USER MOD reduce.3.24.130724 H: found=0, std=0, add=801, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 799 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 14 SER OG : rot 180:sc= -0.942 USER MOD Set 1.2: A 25 GLN : amide:sc= 0 K(o=-0.94,f=-2.1!) USER MOD Single : A 1 MET CE :methyl 128:sc= -0.157 (180deg=-0.938) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0131 USER MOD Single : A 6 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 CYS SG : rot -164:sc= -7.27! USER MOD Single : A 17 CYS SG : rot 180:sc= -0.153 USER MOD Single : A 29 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.261) USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 32 SER OG : rot -150:sc= -0.897 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.173 USER MOD Single : A 44 ASN : amide:sc= -0.853 X(o=-0.85,f=-1.2) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.662 K(o=-0.66,f=-1.5) USER MOD Single : A 52 ASN : amide:sc= -0.119 X(o=-0.12,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 180:sc= -0.53 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.00163 USER MOD Single : A 86 ASN : amide:sc= -0.0342 K(o=-0.034,f=-1.3) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot -126:sc= 1.29 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS : no HD1:sc= -2.14 K(o=-2.1,f=-2.8!) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.0155 K(o=-0.015,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 94.715 15.947 -8.674 1.00 0.00 N ATOM 2 CA GLY A -1 94.608 14.464 -8.556 1.00 0.00 C ATOM 3 C GLY A -1 94.169 13.875 -9.897 1.00 0.00 C ATOM 4 O GLY A -1 93.091 13.321 -10.015 1.00 0.00 O ATOM 0 H1 GLY A -1 95.014 16.347 -7.762 1.00 0.00 H new ATOM 0 H2 GLY A -1 95.416 16.188 -9.404 1.00 0.00 H new ATOM 0 H3 GLY A -1 93.790 16.342 -8.939 1.00 0.00 H new ATOM 0 HA2 GLY A -1 95.568 14.042 -8.259 1.00 0.00 H new ATOM 0 HA3 GLY A -1 93.890 14.201 -7.779 1.00 0.00 H new ATOM 10 N ALA A 0 94.997 13.991 -10.906 1.00 0.00 N ATOM 11 CA ALA A 0 94.637 13.441 -12.251 1.00 0.00 C ATOM 12 C ALA A 0 94.455 11.923 -12.169 1.00 0.00 C ATOM 13 O ALA A 0 93.641 11.350 -12.871 1.00 0.00 O ATOM 14 CB ALA A 0 95.817 13.787 -13.165 1.00 0.00 C ATOM 0 H ALA A 0 95.909 14.444 -10.856 1.00 0.00 H new ATOM 0 HA ALA A 0 93.702 13.859 -12.624 1.00 0.00 H new ATOM 0 HB1 ALA A 0 95.621 13.413 -14.170 1.00 0.00 H new ATOM 0 HB2 ALA A 0 95.946 14.869 -13.199 1.00 0.00 H new ATOM 0 HB3 ALA A 0 96.725 13.326 -12.777 1.00 0.00 H new ATOM 20 N MET A 1 95.208 11.272 -11.315 1.00 0.00 N ATOM 21 CA MET A 1 95.089 9.789 -11.175 1.00 0.00 C ATOM 22 C MET A 1 94.008 9.439 -10.147 1.00 0.00 C ATOM 23 O MET A 1 93.951 10.016 -9.077 1.00 0.00 O ATOM 24 CB MET A 1 96.462 9.327 -10.686 1.00 0.00 C ATOM 25 CG MET A 1 97.514 9.631 -11.754 1.00 0.00 C ATOM 26 SD MET A 1 99.099 8.907 -11.264 1.00 0.00 S ATOM 27 CE MET A 1 98.665 7.178 -11.576 1.00 0.00 C ATOM 0 H MET A 1 95.902 11.707 -10.707 1.00 0.00 H new ATOM 0 HA MET A 1 94.805 9.307 -12.111 1.00 0.00 H new ATOM 0 HB2 MET A 1 96.717 9.833 -9.755 1.00 0.00 H new ATOM 0 HB3 MET A 1 96.443 8.258 -10.473 1.00 0.00 H new ATOM 0 HG2 MET A 1 97.199 9.226 -12.716 1.00 0.00 H new ATOM 0 HG3 MET A 1 97.618 10.709 -11.881 1.00 0.00 H new ATOM 0 HE1 MET A 1 99.423 6.722 -12.213 1.00 0.00 H new ATOM 0 HE2 MET A 1 98.614 6.639 -10.630 1.00 0.00 H new ATOM 0 HE3 MET A 1 97.696 7.130 -12.073 1.00 0.00 H new ATOM 37 N GLY A 2 93.155 8.498 -10.470 1.00 0.00 N ATOM 38 CA GLY A 2 92.077 8.092 -9.519 1.00 0.00 C ATOM 39 C GLY A 2 92.014 6.558 -9.437 1.00 0.00 C ATOM 40 O GLY A 2 92.521 5.883 -10.311 1.00 0.00 O ATOM 0 H GLY A 2 93.160 7.992 -11.356 1.00 0.00 H new ATOM 0 HA2 GLY A 2 92.272 8.512 -8.532 1.00 0.00 H new ATOM 0 HA3 GLY A 2 91.117 8.488 -9.850 1.00 0.00 H new ATOM 44 N PRO A 3 91.395 6.040 -8.389 1.00 0.00 N ATOM 45 CA PRO A 3 91.280 4.566 -8.247 1.00 0.00 C ATOM 46 C PRO A 3 90.315 4.003 -9.297 1.00 0.00 C ATOM 47 O PRO A 3 89.240 3.530 -8.975 1.00 0.00 O ATOM 48 CB PRO A 3 90.727 4.371 -6.835 1.00 0.00 C ATOM 49 CG PRO A 3 90.059 5.664 -6.490 1.00 0.00 C ATOM 50 CD PRO A 3 90.758 6.750 -7.262 1.00 0.00 C ATOM 0 HA PRO A 3 92.228 4.049 -8.396 1.00 0.00 H new ATOM 0 HB2 PRO A 3 90.020 3.542 -6.801 1.00 0.00 H new ATOM 0 HB3 PRO A 3 91.524 4.140 -6.129 1.00 0.00 H new ATOM 0 HG2 PRO A 3 89.000 5.630 -6.748 1.00 0.00 H new ATOM 0 HG3 PRO A 3 90.120 5.854 -5.418 1.00 0.00 H new ATOM 0 HD2 PRO A 3 90.055 7.505 -7.613 1.00 0.00 H new ATOM 0 HD3 PRO A 3 91.496 7.264 -6.647 1.00 0.00 H new ATOM 58 N THR A 4 90.696 4.055 -10.551 1.00 0.00 N ATOM 59 CA THR A 4 89.811 3.526 -11.635 1.00 0.00 C ATOM 60 C THR A 4 90.164 2.069 -11.980 1.00 0.00 C ATOM 61 O THR A 4 89.736 1.553 -12.996 1.00 0.00 O ATOM 62 CB THR A 4 90.074 4.435 -12.839 1.00 0.00 C ATOM 63 OG1 THR A 4 91.450 4.370 -13.187 1.00 0.00 O ATOM 64 CG2 THR A 4 89.699 5.877 -12.491 1.00 0.00 C ATOM 0 H THR A 4 91.584 4.442 -10.870 1.00 0.00 H new ATOM 0 HA THR A 4 88.764 3.526 -11.333 1.00 0.00 H new ATOM 0 HB THR A 4 89.469 4.102 -13.682 1.00 0.00 H new ATOM 0 HG1 THR A 4 91.620 4.950 -13.959 1.00 0.00 H new ATOM 0 HG21 THR A 4 89.888 6.520 -13.351 1.00 0.00 H new ATOM 0 HG22 THR A 4 88.642 5.925 -12.228 1.00 0.00 H new ATOM 0 HG23 THR A 4 90.299 6.215 -11.646 1.00 0.00 H new ATOM 72 N ASP A 5 90.938 1.405 -11.149 1.00 0.00 N ATOM 73 CA ASP A 5 91.371 0.007 -11.470 1.00 0.00 C ATOM 74 C ASP A 5 90.246 -0.989 -11.168 1.00 0.00 C ATOM 75 O ASP A 5 89.482 -0.814 -10.237 1.00 0.00 O ATOM 76 CB ASP A 5 92.579 -0.256 -10.564 1.00 0.00 C ATOM 77 CG ASP A 5 93.730 0.682 -10.944 1.00 0.00 C ATOM 78 OD1 ASP A 5 93.812 1.058 -12.103 1.00 0.00 O ATOM 79 OD2 ASP A 5 94.512 1.009 -10.067 1.00 0.00 O ATOM 0 H ASP A 5 91.287 1.772 -10.264 1.00 0.00 H new ATOM 0 HA ASP A 5 91.618 -0.110 -12.525 1.00 0.00 H new ATOM 0 HB2 ASP A 5 92.303 -0.103 -9.521 1.00 0.00 H new ATOM 0 HB3 ASP A 5 92.897 -1.294 -10.660 1.00 0.00 H new ATOM 84 N GLN A 6 90.144 -2.032 -11.956 1.00 0.00 N ATOM 85 CA GLN A 6 89.105 -3.084 -11.701 1.00 0.00 C ATOM 86 C GLN A 6 89.457 -3.958 -10.486 1.00 0.00 C ATOM 87 O GLN A 6 88.686 -4.818 -10.099 1.00 0.00 O ATOM 88 CB GLN A 6 89.071 -3.934 -12.974 1.00 0.00 C ATOM 89 CG GLN A 6 88.613 -3.071 -14.152 1.00 0.00 C ATOM 90 CD GLN A 6 88.629 -3.903 -15.438 1.00 0.00 C ATOM 91 OE1 GLN A 6 89.331 -4.891 -15.529 1.00 0.00 O ATOM 92 NE2 GLN A 6 87.877 -3.543 -16.442 1.00 0.00 N ATOM 0 H GLN A 6 90.737 -2.202 -12.768 1.00 0.00 H new ATOM 0 HA GLN A 6 88.140 -2.631 -11.474 1.00 0.00 H new ATOM 0 HB2 GLN A 6 90.060 -4.347 -13.175 1.00 0.00 H new ATOM 0 HB3 GLN A 6 88.394 -4.778 -12.843 1.00 0.00 H new ATOM 0 HG2 GLN A 6 87.609 -2.689 -13.967 1.00 0.00 H new ATOM 0 HG3 GLN A 6 89.268 -2.206 -14.258 1.00 0.00 H new ATOM 0 HE21 GLN A 6 87.288 -2.714 -16.366 1.00 0.00 H new ATOM 0 HE22 GLN A 6 87.879 -4.091 -17.302 1.00 0.00 H new ATOM 101 N ASP A 7 90.605 -3.753 -9.887 1.00 0.00 N ATOM 102 CA ASP A 7 90.976 -4.544 -8.671 1.00 0.00 C ATOM 103 C ASP A 7 90.061 -4.175 -7.494 1.00 0.00 C ATOM 104 O ASP A 7 89.862 -4.964 -6.588 1.00 0.00 O ATOM 105 CB ASP A 7 92.442 -4.185 -8.374 1.00 0.00 C ATOM 106 CG ASP A 7 92.583 -2.689 -8.048 1.00 0.00 C ATOM 107 OD1 ASP A 7 91.698 -1.928 -8.407 1.00 0.00 O ATOM 108 OD2 ASP A 7 93.580 -2.330 -7.441 1.00 0.00 O ATOM 0 H ASP A 7 91.302 -3.072 -10.188 1.00 0.00 H new ATOM 0 HA ASP A 7 90.859 -5.616 -8.829 1.00 0.00 H new ATOM 0 HB2 ASP A 7 92.804 -4.780 -7.536 1.00 0.00 H new ATOM 0 HB3 ASP A 7 93.064 -4.434 -9.234 1.00 0.00 H new ATOM 113 N TRP A 8 89.506 -2.984 -7.503 1.00 0.00 N ATOM 114 CA TRP A 8 88.629 -2.549 -6.372 1.00 0.00 C ATOM 115 C TRP A 8 87.236 -3.179 -6.464 1.00 0.00 C ATOM 116 O TRP A 8 86.486 -3.144 -5.511 1.00 0.00 O ATOM 117 CB TRP A 8 88.529 -1.029 -6.476 1.00 0.00 C ATOM 118 CG TRP A 8 89.592 -0.310 -5.710 1.00 0.00 C ATOM 119 CD1 TRP A 8 90.275 0.768 -6.167 1.00 0.00 C ATOM 120 CD2 TRP A 8 90.107 -0.592 -4.374 1.00 0.00 C ATOM 121 NE1 TRP A 8 91.186 1.172 -5.203 1.00 0.00 N ATOM 122 CE2 TRP A 8 91.134 0.377 -4.079 1.00 0.00 C ATOM 123 CE3 TRP A 8 89.798 -1.590 -3.375 1.00 0.00 C ATOM 124 CZ2 TRP A 8 91.841 0.362 -2.836 1.00 0.00 C ATOM 125 CZ3 TRP A 8 90.505 -1.608 -2.125 1.00 0.00 C ATOM 126 CH2 TRP A 8 91.526 -0.635 -1.858 1.00 0.00 C ATOM 0 H TRP A 8 89.624 -2.296 -8.246 1.00 0.00 H new ATOM 0 HA TRP A 8 89.049 -2.866 -5.417 1.00 0.00 H new ATOM 0 HB2 TRP A 8 88.589 -0.739 -7.525 1.00 0.00 H new ATOM 0 HB3 TRP A 8 87.552 -0.711 -6.113 1.00 0.00 H new ATOM 0 HD1 TRP A 8 90.132 1.238 -7.129 1.00 0.00 H new ATOM 0 HE1 TRP A 8 91.820 1.964 -5.313 1.00 0.00 H new ATOM 0 HE3 TRP A 8 89.032 -2.326 -3.570 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 92.607 1.097 -2.637 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 90.268 -2.356 -1.383 1.00 0.00 H new ATOM 0 HH2 TRP A 8 92.057 -0.655 -0.918 1.00 0.00 H new ATOM 137 N ILE A 9 86.873 -3.760 -7.590 1.00 0.00 N ATOM 138 CA ILE A 9 85.456 -4.229 -7.771 1.00 0.00 C ATOM 139 C ILE A 9 85.063 -5.191 -6.635 1.00 0.00 C ATOM 140 O ILE A 9 85.800 -6.093 -6.286 1.00 0.00 O ATOM 141 CB ILE A 9 85.420 -4.939 -9.140 1.00 0.00 C ATOM 142 CG1 ILE A 9 85.797 -3.956 -10.267 1.00 0.00 C ATOM 143 CG2 ILE A 9 84.013 -5.490 -9.406 1.00 0.00 C ATOM 144 CD1 ILE A 9 84.843 -2.754 -10.275 1.00 0.00 C ATOM 0 H ILE A 9 87.491 -3.928 -8.384 1.00 0.00 H new ATOM 0 HA ILE A 9 84.746 -3.402 -7.740 1.00 0.00 H new ATOM 0 HB ILE A 9 86.140 -5.758 -9.122 1.00 0.00 H new ATOM 0 HG12 ILE A 9 86.822 -3.613 -10.130 1.00 0.00 H new ATOM 0 HG13 ILE A 9 85.757 -4.465 -11.230 1.00 0.00 H new ATOM 0 HG21 ILE A 9 83.995 -5.990 -10.374 1.00 0.00 H new ATOM 0 HG22 ILE A 9 83.748 -6.202 -8.625 1.00 0.00 H new ATOM 0 HG23 ILE A 9 83.295 -4.670 -9.408 1.00 0.00 H new ATOM 0 HD11 ILE A 9 85.125 -2.071 -11.077 1.00 0.00 H new ATOM 0 HD12 ILE A 9 83.822 -3.101 -10.435 1.00 0.00 H new ATOM 0 HD13 ILE A 9 84.904 -2.235 -9.318 1.00 0.00 H new ATOM 156 N GLY A 10 83.901 -4.989 -6.068 1.00 0.00 N ATOM 157 CA GLY A 10 83.453 -5.831 -4.920 1.00 0.00 C ATOM 158 C GLY A 10 83.996 -5.310 -3.578 1.00 0.00 C ATOM 159 O GLY A 10 83.706 -5.884 -2.542 1.00 0.00 O ATOM 0 H GLY A 10 83.238 -4.269 -6.355 1.00 0.00 H new ATOM 0 HA2 GLY A 10 82.364 -5.850 -4.888 1.00 0.00 H new ATOM 0 HA3 GLY A 10 83.786 -6.858 -5.072 1.00 0.00 H new ATOM 163 N CYS A 11 84.774 -4.238 -3.567 1.00 0.00 N ATOM 164 CA CYS A 11 85.280 -3.702 -2.255 1.00 0.00 C ATOM 165 C CYS A 11 84.233 -2.776 -1.608 1.00 0.00 C ATOM 166 O CYS A 11 83.401 -2.204 -2.287 1.00 0.00 O ATOM 167 CB CYS A 11 86.626 -2.987 -2.567 1.00 0.00 C ATOM 168 SG CYS A 11 86.406 -1.314 -3.260 1.00 0.00 S ATOM 0 H CYS A 11 85.073 -3.723 -4.395 1.00 0.00 H new ATOM 0 HA CYS A 11 85.449 -4.492 -1.523 1.00 0.00 H new ATOM 0 HB2 CYS A 11 87.215 -2.920 -1.652 1.00 0.00 H new ATOM 0 HB3 CYS A 11 87.197 -3.593 -3.270 1.00 0.00 H new ATOM 0 HG CYS A 11 87.522 -0.915 -3.794 1.00 0.00 H new ATOM 174 N ALA A 12 84.277 -2.634 -0.307 1.00 0.00 N ATOM 175 CA ALA A 12 83.240 -1.826 0.405 1.00 0.00 C ATOM 176 C ALA A 12 83.704 -0.376 0.544 1.00 0.00 C ATOM 177 O ALA A 12 84.730 -0.111 1.144 1.00 0.00 O ATOM 178 CB ALA A 12 83.116 -2.476 1.783 1.00 0.00 C ATOM 0 H ALA A 12 84.990 -3.045 0.295 1.00 0.00 H new ATOM 0 HA ALA A 12 82.290 -1.808 -0.130 1.00 0.00 H new ATOM 0 HB1 ALA A 12 82.371 -1.941 2.372 1.00 0.00 H new ATOM 0 HB2 ALA A 12 82.809 -3.516 1.669 1.00 0.00 H new ATOM 0 HB3 ALA A 12 84.079 -2.436 2.292 1.00 0.00 H new ATOM 184 N VAL A 13 82.960 0.559 0.001 1.00 0.00 N ATOM 185 CA VAL A 13 83.382 1.992 0.071 1.00 0.00 C ATOM 186 C VAL A 13 82.198 2.887 0.453 1.00 0.00 C ATOM 187 O VAL A 13 81.049 2.532 0.255 1.00 0.00 O ATOM 188 CB VAL A 13 83.894 2.336 -1.334 1.00 0.00 C ATOM 189 CG1 VAL A 13 85.082 1.438 -1.678 1.00 0.00 C ATOM 190 CG2 VAL A 13 82.783 2.121 -2.369 1.00 0.00 C ATOM 0 H VAL A 13 82.080 0.390 -0.487 1.00 0.00 H new ATOM 0 HA VAL A 13 84.149 2.152 0.829 1.00 0.00 H new ATOM 0 HB VAL A 13 84.202 3.381 -1.351 1.00 0.00 H new ATOM 0 HG11 VAL A 13 85.446 1.682 -2.676 1.00 0.00 H new ATOM 0 HG12 VAL A 13 85.880 1.596 -0.952 1.00 0.00 H new ATOM 0 HG13 VAL A 13 84.769 0.394 -1.651 1.00 0.00 H new ATOM 0 HG21 VAL A 13 83.158 2.368 -3.362 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.465 1.079 -2.350 1.00 0.00 H new ATOM 0 HG23 VAL A 13 81.935 2.763 -2.131 1.00 0.00 H new ATOM 200 N SER A 14 82.479 4.043 1.002 1.00 0.00 N ATOM 201 CA SER A 14 81.400 5.030 1.292 1.00 0.00 C ATOM 202 C SER A 14 81.636 6.296 0.474 1.00 0.00 C ATOM 203 O SER A 14 82.759 6.740 0.326 1.00 0.00 O ATOM 204 CB SER A 14 81.519 5.323 2.788 1.00 0.00 C ATOM 205 OG SER A 14 80.567 6.316 3.150 1.00 0.00 O ATOM 0 H SER A 14 83.418 4.345 1.263 1.00 0.00 H new ATOM 0 HA SER A 14 80.408 4.657 1.035 1.00 0.00 H new ATOM 0 HB2 SER A 14 81.349 4.413 3.363 1.00 0.00 H new ATOM 0 HB3 SER A 14 82.526 5.666 3.024 1.00 0.00 H new ATOM 0 HG SER A 14 80.640 6.505 4.109 1.00 0.00 H new ATOM 211 N ILE A 15 80.588 6.879 -0.055 1.00 0.00 N ATOM 212 CA ILE A 15 80.764 8.039 -0.981 1.00 0.00 C ATOM 213 C ILE A 15 79.986 9.243 -0.457 1.00 0.00 C ATOM 214 O ILE A 15 78.780 9.183 -0.290 1.00 0.00 O ATOM 215 CB ILE A 15 80.190 7.599 -2.345 1.00 0.00 C ATOM 216 CG1 ILE A 15 80.717 6.205 -2.769 1.00 0.00 C ATOM 217 CG2 ILE A 15 80.592 8.625 -3.410 1.00 0.00 C ATOM 218 CD1 ILE A 15 82.248 6.163 -2.730 1.00 0.00 C ATOM 0 H ILE A 15 79.621 6.602 0.114 1.00 0.00 H new ATOM 0 HA ILE A 15 81.813 8.325 -1.064 1.00 0.00 H new ATOM 0 HB ILE A 15 79.106 7.538 -2.250 1.00 0.00 H new ATOM 0 HG12 ILE A 15 80.311 5.441 -2.105 1.00 0.00 H new ATOM 0 HG13 ILE A 15 80.368 5.971 -3.775 1.00 0.00 H new ATOM 0 HG21 ILE A 15 80.191 8.322 -4.377 1.00 0.00 H new ATOM 0 HG22 ILE A 15 80.193 9.603 -3.142 1.00 0.00 H new ATOM 0 HG23 ILE A 15 81.679 8.681 -3.470 1.00 0.00 H new ATOM 0 HD11 ILE A 15 82.593 5.174 -3.032 1.00 0.00 H new ATOM 0 HD12 ILE A 15 82.650 6.911 -3.413 1.00 0.00 H new ATOM 0 HD13 ILE A 15 82.592 6.374 -1.717 1.00 0.00 H new ATOM 230 N ALA A 16 80.667 10.330 -0.200 1.00 0.00 N ATOM 231 CA ALA A 16 79.970 11.577 0.227 1.00 0.00 C ATOM 232 C ALA A 16 79.796 12.499 -0.978 1.00 0.00 C ATOM 233 O ALA A 16 80.752 13.049 -1.489 1.00 0.00 O ATOM 234 CB ALA A 16 80.891 12.215 1.266 1.00 0.00 C ATOM 0 H ALA A 16 81.682 10.406 -0.268 1.00 0.00 H new ATOM 0 HA ALA A 16 78.978 11.385 0.637 1.00 0.00 H new ATOM 0 HB1 ALA A 16 80.444 13.141 1.628 1.00 0.00 H new ATOM 0 HB2 ALA A 16 81.029 11.528 2.101 1.00 0.00 H new ATOM 0 HB3 ALA A 16 81.857 12.432 0.811 1.00 0.00 H new ATOM 240 N CYS A 17 78.582 12.661 -1.435 1.00 0.00 N ATOM 241 CA CYS A 17 78.313 13.570 -2.589 1.00 0.00 C ATOM 242 C CYS A 17 77.875 14.940 -2.070 1.00 0.00 C ATOM 243 O CYS A 17 77.558 15.093 -0.905 1.00 0.00 O ATOM 244 CB CYS A 17 77.180 12.915 -3.387 1.00 0.00 C ATOM 245 SG CYS A 17 77.664 11.250 -3.922 1.00 0.00 S ATOM 0 H CYS A 17 77.757 12.198 -1.054 1.00 0.00 H new ATOM 0 HA CYS A 17 79.198 13.717 -3.208 1.00 0.00 H new ATOM 0 HB2 CYS A 17 76.280 12.860 -2.775 1.00 0.00 H new ATOM 0 HB3 CYS A 17 76.937 13.527 -4.256 1.00 0.00 H new ATOM 0 HG CYS A 17 76.691 10.710 -4.594 1.00 0.00 H new ATOM 251 N ASP A 18 77.853 15.936 -2.923 1.00 0.00 N ATOM 252 CA ASP A 18 77.482 17.316 -2.468 1.00 0.00 C ATOM 253 C ASP A 18 76.067 17.309 -1.870 1.00 0.00 C ATOM 254 O ASP A 18 75.352 16.330 -1.960 1.00 0.00 O ATOM 255 CB ASP A 18 77.546 18.201 -3.717 1.00 0.00 C ATOM 256 CG ASP A 18 78.982 18.238 -4.255 1.00 0.00 C ATOM 257 OD1 ASP A 18 79.901 18.106 -3.462 1.00 0.00 O ATOM 258 OD2 ASP A 18 79.136 18.400 -5.455 1.00 0.00 O ATOM 0 H ASP A 18 78.076 15.854 -3.915 1.00 0.00 H new ATOM 0 HA ASP A 18 78.154 17.685 -1.693 1.00 0.00 H new ATOM 0 HB2 ASP A 18 76.871 17.816 -4.482 1.00 0.00 H new ATOM 0 HB3 ASP A 18 77.212 19.210 -3.476 1.00 0.00 H new ATOM 263 N GLU A 19 75.668 18.395 -1.260 1.00 0.00 N ATOM 264 CA GLU A 19 74.459 18.373 -0.369 1.00 0.00 C ATOM 265 C GLU A 19 73.224 17.826 -1.097 1.00 0.00 C ATOM 266 O GLU A 19 72.393 17.167 -0.497 1.00 0.00 O ATOM 267 CB GLU A 19 74.227 19.833 0.033 1.00 0.00 C ATOM 268 CG GLU A 19 75.402 20.323 0.881 1.00 0.00 C ATOM 269 CD GLU A 19 75.132 21.753 1.352 1.00 0.00 C ATOM 270 OE1 GLU A 19 74.551 21.906 2.414 1.00 0.00 O ATOM 271 OE2 GLU A 19 75.511 22.671 0.642 1.00 0.00 O ATOM 0 H GLU A 19 76.127 19.303 -1.338 1.00 0.00 H new ATOM 0 HA GLU A 19 74.620 17.721 0.490 1.00 0.00 H new ATOM 0 HB2 GLU A 19 74.123 20.454 -0.857 1.00 0.00 H new ATOM 0 HB3 GLU A 19 73.297 19.923 0.595 1.00 0.00 H new ATOM 0 HG2 GLU A 19 75.543 19.667 1.740 1.00 0.00 H new ATOM 0 HG3 GLU A 19 76.323 20.289 0.299 1.00 0.00 H new ATOM 278 N VAL A 20 73.098 18.088 -2.375 1.00 0.00 N ATOM 279 CA VAL A 20 71.867 17.658 -3.115 1.00 0.00 C ATOM 280 C VAL A 20 71.899 16.142 -3.370 1.00 0.00 C ATOM 281 O VAL A 20 70.868 15.513 -3.520 1.00 0.00 O ATOM 282 CB VAL A 20 71.895 18.440 -4.437 1.00 0.00 C ATOM 283 CG1 VAL A 20 70.676 18.070 -5.288 1.00 0.00 C ATOM 284 CG2 VAL A 20 71.865 19.942 -4.142 1.00 0.00 C ATOM 0 H VAL A 20 73.792 18.580 -2.938 1.00 0.00 H new ATOM 0 HA VAL A 20 70.956 17.859 -2.551 1.00 0.00 H new ATOM 0 HB VAL A 20 72.806 18.188 -4.981 1.00 0.00 H new ATOM 0 HG11 VAL A 20 70.703 18.628 -6.224 1.00 0.00 H new ATOM 0 HG12 VAL A 20 70.693 17.001 -5.502 1.00 0.00 H new ATOM 0 HG13 VAL A 20 69.764 18.317 -4.744 1.00 0.00 H new ATOM 0 HG21 VAL A 20 71.885 20.497 -5.080 1.00 0.00 H new ATOM 0 HG22 VAL A 20 70.955 20.187 -3.594 1.00 0.00 H new ATOM 0 HG23 VAL A 20 72.734 20.212 -3.542 1.00 0.00 H new ATOM 294 N LEU A 21 73.073 15.559 -3.418 1.00 0.00 N ATOM 295 CA LEU A 21 73.183 14.088 -3.667 1.00 0.00 C ATOM 296 C LEU A 21 73.182 13.292 -2.351 1.00 0.00 C ATOM 297 O LEU A 21 72.945 12.098 -2.350 1.00 0.00 O ATOM 298 CB LEU A 21 74.517 13.933 -4.388 1.00 0.00 C ATOM 299 CG LEU A 21 74.416 14.531 -5.792 1.00 0.00 C ATOM 300 CD1 LEU A 21 75.820 14.688 -6.382 1.00 0.00 C ATOM 301 CD2 LEU A 21 73.589 13.602 -6.688 1.00 0.00 C ATOM 0 H LEU A 21 73.963 16.042 -3.295 1.00 0.00 H new ATOM 0 HA LEU A 21 72.341 13.705 -4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 21 75.306 14.432 -3.825 1.00 0.00 H new ATOM 0 HB3 LEU A 21 74.788 12.879 -4.450 1.00 0.00 H new ATOM 0 HG LEU A 21 73.932 15.506 -5.735 1.00 0.00 H new ATOM 0 HD11 LEU A 21 75.749 15.114 -7.383 1.00 0.00 H new ATOM 0 HD12 LEU A 21 76.410 15.349 -5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 21 76.303 13.712 -6.437 1.00 0.00 H new ATOM 0 HD21 LEU A 21 73.518 14.030 -7.688 1.00 0.00 H new ATOM 0 HD22 LEU A 21 74.071 12.626 -6.744 1.00 0.00 H new ATOM 0 HD23 LEU A 21 72.589 13.489 -6.270 1.00 0.00 H new ATOM 313 N GLY A 22 73.443 13.938 -1.237 1.00 0.00 N ATOM 314 CA GLY A 22 73.474 13.215 0.073 1.00 0.00 C ATOM 315 C GLY A 22 74.622 12.199 0.090 1.00 0.00 C ATOM 316 O GLY A 22 75.626 12.369 -0.580 1.00 0.00 O ATOM 0 H GLY A 22 73.636 14.938 -1.181 1.00 0.00 H new ATOM 0 HA2 GLY A 22 73.598 13.929 0.888 1.00 0.00 H new ATOM 0 HA3 GLY A 22 72.525 12.705 0.238 1.00 0.00 H new ATOM 320 N VAL A 23 74.480 11.144 0.855 1.00 0.00 N ATOM 321 CA VAL A 23 75.594 10.151 0.997 1.00 0.00 C ATOM 322 C VAL A 23 75.063 8.733 0.794 1.00 0.00 C ATOM 323 O VAL A 23 73.983 8.402 1.252 1.00 0.00 O ATOM 324 CB VAL A 23 76.117 10.314 2.433 1.00 0.00 C ATOM 325 CG1 VAL A 23 77.315 9.377 2.656 1.00 0.00 C ATOM 326 CG2 VAL A 23 76.553 11.764 2.669 1.00 0.00 C ATOM 0 H VAL A 23 73.639 10.926 1.389 1.00 0.00 H new ATOM 0 HA VAL A 23 76.378 10.318 0.259 1.00 0.00 H new ATOM 0 HB VAL A 23 75.320 10.060 3.132 1.00 0.00 H new ATOM 0 HG11 VAL A 23 77.684 9.494 3.675 1.00 0.00 H new ATOM 0 HG12 VAL A 23 77.003 8.344 2.500 1.00 0.00 H new ATOM 0 HG13 VAL A 23 78.108 9.627 1.952 1.00 0.00 H new ATOM 0 HG21 VAL A 23 76.922 11.871 3.689 1.00 0.00 H new ATOM 0 HG22 VAL A 23 77.345 12.025 1.967 1.00 0.00 H new ATOM 0 HG23 VAL A 23 75.702 12.429 2.519 1.00 0.00 H new ATOM 336 N PHE A 24 75.812 7.897 0.114 1.00 0.00 N ATOM 337 CA PHE A 24 75.420 6.460 0.010 1.00 0.00 C ATOM 338 C PHE A 24 76.622 5.557 0.308 1.00 0.00 C ATOM 339 O PHE A 24 77.759 5.973 0.213 1.00 0.00 O ATOM 340 CB PHE A 24 74.923 6.246 -1.429 1.00 0.00 C ATOM 341 CG PHE A 24 75.997 6.358 -2.491 1.00 0.00 C ATOM 342 CD1 PHE A 24 76.745 5.191 -2.863 1.00 0.00 C ATOM 343 CD2 PHE A 24 76.287 7.621 -3.112 1.00 0.00 C ATOM 344 CE1 PHE A 24 77.774 5.283 -3.859 1.00 0.00 C ATOM 345 CE2 PHE A 24 77.317 7.710 -4.106 1.00 0.00 C ATOM 346 CZ PHE A 24 78.059 6.542 -4.480 1.00 0.00 C ATOM 0 H PHE A 24 76.674 8.149 -0.371 1.00 0.00 H new ATOM 0 HA PHE A 24 74.643 6.209 0.732 1.00 0.00 H new ATOM 0 HB2 PHE A 24 74.464 5.260 -1.498 1.00 0.00 H new ATOM 0 HB3 PHE A 24 74.142 6.976 -1.642 1.00 0.00 H new ATOM 0 HD1 PHE A 24 76.533 4.242 -2.393 1.00 0.00 H new ATOM 0 HD2 PHE A 24 75.730 8.502 -2.830 1.00 0.00 H new ATOM 0 HE1 PHE A 24 78.333 4.403 -4.140 1.00 0.00 H new ATOM 0 HE2 PHE A 24 77.534 8.659 -4.574 1.00 0.00 H new ATOM 0 HZ PHE A 24 78.833 6.611 -5.230 1.00 0.00 H new ATOM 356 N GLN A 25 76.365 4.329 0.667 1.00 0.00 N ATOM 357 CA GLN A 25 77.469 3.351 0.896 1.00 0.00 C ATOM 358 C GLN A 25 77.091 2.010 0.266 1.00 0.00 C ATOM 359 O GLN A 25 75.935 1.625 0.272 1.00 0.00 O ATOM 360 CB GLN A 25 77.585 3.230 2.416 1.00 0.00 C ATOM 361 CG GLN A 25 77.963 4.594 3.004 1.00 0.00 C ATOM 362 CD GLN A 25 78.062 4.501 4.531 1.00 0.00 C ATOM 363 OE1 GLN A 25 78.109 3.423 5.091 1.00 0.00 O ATOM 364 NE2 GLN A 25 78.090 5.601 5.233 1.00 0.00 N ATOM 0 H GLN A 25 75.427 3.957 0.813 1.00 0.00 H new ATOM 0 HA GLN A 25 78.414 3.663 0.451 1.00 0.00 H new ATOM 0 HB2 GLN A 25 76.640 2.888 2.838 1.00 0.00 H new ATOM 0 HB3 GLN A 25 78.339 2.487 2.677 1.00 0.00 H new ATOM 0 HG2 GLN A 25 78.915 4.926 2.590 1.00 0.00 H new ATOM 0 HG3 GLN A 25 77.217 5.338 2.725 1.00 0.00 H new ATOM 0 HE21 GLN A 25 78.051 6.506 4.764 1.00 0.00 H new ATOM 0 HE22 GLN A 25 78.151 5.555 6.250 1.00 0.00 H new ATOM 373 N GLY A 26 78.049 1.300 -0.278 1.00 0.00 N ATOM 374 CA GLY A 26 77.723 0.045 -1.020 1.00 0.00 C ATOM 375 C GLY A 26 79.009 -0.643 -1.474 1.00 0.00 C ATOM 376 O GLY A 26 80.088 -0.083 -1.388 1.00 0.00 O ATOM 0 H GLY A 26 79.041 1.536 -0.240 1.00 0.00 H new ATOM 0 HA2 GLY A 26 77.148 -0.626 -0.382 1.00 0.00 H new ATOM 0 HA3 GLY A 26 77.100 0.275 -1.884 1.00 0.00 H new ATOM 380 N LEU A 27 78.899 -1.858 -1.950 1.00 0.00 N ATOM 381 CA LEU A 27 80.081 -2.544 -2.549 1.00 0.00 C ATOM 382 C LEU A 27 80.153 -2.243 -4.046 1.00 0.00 C ATOM 383 O LEU A 27 79.160 -2.285 -4.748 1.00 0.00 O ATOM 384 CB LEU A 27 79.841 -4.036 -2.314 1.00 0.00 C ATOM 385 CG LEU A 27 79.877 -4.331 -0.813 1.00 0.00 C ATOM 386 CD1 LEU A 27 79.314 -5.730 -0.554 1.00 0.00 C ATOM 387 CD2 LEU A 27 81.326 -4.266 -0.315 1.00 0.00 C ATOM 0 H LEU A 27 78.038 -2.405 -1.949 1.00 0.00 H new ATOM 0 HA LEU A 27 81.020 -2.212 -2.107 1.00 0.00 H new ATOM 0 HB2 LEU A 27 78.877 -4.330 -2.730 1.00 0.00 H new ATOM 0 HB3 LEU A 27 80.602 -4.623 -2.829 1.00 0.00 H new ATOM 0 HG LEU A 27 79.275 -3.592 -0.283 1.00 0.00 H new ATOM 0 HD11 LEU A 27 79.340 -5.940 0.515 1.00 0.00 H new ATOM 0 HD12 LEU A 27 78.285 -5.779 -0.909 1.00 0.00 H new ATOM 0 HD13 LEU A 27 79.916 -6.468 -1.083 1.00 0.00 H new ATOM 0 HD21 LEU A 27 81.353 -4.476 0.754 1.00 0.00 H new ATOM 0 HD22 LEU A 27 81.926 -5.005 -0.845 1.00 0.00 H new ATOM 0 HD23 LEU A 27 81.730 -3.271 -0.500 1.00 0.00 H new ATOM 399 N ILE A 28 81.328 -1.938 -4.528 1.00 0.00 N ATOM 400 CA ILE A 28 81.490 -1.576 -5.971 1.00 0.00 C ATOM 401 C ILE A 28 81.195 -2.794 -6.855 1.00 0.00 C ATOM 402 O ILE A 28 81.612 -3.898 -6.564 1.00 0.00 O ATOM 403 CB ILE A 28 82.958 -1.136 -6.110 1.00 0.00 C ATOM 404 CG1 ILE A 28 83.206 0.088 -5.215 1.00 0.00 C ATOM 405 CG2 ILE A 28 83.275 -0.779 -7.569 1.00 0.00 C ATOM 406 CD1 ILE A 28 84.691 0.461 -5.246 1.00 0.00 C ATOM 0 H ILE A 28 82.190 -1.923 -3.982 1.00 0.00 H new ATOM 0 HA ILE A 28 80.804 -0.789 -6.283 1.00 0.00 H new ATOM 0 HB ILE A 28 83.606 -1.957 -5.803 1.00 0.00 H new ATOM 0 HG12 ILE A 28 82.603 0.929 -5.558 1.00 0.00 H new ATOM 0 HG13 ILE A 28 82.897 -0.129 -4.192 1.00 0.00 H new ATOM 0 HG21 ILE A 28 84.317 -0.470 -7.650 1.00 0.00 H new ATOM 0 HG22 ILE A 28 83.105 -1.650 -8.202 1.00 0.00 H new ATOM 0 HG23 ILE A 28 82.629 0.037 -7.893 1.00 0.00 H new ATOM 0 HD11 ILE A 28 84.861 1.329 -4.610 1.00 0.00 H new ATOM 0 HD12 ILE A 28 85.284 -0.378 -4.882 1.00 0.00 H new ATOM 0 HD13 ILE A 28 84.986 0.697 -6.269 1.00 0.00 H new ATOM 418 N LYS A 29 80.474 -2.591 -7.928 1.00 0.00 N ATOM 419 CA LYS A 29 80.260 -3.689 -8.917 1.00 0.00 C ATOM 420 C LYS A 29 81.065 -3.406 -10.188 1.00 0.00 C ATOM 421 O LYS A 29 81.510 -4.314 -10.865 1.00 0.00 O ATOM 422 CB LYS A 29 78.759 -3.676 -9.211 1.00 0.00 C ATOM 423 CG LYS A 29 78.415 -4.830 -10.155 1.00 0.00 C ATOM 424 CD LYS A 29 78.468 -6.152 -9.386 1.00 0.00 C ATOM 425 CE LYS A 29 78.049 -7.298 -10.309 1.00 0.00 C ATOM 426 NZ LYS A 29 79.232 -7.539 -11.181 1.00 0.00 N ATOM 0 H LYS A 29 80.022 -1.707 -8.162 1.00 0.00 H new ATOM 0 HA LYS A 29 80.586 -4.659 -8.541 1.00 0.00 H new ATOM 0 HB2 LYS A 29 78.195 -3.770 -8.283 1.00 0.00 H new ATOM 0 HB3 LYS A 29 78.474 -2.726 -9.662 1.00 0.00 H new ATOM 0 HG2 LYS A 29 77.422 -4.683 -10.579 1.00 0.00 H new ATOM 0 HG3 LYS A 29 79.117 -4.854 -10.989 1.00 0.00 H new ATOM 0 HD2 LYS A 29 79.476 -6.325 -9.009 1.00 0.00 H new ATOM 0 HD3 LYS A 29 77.807 -6.108 -8.521 1.00 0.00 H new ATOM 0 HE2 LYS A 29 77.790 -8.190 -9.739 1.00 0.00 H new ATOM 0 HE3 LYS A 29 77.172 -7.030 -10.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 78.954 -7.442 -12.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 79.974 -6.845 -10.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 79.596 -8.499 -11.015 1.00 0.00 H new ATOM 440 N GLN A 30 81.250 -2.150 -10.512 1.00 0.00 N ATOM 441 CA GLN A 30 82.048 -1.783 -11.724 1.00 0.00 C ATOM 442 C GLN A 30 82.671 -0.399 -11.527 1.00 0.00 C ATOM 443 O GLN A 30 82.128 0.437 -10.831 1.00 0.00 O ATOM 444 CB GLN A 30 81.061 -1.759 -12.896 1.00 0.00 C ATOM 445 CG GLN A 30 80.617 -3.183 -13.248 1.00 0.00 C ATOM 446 CD GLN A 30 79.743 -3.150 -14.506 1.00 0.00 C ATOM 447 OE1 GLN A 30 79.156 -2.137 -14.829 1.00 0.00 O ATOM 448 NE2 GLN A 30 79.633 -4.227 -15.236 1.00 0.00 N ATOM 0 H GLN A 30 80.880 -1.358 -9.986 1.00 0.00 H new ATOM 0 HA GLN A 30 82.856 -2.491 -11.906 1.00 0.00 H new ATOM 0 HB2 GLN A 30 80.192 -1.154 -12.636 1.00 0.00 H new ATOM 0 HB3 GLN A 30 81.527 -1.292 -13.763 1.00 0.00 H new ATOM 0 HG2 GLN A 30 81.488 -3.816 -13.414 1.00 0.00 H new ATOM 0 HG3 GLN A 30 80.061 -3.618 -12.417 1.00 0.00 H new ATOM 0 HE21 GLN A 30 80.125 -5.079 -14.966 1.00 0.00 H new ATOM 0 HE22 GLN A 30 79.055 -4.217 -16.076 1.00 0.00 H new ATOM 457 N ILE A 31 83.807 -0.154 -12.137 1.00 0.00 N ATOM 458 CA ILE A 31 84.461 1.185 -12.011 1.00 0.00 C ATOM 459 C ILE A 31 85.030 1.617 -13.367 1.00 0.00 C ATOM 460 O ILE A 31 85.603 0.826 -14.094 1.00 0.00 O ATOM 461 CB ILE A 31 85.579 1.019 -10.968 1.00 0.00 C ATOM 462 CG1 ILE A 31 84.970 0.602 -9.622 1.00 0.00 C ATOM 463 CG2 ILE A 31 86.335 2.348 -10.796 1.00 0.00 C ATOM 464 CD1 ILE A 31 86.080 0.345 -8.593 1.00 0.00 C ATOM 0 H ILE A 31 84.309 -0.826 -12.717 1.00 0.00 H new ATOM 0 HA ILE A 31 83.755 1.955 -11.700 1.00 0.00 H new ATOM 0 HB ILE A 31 86.273 0.251 -11.309 1.00 0.00 H new ATOM 0 HG12 ILE A 31 84.302 1.383 -9.259 1.00 0.00 H new ATOM 0 HG13 ILE A 31 84.368 -0.298 -9.750 1.00 0.00 H new ATOM 0 HG21 ILE A 31 87.126 2.224 -10.056 1.00 0.00 H new ATOM 0 HG22 ILE A 31 86.773 2.643 -11.749 1.00 0.00 H new ATOM 0 HG23 ILE A 31 85.642 3.120 -10.461 1.00 0.00 H new ATOM 0 HD11 ILE A 31 85.634 0.050 -7.643 1.00 0.00 H new ATOM 0 HD12 ILE A 31 86.731 -0.452 -8.951 1.00 0.00 H new ATOM 0 HD13 ILE A 31 86.664 1.255 -8.453 1.00 0.00 H new ATOM 476 N SER A 32 84.867 2.869 -13.700 1.00 0.00 N ATOM 477 CA SER A 32 85.489 3.418 -14.939 1.00 0.00 C ATOM 478 C SER A 32 85.880 4.878 -14.707 1.00 0.00 C ATOM 479 O SER A 32 85.349 5.534 -13.832 1.00 0.00 O ATOM 480 CB SER A 32 84.409 3.312 -16.015 1.00 0.00 C ATOM 481 OG SER A 32 83.324 4.166 -15.677 1.00 0.00 O ATOM 0 H SER A 32 84.323 3.542 -13.160 1.00 0.00 H new ATOM 0 HA SER A 32 86.392 2.880 -15.229 1.00 0.00 H new ATOM 0 HB2 SER A 32 84.818 3.592 -16.986 1.00 0.00 H new ATOM 0 HB3 SER A 32 84.063 2.282 -16.099 1.00 0.00 H new ATOM 0 HG SER A 32 82.490 3.791 -16.030 1.00 0.00 H new ATOM 487 N ALA A 33 86.794 5.391 -15.490 1.00 0.00 N ATOM 488 CA ALA A 33 87.372 6.746 -15.201 1.00 0.00 C ATOM 489 C ALA A 33 86.271 7.814 -15.092 1.00 0.00 C ATOM 490 O ALA A 33 86.460 8.838 -14.460 1.00 0.00 O ATOM 491 CB ALA A 33 88.293 7.054 -16.384 1.00 0.00 C ATOM 0 H ALA A 33 87.168 4.932 -16.320 1.00 0.00 H new ATOM 0 HA ALA A 33 87.903 6.753 -14.249 1.00 0.00 H new ATOM 0 HB1 ALA A 33 88.753 8.032 -16.242 1.00 0.00 H new ATOM 0 HB2 ALA A 33 89.071 6.293 -16.447 1.00 0.00 H new ATOM 0 HB3 ALA A 33 87.712 7.056 -17.306 1.00 0.00 H new ATOM 497 N GLU A 34 85.131 7.583 -15.700 1.00 0.00 N ATOM 498 CA GLU A 34 84.071 8.638 -15.741 1.00 0.00 C ATOM 499 C GLU A 34 83.085 8.482 -14.574 1.00 0.00 C ATOM 500 O GLU A 34 82.469 9.443 -14.150 1.00 0.00 O ATOM 501 CB GLU A 34 83.358 8.434 -17.078 1.00 0.00 C ATOM 502 CG GLU A 34 84.344 8.673 -18.227 1.00 0.00 C ATOM 503 CD GLU A 34 83.631 8.547 -19.583 1.00 0.00 C ATOM 504 OE1 GLU A 34 82.560 7.959 -19.629 1.00 0.00 O ATOM 505 OE2 GLU A 34 84.173 9.042 -20.557 1.00 0.00 O ATOM 0 H GLU A 34 84.890 6.710 -16.169 1.00 0.00 H new ATOM 0 HA GLU A 34 84.496 9.637 -15.648 1.00 0.00 H new ATOM 0 HB2 GLU A 34 82.954 7.423 -17.136 1.00 0.00 H new ATOM 0 HB3 GLU A 34 82.515 9.119 -17.160 1.00 0.00 H new ATOM 0 HG2 GLU A 34 84.787 9.664 -18.133 1.00 0.00 H new ATOM 0 HG3 GLU A 34 85.160 7.952 -18.170 1.00 0.00 H new ATOM 512 N GLU A 35 82.930 7.286 -14.054 1.00 0.00 N ATOM 513 CA GLU A 35 81.847 7.038 -13.048 1.00 0.00 C ATOM 514 C GLU A 35 82.179 5.828 -12.163 1.00 0.00 C ATOM 515 O GLU A 35 82.926 4.950 -12.551 1.00 0.00 O ATOM 516 CB GLU A 35 80.582 6.782 -13.877 1.00 0.00 C ATOM 517 CG GLU A 35 80.790 5.572 -14.796 1.00 0.00 C ATOM 518 CD GLU A 35 79.584 5.422 -15.725 1.00 0.00 C ATOM 519 OE1 GLU A 35 78.540 5.008 -15.247 1.00 0.00 O ATOM 520 OE2 GLU A 35 79.724 5.723 -16.898 1.00 0.00 O ATOM 0 H GLU A 35 83.504 6.474 -14.282 1.00 0.00 H new ATOM 0 HA GLU A 35 81.725 7.882 -12.369 1.00 0.00 H new ATOM 0 HB2 GLU A 35 79.734 6.605 -13.215 1.00 0.00 H new ATOM 0 HB3 GLU A 35 80.343 7.664 -14.472 1.00 0.00 H new ATOM 0 HG2 GLU A 35 81.700 5.700 -15.382 1.00 0.00 H new ATOM 0 HG3 GLU A 35 80.918 4.668 -14.201 1.00 0.00 H new ATOM 527 N ILE A 36 81.625 5.785 -10.977 1.00 0.00 N ATOM 528 CA ILE A 36 81.740 4.561 -10.123 1.00 0.00 C ATOM 529 C ILE A 36 80.353 3.939 -9.926 1.00 0.00 C ATOM 530 O ILE A 36 79.377 4.645 -9.738 1.00 0.00 O ATOM 531 CB ILE A 36 82.303 5.051 -8.779 1.00 0.00 C ATOM 532 CG1 ILE A 36 83.644 5.781 -8.988 1.00 0.00 C ATOM 533 CG2 ILE A 36 82.511 3.854 -7.847 1.00 0.00 C ATOM 534 CD1 ILE A 36 84.666 4.851 -9.658 1.00 0.00 C ATOM 0 H ILE A 36 81.094 6.550 -10.560 1.00 0.00 H new ATOM 0 HA ILE A 36 82.380 3.802 -10.572 1.00 0.00 H new ATOM 0 HB ILE A 36 81.592 5.747 -8.333 1.00 0.00 H new ATOM 0 HG12 ILE A 36 83.490 6.666 -9.605 1.00 0.00 H new ATOM 0 HG13 ILE A 36 84.031 6.125 -8.029 1.00 0.00 H new ATOM 0 HG21 ILE A 36 82.910 4.200 -6.894 1.00 0.00 H new ATOM 0 HG22 ILE A 36 81.558 3.352 -7.681 1.00 0.00 H new ATOM 0 HG23 ILE A 36 83.213 3.156 -8.302 1.00 0.00 H new ATOM 0 HD11 ILE A 36 85.606 5.384 -9.797 1.00 0.00 H new ATOM 0 HD12 ILE A 36 84.833 3.979 -9.026 1.00 0.00 H new ATOM 0 HD13 ILE A 36 84.284 4.529 -10.627 1.00 0.00 H new ATOM 546 N THR A 37 80.256 2.630 -9.967 1.00 0.00 N ATOM 547 CA THR A 37 78.917 1.967 -9.859 1.00 0.00 C ATOM 548 C THR A 37 78.921 0.928 -8.730 1.00 0.00 C ATOM 549 O THR A 37 79.830 0.124 -8.623 1.00 0.00 O ATOM 550 CB THR A 37 78.705 1.285 -11.212 1.00 0.00 C ATOM 551 OG1 THR A 37 78.804 2.253 -12.247 1.00 0.00 O ATOM 552 CG2 THR A 37 77.321 0.632 -11.250 1.00 0.00 C ATOM 0 H THR A 37 81.046 1.993 -10.071 1.00 0.00 H new ATOM 0 HA THR A 37 78.124 2.679 -9.628 1.00 0.00 H new ATOM 0 HB THR A 37 79.466 0.518 -11.355 1.00 0.00 H new ATOM 0 HG1 THR A 37 78.670 1.818 -13.115 1.00 0.00 H new ATOM 0 HG21 THR A 37 77.174 0.147 -12.215 1.00 0.00 H new ATOM 0 HG22 THR A 37 77.247 -0.111 -10.456 1.00 0.00 H new ATOM 0 HG23 THR A 37 76.555 1.394 -11.106 1.00 0.00 H new ATOM 560 N ILE A 38 77.906 0.937 -7.896 1.00 0.00 N ATOM 561 CA ILE A 38 77.851 -0.027 -6.745 1.00 0.00 C ATOM 562 C ILE A 38 76.473 -0.698 -6.673 1.00 0.00 C ATOM 563 O ILE A 38 75.541 -0.299 -7.346 1.00 0.00 O ATOM 564 CB ILE A 38 78.097 0.796 -5.472 1.00 0.00 C ATOM 565 CG1 ILE A 38 77.079 1.942 -5.390 1.00 0.00 C ATOM 566 CG2 ILE A 38 79.517 1.367 -5.480 1.00 0.00 C ATOM 567 CD1 ILE A 38 76.795 2.272 -3.925 1.00 0.00 C ATOM 0 H ILE A 38 77.110 1.572 -7.962 1.00 0.00 H new ATOM 0 HA ILE A 38 78.596 -0.814 -6.862 1.00 0.00 H new ATOM 0 HB ILE A 38 77.981 0.147 -4.604 1.00 0.00 H new ATOM 0 HG12 ILE A 38 77.465 2.823 -5.903 1.00 0.00 H new ATOM 0 HG13 ILE A 38 76.156 1.658 -5.895 1.00 0.00 H new ATOM 0 HG21 ILE A 38 79.680 1.949 -4.573 1.00 0.00 H new ATOM 0 HG22 ILE A 38 80.237 0.550 -5.522 1.00 0.00 H new ATOM 0 HG23 ILE A 38 79.646 2.009 -6.351 1.00 0.00 H new ATOM 0 HD11 ILE A 38 76.072 3.086 -3.869 1.00 0.00 H new ATOM 0 HD12 ILE A 38 76.390 1.392 -3.426 1.00 0.00 H new ATOM 0 HD13 ILE A 38 77.720 2.574 -3.434 1.00 0.00 H new ATOM 579 N VAL A 39 76.347 -1.711 -5.851 1.00 0.00 N ATOM 580 CA VAL A 39 75.059 -2.472 -5.763 1.00 0.00 C ATOM 581 C VAL A 39 74.625 -2.621 -4.298 1.00 0.00 C ATOM 582 O VAL A 39 75.408 -2.428 -3.391 1.00 0.00 O ATOM 583 CB VAL A 39 75.345 -3.839 -6.396 1.00 0.00 C ATOM 584 CG1 VAL A 39 75.747 -3.643 -7.859 1.00 0.00 C ATOM 585 CG2 VAL A 39 76.484 -4.538 -5.645 1.00 0.00 C ATOM 0 H VAL A 39 77.086 -2.046 -5.233 1.00 0.00 H new ATOM 0 HA VAL A 39 74.246 -1.960 -6.277 1.00 0.00 H new ATOM 0 HB VAL A 39 74.448 -4.456 -6.337 1.00 0.00 H new ATOM 0 HG11 VAL A 39 75.951 -4.613 -8.313 1.00 0.00 H new ATOM 0 HG12 VAL A 39 74.935 -3.154 -8.397 1.00 0.00 H new ATOM 0 HG13 VAL A 39 76.642 -3.022 -7.911 1.00 0.00 H new ATOM 0 HG21 VAL A 39 76.680 -5.508 -6.102 1.00 0.00 H new ATOM 0 HG22 VAL A 39 77.384 -3.925 -5.696 1.00 0.00 H new ATOM 0 HG23 VAL A 39 76.200 -4.679 -4.602 1.00 0.00 H new ATOM 595 N ARG A 40 73.374 -2.961 -4.068 1.00 0.00 N ATOM 596 CA ARG A 40 72.822 -3.010 -2.666 1.00 0.00 C ATOM 597 C ARG A 40 72.998 -1.648 -1.988 1.00 0.00 C ATOM 598 O ARG A 40 73.569 -1.539 -0.920 1.00 0.00 O ATOM 599 CB ARG A 40 73.610 -4.100 -1.918 1.00 0.00 C ATOM 600 CG ARG A 40 73.514 -5.428 -2.677 1.00 0.00 C ATOM 601 CD ARG A 40 72.075 -5.949 -2.621 1.00 0.00 C ATOM 602 NE ARG A 40 72.124 -7.298 -3.272 1.00 0.00 N ATOM 603 CZ ARG A 40 71.202 -8.217 -3.040 1.00 0.00 C ATOM 604 NH1 ARG A 40 70.185 -7.996 -2.235 1.00 0.00 N ATOM 605 NH2 ARG A 40 71.302 -9.376 -3.630 1.00 0.00 N ATOM 0 H ARG A 40 72.705 -3.209 -4.797 1.00 0.00 H new ATOM 0 HA ARG A 40 71.756 -3.239 -2.665 1.00 0.00 H new ATOM 0 HB2 ARG A 40 74.654 -3.803 -1.819 1.00 0.00 H new ATOM 0 HB3 ARG A 40 73.215 -4.219 -0.909 1.00 0.00 H new ATOM 0 HG2 ARG A 40 73.821 -5.289 -3.714 1.00 0.00 H new ATOM 0 HG3 ARG A 40 74.193 -6.159 -2.239 1.00 0.00 H new ATOM 0 HD2 ARG A 40 71.721 -6.020 -1.593 1.00 0.00 H new ATOM 0 HD3 ARG A 40 71.393 -5.281 -3.148 1.00 0.00 H new ATOM 0 HE ARG A 40 72.889 -7.513 -3.911 1.00 0.00 H new ATOM 0 HH11 ARG A 40 70.091 -7.094 -1.768 1.00 0.00 H new ATOM 0 HH12 ARG A 40 69.491 -8.727 -2.078 1.00 0.00 H new ATOM 0 HH21 ARG A 40 72.083 -9.562 -4.259 1.00 0.00 H new ATOM 0 HH22 ARG A 40 70.599 -10.096 -3.462 1.00 0.00 H new ATOM 619 N ALA A 41 72.504 -0.613 -2.616 1.00 0.00 N ATOM 620 CA ALA A 41 72.798 0.778 -2.148 1.00 0.00 C ATOM 621 C ALA A 41 72.118 1.089 -0.810 1.00 0.00 C ATOM 622 O ALA A 41 70.957 0.788 -0.591 1.00 0.00 O ATOM 623 CB ALA A 41 72.238 1.690 -3.241 1.00 0.00 C ATOM 0 H ALA A 41 71.905 -0.670 -3.439 1.00 0.00 H new ATOM 0 HA ALA A 41 73.867 0.916 -1.984 1.00 0.00 H new ATOM 0 HB1 ALA A 41 72.414 2.731 -2.972 1.00 0.00 H new ATOM 0 HB2 ALA A 41 72.733 1.471 -4.187 1.00 0.00 H new ATOM 0 HB3 ALA A 41 71.167 1.519 -3.344 1.00 0.00 H new ATOM 629 N PHE A 42 72.849 1.700 0.087 1.00 0.00 N ATOM 630 CA PHE A 42 72.224 2.294 1.304 1.00 0.00 C ATOM 631 C PHE A 42 72.450 3.809 1.290 1.00 0.00 C ATOM 632 O PHE A 42 73.504 4.273 0.903 1.00 0.00 O ATOM 633 CB PHE A 42 72.950 1.652 2.490 1.00 0.00 C ATOM 634 CG PHE A 42 72.313 0.373 2.998 1.00 0.00 C ATOM 635 CD1 PHE A 42 72.000 -0.705 2.098 1.00 0.00 C ATOM 636 CD2 PHE A 42 72.022 0.241 4.397 1.00 0.00 C ATOM 637 CE1 PHE A 42 71.398 -1.907 2.600 1.00 0.00 C ATOM 638 CE2 PHE A 42 71.422 -0.962 4.897 1.00 0.00 C ATOM 639 CZ PHE A 42 71.110 -2.035 3.999 1.00 0.00 C ATOM 0 H PHE A 42 73.861 1.813 0.026 1.00 0.00 H new ATOM 0 HA PHE A 42 71.150 2.117 1.356 1.00 0.00 H new ATOM 0 HB2 PHE A 42 73.979 1.440 2.199 1.00 0.00 H new ATOM 0 HB3 PHE A 42 72.992 2.372 3.307 1.00 0.00 H new ATOM 0 HD1 PHE A 42 72.218 -0.610 1.045 1.00 0.00 H new ATOM 0 HD2 PHE A 42 72.255 1.049 5.075 1.00 0.00 H new ATOM 0 HE1 PHE A 42 71.162 -2.715 1.924 1.00 0.00 H new ATOM 0 HE2 PHE A 42 71.205 -1.060 5.951 1.00 0.00 H new ATOM 0 HZ PHE A 42 70.658 -2.940 4.376 1.00 0.00 H new ATOM 649 N ARG A 43 71.474 4.578 1.706 1.00 0.00 N ATOM 650 CA ARG A 43 71.615 6.067 1.671 1.00 0.00 C ATOM 651 C ARG A 43 71.125 6.671 2.987 1.00 0.00 C ATOM 652 O ARG A 43 70.185 6.187 3.586 1.00 0.00 O ATOM 653 CB ARG A 43 70.733 6.524 0.509 1.00 0.00 C ATOM 654 CG ARG A 43 70.942 8.020 0.267 1.00 0.00 C ATOM 655 CD ARG A 43 70.015 8.490 -0.857 1.00 0.00 C ATOM 656 NE ARG A 43 70.401 9.915 -1.113 1.00 0.00 N ATOM 657 CZ ARG A 43 69.579 10.763 -1.708 1.00 0.00 C ATOM 658 NH1 ARG A 43 68.379 10.405 -2.111 1.00 0.00 N ATOM 659 NH2 ARG A 43 69.971 11.993 -1.904 1.00 0.00 N ATOM 0 H ARG A 43 70.584 4.238 2.069 1.00 0.00 H new ATOM 0 HA ARG A 43 72.651 6.382 1.541 1.00 0.00 H new ATOM 0 HB2 ARG A 43 70.979 5.961 -0.391 1.00 0.00 H new ATOM 0 HB3 ARG A 43 69.685 6.324 0.733 1.00 0.00 H new ATOM 0 HG2 ARG A 43 70.737 8.579 1.180 1.00 0.00 H new ATOM 0 HG3 ARG A 43 71.981 8.215 0.001 1.00 0.00 H new ATOM 0 HD2 ARG A 43 70.141 7.881 -1.752 1.00 0.00 H new ATOM 0 HD3 ARG A 43 68.968 8.412 -0.563 1.00 0.00 H new ATOM 0 HE ARG A 43 71.323 10.240 -0.820 1.00 0.00 H new ATOM 0 HH11 ARG A 43 68.057 9.448 -1.968 1.00 0.00 H new ATOM 0 HH12 ARG A 43 67.770 11.085 -2.567 1.00 0.00 H new ATOM 0 HH21 ARG A 43 70.899 12.287 -1.600 1.00 0.00 H new ATOM 0 HH22 ARG A 43 69.349 12.660 -2.362 1.00 0.00 H new ATOM 673 N ASN A 44 71.760 7.725 3.447 1.00 0.00 N ATOM 674 CA ASN A 44 71.339 8.383 4.734 1.00 0.00 C ATOM 675 C ASN A 44 71.263 7.358 5.878 1.00 0.00 C ATOM 676 O ASN A 44 70.361 7.393 6.694 1.00 0.00 O ATOM 677 CB ASN A 44 69.955 8.984 4.459 1.00 0.00 C ATOM 678 CG ASN A 44 70.047 9.989 3.307 1.00 0.00 C ATOM 679 OD1 ASN A 44 69.228 9.978 2.410 1.00 0.00 O ATOM 680 ND2 ASN A 44 71.015 10.864 3.295 1.00 0.00 N ATOM 0 H ASN A 44 72.557 8.162 2.985 1.00 0.00 H new ATOM 0 HA ASN A 44 72.057 9.143 5.044 1.00 0.00 H new ATOM 0 HB2 ASN A 44 69.248 8.193 4.209 1.00 0.00 H new ATOM 0 HB3 ASN A 44 69.578 9.477 5.355 1.00 0.00 H new ATOM 0 HD21 ASN A 44 71.084 11.538 2.533 1.00 0.00 H new ATOM 0 HD22 ASN A 44 71.703 10.874 4.048 1.00 0.00 H new ATOM 687 N GLY A 45 72.207 6.451 5.935 1.00 0.00 N ATOM 688 CA GLY A 45 72.262 5.474 7.065 1.00 0.00 C ATOM 689 C GLY A 45 71.003 4.596 7.097 1.00 0.00 C ATOM 690 O GLY A 45 70.664 4.038 8.125 1.00 0.00 O ATOM 0 H GLY A 45 72.947 6.345 5.241 1.00 0.00 H new ATOM 0 HA2 GLY A 45 73.146 4.844 6.963 1.00 0.00 H new ATOM 0 HA3 GLY A 45 72.360 6.010 8.009 1.00 0.00 H new ATOM 694 N VAL A 46 70.310 4.469 5.989 1.00 0.00 N ATOM 695 CA VAL A 46 69.155 3.520 5.922 1.00 0.00 C ATOM 696 C VAL A 46 69.080 2.888 4.515 1.00 0.00 C ATOM 697 O VAL A 46 69.492 3.503 3.553 1.00 0.00 O ATOM 698 CB VAL A 46 67.922 4.385 6.231 1.00 0.00 C ATOM 699 CG1 VAL A 46 66.630 3.581 6.031 1.00 0.00 C ATOM 700 CG2 VAL A 46 67.998 4.839 7.687 1.00 0.00 C ATOM 0 H VAL A 46 70.496 4.983 5.128 1.00 0.00 H new ATOM 0 HA VAL A 46 69.238 2.690 6.623 1.00 0.00 H new ATOM 0 HB VAL A 46 67.911 5.241 5.556 1.00 0.00 H new ATOM 0 HG11 VAL A 46 65.770 4.212 6.255 1.00 0.00 H new ATOM 0 HG12 VAL A 46 66.570 3.240 4.998 1.00 0.00 H new ATOM 0 HG13 VAL A 46 66.631 2.719 6.698 1.00 0.00 H new ATOM 0 HG21 VAL A 46 67.130 5.454 7.922 1.00 0.00 H new ATOM 0 HG22 VAL A 46 68.012 3.966 8.340 1.00 0.00 H new ATOM 0 HG23 VAL A 46 68.907 5.421 7.840 1.00 0.00 H new ATOM 710 N PRO A 47 68.554 1.678 4.426 1.00 0.00 N ATOM 711 CA PRO A 47 68.542 0.964 3.124 1.00 0.00 C ATOM 712 C PRO A 47 67.567 1.641 2.156 1.00 0.00 C ATOM 713 O PRO A 47 66.541 2.154 2.564 1.00 0.00 O ATOM 714 CB PRO A 47 68.067 -0.455 3.469 1.00 0.00 C ATOM 715 CG PRO A 47 68.048 -0.534 4.967 1.00 0.00 C ATOM 716 CD PRO A 47 67.932 0.870 5.487 1.00 0.00 C ATOM 0 HA PRO A 47 69.517 0.965 2.636 1.00 0.00 H new ATOM 0 HB2 PRO A 47 67.076 -0.646 3.056 1.00 0.00 H new ATOM 0 HB3 PRO A 47 68.738 -1.204 3.048 1.00 0.00 H new ATOM 0 HG2 PRO A 47 67.210 -1.141 5.309 1.00 0.00 H new ATOM 0 HG3 PRO A 47 68.957 -1.007 5.338 1.00 0.00 H new ATOM 0 HD2 PRO A 47 66.892 1.153 5.651 1.00 0.00 H new ATOM 0 HD3 PRO A 47 68.449 0.990 6.439 1.00 0.00 H new ATOM 724 N LEU A 48 67.880 1.647 0.880 1.00 0.00 N ATOM 725 CA LEU A 48 66.925 2.212 -0.125 1.00 0.00 C ATOM 726 C LEU A 48 65.806 1.206 -0.410 1.00 0.00 C ATOM 727 O LEU A 48 65.994 0.010 -0.294 1.00 0.00 O ATOM 728 CB LEU A 48 67.758 2.461 -1.388 1.00 0.00 C ATOM 729 CG LEU A 48 68.902 3.436 -1.081 1.00 0.00 C ATOM 730 CD1 LEU A 48 69.762 3.624 -2.335 1.00 0.00 C ATOM 731 CD2 LEU A 48 68.327 4.793 -0.654 1.00 0.00 C ATOM 0 H LEU A 48 68.752 1.286 0.494 1.00 0.00 H new ATOM 0 HA LEU A 48 66.452 3.127 0.230 1.00 0.00 H new ATOM 0 HB2 LEU A 48 68.162 1.519 -1.758 1.00 0.00 H new ATOM 0 HB3 LEU A 48 67.125 2.868 -2.176 1.00 0.00 H new ATOM 0 HG LEU A 48 69.512 3.031 -0.274 1.00 0.00 H new ATOM 0 HD11 LEU A 48 70.575 4.317 -2.118 1.00 0.00 H new ATOM 0 HD12 LEU A 48 70.176 2.663 -2.640 1.00 0.00 H new ATOM 0 HD13 LEU A 48 69.148 4.027 -3.140 1.00 0.00 H new ATOM 0 HD21 LEU A 48 69.143 5.482 -0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 48 67.714 5.198 -1.459 1.00 0.00 H new ATOM 0 HD23 LEU A 48 67.714 4.664 0.238 1.00 0.00 H new ATOM 743 N ARG A 49 64.642 1.687 -0.780 1.00 0.00 N ATOM 744 CA ARG A 49 63.478 0.769 -1.022 1.00 0.00 C ATOM 745 C ARG A 49 63.833 -0.281 -2.082 1.00 0.00 C ATOM 746 O ARG A 49 63.393 -1.414 -2.013 1.00 0.00 O ATOM 747 CB ARG A 49 62.346 1.669 -1.522 1.00 0.00 C ATOM 748 CG ARG A 49 61.947 2.647 -0.415 1.00 0.00 C ATOM 749 CD ARG A 49 60.754 3.489 -0.879 1.00 0.00 C ATOM 750 NE ARG A 49 59.601 2.536 -0.924 1.00 0.00 N ATOM 751 CZ ARG A 49 59.047 2.060 0.178 1.00 0.00 C ATOM 752 NH1 ARG A 49 59.472 2.401 1.376 1.00 0.00 N ATOM 753 NH2 ARG A 49 58.047 1.228 0.076 1.00 0.00 N ATOM 0 H ARG A 49 64.446 2.677 -0.926 1.00 0.00 H new ATOM 0 HA ARG A 49 63.197 0.227 -0.119 1.00 0.00 H new ATOM 0 HB2 ARG A 49 62.667 2.217 -2.408 1.00 0.00 H new ATOM 0 HB3 ARG A 49 61.488 1.064 -1.814 1.00 0.00 H new ATOM 0 HG2 ARG A 49 61.688 2.100 0.492 1.00 0.00 H new ATOM 0 HG3 ARG A 49 62.788 3.295 -0.168 1.00 0.00 H new ATOM 0 HD2 ARG A 49 60.560 4.311 -0.190 1.00 0.00 H new ATOM 0 HD3 ARG A 49 60.940 3.930 -1.858 1.00 0.00 H new ATOM 0 HE ARG A 49 59.232 2.246 -1.830 1.00 0.00 H new ATOM 0 HH11 ARG A 49 60.252 3.051 1.475 1.00 0.00 H new ATOM 0 HH12 ARG A 49 59.022 2.015 2.206 1.00 0.00 H new ATOM 0 HH21 ARG A 49 57.704 0.954 -0.844 1.00 0.00 H new ATOM 0 HH22 ARG A 49 57.609 0.852 0.917 1.00 0.00 H new ATOM 767 N LYS A 50 64.623 0.094 -3.057 1.00 0.00 N ATOM 768 CA LYS A 50 65.066 -0.886 -4.093 1.00 0.00 C ATOM 769 C LYS A 50 66.450 -1.435 -3.734 1.00 0.00 C ATOM 770 O LYS A 50 67.464 -0.896 -4.142 1.00 0.00 O ATOM 771 CB LYS A 50 65.124 -0.088 -5.396 1.00 0.00 C ATOM 772 CG LYS A 50 63.727 0.434 -5.740 1.00 0.00 C ATOM 773 CD LYS A 50 63.745 1.060 -7.136 1.00 0.00 C ATOM 774 CE LYS A 50 64.625 2.311 -7.124 1.00 0.00 C ATOM 775 NZ LYS A 50 64.421 2.938 -8.460 1.00 0.00 N ATOM 0 H LYS A 50 64.981 1.041 -3.179 1.00 0.00 H new ATOM 0 HA LYS A 50 64.394 -1.740 -4.172 1.00 0.00 H new ATOM 0 HB2 LYS A 50 65.820 0.745 -5.294 1.00 0.00 H new ATOM 0 HB3 LYS A 50 65.497 -0.718 -6.204 1.00 0.00 H new ATOM 0 HG2 LYS A 50 63.004 -0.381 -5.705 1.00 0.00 H new ATOM 0 HG3 LYS A 50 63.411 1.172 -5.003 1.00 0.00 H new ATOM 0 HD2 LYS A 50 64.125 0.342 -7.863 1.00 0.00 H new ATOM 0 HD3 LYS A 50 62.732 1.318 -7.443 1.00 0.00 H new ATOM 0 HE2 LYS A 50 64.336 2.989 -6.321 1.00 0.00 H new ATOM 0 HE3 LYS A 50 65.672 2.055 -6.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 64.993 3.804 -8.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 64.711 2.272 -9.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 63.416 3.177 -8.582 1.00 0.00 H new ATOM 789 N GLN A 51 66.493 -2.500 -2.973 1.00 0.00 N ATOM 790 CA GLN A 51 67.810 -3.085 -2.559 1.00 0.00 C ATOM 791 C GLN A 51 68.606 -3.522 -3.792 1.00 0.00 C ATOM 792 O GLN A 51 69.817 -3.402 -3.831 1.00 0.00 O ATOM 793 CB GLN A 51 67.464 -4.295 -1.687 1.00 0.00 C ATOM 794 CG GLN A 51 68.736 -4.831 -1.029 1.00 0.00 C ATOM 795 CD GLN A 51 68.405 -6.093 -0.231 1.00 0.00 C ATOM 796 OE1 GLN A 51 67.987 -7.088 -0.790 1.00 0.00 O ATOM 797 NE2 GLN A 51 68.577 -6.096 1.063 1.00 0.00 N ATOM 0 H GLN A 51 65.673 -2.992 -2.619 1.00 0.00 H new ATOM 0 HA GLN A 51 68.425 -2.364 -2.021 1.00 0.00 H new ATOM 0 HB2 GLN A 51 66.739 -4.011 -0.924 1.00 0.00 H new ATOM 0 HB3 GLN A 51 67.000 -5.073 -2.294 1.00 0.00 H new ATOM 0 HG2 GLN A 51 69.485 -5.054 -1.789 1.00 0.00 H new ATOM 0 HG3 GLN A 51 69.165 -4.074 -0.372 1.00 0.00 H new ATOM 0 HE21 GLN A 51 68.928 -5.261 1.533 1.00 0.00 H new ATOM 0 HE22 GLN A 51 68.361 -6.933 1.604 1.00 0.00 H new ATOM 806 N ASN A 52 67.931 -4.027 -4.796 1.00 0.00 N ATOM 807 CA ASN A 52 68.641 -4.520 -6.018 1.00 0.00 C ATOM 808 C ASN A 52 68.907 -3.379 -7.019 1.00 0.00 C ATOM 809 O ASN A 52 69.444 -3.614 -8.087 1.00 0.00 O ATOM 810 CB ASN A 52 67.697 -5.554 -6.634 1.00 0.00 C ATOM 811 CG ASN A 52 67.471 -6.700 -5.646 1.00 0.00 C ATOM 812 OD1 ASN A 52 66.348 -7.105 -5.413 1.00 0.00 O ATOM 813 ND2 ASN A 52 68.496 -7.247 -5.052 1.00 0.00 N ATOM 0 H ASN A 52 66.916 -4.119 -4.822 1.00 0.00 H new ATOM 0 HA ASN A 52 69.616 -4.938 -5.768 1.00 0.00 H new ATOM 0 HB2 ASN A 52 66.745 -5.086 -6.887 1.00 0.00 H new ATOM 0 HB3 ASN A 52 68.120 -5.939 -7.562 1.00 0.00 H new ATOM 0 HD21 ASN A 52 68.355 -8.013 -4.393 1.00 0.00 H new ATOM 0 HD22 ASN A 52 69.438 -6.909 -5.246 1.00 0.00 H new ATOM 820 N ALA A 53 68.543 -2.154 -6.692 1.00 0.00 N ATOM 821 CA ALA A 53 68.773 -1.021 -7.646 1.00 0.00 C ATOM 822 C ALA A 53 70.256 -0.644 -7.669 1.00 0.00 C ATOM 823 O ALA A 53 70.896 -0.551 -6.636 1.00 0.00 O ATOM 824 CB ALA A 53 67.933 0.140 -7.111 1.00 0.00 C ATOM 0 H ALA A 53 68.100 -1.895 -5.811 1.00 0.00 H new ATOM 0 HA ALA A 53 68.493 -1.283 -8.666 1.00 0.00 H new ATOM 0 HB1 ALA A 53 68.053 1.006 -7.762 1.00 0.00 H new ATOM 0 HB2 ALA A 53 66.883 -0.152 -7.085 1.00 0.00 H new ATOM 0 HB3 ALA A 53 68.263 0.394 -6.104 1.00 0.00 H new ATOM 830 N GLU A 54 70.803 -0.427 -8.841 1.00 0.00 N ATOM 831 CA GLU A 54 72.247 -0.052 -8.946 1.00 0.00 C ATOM 832 C GLU A 54 72.415 1.474 -8.869 1.00 0.00 C ATOM 833 O GLU A 54 71.625 2.222 -9.416 1.00 0.00 O ATOM 834 CB GLU A 54 72.718 -0.607 -10.306 1.00 0.00 C ATOM 835 CG GLU A 54 72.040 0.127 -11.477 1.00 0.00 C ATOM 836 CD GLU A 54 72.524 -0.469 -12.800 1.00 0.00 C ATOM 837 OE1 GLU A 54 73.676 -0.253 -13.137 1.00 0.00 O ATOM 838 OE2 GLU A 54 71.734 -1.130 -13.454 1.00 0.00 O ATOM 0 H GLU A 54 70.310 -0.494 -9.731 1.00 0.00 H new ATOM 0 HA GLU A 54 72.839 -0.463 -8.128 1.00 0.00 H new ATOM 0 HB2 GLU A 54 73.800 -0.504 -10.388 1.00 0.00 H new ATOM 0 HB3 GLU A 54 72.494 -1.672 -10.363 1.00 0.00 H new ATOM 0 HG2 GLU A 54 70.957 0.036 -11.399 1.00 0.00 H new ATOM 0 HG3 GLU A 54 72.274 1.191 -11.438 1.00 0.00 H new ATOM 845 N VAL A 55 73.440 1.931 -8.193 1.00 0.00 N ATOM 846 CA VAL A 55 73.720 3.401 -8.136 1.00 0.00 C ATOM 847 C VAL A 55 74.934 3.725 -9.008 1.00 0.00 C ATOM 848 O VAL A 55 75.994 3.154 -8.832 1.00 0.00 O ATOM 849 CB VAL A 55 74.025 3.687 -6.658 1.00 0.00 C ATOM 850 CG1 VAL A 55 74.364 5.171 -6.464 1.00 0.00 C ATOM 851 CG2 VAL A 55 72.798 3.344 -5.812 1.00 0.00 C ATOM 0 H VAL A 55 74.098 1.348 -7.676 1.00 0.00 H new ATOM 0 HA VAL A 55 72.888 4.004 -8.502 1.00 0.00 H new ATOM 0 HB VAL A 55 74.876 3.080 -6.350 1.00 0.00 H new ATOM 0 HG11 VAL A 55 74.578 5.361 -5.412 1.00 0.00 H new ATOM 0 HG12 VAL A 55 75.238 5.426 -7.064 1.00 0.00 H new ATOM 0 HG13 VAL A 55 73.517 5.782 -6.778 1.00 0.00 H new ATOM 0 HG21 VAL A 55 73.012 3.546 -4.762 1.00 0.00 H new ATOM 0 HG22 VAL A 55 71.953 3.952 -6.134 1.00 0.00 H new ATOM 0 HG23 VAL A 55 72.554 2.289 -5.936 1.00 0.00 H new ATOM 861 N VAL A 56 74.785 4.633 -9.941 1.00 0.00 N ATOM 862 CA VAL A 56 75.955 5.054 -10.772 1.00 0.00 C ATOM 863 C VAL A 56 76.145 6.565 -10.657 1.00 0.00 C ATOM 864 O VAL A 56 75.320 7.338 -11.106 1.00 0.00 O ATOM 865 CB VAL A 56 75.629 4.659 -12.214 1.00 0.00 C ATOM 866 CG1 VAL A 56 76.850 4.949 -13.084 1.00 0.00 C ATOM 867 CG2 VAL A 56 75.302 3.163 -12.295 1.00 0.00 C ATOM 0 H VAL A 56 73.906 5.100 -10.163 1.00 0.00 H new ATOM 0 HA VAL A 56 76.878 4.577 -10.442 1.00 0.00 H new ATOM 0 HB VAL A 56 74.766 5.228 -12.559 1.00 0.00 H new ATOM 0 HG11 VAL A 56 76.635 4.673 -14.116 1.00 0.00 H new ATOM 0 HG12 VAL A 56 77.088 6.012 -13.034 1.00 0.00 H new ATOM 0 HG13 VAL A 56 77.700 4.370 -12.723 1.00 0.00 H new ATOM 0 HG21 VAL A 56 75.072 2.896 -13.327 1.00 0.00 H new ATOM 0 HG22 VAL A 56 76.160 2.584 -11.953 1.00 0.00 H new ATOM 0 HG23 VAL A 56 74.441 2.944 -11.663 1.00 0.00 H new ATOM 877 N LEU A 57 77.227 6.981 -10.060 1.00 0.00 N ATOM 878 CA LEU A 57 77.433 8.433 -9.788 1.00 0.00 C ATOM 879 C LEU A 57 78.801 8.886 -10.306 1.00 0.00 C ATOM 880 O LEU A 57 79.800 8.218 -10.107 1.00 0.00 O ATOM 881 CB LEU A 57 77.315 8.539 -8.270 1.00 0.00 C ATOM 882 CG LEU A 57 75.829 8.622 -7.904 1.00 0.00 C ATOM 883 CD1 LEU A 57 75.592 7.998 -6.533 1.00 0.00 C ATOM 884 CD2 LEU A 57 75.401 10.091 -7.856 1.00 0.00 C ATOM 0 H LEU A 57 77.984 6.373 -9.746 1.00 0.00 H new ATOM 0 HA LEU A 57 76.713 9.079 -10.291 1.00 0.00 H new ATOM 0 HB2 LEU A 57 77.775 7.674 -7.793 1.00 0.00 H new ATOM 0 HB3 LEU A 57 77.844 9.421 -7.909 1.00 0.00 H new ATOM 0 HG LEU A 57 75.249 8.084 -8.654 1.00 0.00 H new ATOM 0 HD11 LEU A 57 74.533 8.062 -6.282 1.00 0.00 H new ATOM 0 HD12 LEU A 57 75.898 6.952 -6.552 1.00 0.00 H new ATOM 0 HD13 LEU A 57 76.175 8.533 -5.784 1.00 0.00 H new ATOM 0 HD21 LEU A 57 74.344 10.154 -7.596 1.00 0.00 H new ATOM 0 HD22 LEU A 57 75.991 10.618 -7.106 1.00 0.00 H new ATOM 0 HD23 LEU A 57 75.562 10.549 -8.832 1.00 0.00 H new ATOM 896 N LYS A 58 78.847 10.015 -10.970 1.00 0.00 N ATOM 897 CA LYS A 58 80.132 10.489 -11.574 1.00 0.00 C ATOM 898 C LYS A 58 81.068 11.034 -10.490 1.00 0.00 C ATOM 899 O LYS A 58 80.637 11.681 -9.555 1.00 0.00 O ATOM 900 CB LYS A 58 79.732 11.607 -12.540 1.00 0.00 C ATOM 901 CG LYS A 58 78.859 11.030 -13.655 1.00 0.00 C ATOM 902 CD LYS A 58 78.552 12.123 -14.681 1.00 0.00 C ATOM 903 CE LYS A 58 77.576 11.581 -15.727 1.00 0.00 C ATOM 904 NZ LYS A 58 76.848 12.778 -16.232 1.00 0.00 N ATOM 0 H LYS A 58 78.048 10.631 -11.120 1.00 0.00 H new ATOM 0 HA LYS A 58 80.666 9.682 -12.077 1.00 0.00 H new ATOM 0 HB2 LYS A 58 79.189 12.387 -12.006 1.00 0.00 H new ATOM 0 HB3 LYS A 58 80.622 12.071 -12.964 1.00 0.00 H new ATOM 0 HG2 LYS A 58 79.370 10.197 -14.137 1.00 0.00 H new ATOM 0 HG3 LYS A 58 77.932 10.637 -13.239 1.00 0.00 H new ATOM 0 HD2 LYS A 58 78.123 12.993 -14.184 1.00 0.00 H new ATOM 0 HD3 LYS A 58 79.472 12.453 -15.163 1.00 0.00 H new ATOM 0 HE2 LYS A 58 78.104 11.071 -16.533 1.00 0.00 H new ATOM 0 HE3 LYS A 58 76.889 10.857 -15.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 76.159 12.486 -16.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 76.349 13.239 -15.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 77.526 13.446 -16.650 1.00 0.00 H new ATOM 918 N CYS A 59 82.347 10.772 -10.614 1.00 0.00 N ATOM 919 CA CYS A 59 83.342 11.326 -9.635 1.00 0.00 C ATOM 920 C CYS A 59 83.225 12.855 -9.539 1.00 0.00 C ATOM 921 O CYS A 59 83.459 13.440 -8.498 1.00 0.00 O ATOM 922 CB CYS A 59 84.725 10.921 -10.177 1.00 0.00 C ATOM 923 SG CYS A 59 84.975 11.583 -11.850 1.00 0.00 S ATOM 0 H CYS A 59 82.749 10.196 -11.354 1.00 0.00 H new ATOM 0 HA CYS A 59 83.172 10.938 -8.631 1.00 0.00 H new ATOM 0 HB2 CYS A 59 85.505 11.293 -9.513 1.00 0.00 H new ATOM 0 HB3 CYS A 59 84.811 9.835 -10.193 1.00 0.00 H new ATOM 0 HG CYS A 59 86.148 11.231 -12.285 1.00 0.00 H new ATOM 929 N THR A 60 82.864 13.497 -10.624 1.00 0.00 N ATOM 930 CA THR A 60 82.727 14.990 -10.614 1.00 0.00 C ATOM 931 C THR A 60 81.589 15.412 -9.678 1.00 0.00 C ATOM 932 O THR A 60 81.589 16.509 -9.150 1.00 0.00 O ATOM 933 CB THR A 60 82.403 15.384 -12.060 1.00 0.00 C ATOM 934 OG1 THR A 60 81.187 14.765 -12.456 1.00 0.00 O ATOM 935 CG2 THR A 60 83.535 14.933 -12.984 1.00 0.00 C ATOM 0 H THR A 60 82.658 13.052 -11.518 1.00 0.00 H new ATOM 0 HA THR A 60 83.634 15.478 -10.257 1.00 0.00 H new ATOM 0 HB THR A 60 82.298 16.467 -12.126 1.00 0.00 H new ATOM 0 HG1 THR A 60 80.977 15.017 -13.380 1.00 0.00 H new ATOM 0 HG21 THR A 60 83.301 15.215 -14.011 1.00 0.00 H new ATOM 0 HG22 THR A 60 84.466 15.412 -12.680 1.00 0.00 H new ATOM 0 HG23 THR A 60 83.646 13.851 -12.921 1.00 0.00 H new ATOM 943 N ASP A 61 80.623 14.548 -9.471 1.00 0.00 N ATOM 944 CA ASP A 61 79.499 14.876 -8.541 1.00 0.00 C ATOM 945 C ASP A 61 79.853 14.452 -7.109 1.00 0.00 C ATOM 946 O ASP A 61 79.317 14.979 -6.151 1.00 0.00 O ATOM 947 CB ASP A 61 78.302 14.078 -9.061 1.00 0.00 C ATOM 948 CG ASP A 61 77.933 14.550 -10.472 1.00 0.00 C ATOM 949 OD1 ASP A 61 78.159 15.712 -10.770 1.00 0.00 O ATOM 950 OD2 ASP A 61 77.431 13.738 -11.232 1.00 0.00 O ATOM 0 H ASP A 61 80.566 13.628 -9.908 1.00 0.00 H new ATOM 0 HA ASP A 61 79.289 15.945 -8.511 1.00 0.00 H new ATOM 0 HB2 ASP A 61 78.541 13.015 -9.075 1.00 0.00 H new ATOM 0 HB3 ASP A 61 77.451 14.205 -8.392 1.00 0.00 H new ATOM 955 N ILE A 62 80.752 13.505 -6.960 1.00 0.00 N ATOM 956 CA ILE A 62 81.185 13.081 -5.591 1.00 0.00 C ATOM 957 C ILE A 62 82.229 14.062 -5.049 1.00 0.00 C ATOM 958 O ILE A 62 83.049 14.577 -5.786 1.00 0.00 O ATOM 959 CB ILE A 62 81.797 11.684 -5.775 1.00 0.00 C ATOM 960 CG1 ILE A 62 80.749 10.734 -6.366 1.00 0.00 C ATOM 961 CG2 ILE A 62 82.259 11.141 -4.419 1.00 0.00 C ATOM 962 CD1 ILE A 62 81.405 9.393 -6.702 1.00 0.00 C ATOM 0 H ILE A 62 81.203 13.009 -7.728 1.00 0.00 H new ATOM 0 HA ILE A 62 80.359 13.066 -4.880 1.00 0.00 H new ATOM 0 HB ILE A 62 82.649 11.755 -6.451 1.00 0.00 H new ATOM 0 HG12 ILE A 62 79.936 10.585 -5.655 1.00 0.00 H new ATOM 0 HG13 ILE A 62 80.311 11.172 -7.263 1.00 0.00 H new ATOM 0 HG21 ILE A 62 82.693 10.150 -4.553 1.00 0.00 H new ATOM 0 HG22 ILE A 62 83.007 11.810 -3.995 1.00 0.00 H new ATOM 0 HG23 ILE A 62 81.406 11.076 -3.743 1.00 0.00 H new ATOM 0 HD11 ILE A 62 80.659 8.718 -7.122 1.00 0.00 H new ATOM 0 HD12 ILE A 62 82.202 9.550 -7.428 1.00 0.00 H new ATOM 0 HD13 ILE A 62 81.821 8.954 -5.795 1.00 0.00 H new ATOM 974 N ARG A 63 82.199 14.321 -3.764 1.00 0.00 N ATOM 975 CA ARG A 63 83.161 15.292 -3.162 1.00 0.00 C ATOM 976 C ARG A 63 84.306 14.546 -2.470 1.00 0.00 C ATOM 977 O ARG A 63 85.429 15.014 -2.444 1.00 0.00 O ATOM 978 CB ARG A 63 82.341 16.088 -2.146 1.00 0.00 C ATOM 979 CG ARG A 63 83.206 17.198 -1.546 1.00 0.00 C ATOM 980 CD ARG A 63 83.433 18.290 -2.594 1.00 0.00 C ATOM 981 NE ARG A 63 84.349 19.273 -1.933 1.00 0.00 N ATOM 982 CZ ARG A 63 85.647 19.051 -1.822 1.00 0.00 C ATOM 983 NH1 ARG A 63 86.208 17.955 -2.286 1.00 0.00 N ATOM 984 NH2 ARG A 63 86.394 19.945 -1.236 1.00 0.00 N ATOM 0 H ARG A 63 81.546 13.898 -3.105 1.00 0.00 H new ATOM 0 HA ARG A 63 83.616 15.940 -3.911 1.00 0.00 H new ATOM 0 HB2 ARG A 63 81.463 16.518 -2.629 1.00 0.00 H new ATOM 0 HB3 ARG A 63 81.980 15.428 -1.357 1.00 0.00 H new ATOM 0 HG2 ARG A 63 82.718 17.619 -0.667 1.00 0.00 H new ATOM 0 HG3 ARG A 63 84.162 16.791 -1.216 1.00 0.00 H new ATOM 0 HD2 ARG A 63 83.880 17.881 -3.500 1.00 0.00 H new ATOM 0 HD3 ARG A 63 82.493 18.759 -2.885 1.00 0.00 H new ATOM 0 HE ARG A 63 83.960 20.138 -1.558 1.00 0.00 H new ATOM 0 HH11 ARG A 63 85.638 17.246 -2.748 1.00 0.00 H new ATOM 0 HH12 ARG A 63 87.213 17.814 -2.184 1.00 0.00 H new ATOM 0 HH21 ARG A 63 85.975 20.800 -0.871 1.00 0.00 H new ATOM 0 HH22 ARG A 63 87.398 19.789 -1.142 1.00 0.00 H new ATOM 998 N SER A 64 84.028 13.389 -1.911 1.00 0.00 N ATOM 999 CA SER A 64 85.105 12.611 -1.217 1.00 0.00 C ATOM 1000 C SER A 64 84.705 11.139 -1.086 1.00 0.00 C ATOM 1001 O SER A 64 83.539 10.811 -1.001 1.00 0.00 O ATOM 1002 CB SER A 64 85.242 13.258 0.160 1.00 0.00 C ATOM 1003 OG SER A 64 86.327 12.657 0.855 1.00 0.00 O ATOM 0 H SER A 64 83.106 12.953 -1.906 1.00 0.00 H new ATOM 0 HA SER A 64 86.044 12.631 -1.770 1.00 0.00 H new ATOM 0 HB2 SER A 64 85.411 14.330 0.056 1.00 0.00 H new ATOM 0 HB3 SER A 64 84.319 13.134 0.726 1.00 0.00 H new ATOM 0 HG SER A 64 86.419 13.071 1.739 1.00 0.00 H new ATOM 1009 N ILE A 65 85.674 10.253 -1.068 1.00 0.00 N ATOM 1010 CA ILE A 65 85.363 8.789 -0.999 1.00 0.00 C ATOM 1011 C ILE A 65 86.340 8.092 -0.045 1.00 0.00 C ATOM 1012 O ILE A 65 87.482 8.490 0.089 1.00 0.00 O ATOM 1013 CB ILE A 65 85.530 8.247 -2.425 1.00 0.00 C ATOM 1014 CG1 ILE A 65 84.614 9.015 -3.392 1.00 0.00 C ATOM 1015 CG2 ILE A 65 85.162 6.758 -2.444 1.00 0.00 C ATOM 1016 CD1 ILE A 65 84.864 8.542 -4.827 1.00 0.00 C ATOM 0 H ILE A 65 86.668 10.481 -1.098 1.00 0.00 H new ATOM 0 HA ILE A 65 84.355 8.610 -0.626 1.00 0.00 H new ATOM 0 HB ILE A 65 86.565 8.376 -2.741 1.00 0.00 H new ATOM 0 HG12 ILE A 65 83.570 8.855 -3.123 1.00 0.00 H new ATOM 0 HG13 ILE A 65 84.803 10.086 -3.314 1.00 0.00 H new ATOM 0 HG21 ILE A 65 85.279 6.367 -3.455 1.00 0.00 H new ATOM 0 HG22 ILE A 65 85.818 6.212 -1.766 1.00 0.00 H new ATOM 0 HG23 ILE A 65 84.127 6.635 -2.125 1.00 0.00 H new ATOM 0 HD11 ILE A 65 84.213 9.089 -5.509 1.00 0.00 H new ATOM 0 HD12 ILE A 65 85.905 8.725 -5.094 1.00 0.00 H new ATOM 0 HD13 ILE A 65 84.653 7.475 -4.901 1.00 0.00 H new ATOM 1028 N ASP A 66 85.889 7.054 0.618 1.00 0.00 N ATOM 1029 CA ASP A 66 86.788 6.288 1.536 1.00 0.00 C ATOM 1030 C ASP A 66 86.568 4.778 1.364 1.00 0.00 C ATOM 1031 O ASP A 66 85.450 4.304 1.417 1.00 0.00 O ATOM 1032 CB ASP A 66 86.389 6.739 2.948 1.00 0.00 C ATOM 1033 CG ASP A 66 84.910 6.426 3.210 1.00 0.00 C ATOM 1034 OD1 ASP A 66 84.630 5.341 3.692 1.00 0.00 O ATOM 1035 OD2 ASP A 66 84.086 7.279 2.924 1.00 0.00 O ATOM 0 H ASP A 66 84.933 6.704 0.562 1.00 0.00 H new ATOM 0 HA ASP A 66 87.842 6.474 1.332 1.00 0.00 H new ATOM 0 HB2 ASP A 66 87.011 6.234 3.687 1.00 0.00 H new ATOM 0 HB3 ASP A 66 86.566 7.809 3.059 1.00 0.00 H new ATOM 1040 N LEU A 67 87.625 4.030 1.158 1.00 0.00 N ATOM 1041 CA LEU A 67 87.492 2.539 1.085 1.00 0.00 C ATOM 1042 C LEU A 67 87.321 1.960 2.493 1.00 0.00 C ATOM 1043 O LEU A 67 88.221 2.025 3.310 1.00 0.00 O ATOM 1044 CB LEU A 67 88.805 2.052 0.464 1.00 0.00 C ATOM 1045 CG LEU A 67 88.671 2.002 -1.063 1.00 0.00 C ATOM 1046 CD1 LEU A 67 89.982 2.454 -1.709 1.00 0.00 C ATOM 1047 CD2 LEU A 67 88.361 0.567 -1.505 1.00 0.00 C ATOM 0 H LEU A 67 88.573 4.386 1.037 1.00 0.00 H new ATOM 0 HA LEU A 67 86.626 2.228 0.501 1.00 0.00 H new ATOM 0 HB2 LEU A 67 89.620 2.719 0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 67 89.055 1.063 0.849 1.00 0.00 H new ATOM 0 HG LEU A 67 87.863 2.664 -1.373 1.00 0.00 H new ATOM 0 HD11 LEU A 67 89.884 2.418 -2.794 1.00 0.00 H new ATOM 0 HD12 LEU A 67 90.208 3.474 -1.399 1.00 0.00 H new ATOM 0 HD13 LEU A 67 90.789 1.792 -1.395 1.00 0.00 H new ATOM 0 HD21 LEU A 67 88.266 0.533 -2.590 1.00 0.00 H new ATOM 0 HD22 LEU A 67 89.169 -0.093 -1.191 1.00 0.00 H new ATOM 0 HD23 LEU A 67 87.427 0.240 -1.049 1.00 0.00 H new ATOM 1059 N ILE A 68 86.172 1.396 2.776 1.00 0.00 N ATOM 1060 CA ILE A 68 85.915 0.846 4.146 1.00 0.00 C ATOM 1061 C ILE A 68 86.672 -0.473 4.336 1.00 0.00 C ATOM 1062 O ILE A 68 87.455 -0.621 5.256 1.00 0.00 O ATOM 1063 CB ILE A 68 84.397 0.614 4.215 1.00 0.00 C ATOM 1064 CG1 ILE A 68 83.661 1.938 3.970 1.00 0.00 C ATOM 1065 CG2 ILE A 68 84.015 0.079 5.600 1.00 0.00 C ATOM 1066 CD1 ILE A 68 82.156 1.677 3.876 1.00 0.00 C ATOM 0 H ILE A 68 85.400 1.292 2.118 1.00 0.00 H new ATOM 0 HA ILE A 68 86.254 1.524 4.930 1.00 0.00 H new ATOM 0 HB ILE A 68 84.115 -0.112 3.452 1.00 0.00 H new ATOM 0 HG12 ILE A 68 83.869 2.637 4.780 1.00 0.00 H new ATOM 0 HG13 ILE A 68 84.019 2.400 3.050 1.00 0.00 H new ATOM 0 HG21 ILE A 68 82.938 -0.083 5.643 1.00 0.00 H new ATOM 0 HG22 ILE A 68 84.532 -0.864 5.781 1.00 0.00 H new ATOM 0 HG23 ILE A 68 84.303 0.803 6.362 1.00 0.00 H new ATOM 0 HD11 ILE A 68 81.634 2.618 3.702 1.00 0.00 H new ATOM 0 HD12 ILE A 68 81.956 0.993 3.051 1.00 0.00 H new ATOM 0 HD13 ILE A 68 81.805 1.234 4.808 1.00 0.00 H new ATOM 1078 N GLU A 69 86.441 -1.428 3.469 1.00 0.00 N ATOM 1079 CA GLU A 69 87.068 -2.776 3.637 1.00 0.00 C ATOM 1080 C GLU A 69 87.588 -3.305 2.288 1.00 0.00 C ATOM 1081 O GLU A 69 86.968 -3.071 1.269 1.00 0.00 O ATOM 1082 CB GLU A 69 85.945 -3.668 4.165 1.00 0.00 C ATOM 1083 CG GLU A 69 85.539 -3.206 5.565 1.00 0.00 C ATOM 1084 CD GLU A 69 84.851 -4.356 6.304 1.00 0.00 C ATOM 1085 OE1 GLU A 69 85.543 -5.284 6.689 1.00 0.00 O ATOM 1086 OE2 GLU A 69 83.645 -4.289 6.472 1.00 0.00 O ATOM 0 H GLU A 69 85.843 -1.331 2.649 1.00 0.00 H new ATOM 0 HA GLU A 69 87.924 -2.748 4.311 1.00 0.00 H new ATOM 0 HB2 GLU A 69 85.087 -3.626 3.494 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.275 -4.706 4.195 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.418 -2.877 6.120 1.00 0.00 H new ATOM 0 HG3 GLU A 69 84.867 -2.350 5.496 1.00 0.00 H new ATOM 1093 N PRO A 70 88.708 -4.010 2.311 1.00 0.00 N ATOM 1094 CA PRO A 70 89.279 -4.550 1.049 1.00 0.00 C ATOM 1095 C PRO A 70 88.289 -5.506 0.377 1.00 0.00 C ATOM 1096 O PRO A 70 87.499 -6.158 1.036 1.00 0.00 O ATOM 1097 CB PRO A 70 90.541 -5.298 1.490 1.00 0.00 C ATOM 1098 CG PRO A 70 90.407 -5.481 2.968 1.00 0.00 C ATOM 1099 CD PRO A 70 89.533 -4.370 3.477 1.00 0.00 C ATOM 0 HA PRO A 70 89.495 -3.768 0.321 1.00 0.00 H new ATOM 0 HB2 PRO A 70 90.624 -6.259 0.982 1.00 0.00 H new ATOM 0 HB3 PRO A 70 91.438 -4.730 1.246 1.00 0.00 H new ATOM 0 HG2 PRO A 70 89.967 -6.452 3.197 1.00 0.00 H new ATOM 0 HG3 PRO A 70 91.385 -5.452 3.449 1.00 0.00 H new ATOM 0 HD2 PRO A 70 88.919 -4.697 4.316 1.00 0.00 H new ATOM 0 HD3 PRO A 70 90.124 -3.523 3.825 1.00 0.00 H new ATOM 1107 N ALA A 71 88.331 -5.591 -0.931 1.00 0.00 N ATOM 1108 CA ALA A 71 87.377 -6.482 -1.665 1.00 0.00 C ATOM 1109 C ALA A 71 87.749 -7.954 -1.454 1.00 0.00 C ATOM 1110 O ALA A 71 88.913 -8.308 -1.410 1.00 0.00 O ATOM 1111 CB ALA A 71 87.513 -6.095 -3.146 1.00 0.00 C ATOM 0 H ALA A 71 88.986 -5.081 -1.523 1.00 0.00 H new ATOM 0 HA ALA A 71 86.353 -6.362 -1.310 1.00 0.00 H new ATOM 0 HB1 ALA A 71 86.841 -6.709 -3.746 1.00 0.00 H new ATOM 0 HB2 ALA A 71 87.254 -5.044 -3.273 1.00 0.00 H new ATOM 0 HB3 ALA A 71 88.540 -6.257 -3.472 1.00 0.00 H new ATOM 1117 N LYS A 72 86.763 -8.808 -1.321 1.00 0.00 N ATOM 1118 CA LYS A 72 87.035 -10.273 -1.212 1.00 0.00 C ATOM 1119 C LYS A 72 86.965 -10.922 -2.598 1.00 0.00 C ATOM 1120 O LYS A 72 86.148 -10.552 -3.421 1.00 0.00 O ATOM 1121 CB LYS A 72 85.928 -10.818 -0.308 1.00 0.00 C ATOM 1122 CG LYS A 72 86.227 -12.277 0.040 1.00 0.00 C ATOM 1123 CD LYS A 72 85.092 -12.843 0.895 1.00 0.00 C ATOM 1124 CE LYS A 72 85.455 -14.255 1.359 1.00 0.00 C ATOM 1125 NZ LYS A 72 86.033 -14.077 2.719 1.00 0.00 N ATOM 0 H LYS A 72 85.777 -8.550 -1.283 1.00 0.00 H new ATOM 0 HA LYS A 72 88.026 -10.482 -0.809 1.00 0.00 H new ATOM 0 HB2 LYS A 72 85.861 -10.222 0.602 1.00 0.00 H new ATOM 0 HB3 LYS A 72 84.964 -10.743 -0.810 1.00 0.00 H new ATOM 0 HG2 LYS A 72 86.336 -12.864 -0.872 1.00 0.00 H new ATOM 0 HG3 LYS A 72 87.172 -12.347 0.579 1.00 0.00 H new ATOM 0 HD2 LYS A 72 84.917 -12.200 1.757 1.00 0.00 H new ATOM 0 HD3 LYS A 72 84.166 -12.865 0.320 1.00 0.00 H new ATOM 0 HE2 LYS A 72 84.577 -14.900 1.385 1.00 0.00 H new ATOM 0 HE3 LYS A 72 86.172 -14.720 0.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 86.307 -15.004 3.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 86.871 -13.464 2.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 85.325 -13.638 3.342 1.00 0.00 H new ATOM 1139 N GLN A 73 87.816 -11.886 -2.860 1.00 0.00 N ATOM 1140 CA GLN A 73 87.833 -12.544 -4.210 1.00 0.00 C ATOM 1141 C GLN A 73 86.448 -13.113 -4.556 1.00 0.00 C ATOM 1142 O GLN A 73 85.772 -13.674 -3.714 1.00 0.00 O ATOM 1143 CB GLN A 73 88.877 -13.667 -4.106 1.00 0.00 C ATOM 1144 CG GLN A 73 88.471 -14.670 -3.020 1.00 0.00 C ATOM 1145 CD GLN A 73 89.532 -15.768 -2.917 1.00 0.00 C ATOM 1146 OE1 GLN A 73 90.545 -15.590 -2.270 1.00 0.00 O ATOM 1147 NE2 GLN A 73 89.341 -16.903 -3.531 1.00 0.00 N ATOM 0 H GLN A 73 88.502 -12.247 -2.197 1.00 0.00 H new ATOM 0 HA GLN A 73 88.082 -11.837 -5.001 1.00 0.00 H new ATOM 0 HB2 GLN A 73 88.970 -14.177 -5.065 1.00 0.00 H new ATOM 0 HB3 GLN A 73 89.854 -13.244 -3.873 1.00 0.00 H new ATOM 0 HG2 GLN A 73 88.364 -14.161 -2.062 1.00 0.00 H new ATOM 0 HG3 GLN A 73 87.501 -15.108 -3.258 1.00 0.00 H new ATOM 0 HE21 GLN A 73 88.491 -17.052 -4.074 1.00 0.00 H new ATOM 0 HE22 GLN A 73 90.042 -17.641 -3.468 1.00 0.00 H new ATOM 1156 N ASP A 74 86.030 -12.968 -5.790 1.00 0.00 N ATOM 1157 CA ASP A 74 84.678 -13.456 -6.198 1.00 0.00 C ATOM 1158 C ASP A 74 84.744 -14.929 -6.610 1.00 0.00 C ATOM 1159 O ASP A 74 85.428 -15.287 -7.552 1.00 0.00 O ATOM 1160 CB ASP A 74 84.285 -12.583 -7.391 1.00 0.00 C ATOM 1161 CG ASP A 74 82.849 -12.903 -7.821 1.00 0.00 C ATOM 1162 OD1 ASP A 74 82.061 -13.284 -6.968 1.00 0.00 O ATOM 1163 OD2 ASP A 74 82.560 -12.760 -8.998 1.00 0.00 O ATOM 0 H ASP A 74 86.571 -12.530 -6.535 1.00 0.00 H new ATOM 0 HA ASP A 74 83.954 -13.388 -5.386 1.00 0.00 H new ATOM 0 HB2 ASP A 74 84.368 -11.529 -7.125 1.00 0.00 H new ATOM 0 HB3 ASP A 74 84.970 -12.757 -8.221 1.00 0.00 H new ATOM 1168 N LEU A 75 84.035 -15.781 -5.909 1.00 0.00 N ATOM 1169 CA LEU A 75 84.008 -17.229 -6.276 1.00 0.00 C ATOM 1170 C LEU A 75 82.701 -17.558 -7.004 1.00 0.00 C ATOM 1171 O LEU A 75 81.626 -17.203 -6.554 1.00 0.00 O ATOM 1172 CB LEU A 75 84.091 -17.976 -4.943 1.00 0.00 C ATOM 1173 CG LEU A 75 84.343 -19.462 -5.202 1.00 0.00 C ATOM 1174 CD1 LEU A 75 85.808 -19.672 -5.586 1.00 0.00 C ATOM 1175 CD2 LEU A 75 84.030 -20.259 -3.934 1.00 0.00 C ATOM 0 H LEU A 75 83.472 -15.533 -5.095 1.00 0.00 H new ATOM 0 HA LEU A 75 84.822 -17.507 -6.945 1.00 0.00 H new ATOM 0 HB2 LEU A 75 84.893 -17.562 -4.332 1.00 0.00 H new ATOM 0 HB3 LEU A 75 83.165 -17.846 -4.384 1.00 0.00 H new ATOM 0 HG LEU A 75 83.702 -19.803 -6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 75 85.988 -20.731 -5.771 1.00 0.00 H new ATOM 0 HD12 LEU A 75 86.033 -19.103 -6.488 1.00 0.00 H new ATOM 0 HD13 LEU A 75 86.450 -19.332 -4.773 1.00 0.00 H new ATOM 0 HD21 LEU A 75 84.209 -21.319 -4.117 1.00 0.00 H new ATOM 0 HD22 LEU A 75 84.672 -19.917 -3.122 1.00 0.00 H new ATOM 0 HD23 LEU A 75 82.986 -20.110 -3.659 1.00 0.00 H new ATOM 1187 N ASP A 76 82.788 -18.232 -8.125 1.00 0.00 N ATOM 1188 CA ASP A 76 81.564 -18.500 -8.948 1.00 0.00 C ATOM 1189 C ASP A 76 80.860 -19.797 -8.514 1.00 0.00 C ATOM 1190 O ASP A 76 80.005 -20.301 -9.219 1.00 0.00 O ATOM 1191 CB ASP A 76 82.072 -18.614 -10.392 1.00 0.00 C ATOM 1192 CG ASP A 76 83.090 -19.762 -10.534 1.00 0.00 C ATOM 1193 OD1 ASP A 76 83.263 -20.520 -9.592 1.00 0.00 O ATOM 1194 OD2 ASP A 76 83.685 -19.859 -11.596 1.00 0.00 O ATOM 0 H ASP A 76 83.655 -18.609 -8.507 1.00 0.00 H new ATOM 0 HA ASP A 76 80.824 -17.708 -8.830 1.00 0.00 H new ATOM 0 HB2 ASP A 76 81.231 -18.785 -11.064 1.00 0.00 H new ATOM 0 HB3 ASP A 76 82.535 -17.674 -10.693 1.00 0.00 H new ATOM 1199 N GLY A 77 81.208 -20.339 -7.367 1.00 0.00 N ATOM 1200 CA GLY A 77 80.562 -21.603 -6.900 1.00 0.00 C ATOM 1201 C GLY A 77 81.144 -22.793 -7.666 1.00 0.00 C ATOM 1202 O GLY A 77 80.473 -23.786 -7.884 1.00 0.00 O ATOM 0 H GLY A 77 81.913 -19.957 -6.736 1.00 0.00 H new ATOM 0 HA2 GLY A 77 80.725 -21.732 -5.830 1.00 0.00 H new ATOM 0 HA3 GLY A 77 79.484 -21.551 -7.054 1.00 0.00 H new ATOM 1206 N HIS A 78 82.387 -22.699 -8.074 1.00 0.00 N ATOM 1207 CA HIS A 78 83.026 -23.826 -8.830 1.00 0.00 C ATOM 1208 C HIS A 78 83.015 -25.107 -7.989 1.00 0.00 C ATOM 1209 O HIS A 78 82.767 -26.187 -8.493 1.00 0.00 O ATOM 1210 CB HIS A 78 84.465 -23.376 -9.095 1.00 0.00 C ATOM 1211 CG HIS A 78 85.256 -24.353 -9.923 1.00 0.00 C ATOM 1212 ND1 HIS A 78 86.063 -25.323 -9.350 1.00 0.00 N ATOM 1213 CD2 HIS A 78 85.373 -24.521 -11.280 1.00 0.00 C ATOM 1214 CE1 HIS A 78 86.625 -26.026 -10.351 1.00 0.00 C ATOM 1215 NE2 HIS A 78 86.238 -25.578 -11.549 1.00 0.00 N ATOM 0 H HIS A 78 82.988 -21.890 -7.917 1.00 0.00 H new ATOM 0 HA HIS A 78 82.493 -24.046 -9.755 1.00 0.00 H new ATOM 0 HB2 HIS A 78 84.448 -22.412 -9.603 1.00 0.00 H new ATOM 0 HB3 HIS A 78 84.972 -23.226 -8.142 1.00 0.00 H new ATOM 0 HD2 HIS A 78 84.870 -23.924 -12.026 1.00 0.00 H new ATOM 0 HE1 HIS A 78 87.306 -26.851 -10.204 1.00 0.00 H new ATOM 0 HE2 HIS A 78 86.516 -25.934 -12.463 1.00 0.00 H new ATOM 1223 N THR A 79 83.283 -24.988 -6.712 1.00 0.00 N ATOM 1224 CA THR A 79 83.295 -26.190 -5.822 1.00 0.00 C ATOM 1225 C THR A 79 81.883 -26.482 -5.308 1.00 0.00 C ATOM 1226 O THR A 79 80.997 -25.652 -5.403 1.00 0.00 O ATOM 1227 CB THR A 79 84.224 -25.824 -4.659 1.00 0.00 C ATOM 1228 OG1 THR A 79 83.702 -24.691 -3.979 1.00 0.00 O ATOM 1229 CG2 THR A 79 85.624 -25.507 -5.192 1.00 0.00 C ATOM 0 H THR A 79 83.495 -24.106 -6.246 1.00 0.00 H new ATOM 0 HA THR A 79 83.635 -27.083 -6.346 1.00 0.00 H new ATOM 0 HB THR A 79 84.289 -26.665 -3.969 1.00 0.00 H new ATOM 0 HG1 THR A 79 84.293 -24.456 -3.234 1.00 0.00 H new ATOM 0 HG21 THR A 79 86.280 -25.248 -4.361 1.00 0.00 H new ATOM 0 HG22 THR A 79 86.022 -26.380 -5.710 1.00 0.00 H new ATOM 0 HG23 THR A 79 85.568 -24.668 -5.885 1.00 0.00 H new ATOM 1237 N ALA A 80 81.673 -27.656 -4.764 1.00 0.00 N ATOM 1238 CA ALA A 80 80.319 -28.013 -4.229 1.00 0.00 C ATOM 1239 C ALA A 80 79.912 -27.030 -3.117 1.00 0.00 C ATOM 1240 O ALA A 80 80.761 -26.370 -2.553 1.00 0.00 O ATOM 1241 CB ALA A 80 80.463 -29.429 -3.665 1.00 0.00 C ATOM 0 H ALA A 80 82.381 -28.384 -4.667 1.00 0.00 H new ATOM 0 HA ALA A 80 79.550 -27.963 -5.000 1.00 0.00 H new ATOM 0 HB1 ALA A 80 79.507 -29.756 -3.255 1.00 0.00 H new ATOM 0 HB2 ALA A 80 80.768 -30.108 -4.461 1.00 0.00 H new ATOM 0 HB3 ALA A 80 81.216 -29.432 -2.877 1.00 0.00 H new ATOM 1247 N PRO A 81 78.623 -26.953 -2.826 1.00 0.00 N ATOM 1248 CA PRO A 81 78.144 -25.981 -1.806 1.00 0.00 C ATOM 1249 C PRO A 81 78.822 -26.244 -0.445 1.00 0.00 C ATOM 1250 O PRO A 81 78.538 -27.242 0.188 1.00 0.00 O ATOM 1251 CB PRO A 81 76.639 -26.246 -1.712 1.00 0.00 C ATOM 1252 CG PRO A 81 76.282 -26.995 -2.956 1.00 0.00 C ATOM 1253 CD PRO A 81 77.513 -27.737 -3.396 1.00 0.00 C ATOM 0 HA PRO A 81 78.374 -24.949 -2.073 1.00 0.00 H new ATOM 0 HB2 PRO A 81 76.399 -26.828 -0.822 1.00 0.00 H new ATOM 0 HB3 PRO A 81 76.081 -25.312 -1.643 1.00 0.00 H new ATOM 0 HG2 PRO A 81 75.462 -27.688 -2.766 1.00 0.00 H new ATOM 0 HG3 PRO A 81 75.947 -26.310 -3.735 1.00 0.00 H new ATOM 0 HD2 PRO A 81 77.516 -28.762 -3.024 1.00 0.00 H new ATOM 0 HD3 PRO A 81 77.579 -27.792 -4.483 1.00 0.00 H new ATOM 1261 N PRO A 82 79.701 -25.347 -0.025 1.00 0.00 N ATOM 1262 CA PRO A 82 80.382 -25.531 1.283 1.00 0.00 C ATOM 1263 C PRO A 82 79.388 -25.315 2.439 1.00 0.00 C ATOM 1264 O PRO A 82 78.303 -24.813 2.220 1.00 0.00 O ATOM 1265 CB PRO A 82 81.463 -24.453 1.293 1.00 0.00 C ATOM 1266 CG PRO A 82 80.996 -23.414 0.326 1.00 0.00 C ATOM 1267 CD PRO A 82 80.141 -24.110 -0.698 1.00 0.00 C ATOM 0 HA PRO A 82 80.791 -26.533 1.410 1.00 0.00 H new ATOM 0 HB2 PRO A 82 81.589 -24.033 2.291 1.00 0.00 H new ATOM 0 HB3 PRO A 82 82.428 -24.862 0.995 1.00 0.00 H new ATOM 0 HG2 PRO A 82 80.427 -22.639 0.839 1.00 0.00 H new ATOM 0 HG3 PRO A 82 81.845 -22.923 -0.151 1.00 0.00 H new ATOM 0 HD2 PRO A 82 79.292 -23.494 -0.992 1.00 0.00 H new ATOM 0 HD3 PRO A 82 80.705 -24.329 -1.605 1.00 0.00 H new ATOM 1275 N PRO A 83 79.778 -25.698 3.645 1.00 0.00 N ATOM 1276 CA PRO A 83 78.888 -25.495 4.821 1.00 0.00 C ATOM 1277 C PRO A 83 78.549 -24.010 4.989 1.00 0.00 C ATOM 1278 O PRO A 83 79.307 -23.145 4.590 1.00 0.00 O ATOM 1279 CB PRO A 83 79.711 -25.998 6.008 1.00 0.00 C ATOM 1280 CG PRO A 83 80.792 -26.848 5.420 1.00 0.00 C ATOM 1281 CD PRO A 83 81.047 -26.341 4.028 1.00 0.00 C ATOM 0 HA PRO A 83 77.937 -26.019 4.721 1.00 0.00 H new ATOM 0 HB2 PRO A 83 80.131 -25.166 6.574 1.00 0.00 H new ATOM 0 HB3 PRO A 83 79.093 -26.573 6.698 1.00 0.00 H new ATOM 0 HG2 PRO A 83 81.698 -26.790 6.023 1.00 0.00 H new ATOM 0 HG3 PRO A 83 80.490 -27.895 5.399 1.00 0.00 H new ATOM 0 HD2 PRO A 83 81.876 -25.633 4.007 1.00 0.00 H new ATOM 0 HD3 PRO A 83 81.304 -27.153 3.348 1.00 0.00 H new ATOM 1289 N VAL A 84 77.415 -23.716 5.577 1.00 0.00 N ATOM 1290 CA VAL A 84 76.993 -22.290 5.741 1.00 0.00 C ATOM 1291 C VAL A 84 76.694 -21.986 7.214 1.00 0.00 C ATOM 1292 O VAL A 84 76.410 -22.876 7.994 1.00 0.00 O ATOM 1293 CB VAL A 84 75.729 -22.139 4.883 1.00 0.00 C ATOM 1294 CG1 VAL A 84 76.068 -22.434 3.421 1.00 0.00 C ATOM 1295 CG2 VAL A 84 74.649 -23.120 5.358 1.00 0.00 C ATOM 0 H VAL A 84 76.762 -24.404 5.951 1.00 0.00 H new ATOM 0 HA VAL A 84 77.773 -21.594 5.432 1.00 0.00 H new ATOM 0 HB VAL A 84 75.355 -21.120 4.979 1.00 0.00 H new ATOM 0 HG11 VAL A 84 75.171 -22.327 2.811 1.00 0.00 H new ATOM 0 HG12 VAL A 84 76.828 -21.733 3.075 1.00 0.00 H new ATOM 0 HG13 VAL A 84 76.447 -23.452 3.334 1.00 0.00 H new ATOM 0 HG21 VAL A 84 73.757 -23.005 4.743 1.00 0.00 H new ATOM 0 HG22 VAL A 84 75.021 -24.141 5.270 1.00 0.00 H new ATOM 0 HG23 VAL A 84 74.401 -22.912 6.399 1.00 0.00 H new ATOM 1305 N VAL A 85 76.759 -20.733 7.590 1.00 0.00 N ATOM 1306 CA VAL A 85 76.509 -20.353 9.014 1.00 0.00 C ATOM 1307 C VAL A 85 75.520 -19.181 9.084 1.00 0.00 C ATOM 1308 O VAL A 85 75.496 -18.328 8.216 1.00 0.00 O ATOM 1309 CB VAL A 85 77.886 -19.957 9.567 1.00 0.00 C ATOM 1310 CG1 VAL A 85 78.456 -18.777 8.773 1.00 0.00 C ATOM 1311 CG2 VAL A 85 77.752 -19.560 11.041 1.00 0.00 C ATOM 0 H VAL A 85 76.976 -19.954 6.969 1.00 0.00 H new ATOM 0 HA VAL A 85 76.066 -21.164 9.592 1.00 0.00 H new ATOM 0 HB VAL A 85 78.561 -20.808 9.475 1.00 0.00 H new ATOM 0 HG11 VAL A 85 79.432 -18.506 9.175 1.00 0.00 H new ATOM 0 HG12 VAL A 85 78.560 -19.060 7.726 1.00 0.00 H new ATOM 0 HG13 VAL A 85 77.781 -17.925 8.853 1.00 0.00 H new ATOM 0 HG21 VAL A 85 78.730 -19.279 11.433 1.00 0.00 H new ATOM 0 HG22 VAL A 85 77.069 -18.715 11.130 1.00 0.00 H new ATOM 0 HG23 VAL A 85 77.362 -20.403 11.611 1.00 0.00 H new ATOM 1321 N ASN A 86 74.708 -19.140 10.112 1.00 0.00 N ATOM 1322 CA ASN A 86 73.711 -18.031 10.248 1.00 0.00 C ATOM 1323 C ASN A 86 74.433 -16.685 10.345 1.00 0.00 C ATOM 1324 O ASN A 86 75.642 -16.631 10.487 1.00 0.00 O ATOM 1325 CB ASN A 86 72.948 -18.323 11.544 1.00 0.00 C ATOM 1326 CG ASN A 86 72.203 -19.655 11.415 1.00 0.00 C ATOM 1327 OD1 ASN A 86 71.921 -20.105 10.323 1.00 0.00 O ATOM 1328 ND2 ASN A 86 71.870 -20.308 12.495 1.00 0.00 N ATOM 0 H ASN A 86 74.692 -19.828 10.865 1.00 0.00 H new ATOM 0 HA ASN A 86 73.041 -17.977 9.390 1.00 0.00 H new ATOM 0 HB2 ASN A 86 73.641 -18.363 12.384 1.00 0.00 H new ATOM 0 HB3 ASN A 86 72.242 -17.519 11.751 1.00 0.00 H new ATOM 0 HD21 ASN A 86 71.373 -21.196 12.421 1.00 0.00 H new ATOM 0 HD22 ASN A 86 72.107 -19.931 13.413 1.00 0.00 H new ATOM 1335 N LYS A 87 73.700 -15.600 10.269 1.00 0.00 N ATOM 1336 CA LYS A 87 74.341 -14.245 10.318 1.00 0.00 C ATOM 1337 C LYS A 87 75.119 -14.072 11.636 1.00 0.00 C ATOM 1338 O LYS A 87 74.675 -14.538 12.666 1.00 0.00 O ATOM 1339 CB LYS A 87 73.184 -13.243 10.246 1.00 0.00 C ATOM 1340 CG LYS A 87 73.599 -12.044 9.392 1.00 0.00 C ATOM 1341 CD LYS A 87 72.385 -11.517 8.625 1.00 0.00 C ATOM 1342 CE LYS A 87 71.666 -10.461 9.466 1.00 0.00 C ATOM 1343 NZ LYS A 87 70.924 -9.624 8.482 1.00 0.00 N ATOM 0 H LYS A 87 72.684 -15.593 10.175 1.00 0.00 H new ATOM 0 HA LYS A 87 75.051 -14.101 9.504 1.00 0.00 H new ATOM 0 HB2 LYS A 87 72.302 -13.720 9.818 1.00 0.00 H new ATOM 0 HB3 LYS A 87 72.913 -12.912 11.249 1.00 0.00 H new ATOM 0 HG2 LYS A 87 74.011 -11.258 10.025 1.00 0.00 H new ATOM 0 HG3 LYS A 87 74.384 -12.336 8.695 1.00 0.00 H new ATOM 0 HD2 LYS A 87 72.701 -11.086 7.675 1.00 0.00 H new ATOM 0 HD3 LYS A 87 71.705 -12.337 8.393 1.00 0.00 H new ATOM 0 HE2 LYS A 87 70.987 -10.923 10.183 1.00 0.00 H new ATOM 0 HE3 LYS A 87 72.375 -9.862 10.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 70.405 -8.876 8.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 71.597 -9.192 7.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 70.252 -10.219 7.957 1.00 0.00 H new ATOM 1357 N PRO A 88 76.261 -13.406 11.576 1.00 0.00 N ATOM 1358 CA PRO A 88 77.088 -13.229 12.800 1.00 0.00 C ATOM 1359 C PRO A 88 76.296 -12.489 13.884 1.00 0.00 C ATOM 1360 O PRO A 88 75.613 -11.519 13.612 1.00 0.00 O ATOM 1361 CB PRO A 88 78.278 -12.388 12.336 1.00 0.00 C ATOM 1362 CG PRO A 88 78.294 -12.495 10.844 1.00 0.00 C ATOM 1363 CD PRO A 88 76.884 -12.768 10.403 1.00 0.00 C ATOM 0 HA PRO A 88 77.394 -14.180 13.236 1.00 0.00 H new ATOM 0 HB2 PRO A 88 78.171 -11.351 12.653 1.00 0.00 H new ATOM 0 HB3 PRO A 88 79.209 -12.758 12.765 1.00 0.00 H new ATOM 0 HG2 PRO A 88 78.666 -11.573 10.396 1.00 0.00 H new ATOM 0 HG3 PRO A 88 78.960 -13.296 10.523 1.00 0.00 H new ATOM 0 HD2 PRO A 88 76.367 -11.849 10.127 1.00 0.00 H new ATOM 0 HD3 PRO A 88 76.858 -13.422 9.532 1.00 0.00 H new ATOM 1371 N THR A 89 76.388 -12.946 15.109 1.00 0.00 N ATOM 1372 CA THR A 89 75.674 -12.260 16.231 1.00 0.00 C ATOM 1373 C THR A 89 76.427 -10.977 16.636 1.00 0.00 C ATOM 1374 O THR A 89 77.642 -10.976 16.667 1.00 0.00 O ATOM 1375 CB THR A 89 75.665 -13.272 17.387 1.00 0.00 C ATOM 1376 OG1 THR A 89 75.016 -12.694 18.511 1.00 0.00 O ATOM 1377 CG2 THR A 89 77.100 -13.659 17.771 1.00 0.00 C ATOM 0 H THR A 89 76.929 -13.767 15.381 1.00 0.00 H new ATOM 0 HA THR A 89 74.664 -11.960 15.952 1.00 0.00 H new ATOM 0 HB THR A 89 75.132 -14.168 17.069 1.00 0.00 H new ATOM 0 HG1 THR A 89 75.602 -12.754 19.294 1.00 0.00 H new ATOM 0 HG21 THR A 89 77.076 -14.376 18.591 1.00 0.00 H new ATOM 0 HG22 THR A 89 77.598 -14.107 16.911 1.00 0.00 H new ATOM 0 HG23 THR A 89 77.646 -12.769 18.083 1.00 0.00 H new ATOM 1385 N PRO A 90 75.695 -9.915 16.935 1.00 0.00 N ATOM 1386 CA PRO A 90 76.356 -8.652 17.354 1.00 0.00 C ATOM 1387 C PRO A 90 77.136 -8.870 18.653 1.00 0.00 C ATOM 1388 O PRO A 90 78.191 -8.299 18.854 1.00 0.00 O ATOM 1389 CB PRO A 90 75.201 -7.673 17.572 1.00 0.00 C ATOM 1390 CG PRO A 90 73.971 -8.516 17.685 1.00 0.00 C ATOM 1391 CD PRO A 90 74.229 -9.782 16.916 1.00 0.00 C ATOM 0 HA PRO A 90 77.072 -8.286 16.618 1.00 0.00 H new ATOM 0 HB2 PRO A 90 75.354 -7.081 18.475 1.00 0.00 H new ATOM 0 HB3 PRO A 90 75.120 -6.972 16.741 1.00 0.00 H new ATOM 0 HG2 PRO A 90 73.751 -8.738 18.729 1.00 0.00 H new ATOM 0 HG3 PRO A 90 73.106 -7.990 17.282 1.00 0.00 H new ATOM 0 HD2 PRO A 90 73.744 -10.639 17.383 1.00 0.00 H new ATOM 0 HD3 PRO A 90 73.847 -9.716 15.897 1.00 0.00 H new ATOM 1399 N VAL A 91 76.619 -9.694 19.530 1.00 0.00 N ATOM 1400 CA VAL A 91 77.338 -9.996 20.807 1.00 0.00 C ATOM 1401 C VAL A 91 77.387 -11.511 21.040 1.00 0.00 C ATOM 1402 O VAL A 91 76.533 -12.243 20.573 1.00 0.00 O ATOM 1403 CB VAL A 91 76.529 -9.295 21.906 1.00 0.00 C ATOM 1404 CG1 VAL A 91 76.512 -7.788 21.644 1.00 0.00 C ATOM 1405 CG2 VAL A 91 75.088 -9.820 21.918 1.00 0.00 C ATOM 0 H VAL A 91 75.726 -10.173 19.416 1.00 0.00 H new ATOM 0 HA VAL A 91 78.371 -9.648 20.791 1.00 0.00 H new ATOM 0 HB VAL A 91 76.993 -9.499 22.871 1.00 0.00 H new ATOM 0 HG11 VAL A 91 75.937 -7.289 22.425 1.00 0.00 H new ATOM 0 HG12 VAL A 91 77.533 -7.407 21.646 1.00 0.00 H new ATOM 0 HG13 VAL A 91 76.053 -7.592 20.675 1.00 0.00 H new ATOM 0 HG21 VAL A 91 74.523 -9.315 22.702 1.00 0.00 H new ATOM 0 HG22 VAL A 91 74.622 -9.625 20.952 1.00 0.00 H new ATOM 0 HG23 VAL A 91 75.093 -10.893 22.108 1.00 0.00 H new ATOM 1415 N LYS A 92 78.375 -11.979 21.761 1.00 0.00 N ATOM 1416 CA LYS A 92 78.515 -13.449 21.994 1.00 0.00 C ATOM 1417 C LYS A 92 78.406 -13.765 23.489 1.00 0.00 C ATOM 1418 O LYS A 92 78.994 -13.092 24.317 1.00 0.00 O ATOM 1419 CB LYS A 92 79.909 -13.802 21.473 1.00 0.00 C ATOM 1420 CG LYS A 92 80.093 -15.321 21.495 1.00 0.00 C ATOM 1421 CD LYS A 92 81.458 -15.678 20.902 1.00 0.00 C ATOM 1422 CE LYS A 92 82.566 -15.202 21.844 1.00 0.00 C ATOM 1423 NZ LYS A 92 83.608 -16.265 21.778 1.00 0.00 N ATOM 0 H LYS A 92 79.094 -11.403 22.200 1.00 0.00 H new ATOM 0 HA LYS A 92 77.734 -14.020 21.492 1.00 0.00 H new ATOM 0 HB2 LYS A 92 80.036 -13.424 20.458 1.00 0.00 H new ATOM 0 HB3 LYS A 92 80.671 -13.324 22.089 1.00 0.00 H new ATOM 0 HG2 LYS A 92 80.020 -15.692 22.517 1.00 0.00 H new ATOM 0 HG3 LYS A 92 79.299 -15.803 20.924 1.00 0.00 H new ATOM 0 HD2 LYS A 92 81.531 -16.755 20.753 1.00 0.00 H new ATOM 0 HD3 LYS A 92 81.574 -15.213 19.923 1.00 0.00 H new ATOM 0 HE2 LYS A 92 82.965 -14.238 21.529 1.00 0.00 H new ATOM 0 HE3 LYS A 92 82.193 -15.076 22.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 84.403 -16.011 22.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 83.201 -17.170 22.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 83.948 -16.357 20.800 1.00 0.00 H new ATOM 1437 N LEU A 93 77.657 -14.783 23.833 1.00 0.00 N ATOM 1438 CA LEU A 93 77.531 -15.183 25.267 1.00 0.00 C ATOM 1439 C LEU A 93 78.236 -16.532 25.501 1.00 0.00 C ATOM 1440 O LEU A 93 78.511 -17.243 24.555 1.00 0.00 O ATOM 1441 CB LEU A 93 76.027 -15.313 25.513 1.00 0.00 C ATOM 1442 CG LEU A 93 75.408 -13.919 25.634 1.00 0.00 C ATOM 1443 CD1 LEU A 93 73.908 -14.000 25.342 1.00 0.00 C ATOM 1444 CD2 LEU A 93 75.621 -13.389 27.053 1.00 0.00 C ATOM 0 H LEU A 93 77.125 -15.356 23.178 1.00 0.00 H new ATOM 0 HA LEU A 93 77.991 -14.461 25.941 1.00 0.00 H new ATOM 0 HB2 LEU A 93 75.560 -15.860 24.694 1.00 0.00 H new ATOM 0 HB3 LEU A 93 75.845 -15.884 26.423 1.00 0.00 H new ATOM 0 HG LEU A 93 75.883 -13.247 24.919 1.00 0.00 H new ATOM 0 HD11 LEU A 93 73.466 -13.007 25.428 1.00 0.00 H new ATOM 0 HD12 LEU A 93 73.754 -14.379 24.332 1.00 0.00 H new ATOM 0 HD13 LEU A 93 73.434 -14.671 26.058 1.00 0.00 H new ATOM 0 HD21 LEU A 93 75.180 -12.396 27.140 1.00 0.00 H new ATOM 0 HD22 LEU A 93 75.146 -14.061 27.768 1.00 0.00 H new ATOM 0 HD23 LEU A 93 76.689 -13.332 27.264 1.00 0.00 H new ATOM 1456 N PRO A 94 78.514 -16.855 26.752 1.00 0.00 N ATOM 1457 CA PRO A 94 79.210 -18.135 27.055 1.00 0.00 C ATOM 1458 C PRO A 94 78.390 -19.328 26.549 1.00 0.00 C ATOM 1459 O PRO A 94 77.190 -19.392 26.743 1.00 0.00 O ATOM 1460 CB PRO A 94 79.310 -18.159 28.582 1.00 0.00 C ATOM 1461 CG PRO A 94 79.085 -16.747 29.021 1.00 0.00 C ATOM 1462 CD PRO A 94 78.223 -16.091 27.978 1.00 0.00 C ATOM 0 HA PRO A 94 80.185 -18.204 26.572 1.00 0.00 H new ATOM 0 HB2 PRO A 94 78.565 -18.827 29.013 1.00 0.00 H new ATOM 0 HB3 PRO A 94 80.287 -18.519 28.905 1.00 0.00 H new ATOM 0 HG2 PRO A 94 78.598 -16.720 29.996 1.00 0.00 H new ATOM 0 HG3 PRO A 94 80.034 -16.220 29.124 1.00 0.00 H new ATOM 0 HD2 PRO A 94 77.167 -16.144 28.241 1.00 0.00 H new ATOM 0 HD3 PRO A 94 78.470 -15.036 27.860 1.00 0.00 H new ATOM 1470 N HIS A 95 79.036 -20.269 25.903 1.00 0.00 N ATOM 1471 CA HIS A 95 78.312 -21.473 25.389 1.00 0.00 C ATOM 1472 C HIS A 95 79.109 -22.743 25.697 1.00 0.00 C ATOM 1473 O HIS A 95 78.560 -23.739 26.131 1.00 0.00 O ATOM 1474 CB HIS A 95 78.208 -21.258 23.879 1.00 0.00 C ATOM 1475 CG HIS A 95 77.339 -20.089 23.496 1.00 0.00 C ATOM 1476 ND1 HIS A 95 77.828 -19.008 22.779 1.00 0.00 N ATOM 1477 CD2 HIS A 95 76.013 -19.821 23.722 1.00 0.00 C ATOM 1478 CE1 HIS A 95 76.810 -18.146 22.601 1.00 0.00 C ATOM 1479 NE2 HIS A 95 75.680 -18.594 23.157 1.00 0.00 N ATOM 0 H HIS A 95 80.037 -20.254 25.709 1.00 0.00 H new ATOM 0 HA HIS A 95 77.333 -21.594 25.852 1.00 0.00 H new ATOM 0 HB2 HIS A 95 79.208 -21.106 23.472 1.00 0.00 H new ATOM 0 HB3 HIS A 95 77.811 -22.162 23.418 1.00 0.00 H new ATOM 0 HD2 HIS A 95 75.331 -20.465 24.257 1.00 0.00 H new ATOM 0 HE1 HIS A 95 76.896 -17.207 22.074 1.00 0.00 H new ATOM 0 HE2 HIS A 95 74.769 -18.135 23.165 1.00 0.00 H new ATOM 1487 N PHE A 96 80.400 -22.711 25.473 1.00 0.00 N ATOM 1488 CA PHE A 96 81.250 -23.911 25.747 1.00 0.00 C ATOM 1489 C PHE A 96 82.518 -23.507 26.504 1.00 0.00 C ATOM 1490 O PHE A 96 82.995 -22.394 26.387 1.00 0.00 O ATOM 1491 CB PHE A 96 81.598 -24.480 24.368 1.00 0.00 C ATOM 1492 CG PHE A 96 82.212 -23.469 23.425 1.00 0.00 C ATOM 1493 CD1 PHE A 96 83.635 -23.291 23.384 1.00 0.00 C ATOM 1494 CD2 PHE A 96 81.368 -22.690 22.564 1.00 0.00 C ATOM 1495 CE1 PHE A 96 84.214 -22.335 22.483 1.00 0.00 C ATOM 1496 CE2 PHE A 96 81.946 -21.734 21.665 1.00 0.00 C ATOM 1497 CZ PHE A 96 83.370 -21.556 21.624 1.00 0.00 C ATOM 0 H PHE A 96 80.904 -21.901 25.110 1.00 0.00 H new ATOM 0 HA PHE A 96 80.736 -24.644 26.369 1.00 0.00 H new ATOM 0 HB2 PHE A 96 82.290 -25.312 24.493 1.00 0.00 H new ATOM 0 HB3 PHE A 96 80.693 -24.884 23.913 1.00 0.00 H new ATOM 0 HD1 PHE A 96 84.271 -23.877 24.031 1.00 0.00 H new ATOM 0 HD2 PHE A 96 80.297 -22.824 22.593 1.00 0.00 H new ATOM 0 HE1 PHE A 96 85.285 -22.202 22.452 1.00 0.00 H new ATOM 0 HE2 PHE A 96 81.310 -21.148 21.019 1.00 0.00 H new ATOM 0 HZ PHE A 96 83.805 -20.836 20.947 1.00 0.00 H new ATOM 1507 N SER A 97 83.063 -24.412 27.282 1.00 0.00 N ATOM 1508 CA SER A 97 84.271 -24.083 28.104 1.00 0.00 C ATOM 1509 C SER A 97 85.532 -24.043 27.234 1.00 0.00 C ATOM 1510 O SER A 97 86.496 -23.377 27.565 1.00 0.00 O ATOM 1511 CB SER A 97 84.373 -25.207 29.137 1.00 0.00 C ATOM 1512 OG SER A 97 84.722 -26.418 28.479 1.00 0.00 O ATOM 0 H SER A 97 82.722 -25.368 27.383 1.00 0.00 H new ATOM 0 HA SER A 97 84.183 -23.102 28.571 1.00 0.00 H new ATOM 0 HB2 SER A 97 85.122 -24.959 29.889 1.00 0.00 H new ATOM 0 HB3 SER A 97 83.424 -25.324 29.660 1.00 0.00 H new ATOM 0 HG SER A 97 84.790 -27.140 29.138 1.00 0.00 H new ATOM 1518 N ASN A 98 85.533 -24.749 26.126 1.00 0.00 N ATOM 1519 CA ASN A 98 86.761 -24.804 25.267 1.00 0.00 C ATOM 1520 C ASN A 98 87.108 -23.404 24.753 1.00 0.00 C ATOM 1521 O ASN A 98 86.235 -22.618 24.439 1.00 0.00 O ATOM 1522 CB ASN A 98 86.404 -25.732 24.101 1.00 0.00 C ATOM 1523 CG ASN A 98 86.074 -27.127 24.636 1.00 0.00 C ATOM 1524 OD1 ASN A 98 86.513 -27.500 25.706 1.00 0.00 O ATOM 1525 ND2 ASN A 98 85.310 -27.918 23.933 1.00 0.00 N ATOM 0 H ASN A 98 84.739 -25.288 25.780 1.00 0.00 H new ATOM 0 HA ASN A 98 87.629 -25.167 25.818 1.00 0.00 H new ATOM 0 HB2 ASN A 98 85.552 -25.331 23.552 1.00 0.00 H new ATOM 0 HB3 ASN A 98 87.237 -25.788 23.400 1.00 0.00 H new ATOM 0 HD21 ASN A 98 85.082 -28.849 24.282 1.00 0.00 H new ATOM 0 HD22 ASN A 98 84.941 -27.605 23.035 1.00 0.00 H new ATOM 1532 N ILE A 99 88.378 -23.094 24.669 1.00 0.00 N ATOM 1533 CA ILE A 99 88.800 -21.742 24.185 1.00 0.00 C ATOM 1534 C ILE A 99 89.629 -21.882 22.902 1.00 0.00 C ATOM 1535 O ILE A 99 90.494 -22.734 22.804 1.00 0.00 O ATOM 1536 CB ILE A 99 89.651 -21.152 25.318 1.00 0.00 C ATOM 1537 CG1 ILE A 99 88.817 -21.073 26.603 1.00 0.00 C ATOM 1538 CG2 ILE A 99 90.116 -19.743 24.934 1.00 0.00 C ATOM 1539 CD1 ILE A 99 89.713 -20.641 27.768 1.00 0.00 C ATOM 0 H ILE A 99 89.144 -23.721 24.916 1.00 0.00 H new ATOM 0 HA ILE A 99 87.949 -21.103 23.949 1.00 0.00 H new ATOM 0 HB ILE A 99 90.518 -21.792 25.483 1.00 0.00 H new ATOM 0 HG12 ILE A 99 88.000 -20.363 26.476 1.00 0.00 H new ATOM 0 HG13 ILE A 99 88.366 -22.042 26.817 1.00 0.00 H new ATOM 0 HG21 ILE A 99 90.720 -19.327 25.740 1.00 0.00 H new ATOM 0 HG22 ILE A 99 90.712 -19.792 24.023 1.00 0.00 H new ATOM 0 HG23 ILE A 99 89.247 -19.106 24.766 1.00 0.00 H new ATOM 0 HD11 ILE A 99 89.121 -20.585 28.681 1.00 0.00 H new ATOM 0 HD12 ILE A 99 90.514 -21.368 27.900 1.00 0.00 H new ATOM 0 HD13 ILE A 99 90.142 -19.662 27.553 1.00 0.00 H new ATOM 1551 N LEU A 100 89.367 -21.049 21.924 1.00 0.00 N ATOM 1552 CA LEU A 100 90.142 -21.118 20.643 1.00 0.00 C ATOM 1553 C LEU A 100 91.628 -20.867 20.911 1.00 0.00 C ATOM 1554 O LEU A 100 92.488 -21.441 20.266 1.00 0.00 O ATOM 1555 CB LEU A 100 89.565 -20.012 19.752 1.00 0.00 C ATOM 1556 CG LEU A 100 88.090 -20.298 19.455 1.00 0.00 C ATOM 1557 CD1 LEU A 100 87.499 -19.140 18.649 1.00 0.00 C ATOM 1558 CD2 LEU A 100 87.970 -21.590 18.641 1.00 0.00 C ATOM 0 H LEU A 100 88.650 -20.324 21.956 1.00 0.00 H new ATOM 0 HA LEU A 100 90.061 -22.097 20.171 1.00 0.00 H new ATOM 0 HB2 LEU A 100 89.665 -19.046 20.246 1.00 0.00 H new ATOM 0 HB3 LEU A 100 90.128 -19.953 18.820 1.00 0.00 H new ATOM 0 HG LEU A 100 87.548 -20.407 20.395 1.00 0.00 H new ATOM 0 HD11 LEU A 100 86.449 -19.343 18.437 1.00 0.00 H new ATOM 0 HD12 LEU A 100 87.582 -18.217 19.223 1.00 0.00 H new ATOM 0 HD13 LEU A 100 88.044 -19.034 17.711 1.00 0.00 H new ATOM 0 HD21 LEU A 100 86.920 -21.791 18.431 1.00 0.00 H new ATOM 0 HD22 LEU A 100 88.513 -21.480 17.702 1.00 0.00 H new ATOM 0 HD23 LEU A 100 88.392 -22.419 19.210 1.00 0.00 H new ATOM 1570 N GLY A 101 91.933 -20.013 21.858 1.00 0.00 N ATOM 1571 CA GLY A 101 93.360 -19.715 22.181 1.00 0.00 C ATOM 1572 C GLY A 101 93.504 -18.237 22.544 1.00 0.00 C ATOM 1573 O GLY A 101 94.183 -17.531 21.816 1.00 0.00 O ATOM 1574 OXT GLY A 101 92.934 -17.834 23.544 1.00 0.00 O ATOM 0 H GLY A 101 91.250 -19.508 22.423 1.00 0.00 H new ATOM 0 HA2 GLY A 101 93.694 -20.338 23.011 1.00 0.00 H new ATOM 0 HA3 GLY A 101 93.994 -19.954 21.328 1.00 0.00 H new TER 1578 GLY A 101