 C ATOM 1012 OE1 GLN A 70 -6.045 17.506 -0.954 1.00 0.00 O ATOM 1013 NE2 GLN A 70 -5.504 19.121 0.495 1.00 0.00 N ATOM 0 H GLN A 70 -3.407 13.400 0.482 1.00 0.00 H new ATOM 0 HA GLN A 70 -3.684 16.176 -0.526 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -5.873 15.141 0.062 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -5.259 14.780 1.663 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -6.592 16.767 1.815 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -4.917 17.225 2.052 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -5.257 19.373 1.452 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -5.567 19.843 -0.223 1.00 0.00 H new ATOM 1022 N PRO A 71 -2.064 16.961 1.204 1.00 0.00 N ATOM 1023 CA PRO A 71 -1.032 17.419 2.147 1.00 0.00 C ATOM 1024 C PRO A 71 -1.568 17.691 3.552 1.00 0.00 C ATOM 1025 O PRO A 71 -2.612 18.329 3.723 1.00 0.00 O ATOM 1026 CB PRO A 71 -0.515 18.717 1.528 1.00 0.00 C ATOM 1027 CG PRO A 71 -1.568 19.147 0.566 1.00 0.00 C ATOM 1028 CD PRO A 71 -2.226 17.891 0.075 1.00 0.00 C ATOM 0 HA PRO A 71 -0.268 16.653 2.283 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -0.348 19.476 2.292 1.00 0.00 H new ATOM 0 HB3 PRO A 71 0.437 18.558 1.022 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -2.292 19.802 1.049 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -1.133 19.708 -0.262 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -3.277 18.054 -0.164 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.748 17.513 -0.829 1.00 0.00 H new ATOM 1036 N GLY A 72 -0.839 17.204 4.550 1.00 0.00 N ATOM 1037 CA GLY A 72 -1.201 17.447 5.932 1.00 0.00 C ATOM 1038 C GLY A 72 -2.188 16.428 6.456 1.00 0.00 C ATOM 1039 O GLY A 72 -2.927 16.700 7.404 1.00 0.00 O ATOM 0 H GLY A 72 0.002 16.641 4.424 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -0.302 17.429 6.549 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -1.630 18.445 6.022 1.00 0.00 H new ATOM 1043 N VAL A 73 -2.202 15.250 5.845 1.00 0.00 N ATOM 1044 CA VAL A 73 -3.162 14.221 6.207 1.00 0.00 C ATOM 1045 C VAL A 73 -2.478 12.877 6.440 1.00 0.00 C ATOM 1046 O VAL A 73 -1.456 12.564 5.824 1.00 0.00 O ATOM 1047 CB VAL A 73 -4.233 14.051 5.115 1.00 0.00 C ATOM 1048 CG1 VAL A 73 -5.352 13.159 5.576 1.00 0.00 C ATOM 1049 CG2 VAL A 73 -4.827 15.371 4.702 1.00 0.00 C ATOM 0 H VAL A 73 -1.560 14.986 5.098 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.636 14.546 7.133 1.00 0.00 H new ATOM 0 HB VAL A 73 -3.725 13.599 4.264 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -6.090 13.061 4.780 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -4.954 12.175 5.825 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -5.824 13.593 6.457 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -5.578 15.206 3.930 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -5.292 15.847 5.565 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -4.041 16.017 4.311 1.00 0.00 H new ATOM 1059 N GLN A 74 -3.065 12.093 7.333 1.00 0.00 N ATOM 1060 CA GLN A 74 -2.568 10.784 7.689 1.00 0.00 C ATOM 1061 C GLN A 74 -2.981 9.775 6.629 1.00 0.00 C ATOM 1062 O GLN A 74 -4.160 9.432 6.520 1.00 0.00 O ATOM 1063 CB GLN A 74 -3.173 10.397 9.030 1.00 0.00 C ATOM 1064 CG GLN A 74 -2.389 9.346 9.806 1.00 0.00 C ATOM 1065 CD GLN A 74 -1.038 9.845 10.283 1.00 0.00 C ATOM 1066 OE1 GLN A 74 -0.927 10.429 11.359 1.00 0.00 O ATOM 1067 NE2 GLN A 74 0.003 9.602 9.504 1.00 0.00 N ATOM 0 H GLN A 74 -3.913 12.358 7.835 1.00 0.00 H new ATOM 0 HA GLN A 74 -1.480 10.797 7.756 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -3.260 11.293 9.645 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -4.184 10.026 8.863 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -2.976 9.025 10.667 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -2.244 8.470 9.174 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -0.126 9.115 8.617 1.00 0.00 H new ATOM 0 HE22 GLN A 74 0.935 9.902 9.790 1.00 0.00 H new ATOM 1076 N TYR A 75 -2.027 9.324 5.838 1.00 0.00 N ATOM 1077 CA TYR A 75 -2.321 8.381 4.778 1.00 0.00 C ATOM 1078 C TYR A 75 -1.948 6.966 5.163 1.00 0.00 C ATOM 1079 O TYR A 75 -0.784 6.654 5.403 1.00 0.00 O ATOM 1080 CB TYR A 75 -1.626 8.787 3.486 1.00 0.00 C ATOM 1081 CG TYR A 75 -2.543 9.555 2.573 1.00 0.00 C ATOM 1082 CD1 TYR A 75 -2.778 10.908 2.768 1.00 0.00 C ATOM 1083 CD2 TYR A 75 -3.204 8.912 1.537 1.00 0.00 C ATOM 1084 CE1 TYR A 75 -3.642 11.602 1.947 1.00 0.00 C ATOM 1085 CE2 TYR A 75 -4.073 9.597 0.718 1.00 0.00 C ATOM 1086 CZ TYR A 75 -4.287 10.939 0.924 1.00 0.00 C ATOM 1087 OH TYR A 75 -5.160 11.618 0.113 1.00 0.00 O ATOM 0 H TYR A 75 -1.046 9.594 5.909 1.00 0.00 H new ATOM 0 HA TYR A 75 -3.399 8.402 4.615 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.753 9.396 3.719 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -1.265 7.896 2.972 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -2.278 11.425 3.574 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -3.034 7.858 1.370 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.812 12.657 2.104 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -4.584 9.083 -0.082 1.00 0.00 H new ATOM 0 HH TYR A 75 -5.926 11.044 -0.096 1.00 0.00 H new ATOM 1097 N ASN A 76 -2.958 6.124 5.233 1.00 0.00 N ATOM 1098 CA ASN A 76 -2.773 4.718 5.526 1.00 0.00 C ATOM 1099 C ASN A 76 -2.557 3.956 4.231 1.00 0.00 C ATOM 1100 O ASN A 76 -3.479 3.825 3.420 1.00 0.00 O ATOM 1101 CB ASN A 76 -3.994 4.150 6.257 1.00 0.00 C ATOM 1102 CG ASN A 76 -4.328 4.906 7.529 1.00 0.00 C ATOM 1103 OD1 ASN A 76 -3.812 4.597 8.602 1.00 0.00 O ATOM 1104 ND2 ASN A 76 -5.214 5.887 7.425 1.00 0.00 N ATOM 0 H ASN A 76 -3.931 6.395 5.088 1.00 0.00 H new ATOM 0 HA ASN A 76 -1.901 4.608 6.171 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -4.855 4.176 5.589 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -3.811 3.103 6.500 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -5.490 6.415 8.253 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -5.620 6.114 6.517 1.00 0.00 H new ATOM 1111 N ILE A 77 -1.333 3.497 4.021 1.00 0.00 N ATOM 1112 CA ILE A 77 -1.013 2.672 2.869 1.00 0.00 C ATOM 1113 C ILE A 77 -1.150 1.215 3.237 1.00 0.00 C ATOM 1114 O ILE A 77 -0.437 0.703 4.100 1.00 0.00 O ATOM 1115 CB ILE A 77 0.414 2.913 2.329 1.00 0.00 C ATOM 1116 CG1 ILE A 77 0.618 4.351 1.884 1.00 0.00 C ATOM 1117 CG2 ILE A 77 0.737 1.988 1.166 1.00 0.00 C ATOM 1118 CD1 ILE A 77 1.055 5.292 2.985 1.00 0.00 C ATOM 0 H ILE A 77 -0.542 3.684 4.637 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.715 2.949 2.082 1.00 0.00 H new ATOM 0 HB ILE A 77 1.089 2.700 3.158 1.00 0.00 H new ATOM 0 HG12 ILE A 77 1.364 4.370 1.090 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.313 4.721 1.455 1.00 0.00 H new ATOM 0 HG21 ILE A 77 1.749 2.187 0.813 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.665 0.951 1.495 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.029 2.162 0.355 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.177 6.296 2.579 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.300 5.308 3.771 1.00 0.00 H new ATOM 0 HD13 ILE A 77 2.004 4.951 3.400 1.00 0.00 H new ATOM 1130 N THR A 78 -2.079 0.565 2.596 1.00 0.00 N ATOM 1131 CA THR A 78 -2.329 -0.819 2.833 1.00 0.00 C ATOM 1132 C THR A 78 -1.865 -1.651 1.641 1.00 0.00 C ATOM 1133 O THR A 78 -2.390 -1.503 0.531 1.00 0.00 O ATOM 1134 CB THR A 78 -3.823 -1.030 3.096 1.00 0.00 C ATOM 1135 OG1 THR A 78 -4.228 -0.229 4.217 1.00 0.00 O ATOM 1136 CG2 THR A 78 -4.135 -2.490 3.377 1.00 0.00 C ATOM 0 H THR A 78 -2.685 0.987 1.892 1.00 0.00 H new ATOM 0 HA THR A 78 -1.768 -1.144 3.710 1.00 0.00 H new ATOM 0 HB THR A 78 -4.372 -0.731 2.203 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.184 -0.362 4.385 1.00 0.00 H new ATOM 0 HG21 THR A 78 -5.203 -2.605 3.559 1.00 0.00 H new ATOM 0 HG22 THR A 78 -3.846 -3.096 2.518 1.00 0.00 H new ATOM 0 HG23 THR A 78 -3.580 -2.818 4.256 1.00 0.00 H new ATOM 1144 N ILE A 79 -0.874 -2.511 1.869 1.00 0.00 N ATOM 1145 CA ILE A 79 -0.342 -3.340 0.782 1.00 0.00 C ATOM 1146 C ILE A 79 -1.031 -4.702 0.802 1.00 0.00 C ATOM 1147 O ILE A 79 -1.295 -5.257 1.859 1.00 0.00 O ATOM 1148 CB ILE A 79 1.200 -3.587 0.841 1.00 0.00 C ATOM 1149 CG1 ILE A 79 2.042 -2.330 1.038 1.00 0.00 C ATOM 1150 CG2 ILE A 79 1.679 -4.235 -0.429 1.00 0.00 C ATOM 1151 CD1 ILE A 79 1.689 -1.172 0.145 1.00 0.00 C ATOM 0 H ILE A 79 -0.429 -2.653 2.776 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.541 -2.780 -0.132 1.00 0.00 H new ATOM 0 HB ILE A 79 1.335 -4.226 1.714 1.00 0.00 H new ATOM 0 HG12 ILE A 79 1.948 -2.009 2.075 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.089 -2.585 0.877 1.00 0.00 H new ATOM 0 HG21 ILE A 79 2.755 -4.399 -0.370 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.173 -5.191 -0.563 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.457 -3.585 -1.275 1.00 0.00 H new ATOM 0 HD11 ILE A 79 2.345 -0.330 0.365 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.812 -1.466 -0.897 1.00 0.00 H new ATOM 0 HD13 ILE A 79 0.653 -0.880 0.320 1.00 0.00 H new ATOM 1163 N TYR A 80 -1.330 -5.221 -0.366 1.00 0.00 N ATOM 1164 CA TYR A 80 -1.962 -6.519 -0.499 1.00 0.00 C ATOM 1165 C TYR A 80 -1.166 -7.381 -1.460 1.00 0.00 C ATOM 1166 O TYR A 80 -1.106 -7.084 -2.650 1.00 0.00 O ATOM 1167 CB TYR A 80 -3.377 -6.384 -1.069 1.00 0.00 C ATOM 1168 CG TYR A 80 -4.316 -5.475 -0.304 1.00 0.00 C ATOM 1169 CD1 TYR A 80 -4.396 -4.114 -0.591 1.00 0.00 C ATOM 1170 CD2 TYR A 80 -5.153 -5.990 0.676 1.00 0.00 C ATOM 1171 CE1 TYR A 80 -5.284 -3.300 0.080 1.00 0.00 C ATOM 1172 CE2 TYR A 80 -6.038 -5.178 1.355 1.00 0.00 C ATOM 1173 CZ TYR A 80 -6.102 -3.836 1.052 1.00 0.00 C ATOM 1174 OH TYR A 80 -6.993 -3.025 1.718 1.00 0.00 O ATOM 0 H TYR A 80 -1.143 -4.756 -1.255 1.00 0.00 H new ATOM 0 HA TYR A 80 -2.002 -6.969 0.493 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -3.302 -6.017 -2.093 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.824 -7.377 -1.118 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -3.754 -3.691 -1.349 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.111 -7.043 0.911 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -5.339 -2.247 -0.155 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -6.677 -5.593 2.120 1.00 0.00 H new ATOM 0 HH TYR A 80 -7.495 -3.557 2.370 1.00 0.00 H new ATOM 1184 N ALA A 81 -0.556 -8.439 -0.967 1.00 0.00 N ATOM 1185 CA ALA A 81 0.058 -9.404 -1.858 1.00 0.00 C ATOM 1186 C ALA A 81 -1.015 -10.369 -2.315 1.00 0.00 C ATOM 1187 O ALA A 81 -1.655 -11.025 -1.501 1.00 0.00 O ATOM 1188 CB ALA A 81 1.217 -10.140 -1.172 1.00 0.00 C ATOM 0 H ALA A 81 -0.472 -8.652 0.027 1.00 0.00 H new ATOM 0 HA ALA A 81 0.486 -8.892 -2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.655 -10.856 -1.867 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.976 -9.419 -0.867 1.00 0.00 H new ATOM 0 HB3 ALA A 81 0.844 -10.668 -0.294 1.00 0.00 H new ATOM 1194 N VAL A 82 -1.246 -10.427 -3.608 1.00 0.00 N ATOM 1195 CA VAL A 82 -2.333 -11.256 -4.125 1.00 0.00 C ATOM 1196 C VAL A 82 -1.774 -12.440 -4.875 1.00 0.00 C ATOM 1197 O VAL A 82 -0.774 -12.303 -5.563 1.00 0.00 O ATOM 1198 CB VAL A 82 -3.299 -10.465 -5.044 1.00 0.00 C ATOM 1199 CG1 VAL A 82 -2.571 -9.838 -6.201 1.00 0.00 C ATOM 1200 CG2 VAL A 82 -4.407 -11.356 -5.576 1.00 0.00 C ATOM 0 H VAL A 82 -0.712 -9.923 -4.316 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.907 -11.598 -3.264 1.00 0.00 H new ATOM 0 HB VAL A 82 -3.737 -9.676 -4.433 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -3.279 -9.292 -6.824 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.813 -9.151 -5.825 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.092 -10.617 -6.794 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -5.067 -10.772 -6.217 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -3.972 -12.173 -6.152 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -4.978 -11.764 -4.742 1.00 0.00 H new ATOM 1210 N GLU A 83 -2.405 -13.599 -4.726 1.00 0.00 N ATOM 1211 CA GLU A 83 -1.984 -14.781 -5.450 1.00 0.00 C ATOM 1212 C GLU A 83 -3.144 -15.335 -6.268 1.00 0.00 C ATOM 1213 O GLU A 83 -4.278 -14.873 -6.126 1.00 0.00 O ATOM 1214 CB GLU A 83 -1.401 -15.857 -4.535 1.00 0.00 C ATOM 1215 CG GLU A 83 -1.125 -15.405 -3.130 1.00 0.00 C ATOM 1216 CD GLU A 83 -2.242 -15.764 -2.176 1.00 0.00 C ATOM 1217 OE1 GLU A 83 -2.561 -16.973 -2.077 1.00 0.00 O ATOM 1218 OE2 GLU A 83 -2.801 -14.857 -1.526 1.00 0.00 O ATOM 0 H GLU A 83 -3.207 -13.740 -4.111 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.181 -14.479 -6.123 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -2.092 -16.700 -4.502 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.473 -16.223 -4.973 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.196 -15.856 -2.783 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.977 -14.325 -3.122 1.00 0.00 H new ATOM 1225 N GLU A 84 -2.835 -16.309 -7.124 1.00 0.00 N ATOM 1226 CA GLU A 84 -3.763 -16.845 -8.128 1.00 0.00 C ATOM 1227 C GLU A 84 -5.223 -16.881 -7.665 1.00 0.00 C ATOM 1228 O GLU A 84 -6.096 -16.312 -8.323 1.00 0.00 O ATOM 1229 CB GLU A 84 -3.332 -18.255 -8.529 1.00 0.00 C ATOM 1230 CG GLU A 84 -1.912 -18.332 -9.066 1.00 0.00 C ATOM 1231 CD GLU A 84 -1.536 -19.731 -9.508 1.00 0.00 C ATOM 1232 OE1 GLU A 84 -1.994 -20.168 -10.583 1.00 0.00 O ATOM 1233 OE2 GLU A 84 -0.778 -20.404 -8.781 1.00 0.00 O ATOM 0 H GLU A 84 -1.919 -16.757 -7.142 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.717 -16.163 -8.977 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -3.419 -18.912 -7.663 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -4.018 -18.633 -9.287 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.807 -17.648 -9.908 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -1.217 -17.998 -8.296 1.00 0.00 H new ATOM 1240 N ASN A 85 -5.490 -17.536 -6.543 1.00 0.00 N ATOM 1241 CA ASN A 85 -6.868 -17.717 -6.095 1.00 0.00 C ATOM 1242 C ASN A 85 -7.097 -17.179 -4.688 1.00 0.00 C ATOM 1243 O ASN A 85 -8.118 -17.486 -4.069 1.00 0.00 O ATOM 1244 CB ASN A 85 -7.259 -19.198 -6.139 1.00 0.00 C ATOM 1245 CG ASN A 85 -7.457 -19.718 -7.550 1.00 0.00 C ATOM 1246 OD1 ASN A 85 -8.556 -19.639 -8.103 1.00 0.00 O ATOM 1247 ND2 ASN A 85 -6.405 -20.267 -8.139 1.00 0.00 N ATOM 0 H ASN A 85 -4.783 -17.946 -5.933 1.00 0.00 H new ATOM 0 HA ASN A 85 -7.495 -17.147 -6.780 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -6.485 -19.787 -5.646 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -8.179 -19.342 -5.572 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.488 -20.643 -9.083 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -5.512 -20.314 -7.648 1.00 0.00 H new ATOM 1254 N GLN A 86 -6.170 -16.375 -4.175 1.00 0.00 N ATOM 1255 CA GLN A 86 -6.296 -15.870 -2.810 1.00 0.00 C ATOM 1256 C GLN A 86 -5.727 -14.460 -2.671 1.00 0.00 C ATOM 1257 O GLN A 86 -5.086 -13.934 -3.583 1.00 0.00 O ATOM 1258 CB GLN A 86 -5.567 -16.783 -1.823 1.00 0.00 C ATOM 1259 CG GLN A 86 -6.079 -18.214 -1.764 1.00 0.00 C ATOM 1260 CD GLN A 86 -5.336 -19.077 -0.754 1.00 0.00 C ATOM 1261 OE1 GLN A 86 -5.912 -19.997 -0.171 1.00 0.00 O ATOM 1262 NE2 GLN A 86 -4.051 -18.810 -0.544 1.00 0.00 N ATOM 0 H GLN A 86 -5.336 -16.063 -4.673 1.00 0.00 H new ATOM 0 HA GLN A 86 -7.362 -15.848 -2.584 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -4.509 -16.803 -2.085 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -5.640 -16.347 -0.827 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -7.139 -18.203 -1.512 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -5.991 -18.665 -2.752 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -3.602 -18.041 -1.042 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -3.514 -19.374 0.115 1.00 0.00 H new ATOM 1271 N GLU A 87 -5.977 -13.866 -1.513 1.00 0.00 N ATOM 1272 CA GLU A 87 -5.405 -12.578 -1.147 1.00 0.00 C ATOM 1273 C GLU A 87 -4.728 -12.701 0.212 1.00 0.00 C ATOM 1274 O GLU A 87 -5.353 -13.130 1.187 1.00 0.00 O ATOM 1275 CB GLU A 87 -6.484 -11.495 -1.080 1.00 0.00 C ATOM 1276 CG GLU A 87 -7.208 -11.247 -2.393 1.00 0.00 C ATOM 1277 CD GLU A 87 -8.221 -10.128 -2.280 1.00 0.00 C ATOM 1278 OE1 GLU A 87 -9.298 -10.350 -1.680 1.00 0.00 O ATOM 1279 OE2 GLU A 87 -7.951 -9.018 -2.784 1.00 0.00 O ATOM 0 H GLU A 87 -6.585 -14.265 -0.798 1.00 0.00 H new ATOM 0 HA GLU A 87 -4.679 -12.292 -1.908 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -7.216 -11.775 -0.323 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -6.026 -10.563 -0.750 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -6.481 -11.001 -3.167 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -7.711 -12.161 -2.708 1.00 0.00 H new ATOM 1286 N SER A 88 -3.455 -12.347 0.275 1.00 0.00 N ATOM 1287 CA SER A 88 -2.686 -12.467 1.503 1.00 0.00 C ATOM 1288 C SER A 88 -3.044 -11.352 2.488 1.00 0.00 C ATOM 1289 O SER A 88 -3.913 -10.521 2.209 1.00 0.00 O ATOM 1290 CB SER A 88 -1.190 -12.438 1.187 1.00 0.00 C ATOM 1291 OG SER A 88 -0.868 -13.384 0.181 1.00 0.00 O ATOM 0 H SER A 88 -2.930 -11.972 -0.515 1.00 0.00 H new ATOM 0 HA SER A 88 -2.933 -13.420 1.971 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.903 -11.439 0.858 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.619 -12.653 2.090 1.00 0.00 H new ATOM 0 HG SER A 88 -0.987 -12.976 -0.702 1.00 0.00 H new ATOM 1297 N THR A 89 -2.379 -11.344 3.636 1.00 0.00 N ATOM 1298 CA THR A 89 -2.645 -10.362 4.673 1.00 0.00 C ATOM 1299 C THR A 89 -2.233 -8.954 4.230 1.00 0.00 C ATOM 1300 O THR A 89 -1.415 -8.789 3.324 1.00 0.00 O ATOM 1301 CB THR A 89 -1.923 -10.752 5.978 1.00 0.00 C ATOM 1302 OG1 THR A 89 -0.611 -11.246 5.688 1.00 0.00 O ATOM 1303 CG2 THR A 89 -2.710 -11.812 6.729 1.00 0.00 C ATOM 0 H THR A 89 -1.646 -12.013 3.871 1.00 0.00 H new ATOM 0 HA THR A 89 -3.720 -10.350 4.856 1.00 0.00 H new ATOM 0 HB THR A 89 -1.844 -9.862 6.603 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.161 -11.489 6.524 1.00 0.00 H new ATOM 0 HG21 THR A 89 -2.184 -12.074 7.647 1.00 0.00 H new ATOM 0 HG22 THR A 89 -3.699 -11.425 6.975 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.813 -12.699 6.104 1.00 0.00 H new ATOM 1311 N PRO A 90 -2.856 -7.922 4.813 1.00 0.00 N ATOM 1312 CA PRO A 90 -2.555 -6.531 4.487 1.00 0.00 C ATOM 1313 C PRO A 90 -1.419 -5.901 5.310 1.00 0.00 C ATOM 1314 O PRO A 90 -1.274 -6.147 6.508 1.00 0.00 O ATOM 1315 CB PRO A 90 -3.878 -5.838 4.800 1.00 0.00 C ATOM 1316 CG PRO A 90 -4.459 -6.620 5.931 1.00 0.00 C ATOM 1317 CD PRO A 90 -3.951 -8.028 5.793 1.00 0.00 C ATOM 0 HA PRO A 90 -2.199 -6.436 3.461 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -3.723 -4.796 5.078 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -4.541 -5.841 3.935 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -4.161 -6.194 6.889 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.548 -6.597 5.897 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.596 -8.419 6.747 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.734 -8.702 5.444 1.00 0.00 H new ATOM 1325 N VAL A 91 -0.623 -5.088 4.625 1.00 0.00 N ATOM 1326 CA VAL A 91 0.290 -4.134 5.242 1.00 0.00 C ATOM 1327 C VAL A 91 -0.488 -2.883 5.578 1.00 0.00 C ATOM 1328 O VAL A 91 -1.197 -2.385 4.715 1.00 0.00 O ATOM 1329 CB VAL A 91 1.369 -3.681 4.251 1.00 0.00 C ATOM 1330 CG1 VAL A 91 1.984 -2.369 4.714 1.00 0.00 C ATOM 1331 CG2 VAL A 91 2.437 -4.736 4.063 1.00 0.00 C ATOM 0 H VAL A 91 -0.594 -5.074 3.606 1.00 0.00 H new ATOM 0 HA VAL A 91 0.739 -4.615 6.111 1.00 0.00 H new ATOM 0 HB VAL A 91 0.893 -3.528 3.283 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.749 -2.055 4.004 1.00 0.00 H new ATOM 0 HG12 VAL A 91 1.209 -1.605 4.774 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.435 -2.505 5.697 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.183 -4.377 3.354 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.916 -4.943 5.020 1.00 0.00 H new ATOM 0 HG23 VAL A 91 1.982 -5.650 3.680 1.00 0.00 H new ATOM 1341 N VAL A 92 -0.364 -2.363 6.787 1.00 0.00 N ATOM 1342 CA VAL A 92 -0.924 -1.054 7.074 1.00 0.00 C ATOM 1343 C VAL A 92 0.155 -0.131 7.632 1.00 0.00 C ATOM 1344 O VAL A 92 0.590 -0.283 8.773 1.00 0.00 O ATOM 1345 CB VAL A 92 -2.110 -1.119 8.059 1.00 0.00 C ATOM 1346 CG1 VAL A 92 -2.817 0.226 8.107 1.00 0.00 C ATOM 1347 CG2 VAL A 92 -3.087 -2.220 7.671 1.00 0.00 C ATOM 0 H VAL A 92 0.108 -2.815 7.570 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.303 -0.659 6.132 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.721 -1.353 9.050 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.653 0.173 8.804 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.117 0.993 8.438 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.188 0.477 7.114 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -3.912 -2.242 8.383 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -3.476 -2.026 6.671 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.574 -3.182 7.681 1.00 0.00 H new ATOM 1357 N ILE A 93 0.589 0.815 6.812 1.00 0.00 N ATOM 1358 CA ILE A 93 1.588 1.795 7.215 1.00 0.00 C ATOM 1359 C ILE A 93 1.029 3.207 7.082 1.00 0.00 C ATOM 1360 O ILE A 93 0.768 3.679 5.977 1.00 0.00 O ATOM 1361 CB ILE A 93 2.895 1.663 6.389 1.00 0.00 C ATOM 1362 CG1 ILE A 93 2.592 1.480 4.906 1.00 0.00 C ATOM 1363 CG2 ILE A 93 3.728 0.502 6.904 1.00 0.00 C ATOM 1364 CD1 ILE A 93 3.798 1.706 4.031 1.00 0.00 C ATOM 0 H ILE A 93 0.261 0.925 5.853 1.00 0.00 H new ATOM 0 HA ILE A 93 1.833 1.599 8.259 1.00 0.00 H new ATOM 0 HB ILE A 93 3.464 2.586 6.506 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.212 0.472 4.739 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.802 2.171 4.613 1.00 0.00 H new ATOM 0 HG21 ILE A 93 4.642 0.421 6.316 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.984 0.673 7.950 1.00 0.00 H new ATOM 0 HG23 ILE A 93 3.157 -0.422 6.817 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.522 1.562 2.986 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.165 2.723 4.172 1.00 0.00 H new ATOM 0 HD13 ILE A 93 4.581 0.997 4.300 1.00 0.00 H new ATOM 1376 N GLN A 94 0.817 3.868 8.209 1.00 0.00 N ATOM 1377 CA GLN A 94 0.226 5.198 8.200 1.00 0.00 C ATOM 1378 C GLN A 94 1.291 6.286 8.282 1.00 0.00 C ATOM 1379 O GLN A 94 1.985 6.436 9.287 1.00 0.00 O ATOM 1380 CB GLN A 94 -0.804 5.348 9.326 1.00 0.00 C ATOM 1381 CG GLN A 94 -0.299 4.938 10.701 1.00 0.00 C ATOM 1382 CD GLN A 94 -1.389 5.000 11.751 1.00 0.00 C ATOM 1383 OE1 GLN A 94 -1.578 6.025 12.411 1.00 0.00 O ATOM 1384 NE2 GLN A 94 -2.115 3.905 11.911 1.00 0.00 N ATOM 0 H GLN A 94 1.043 3.509 9.136 1.00 0.00 H new ATOM 0 HA GLN A 94 -0.292 5.321 7.249 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -1.130 6.387 9.367 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -1.681 4.749 9.081 1.00 0.00 H new ATOM 0 HG2 GLN A 94 0.100 3.925 10.653 1.00 0.00 H new ATOM 0 HG3 GLN A 94 0.523 5.591 10.994 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -1.924 3.079 11.343 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -2.865 3.887 12.602 1.00 0.00 H new ATOM 1393 N GLN A 95 1.412 7.033 7.200 1.00 0.00 N ATOM 1394 CA GLN A 95 2.371 8.118 7.103 1.00 0.00 C ATOM 1395 C GLN A 95 1.645 9.407 6.731 1.00 0.00 C ATOM 1396 O GLN A 95 0.835 9.417 5.808 1.00 0.00 O ATOM 1397 CB GLN A 95 3.420 7.779 6.040 1.00 0.00 C ATOM 1398 CG GLN A 95 4.855 7.775 6.551 1.00 0.00 C ATOM 1399 CD GLN A 95 5.319 9.115 7.101 1.00 0.00 C ATOM 1400 OE1 GLN A 95 6.170 9.169 7.986 1.00 0.00 O ATOM 1401 NE2 GLN A 95 4.763 10.206 6.595 1.00 0.00 N ATOM 0 H GLN A 95 0.846 6.904 6.361 1.00 0.00 H new ATOM 0 HA GLN A 95 2.869 8.255 8.063 1.00 0.00 H new ATOM 0 HB2 GLN A 95 3.193 6.798 5.623 1.00 0.00 H new ATOM 0 HB3 GLN A 95 3.339 8.498 5.225 1.00 0.00 H new ATOM 0 HG2 GLN A 95 4.950 7.021 7.332 1.00 0.00 H new ATOM 0 HG3 GLN A 95 5.518 7.478 5.739 1.00 0.00 H new ATOM 0 HE21 GLN A 95 4.059 10.126 5.861 1.00 0.00 H new ATOM 0 HE22 GLN A 95 5.039 11.126 6.940 1.00 0.00 H new ATOM 1410 N GLU A 96 1.918 10.485 7.450 1.00 0.00 N ATOM 1411 CA GLU A 96 1.262 11.753 7.170 1.00 0.00 C ATOM 1412 C GLU A 96 2.016 12.516 6.102 1.00 0.00 C ATOM 1413 O GLU A 96 3.233 12.692 6.186 1.00 0.00 O ATOM 1414 CB GLU A 96 1.146 12.615 8.427 1.00 0.00 C ATOM 1415 CG GLU A 96 0.553 13.991 8.158 1.00 0.00 C ATOM 1416 CD GLU A 96 0.613 14.905 9.359 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -0.251 14.780 10.250 1.00 0.00 O ATOM 1418 OE2 GLU A 96 1.519 15.763 9.412 1.00 0.00 O ATOM 0 H GLU A 96 2.582 10.508 8.224 1.00 0.00 H new ATOM 0 HA GLU A 96 0.257 11.527 6.814 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.527 12.097 9.159 1.00 0.00 H new ATOM 0 HB3 GLU A 96 2.134 12.733 8.871 1.00 0.00 H new ATOM 0 HG2 GLU A 96 1.087 14.455 7.329 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -0.485 13.878 7.846 1.00 0.00 H new ATOM 1425 N THR A 97 1.278 12.961 5.106 1.00 0.00 N ATOM 1426 CA THR A 97 1.828 13.716 4.003 1.00 0.00 C ATOM 1427 C THR A 97 2.476 15.011 4.488 1.00 0.00 C ATOM 1428 O THR A 97 1.813 15.877 5.062 1.00 0.00 O ATOM 1429 CB THR A 97 0.718 14.042 2.998 1.00 0.00 C ATOM 1430 OG1 THR A 97 -0.409 14.573 3.705 1.00 0.00 O ATOM 1431 CG2 THR A 97 0.296 12.801 2.226 1.00 0.00 C ATOM 0 H THR A 97 0.272 12.807 5.040 1.00 0.00 H new ATOM 0 HA THR A 97 2.596 13.109 3.524 1.00 0.00 H new ATOM 0 HB THR A 97 1.096 14.774 2.284 1.00 0.00 H new ATOM 0 HG1 THR A 97 -1.217 14.463 3.162 1.00 0.00 H new ATOM 0 HG21 THR A 97 -0.493 13.062 1.520 1.00 0.00 H new ATOM 0 HG22 THR A 97 1.152 12.402 1.682 1.00 0.00 H new ATOM 0 HG23 THR A 97 -0.074 12.048 2.922 1.00 0.00 H new ATOM 1439 N THR A 98 3.777 15.127 4.265 1.00 0.00 N ATOM 1440 CA THR A 98 4.521 16.308 4.666 1.00 0.00 C ATOM 1441 C THR A 98 4.140 17.489 3.784 1.00 0.00 C ATOM 1442 O THR A 98 4.127 18.637 4.227 1.00 0.00 O ATOM 1443 CB THR A 98 6.036 16.052 4.562 1.00 0.00 C ATOM 1444 OG1 THR A 98 6.375 14.877 5.312 1.00 0.00 O ATOM 1445 CG2 THR A 98 6.840 17.238 5.078 1.00 0.00 C ATOM 0 H THR A 98 4.341 14.412 3.805 1.00 0.00 H new ATOM 0 HA THR A 98 4.273 16.537 5.702 1.00 0.00 H new ATOM 0 HB THR A 98 6.284 15.909 3.510 1.00 0.00 H new ATOM 0 HG1 THR A 98 7.339 14.713 5.245 1.00 0.00 H new ATOM 0 HG21 THR A 98 7.905 17.022 4.989 1.00 0.00 H new ATOM 0 HG22 THR A 98 6.599 18.124 4.490 1.00 0.00 H new ATOM 0 HG23 THR A 98 6.592 17.418 6.124 1.00 0.00 H new ATOM 1453 N GLY A 99 3.805 17.179 2.540 1.00 0.00 N ATOM 1454 CA GLY A 99 3.353 18.188 1.609 1.00 0.00 C ATOM 1455 C GLY A 99 4.437 19.174 1.248 1.00 0.00 C ATOM 1456 O GLY A 99 5.446 18.805 0.644 1.00 0.00 O ATOM 0 H GLY A 99 3.840 16.234 2.157 1.00 0.00 H new ATOM 0 HA2 GLY A 99 2.991 17.704 0.702 1.00 0.00 H new ATOM 0 HA3 GLY A 99 2.509 18.725 2.042 1.00 0.00 H new ATOM 1460 N THR A 100 4.231 20.422 1.621 1.00 0.00 N ATOM 1461 CA THR A 100 5.199 21.466 1.358 1.00 0.00 C ATOM 1462 C THR A 100 6.136 21.633 2.550 1.00 0.00 C ATOM 1463 O THR A 100 5.683 21.884 3.669 1.00 0.00 O ATOM 1464 CB THR A 100 4.491 22.802 1.077 1.00 0.00 C ATOM 1465 OG1 THR A 100 3.467 22.612 0.091 1.00 0.00 O ATOM 1466 CG2 THR A 100 5.473 23.846 0.597 1.00 0.00 C ATOM 0 H THR A 100 3.394 20.738 2.111 1.00 0.00 H new ATOM 0 HA THR A 100 5.778 21.177 0.481 1.00 0.00 H new ATOM 0 HB THR A 100 4.043 23.153 2.007 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.018 23.466 -0.083 1.00 0.00 H new ATOM 0 HG21 THR A 100 4.946 24.781 0.406 1.00 0.00 H new ATOM 0 HG22 THR A 100 6.234 24.008 1.360 1.00 0.00 H new ATOM 0 HG23 THR A 100 5.948 23.503 -0.322 1.00 0.00 H new ATOM 1474 N PRO A 101 7.451 21.464 2.333 1.00 0.00 N ATOM 1475 CA PRO A 101 8.455 21.677 3.377 1.00 0.00 C ATOM 1476 C PRO A 101 8.353 23.081 3.959 1.00 0.00 C ATOM 1477 O PRO A 101 8.297 24.063 3.218 1.00 0.00 O ATOM 1478 CB PRO A 101 9.788 21.492 2.646 1.00 0.00 C ATOM 1479 CG PRO A 101 9.459 20.668 1.451 1.00 0.00 C ATOM 1480 CD PRO A 101 8.060 21.052 1.057 1.00 0.00 C ATOM 0 HA PRO A 101 8.333 20.995 4.218 1.00 0.00 H new ATOM 0 HB2 PRO A 101 10.217 22.452 2.358 1.00 0.00 H new ATOM 0 HB3 PRO A 101 10.520 20.993 3.280 1.00 0.00 H new ATOM 0 HG2 PRO A 101 10.160 20.861 0.639 1.00 0.00 H new ATOM 0 HG3 PRO A 101 9.522 19.604 1.681 1.00 0.00 H new ATOM 0 HD2 PRO A 101 8.055 21.863 0.328 1.00 0.00 H new ATOM 0 HD3 PRO A 101 7.525 20.216 0.607 1.00 0.00 H new ATOM 1488 N ARG A 102 8.322 23.172 5.279 1.00 0.00 N ATOM 1489 CA ARG A 102 8.139 24.452 5.952 1.00 0.00 C ATOM 1490 C ARG A 102 9.466 25.196 6.077 1.00 0.00 C ATOM 1491 O ARG A 102 9.826 25.669 7.156 1.00 0.00 O ATOM 1492 CB ARG A 102 7.521 24.249 7.340 1.00 0.00 C ATOM 1493 CG ARG A 102 6.206 23.483 7.327 1.00 0.00 C ATOM 1494 CD ARG A 102 5.154 24.168 6.468 1.00 0.00 C ATOM 1495 NE ARG A 102 3.887 23.440 6.481 1.00 0.00 N ATOM 1496 CZ ARG A 102 2.905 23.624 5.598 1.00 0.00 C ATOM 1497 NH1 ARG A 102 3.035 24.515 4.619 1.00 0.00 N ATOM 1498 NH2 ARG A 102 1.791 22.912 5.692 1.00 0.00 N ATOM 0 H ARG A 102 8.421 22.375 5.908 1.00 0.00 H new ATOM 0 HA ARG A 102 7.459 25.053 5.348 1.00 0.00 H new ATOM 0 HB2 ARG A 102 8.234 23.716 7.969 1.00 0.00 H new ATOM 0 HB3 ARG A 102 7.357 25.224 7.799 1.00 0.00 H new ATOM 0 HG2 ARG A 102 6.378 22.474 6.953 1.00 0.00 H new ATOM 0 HG3 ARG A 102 5.834 23.385 8.347 1.00 0.00 H new ATOM 0 HD2 ARG A 102 4.994 25.184 6.830 1.00 0.00 H new ATOM 0 HD3 ARG A 102 5.517 24.248 5.443 1.00 0.00 H new ATOM 0 HE ARG A 102 3.744 22.745 7.214 1.00 0.00 H new ATOM 0 HH11 ARG A 102 3.891 25.064 4.539 1.00 0.00 H new ATOM 0 HH12 ARG A 102 2.279 24.649 3.948 1.00 0.00 H new ATOM 0 HH21 ARG A 102 1.686 22.225 6.439 1.00 0.00 H new ATOM 0 HH22 ARG A 102 1.038 23.051 5.018 1.00 0.00 H new ATOM 1512 N SER A 103 10.186 25.295 4.970 1.00 0.00 N ATOM 1513 CA SER A 103 11.461 25.992 4.945 1.00 0.00 C ATOM 1514 C SER A 103 11.252 27.486 5.166 1.00 0.00 C ATOM 1515 O SER A 103 12.030 28.140 5.858 1.00 0.00 O ATOM 1516 CB SER A 103 12.160 25.741 3.611 1.00 0.00 C ATOM 1517 OG SER A 103 12.250 24.349 3.344 1.00 0.00 O ATOM 0 H SER A 103 9.906 24.899 4.073 1.00 0.00 H new ATOM 0 HA SER A 103 12.090 25.612 5.750 1.00 0.00 H new ATOM 0 HB2 SER A 103 11.612 26.235 2.809 1.00 0.00 H new ATOM 0 HB3 SER A 103 13.159 26.178 3.630 1.00 0.00 H new ATOM 0 HG SER A 103 12.699 24.209 2.484 1.00 0.00 H new ATOM 1523 N ASP A 104 10.184 28.015 4.588 1.00 0.00 N ATOM 1524 CA ASP A 104 9.842 29.417 4.755 1.00 0.00 C ATOM 1525 C ASP A 104 8.823 29.576 5.872 1.00 0.00 C ATOM 1526 O ASP A 104 8.238 28.593 6.332 1.00 0.00 O ATOM 1527 CB ASP A 104 9.287 30.006 3.455 1.00 0.00 C ATOM 1528 CG ASP A 104 10.307 30.007 2.335 1.00 0.00 C ATOM 1529 OD1 ASP A 104 11.344 30.690 2.475 1.00 0.00 O ATOM 1530 OD2 ASP A 104 10.077 29.330 1.309 1.00 0.00 O ATOM 0 H ASP A 104 9.538 27.491 3.997 1.00 0.00 H new ATOM 0 HA ASP A 104 10.751 29.959 5.016 1.00 0.00 H new ATOM 0 HB2 ASP A 104 8.413 29.434 3.145 1.00 0.00 H new ATOM 0 HB3 ASP A 104 8.951 31.027 3.637 1.00 0.00 H new ATOM 1535 N GLY A 105 8.618 30.809 6.310 1.00 0.00 N ATOM 1536 CA GLY A 105 7.670 31.075 7.371 1.00 0.00 C ATOM 1537 C GLY A 105 8.228 30.737 8.738 1.00 0.00 C ATOM 1538 O GLY A 105 7.497 30.299 9.624 1.00 0.00 O ATOM 0 H GLY A 105 9.095 31.634 5.947 1.00 0.00 H new ATOM 0 HA2 GLY A 105 7.387 32.127 7.347 1.00 0.00 H new ATOM 0 HA3 GLY A 105 6.763 30.496 7.198 1.00 0.00 H new ATOM 1542 N THR A 106 9.524 30.940 8.909 1.00 0.00 N ATOM 1543 CA THR A 106 10.182 30.630 10.167 1.00 0.00 C ATOM 1544 C THR A 106 10.457 31.909 10.960 1.00 0.00 C ATOM 1545 O THR A 106 9.670 32.219 11.881 1.00 0.00 O ATOM 1546 CB THR A 106 11.496 29.862 9.925 1.00 0.00 C ATOM 1547 OG1 THR A 106 11.245 28.745 9.058 1.00 0.00 O ATOM 1548 CG2 THR A 106 12.087 29.362 11.236 1.00 0.00 C ATOM 1549 OXT THR A 106 11.443 32.614 10.647 1.00 0.00 O ATOM 0 H THR A 106 10.142 31.319 8.191 1.00 0.00 H new ATOM 0 HA THR A 106 9.514 29.995 10.748 1.00 0.00 H new ATOM 0 HB THR A 106 12.211 30.542 9.462 1.00 0.00 H new ATOM 0 HG1 THR A 106 12.081 28.257 8.902 1.00 0.00 H new ATOM 0 HG21 THR A 106 13.013 28.824 11.036 1.00 0.00 H new ATOM 0 HG22 THR A 106 12.294 30.210 11.889 1.00 0.00 H new ATOM 0 HG23 THR A 106 11.377 28.694 11.724 1.00 0.00 H new TER 1557 THR A 106