USER MOD reduce.3.24.130724 H: found=0, std=0, add=873, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 871 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 17:sc= 0.44! USER MOD Single : A 5 SER OG : rot 47:sc= 0.298 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.453 X(o=-0.45,f=-0.45) USER MOD Single : A 17 ASN : amide:sc= -0.42 K(o=-0.42,f=-4.7!) USER MOD Single : A 18 GLN : amide:sc= -0.0763 X(o=-0.076,f=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot -28:sc= 0.437 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc=-0.00707 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.0253 USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 GLN : amide:sc= -0.106 K(o=-0.11,f=-1.2!) USER MOD Single : A 61 ASN : amide:sc= -0.155 X(o=-0.16,f=-0.48) USER MOD Single : A 65 GLN : amide:sc= -3.79! C(o=-3.8!,f=-5.6!) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -173:sc=-0.00304 (180deg=-0.069) USER MOD Single : A 74 THR OG1 : rot 85:sc= 0.259 USER MOD Single : A 77 TYR OH : rot -140:sc= 0.0629 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 38:sc= 1.03 USER MOD Single : A 85 SER OG : rot -170:sc= -0.212 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 28:sc= 0.164 USER MOD Single : A 93 TYR OH : rot 110:sc= -1.04 USER MOD Single : A 97 GLN : amide:sc= -0.0623 K(o=-0.062,f=-1.2) USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.141 USER MOD Single : A 112 ASN : amide:sc= -0.163 K(o=-0.16,f=-2.2!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.634 53.967 9.991 1.00 0.00 N ATOM 2 CA GLY A 1 -12.442 53.689 10.772 1.00 0.00 C ATOM 3 C GLY A 1 -11.406 52.907 9.990 1.00 0.00 C ATOM 4 O GLY A 1 -10.356 53.440 9.630 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.311 54.503 10.570 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.377 54.526 9.152 1.00 0.00 H new ATOM 0 H3 GLY A 1 -14.069 53.071 9.690 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.005 54.629 11.109 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.719 53.128 11.665 1.00 0.00 H new ATOM 8 N SER A 2 -11.699 51.637 9.728 1.00 0.00 N ATOM 9 CA SER A 2 -10.782 50.778 8.988 1.00 0.00 C ATOM 10 C SER A 2 -11.538 49.910 7.987 1.00 0.00 C ATOM 11 O SER A 2 -12.769 49.883 7.977 1.00 0.00 O ATOM 12 CB SER A 2 -9.991 49.891 9.953 1.00 0.00 C ATOM 13 OG SER A 2 -9.077 50.658 10.717 1.00 0.00 O ATOM 0 H SER A 2 -12.564 51.180 10.017 1.00 0.00 H new ATOM 0 HA SER A 2 -10.089 51.416 8.439 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.678 49.369 10.619 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.451 49.129 9.392 1.00 0.00 H new ATOM 0 HG SER A 2 -8.585 50.069 11.327 1.00 0.00 H new ATOM 19 N SER A 3 -10.793 49.202 7.145 1.00 0.00 N ATOM 20 CA SER A 3 -11.391 48.336 6.136 1.00 0.00 C ATOM 21 C SER A 3 -10.319 47.548 5.391 1.00 0.00 C ATOM 22 O SER A 3 -9.382 48.122 4.837 1.00 0.00 O ATOM 23 CB SER A 3 -12.212 49.164 5.145 1.00 0.00 C ATOM 24 OG SER A 3 -11.370 49.877 4.255 1.00 0.00 O ATOM 0 H SER A 3 -9.773 49.211 7.141 1.00 0.00 H new ATOM 0 HA SER A 3 -12.049 47.630 6.643 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.873 48.508 4.578 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.847 49.863 5.689 1.00 0.00 H new ATOM 0 HG SER A 3 -10.467 49.496 4.283 1.00 0.00 H new ATOM 30 N GLY A 4 -10.464 46.226 5.382 1.00 0.00 N ATOM 31 CA GLY A 4 -9.501 45.379 4.703 1.00 0.00 C ATOM 32 C GLY A 4 -10.145 44.494 3.654 1.00 0.00 C ATOM 33 O GLY A 4 -11.208 44.819 3.126 1.00 0.00 O ATOM 0 H GLY A 4 -11.231 45.727 5.833 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.742 46.003 4.231 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.990 44.755 5.436 1.00 0.00 H new ATOM 37 N SER A 5 -9.499 43.372 3.351 1.00 0.00 N ATOM 38 CA SER A 5 -10.013 42.440 2.354 1.00 0.00 C ATOM 39 C SER A 5 -9.398 41.056 2.536 1.00 0.00 C ATOM 40 O SER A 5 -8.206 40.858 2.298 1.00 0.00 O ATOM 41 CB SER A 5 -9.724 42.958 0.944 1.00 0.00 C ATOM 42 OG SER A 5 -8.352 43.276 0.789 1.00 0.00 O ATOM 0 H SER A 5 -8.619 43.087 3.781 1.00 0.00 H new ATOM 0 HA SER A 5 -11.092 42.360 2.490 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.011 42.205 0.210 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.330 43.842 0.747 1.00 0.00 H new ATOM 0 HG SER A 5 -7.805 42.547 1.148 1.00 0.00 H new ATOM 48 N SER A 6 -10.219 40.101 2.960 1.00 0.00 N ATOM 49 CA SER A 6 -9.756 38.736 3.179 1.00 0.00 C ATOM 50 C SER A 6 -10.772 37.727 2.651 1.00 0.00 C ATOM 51 O SER A 6 -11.968 38.008 2.589 1.00 0.00 O ATOM 52 CB SER A 6 -9.504 38.492 4.668 1.00 0.00 C ATOM 53 OG SER A 6 -8.276 39.068 5.078 1.00 0.00 O ATOM 0 H SER A 6 -11.209 40.247 3.159 1.00 0.00 H new ATOM 0 HA SER A 6 -8.821 38.604 2.634 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.321 38.915 5.253 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.491 37.420 4.867 1.00 0.00 H new ATOM 0 HG SER A 6 -8.139 38.900 6.034 1.00 0.00 H new ATOM 59 N GLY A 7 -10.285 36.549 2.272 1.00 0.00 N ATOM 60 CA GLY A 7 -11.162 35.515 1.755 1.00 0.00 C ATOM 61 C GLY A 7 -10.911 34.166 2.398 1.00 0.00 C ATOM 62 O GLY A 7 -9.980 33.993 3.186 1.00 0.00 O ATOM 0 H GLY A 7 -9.299 36.293 2.314 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -12.199 35.806 1.922 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.024 35.431 0.677 1.00 0.00 H new ATOM 66 N PRO A 8 -11.756 33.180 2.064 1.00 0.00 N ATOM 67 CA PRO A 8 -11.642 31.822 2.604 1.00 0.00 C ATOM 68 C PRO A 8 -10.417 31.086 2.071 1.00 0.00 C ATOM 69 O PRO A 8 -9.759 31.529 1.129 1.00 0.00 O ATOM 70 CB PRO A 8 -12.926 31.140 2.125 1.00 0.00 C ATOM 71 CG PRO A 8 -13.320 31.892 0.901 1.00 0.00 C ATOM 72 CD PRO A 8 -12.888 33.314 1.131 1.00 0.00 C ATOM 0 HA PRO A 8 -11.523 31.824 3.687 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -12.756 30.086 1.905 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -13.706 31.185 2.885 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -12.839 31.476 0.016 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -14.396 31.833 0.736 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -12.588 33.798 0.202 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -13.692 33.914 1.558 1.00 0.00 H new ATOM 80 N PRO A 9 -10.104 29.935 2.684 1.00 0.00 N ATOM 81 CA PRO A 9 -8.957 29.114 2.286 1.00 0.00 C ATOM 82 C PRO A 9 -9.163 28.448 0.930 1.00 0.00 C ATOM 83 O PRO A 9 -10.215 27.866 0.666 1.00 0.00 O ATOM 84 CB PRO A 9 -8.876 28.059 3.392 1.00 0.00 C ATOM 85 CG PRO A 9 -10.262 27.966 3.930 1.00 0.00 C ATOM 86 CD PRO A 9 -10.845 29.347 3.812 1.00 0.00 C ATOM 0 HA PRO A 9 -8.050 29.708 2.176 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -8.539 27.100 3.000 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -8.169 28.353 4.168 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -10.852 27.244 3.366 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -10.256 27.632 4.968 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -11.917 29.315 3.616 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -10.705 29.922 4.728 1.00 0.00 H new ATOM 94 N VAL A 10 -8.152 28.538 0.072 1.00 0.00 N ATOM 95 CA VAL A 10 -8.222 27.943 -1.258 1.00 0.00 C ATOM 96 C VAL A 10 -7.166 26.857 -1.430 1.00 0.00 C ATOM 97 O VAL A 10 -5.968 27.119 -1.325 1.00 0.00 O ATOM 98 CB VAL A 10 -8.034 29.005 -2.358 1.00 0.00 C ATOM 99 CG1 VAL A 10 -6.651 29.632 -2.265 1.00 0.00 C ATOM 100 CG2 VAL A 10 -8.259 28.392 -3.732 1.00 0.00 C ATOM 0 H VAL A 10 -7.274 29.017 0.274 1.00 0.00 H new ATOM 0 HA VAL A 10 -9.213 27.501 -1.356 1.00 0.00 H new ATOM 0 HB VAL A 10 -8.773 29.792 -2.210 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -6.537 30.380 -3.050 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -6.532 30.107 -1.291 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.892 28.859 -2.387 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -8.122 29.156 -4.498 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.544 27.585 -3.892 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -9.272 27.995 -3.792 1.00 0.00 H new ATOM 110 N ILE A 11 -7.620 25.636 -1.695 1.00 0.00 N ATOM 111 CA ILE A 11 -6.714 24.509 -1.883 1.00 0.00 C ATOM 112 C ILE A 11 -6.100 24.525 -3.278 1.00 0.00 C ATOM 113 O ILE A 11 -6.738 24.129 -4.253 1.00 0.00 O ATOM 114 CB ILE A 11 -7.435 23.166 -1.667 1.00 0.00 C ATOM 115 CG1 ILE A 11 -7.885 23.031 -0.211 1.00 0.00 C ATOM 116 CG2 ILE A 11 -6.526 22.009 -2.055 1.00 0.00 C ATOM 117 CD1 ILE A 11 -8.838 21.880 0.024 1.00 0.00 C ATOM 0 H ILE A 11 -8.609 25.402 -1.784 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.924 24.611 -1.140 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.319 23.139 -2.304 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.007 22.900 0.421 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -8.365 23.959 0.100 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -7.050 21.066 -1.897 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -6.251 22.099 -3.106 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -5.626 22.032 -1.441 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -9.114 21.846 1.078 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -9.734 22.020 -0.582 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.354 20.944 -0.255 1.00 0.00 H new ATOM 129 N ARG A 12 -4.855 24.984 -3.366 1.00 0.00 N ATOM 130 CA ARG A 12 -4.154 25.051 -4.642 1.00 0.00 C ATOM 131 C ARG A 12 -3.865 23.652 -5.177 1.00 0.00 C ATOM 132 O ARG A 12 -4.214 23.327 -6.312 1.00 0.00 O ATOM 133 CB ARG A 12 -2.846 25.830 -4.489 1.00 0.00 C ATOM 134 CG ARG A 12 -3.011 27.163 -3.778 1.00 0.00 C ATOM 135 CD ARG A 12 -3.458 28.255 -4.738 1.00 0.00 C ATOM 136 NE ARG A 12 -2.575 28.360 -5.896 1.00 0.00 N ATOM 137 CZ ARG A 12 -1.453 29.070 -5.903 1.00 0.00 C ATOM 138 NH1 ARG A 12 -1.078 29.734 -4.817 1.00 0.00 N ATOM 139 NH2 ARG A 12 -0.702 29.117 -6.996 1.00 0.00 N ATOM 0 H ARG A 12 -4.312 25.315 -2.568 1.00 0.00 H new ATOM 0 HA ARG A 12 -4.796 25.569 -5.354 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -2.132 25.219 -3.937 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -2.419 26.005 -5.477 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -3.742 27.061 -2.976 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -2.067 27.449 -3.314 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -4.474 28.048 -5.074 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -3.484 29.210 -4.214 1.00 0.00 H new ATOM 0 HE ARG A 12 -2.834 27.860 -6.747 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -1.652 29.700 -3.975 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -0.216 30.279 -4.825 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -0.986 28.607 -7.832 1.00 0.00 H new ATOM 0 HH22 ARG A 12 0.160 29.663 -7.000 1.00 0.00 H new ATOM 153 N GLN A 13 -3.226 22.828 -4.353 1.00 0.00 N ATOM 154 CA GLN A 13 -2.889 21.465 -4.745 1.00 0.00 C ATOM 155 C GLN A 13 -3.562 20.452 -3.824 1.00 0.00 C ATOM 156 O GLN A 13 -3.162 20.282 -2.674 1.00 0.00 O ATOM 157 CB GLN A 13 -1.373 21.264 -4.721 1.00 0.00 C ATOM 158 CG GLN A 13 -0.695 21.591 -6.042 1.00 0.00 C ATOM 159 CD GLN A 13 -1.347 20.895 -7.220 1.00 0.00 C ATOM 160 OE1 GLN A 13 -1.750 21.537 -8.190 1.00 0.00 O ATOM 161 NE2 GLN A 13 -1.455 19.574 -7.142 1.00 0.00 N ATOM 0 H GLN A 13 -2.931 23.081 -3.410 1.00 0.00 H new ATOM 0 HA GLN A 13 -3.253 21.306 -5.760 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -0.944 21.889 -3.938 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -1.156 20.229 -4.457 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -0.720 22.669 -6.202 1.00 0.00 H new ATOM 0 HG3 GLN A 13 0.354 21.301 -5.989 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -1.107 19.082 -6.319 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -1.886 19.052 -7.905 1.00 0.00 H new ATOM 170 N GLY A 14 -4.588 19.781 -4.340 1.00 0.00 N ATOM 171 CA GLY A 14 -5.301 18.794 -3.550 1.00 0.00 C ATOM 172 C GLY A 14 -5.022 17.376 -4.007 1.00 0.00 C ATOM 173 O GLY A 14 -4.581 17.138 -5.131 1.00 0.00 O ATOM 0 H GLY A 14 -4.938 19.903 -5.290 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -5.018 18.898 -2.503 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -6.372 18.988 -3.611 1.00 0.00 H new ATOM 177 N PRO A 15 -5.282 16.403 -3.121 1.00 0.00 N ATOM 178 CA PRO A 15 -5.063 14.984 -3.416 1.00 0.00 C ATOM 179 C PRO A 15 -6.053 14.446 -4.444 1.00 0.00 C ATOM 180 O PRO A 15 -7.251 14.717 -4.367 1.00 0.00 O ATOM 181 CB PRO A 15 -5.275 14.303 -2.062 1.00 0.00 C ATOM 182 CG PRO A 15 -6.171 15.226 -1.310 1.00 0.00 C ATOM 183 CD PRO A 15 -5.810 16.613 -1.762 1.00 0.00 C ATOM 0 HA PRO A 15 -4.079 14.805 -3.849 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -5.729 13.319 -2.180 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -4.329 14.157 -1.540 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -7.219 15.008 -1.518 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -6.030 15.117 -0.235 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -6.678 17.273 -1.766 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -5.066 17.068 -1.108 1.00 0.00 H new ATOM 191 N VAL A 16 -5.544 13.682 -5.405 1.00 0.00 N ATOM 192 CA VAL A 16 -6.384 13.105 -6.448 1.00 0.00 C ATOM 193 C VAL A 16 -6.601 11.614 -6.216 1.00 0.00 C ATOM 194 O VAL A 16 -5.952 11.007 -5.365 1.00 0.00 O ATOM 195 CB VAL A 16 -5.767 13.311 -7.844 1.00 0.00 C ATOM 196 CG1 VAL A 16 -5.593 14.793 -8.138 1.00 0.00 C ATOM 197 CG2 VAL A 16 -4.438 12.578 -7.952 1.00 0.00 C ATOM 0 H VAL A 16 -4.554 13.448 -5.483 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.343 13.621 -6.403 1.00 0.00 H new ATOM 0 HB VAL A 16 -6.447 12.895 -8.588 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -5.156 14.919 -9.129 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -6.564 15.287 -8.105 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -4.934 15.237 -7.392 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -4.016 12.734 -8.945 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -3.749 12.962 -7.200 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -4.596 11.512 -7.789 1.00 0.00 H new ATOM 207 N ASN A 17 -7.519 11.029 -6.979 1.00 0.00 N ATOM 208 CA ASN A 17 -7.823 9.608 -6.856 1.00 0.00 C ATOM 209 C ASN A 17 -6.648 8.758 -7.330 1.00 0.00 C ATOM 210 O ASN A 17 -6.191 8.892 -8.465 1.00 0.00 O ATOM 211 CB ASN A 17 -9.076 9.262 -7.662 1.00 0.00 C ATOM 212 CG ASN A 17 -8.887 9.488 -9.150 1.00 0.00 C ATOM 213 OD1 ASN A 17 -8.174 10.402 -9.565 1.00 0.00 O ATOM 214 ND2 ASN A 17 -9.527 8.653 -9.961 1.00 0.00 N ATOM 0 H ASN A 17 -8.065 11.517 -7.689 1.00 0.00 H new ATOM 0 HA ASN A 17 -8.005 9.390 -5.804 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -9.341 8.219 -7.486 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -9.911 9.867 -7.308 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.438 8.755 -10.972 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -10.107 7.910 -9.573 1.00 0.00 H new ATOM 221 N GLN A 18 -6.165 7.884 -6.453 1.00 0.00 N ATOM 222 CA GLN A 18 -5.044 7.012 -6.782 1.00 0.00 C ATOM 223 C GLN A 18 -5.307 5.586 -6.311 1.00 0.00 C ATOM 224 O GLN A 18 -5.865 5.368 -5.235 1.00 0.00 O ATOM 225 CB GLN A 18 -3.756 7.542 -6.149 1.00 0.00 C ATOM 226 CG GLN A 18 -3.357 8.922 -6.645 1.00 0.00 C ATOM 227 CD GLN A 18 -2.300 9.572 -5.775 1.00 0.00 C ATOM 228 OE1 GLN A 18 -1.209 9.899 -6.242 1.00 0.00 O ATOM 229 NE2 GLN A 18 -2.619 9.764 -4.500 1.00 0.00 N ATOM 0 H GLN A 18 -6.532 7.761 -5.509 1.00 0.00 H new ATOM 0 HA GLN A 18 -4.930 7.001 -7.866 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -3.880 7.576 -5.067 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -2.946 6.843 -6.355 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -2.983 8.843 -7.666 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -4.239 9.561 -6.677 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -3.535 9.478 -4.155 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -1.948 10.198 -3.866 1.00 0.00 H new ATOM 238 N THR A 19 -4.902 4.615 -7.124 1.00 0.00 N ATOM 239 CA THR A 19 -5.094 3.209 -6.792 1.00 0.00 C ATOM 240 C THR A 19 -3.816 2.596 -6.231 1.00 0.00 C ATOM 241 O THR A 19 -2.761 2.651 -6.862 1.00 0.00 O ATOM 242 CB THR A 19 -5.542 2.397 -8.022 1.00 0.00 C ATOM 243 OG1 THR A 19 -6.510 3.139 -8.773 1.00 0.00 O ATOM 244 CG2 THR A 19 -6.135 1.061 -7.602 1.00 0.00 C ATOM 0 H THR A 19 -4.438 4.777 -8.018 1.00 0.00 H new ATOM 0 HA THR A 19 -5.876 3.168 -6.034 1.00 0.00 H new ATOM 0 HB THR A 19 -4.667 2.209 -8.644 1.00 0.00 H new ATOM 0 HG1 THR A 19 -6.788 2.617 -9.554 1.00 0.00 H new ATOM 0 HG21 THR A 19 -6.444 0.506 -8.488 1.00 0.00 H new ATOM 0 HG22 THR A 19 -5.387 0.486 -7.056 1.00 0.00 H new ATOM 0 HG23 THR A 19 -7.000 1.232 -6.961 1.00 0.00 H new ATOM 252 N VAL A 20 -3.919 2.012 -5.041 1.00 0.00 N ATOM 253 CA VAL A 20 -2.770 1.387 -4.396 1.00 0.00 C ATOM 254 C VAL A 20 -3.073 -0.059 -4.016 1.00 0.00 C ATOM 255 O VAL A 20 -4.181 -0.379 -3.586 1.00 0.00 O ATOM 256 CB VAL A 20 -2.347 2.160 -3.133 1.00 0.00 C ATOM 257 CG1 VAL A 20 -1.475 1.289 -2.241 1.00 0.00 C ATOM 258 CG2 VAL A 20 -1.622 3.443 -3.512 1.00 0.00 C ATOM 0 H VAL A 20 -4.785 1.959 -4.505 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.952 1.407 -5.116 1.00 0.00 H new ATOM 0 HB VAL A 20 -3.244 2.428 -2.574 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -1.186 1.852 -1.354 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.033 0.401 -1.942 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -0.581 0.989 -2.788 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.330 3.977 -2.608 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -0.732 3.200 -4.093 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.283 4.072 -4.107 1.00 0.00 H new ATOM 268 N ALA A 21 -2.080 -0.927 -4.177 1.00 0.00 N ATOM 269 CA ALA A 21 -2.240 -2.338 -3.848 1.00 0.00 C ATOM 270 C ALA A 21 -2.293 -2.548 -2.338 1.00 0.00 C ATOM 271 O ALA A 21 -1.928 -1.662 -1.565 1.00 0.00 O ATOM 272 CB ALA A 21 -1.107 -3.153 -4.456 1.00 0.00 C ATOM 0 H ALA A 21 -1.157 -0.678 -4.533 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.186 -2.679 -4.269 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.239 -4.205 -4.203 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -1.116 -3.037 -5.540 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.154 -2.801 -4.062 1.00 0.00 H new ATOM 278 N VAL A 22 -2.750 -3.726 -1.925 1.00 0.00 N ATOM 279 CA VAL A 22 -2.850 -4.052 -0.507 1.00 0.00 C ATOM 280 C VAL A 22 -1.489 -3.967 0.174 1.00 0.00 C ATOM 281 O VAL A 22 -0.456 -4.223 -0.445 1.00 0.00 O ATOM 282 CB VAL A 22 -3.431 -5.462 -0.296 1.00 0.00 C ATOM 283 CG1 VAL A 22 -3.116 -5.965 1.105 1.00 0.00 C ATOM 284 CG2 VAL A 22 -4.931 -5.464 -0.546 1.00 0.00 C ATOM 0 H VAL A 22 -3.057 -4.470 -2.552 1.00 0.00 H new ATOM 0 HA VAL A 22 -3.522 -3.319 -0.060 1.00 0.00 H new ATOM 0 HB VAL A 22 -2.966 -6.138 -1.013 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -3.534 -6.963 1.236 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.036 -6.004 1.243 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.552 -5.289 1.841 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -5.324 -6.469 -0.392 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -5.416 -4.775 0.145 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.130 -5.150 -1.571 1.00 0.00 H new ATOM 294 N ASP A 23 -1.495 -3.606 1.452 1.00 0.00 N ATOM 295 CA ASP A 23 -0.260 -3.488 2.220 1.00 0.00 C ATOM 296 C ASP A 23 0.764 -2.639 1.474 1.00 0.00 C ATOM 297 O ASP A 23 1.970 -2.799 1.658 1.00 0.00 O ATOM 298 CB ASP A 23 0.320 -4.874 2.508 1.00 0.00 C ATOM 299 CG ASP A 23 1.203 -4.887 3.740 1.00 0.00 C ATOM 300 OD1 ASP A 23 2.371 -4.457 3.638 1.00 0.00 O ATOM 301 OD2 ASP A 23 0.725 -5.326 4.807 1.00 0.00 O ATOM 0 H ASP A 23 -2.341 -3.390 1.979 1.00 0.00 H new ATOM 0 HA ASP A 23 -0.493 -2.997 3.165 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -0.495 -5.585 2.641 1.00 0.00 H new ATOM 0 HB3 ASP A 23 0.898 -5.209 1.647 1.00 0.00 H new ATOM 306 N GLY A 24 0.275 -1.736 0.630 1.00 0.00 N ATOM 307 CA GLY A 24 1.161 -0.875 -0.132 1.00 0.00 C ATOM 308 C GLY A 24 1.500 0.405 0.604 1.00 0.00 C ATOM 309 O GLY A 24 1.781 0.386 1.803 1.00 0.00 O ATOM 0 H GLY A 24 -0.719 -1.585 0.460 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.081 -1.415 -0.359 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.693 -0.629 -1.085 1.00 0.00 H new ATOM 313 N THR A 25 1.477 1.524 -0.115 1.00 0.00 N ATOM 314 CA THR A 25 1.787 2.819 0.477 1.00 0.00 C ATOM 315 C THR A 25 1.217 3.957 -0.362 1.00 0.00 C ATOM 316 O THR A 25 1.587 4.132 -1.523 1.00 0.00 O ATOM 317 CB THR A 25 3.307 3.019 0.626 1.00 0.00 C ATOM 318 OG1 THR A 25 3.894 1.868 1.243 1.00 0.00 O ATOM 319 CG2 THR A 25 3.611 4.256 1.458 1.00 0.00 C ATOM 0 H THR A 25 1.247 1.559 -1.108 1.00 0.00 H new ATOM 0 HA THR A 25 1.327 2.833 1.465 1.00 0.00 H new ATOM 0 HB THR A 25 3.732 3.155 -0.368 1.00 0.00 H new ATOM 0 HG1 THR A 25 3.234 1.436 1.824 1.00 0.00 H new ATOM 0 HG21 THR A 25 4.690 4.377 1.550 1.00 0.00 H new ATOM 0 HG22 THR A 25 3.188 5.135 0.972 1.00 0.00 H new ATOM 0 HG23 THR A 25 3.173 4.144 2.450 1.00 0.00 H new ATOM 327 N PHE A 26 0.314 4.729 0.233 1.00 0.00 N ATOM 328 CA PHE A 26 -0.309 5.851 -0.460 1.00 0.00 C ATOM 329 C PHE A 26 -0.148 7.141 0.340 1.00 0.00 C ATOM 330 O PHE A 26 -0.337 7.158 1.556 1.00 0.00 O ATOM 331 CB PHE A 26 -1.793 5.569 -0.702 1.00 0.00 C ATOM 332 CG PHE A 26 -2.602 5.492 0.561 1.00 0.00 C ATOM 333 CD1 PHE A 26 -2.702 4.302 1.264 1.00 0.00 C ATOM 334 CD2 PHE A 26 -3.262 6.610 1.046 1.00 0.00 C ATOM 335 CE1 PHE A 26 -3.447 4.229 2.426 1.00 0.00 C ATOM 336 CE2 PHE A 26 -4.008 6.542 2.208 1.00 0.00 C ATOM 337 CZ PHE A 26 -4.099 5.350 2.899 1.00 0.00 C ATOM 0 H PHE A 26 -0.003 4.598 1.194 1.00 0.00 H new ATOM 0 HA PHE A 26 0.191 5.975 -1.421 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -2.204 6.351 -1.340 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -1.892 4.629 -1.245 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -2.192 3.422 0.900 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -3.193 7.545 0.510 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -3.519 3.295 2.964 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.519 7.420 2.575 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.679 5.295 3.808 1.00 0.00 H new ATOM 347 N VAL A 27 0.202 8.220 -0.353 1.00 0.00 N ATOM 348 CA VAL A 27 0.388 9.515 0.291 1.00 0.00 C ATOM 349 C VAL A 27 -0.497 10.579 -0.349 1.00 0.00 C ATOM 350 O VAL A 27 -0.506 10.742 -1.570 1.00 0.00 O ATOM 351 CB VAL A 27 1.857 9.972 0.219 1.00 0.00 C ATOM 352 CG1 VAL A 27 2.054 11.261 1.002 1.00 0.00 C ATOM 353 CG2 VAL A 27 2.781 8.879 0.734 1.00 0.00 C ATOM 0 H VAL A 27 0.362 8.223 -1.360 1.00 0.00 H new ATOM 0 HA VAL A 27 0.105 9.392 1.336 1.00 0.00 H new ATOM 0 HB VAL A 27 2.108 10.166 -0.824 1.00 0.00 H new ATOM 0 HG11 VAL A 27 3.098 11.569 0.940 1.00 0.00 H new ATOM 0 HG12 VAL A 27 1.420 12.042 0.582 1.00 0.00 H new ATOM 0 HG13 VAL A 27 1.786 11.097 2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 27 3.815 9.219 0.676 1.00 0.00 H new ATOM 0 HG22 VAL A 27 2.532 8.650 1.770 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.659 7.983 0.125 1.00 0.00 H new ATOM 363 N LEU A 28 -1.239 11.302 0.482 1.00 0.00 N ATOM 364 CA LEU A 28 -2.128 12.352 -0.002 1.00 0.00 C ATOM 365 C LEU A 28 -1.670 13.722 0.489 1.00 0.00 C ATOM 366 O LEU A 28 -1.662 13.991 1.690 1.00 0.00 O ATOM 367 CB LEU A 28 -3.562 12.086 0.458 1.00 0.00 C ATOM 368 CG LEU A 28 -4.059 10.648 0.307 1.00 0.00 C ATOM 369 CD1 LEU A 28 -5.166 10.358 1.309 1.00 0.00 C ATOM 370 CD2 LEU A 28 -4.545 10.398 -1.113 1.00 0.00 C ATOM 0 H LEU A 28 -1.243 11.180 1.495 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.096 12.347 -1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.644 12.369 1.507 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.229 12.741 -0.102 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.227 9.973 0.509 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.507 9.330 1.187 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.786 10.496 2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.999 11.040 1.138 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.895 9.370 -1.202 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.363 11.081 -1.343 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.726 10.564 -1.813 1.00 0.00 H new ATOM 382 N SER A 29 -1.291 14.585 -0.448 1.00 0.00 N ATOM 383 CA SER A 29 -0.831 15.926 -0.111 1.00 0.00 C ATOM 384 C SER A 29 -1.971 16.935 -0.220 1.00 0.00 C ATOM 385 O SER A 29 -2.785 16.873 -1.141 1.00 0.00 O ATOM 386 CB SER A 29 0.320 16.340 -1.030 1.00 0.00 C ATOM 387 OG SER A 29 0.613 17.719 -0.892 1.00 0.00 O ATOM 0 H SER A 29 -1.294 14.379 -1.447 1.00 0.00 H new ATOM 0 HA SER A 29 -0.477 15.913 0.920 1.00 0.00 H new ATOM 0 HB2 SER A 29 1.207 15.751 -0.795 1.00 0.00 H new ATOM 0 HB3 SER A 29 0.059 16.123 -2.066 1.00 0.00 H new ATOM 0 HG SER A 29 1.353 17.957 -1.489 1.00 0.00 H new ATOM 393 N CYS A 30 -2.022 17.865 0.729 1.00 0.00 N ATOM 394 CA CYS A 30 -3.060 18.888 0.742 1.00 0.00 C ATOM 395 C CYS A 30 -2.480 20.247 1.120 1.00 0.00 C ATOM 396 O CYS A 30 -1.900 20.410 2.194 1.00 0.00 O ATOM 397 CB CYS A 30 -4.170 18.504 1.723 1.00 0.00 C ATOM 398 SG CYS A 30 -5.631 19.590 1.654 1.00 0.00 S ATOM 0 H CYS A 30 -1.356 17.930 1.499 1.00 0.00 H new ATOM 0 HA CYS A 30 -3.479 18.958 -0.262 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -4.482 17.480 1.519 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -3.767 18.519 2.736 1.00 0.00 H new ATOM 403 N VAL A 31 -2.641 21.221 0.230 1.00 0.00 N ATOM 404 CA VAL A 31 -2.135 22.568 0.470 1.00 0.00 C ATOM 405 C VAL A 31 -3.249 23.602 0.354 1.00 0.00 C ATOM 406 O VAL A 31 -3.978 23.636 -0.636 1.00 0.00 O ATOM 407 CB VAL A 31 -1.010 22.928 -0.518 1.00 0.00 C ATOM 408 CG1 VAL A 31 -0.443 24.304 -0.203 1.00 0.00 C ATOM 409 CG2 VAL A 31 0.085 21.872 -0.487 1.00 0.00 C ATOM 0 H VAL A 31 -3.118 21.103 -0.664 1.00 0.00 H new ATOM 0 HA VAL A 31 -1.736 22.581 1.484 1.00 0.00 H new ATOM 0 HB VAL A 31 -1.429 22.955 -1.524 1.00 0.00 H new ATOM 0 HG11 VAL A 31 0.351 24.541 -0.911 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.234 25.050 -0.281 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.039 24.308 0.809 1.00 0.00 H new ATOM 0 HG21 VAL A 31 0.872 22.143 -1.191 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.503 21.811 0.518 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.334 20.905 -0.765 1.00 0.00 H new ATOM 419 N ALA A 32 -3.374 24.445 1.374 1.00 0.00 N ATOM 420 CA ALA A 32 -4.397 25.483 1.386 1.00 0.00 C ATOM 421 C ALA A 32 -3.857 26.780 1.980 1.00 0.00 C ATOM 422 O ALA A 32 -3.165 26.768 2.999 1.00 0.00 O ATOM 423 CB ALA A 32 -5.617 25.012 2.164 1.00 0.00 C ATOM 0 H ALA A 32 -2.779 24.429 2.203 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.691 25.681 0.355 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -6.373 25.797 2.165 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -6.024 24.116 1.695 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.329 24.785 3.190 1.00 0.00 H new ATOM 429 N THR A 33 -4.177 27.898 1.337 1.00 0.00 N ATOM 430 CA THR A 33 -3.722 29.203 1.801 1.00 0.00 C ATOM 431 C THR A 33 -4.657 29.765 2.866 1.00 0.00 C ATOM 432 O THR A 33 -5.744 29.235 3.093 1.00 0.00 O ATOM 433 CB THR A 33 -3.624 30.209 0.638 1.00 0.00 C ATOM 434 OG1 THR A 33 -4.874 30.885 0.468 1.00 0.00 O ATOM 435 CG2 THR A 33 -3.242 29.506 -0.655 1.00 0.00 C ATOM 0 H THR A 33 -4.750 27.926 0.493 1.00 0.00 H new ATOM 0 HA THR A 33 -2.731 29.058 2.232 1.00 0.00 H new ATOM 0 HB THR A 33 -2.849 30.936 0.880 1.00 0.00 H new ATOM 0 HG1 THR A 33 -4.803 31.524 -0.272 1.00 0.00 H new ATOM 0 HG21 THR A 33 -3.179 30.237 -1.461 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.275 29.017 -0.532 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.997 28.759 -0.900 1.00 0.00 H new ATOM 443 N GLY A 34 -4.227 30.842 3.516 1.00 0.00 N ATOM 444 CA GLY A 34 -5.039 31.458 4.549 1.00 0.00 C ATOM 445 C GLY A 34 -4.224 31.870 5.759 1.00 0.00 C ATOM 446 O GLY A 34 -3.364 31.120 6.221 1.00 0.00 O ATOM 0 H GLY A 34 -3.331 31.299 3.346 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -5.541 32.334 4.138 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.817 30.761 4.859 1.00 0.00 H new ATOM 450 N SER A 35 -4.492 33.067 6.271 1.00 0.00 N ATOM 451 CA SER A 35 -3.772 33.580 7.431 1.00 0.00 C ATOM 452 C SER A 35 -4.724 33.816 8.600 1.00 0.00 C ATOM 453 O SER A 35 -5.697 34.562 8.500 1.00 0.00 O ATOM 454 CB SER A 35 -3.051 34.881 7.075 1.00 0.00 C ATOM 455 OG SER A 35 -2.407 35.434 8.210 1.00 0.00 O ATOM 0 H SER A 35 -5.202 33.699 5.901 1.00 0.00 H new ATOM 0 HA SER A 35 -3.035 32.835 7.730 1.00 0.00 H new ATOM 0 HB2 SER A 35 -2.316 34.691 6.293 1.00 0.00 H new ATOM 0 HB3 SER A 35 -3.766 35.599 6.673 1.00 0.00 H new ATOM 0 HG SER A 35 -1.952 36.264 7.956 1.00 0.00 H new ATOM 461 N PRO A 36 -4.436 33.164 9.737 1.00 0.00 N ATOM 462 CA PRO A 36 -3.280 32.272 9.867 1.00 0.00 C ATOM 463 C PRO A 36 -3.442 30.990 9.058 1.00 0.00 C ATOM 464 O PRO A 36 -4.470 30.776 8.414 1.00 0.00 O ATOM 465 CB PRO A 36 -3.241 31.958 11.365 1.00 0.00 C ATOM 466 CG PRO A 36 -4.646 32.142 11.826 1.00 0.00 C ATOM 467 CD PRO A 36 -5.218 33.247 10.982 1.00 0.00 C ATOM 0 HA PRO A 36 -2.367 32.732 9.490 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -2.894 30.941 11.548 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.560 32.626 11.892 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -5.219 31.223 11.706 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -4.679 32.402 12.884 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -6.283 33.103 10.798 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -5.106 34.219 11.463 1.00 0.00 H new ATOM 475 N VAL A 37 -2.421 30.139 9.094 1.00 0.00 N ATOM 476 CA VAL A 37 -2.452 28.877 8.365 1.00 0.00 C ATOM 477 C VAL A 37 -3.641 28.024 8.793 1.00 0.00 C ATOM 478 O VAL A 37 -3.944 27.887 9.978 1.00 0.00 O ATOM 479 CB VAL A 37 -1.155 28.074 8.579 1.00 0.00 C ATOM 480 CG1 VAL A 37 -1.227 26.740 7.852 1.00 0.00 C ATOM 481 CG2 VAL A 37 0.051 28.878 8.117 1.00 0.00 C ATOM 0 H VAL A 37 -1.562 30.301 9.620 1.00 0.00 H new ATOM 0 HA VAL A 37 -2.548 29.124 7.308 1.00 0.00 H new ATOM 0 HB VAL A 37 -1.043 27.874 9.645 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.302 26.187 8.015 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -2.068 26.162 8.235 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.363 26.914 6.785 1.00 0.00 H new ATOM 0 HG21 VAL A 37 0.959 28.296 8.275 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -0.051 29.110 7.057 1.00 0.00 H new ATOM 0 HG23 VAL A 37 0.110 29.805 8.687 1.00 0.00 H new ATOM 491 N PRO A 38 -4.332 27.435 7.806 1.00 0.00 N ATOM 492 CA PRO A 38 -5.499 26.584 8.055 1.00 0.00 C ATOM 493 C PRO A 38 -5.122 25.261 8.712 1.00 0.00 C ATOM 494 O PRO A 38 -3.952 24.876 8.731 1.00 0.00 O ATOM 495 CB PRO A 38 -6.068 26.342 6.654 1.00 0.00 C ATOM 496 CG PRO A 38 -4.904 26.509 5.739 1.00 0.00 C ATOM 497 CD PRO A 38 -4.027 27.555 6.370 1.00 0.00 C ATOM 0 HA PRO A 38 -6.205 27.052 8.742 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -6.499 25.344 6.569 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -6.861 27.053 6.420 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -4.365 25.569 5.618 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -5.230 26.820 4.746 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -2.972 27.371 6.167 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -4.255 28.552 5.993 1.00 0.00 H new ATOM 505 N THR A 39 -6.120 24.567 9.251 1.00 0.00 N ATOM 506 CA THR A 39 -5.892 23.287 9.910 1.00 0.00 C ATOM 507 C THR A 39 -6.098 22.127 8.943 1.00 0.00 C ATOM 508 O THR A 39 -7.183 21.955 8.387 1.00 0.00 O ATOM 509 CB THR A 39 -6.828 23.104 11.120 1.00 0.00 C ATOM 510 OG1 THR A 39 -6.779 24.265 11.957 1.00 0.00 O ATOM 511 CG2 THR A 39 -6.436 21.875 11.926 1.00 0.00 C ATOM 0 H THR A 39 -7.094 24.870 9.244 1.00 0.00 H new ATOM 0 HA THR A 39 -4.858 23.289 10.256 1.00 0.00 H new ATOM 0 HB THR A 39 -7.844 22.967 10.749 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.378 24.142 12.723 1.00 0.00 H new ATOM 0 HG21 THR A 39 -7.111 21.766 12.775 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.502 20.989 11.294 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.414 21.988 12.287 1.00 0.00 H new ATOM 519 N ILE A 40 -5.050 21.333 8.747 1.00 0.00 N ATOM 520 CA ILE A 40 -5.118 20.188 7.848 1.00 0.00 C ATOM 521 C ILE A 40 -5.681 18.963 8.561 1.00 0.00 C ATOM 522 O ILE A 40 -5.209 18.583 9.634 1.00 0.00 O ATOM 523 CB ILE A 40 -3.732 19.841 7.273 1.00 0.00 C ATOM 524 CG1 ILE A 40 -3.155 21.040 6.517 1.00 0.00 C ATOM 525 CG2 ILE A 40 -3.825 18.628 6.361 1.00 0.00 C ATOM 526 CD1 ILE A 40 -4.113 21.637 5.510 1.00 0.00 C ATOM 0 H ILE A 40 -4.145 21.462 9.199 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.782 20.467 7.030 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.063 19.599 8.099 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.870 21.809 7.235 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.245 20.731 6.002 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.837 18.396 5.963 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -4.198 17.775 6.927 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.507 18.843 5.538 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.638 22.482 5.012 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -4.379 20.883 4.770 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -5.013 21.977 6.022 1.00 0.00 H new ATOM 538 N LEU A 41 -6.690 18.346 7.956 1.00 0.00 N ATOM 539 CA LEU A 41 -7.318 17.161 8.531 1.00 0.00 C ATOM 540 C LEU A 41 -7.802 16.216 7.437 1.00 0.00 C ATOM 541 O LEU A 41 -7.679 16.512 6.248 1.00 0.00 O ATOM 542 CB LEU A 41 -8.489 17.565 9.428 1.00 0.00 C ATOM 543 CG LEU A 41 -8.197 18.647 10.468 1.00 0.00 C ATOM 544 CD1 LEU A 41 -9.440 19.482 10.732 1.00 0.00 C ATOM 545 CD2 LEU A 41 -7.688 18.022 11.759 1.00 0.00 C ATOM 0 H LEU A 41 -7.091 18.646 7.068 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.572 16.640 9.131 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -9.304 17.911 8.793 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -8.845 16.676 9.948 1.00 0.00 H new ATOM 0 HG LEU A 41 -7.420 19.303 10.074 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.213 20.247 11.475 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -9.761 19.959 9.806 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -10.238 18.839 11.105 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -7.485 18.807 12.488 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.442 17.343 12.157 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.771 17.468 11.558 1.00 0.00 H new ATOM 557 N TRP A 42 -8.354 15.079 7.846 1.00 0.00 N ATOM 558 CA TRP A 42 -8.859 14.091 6.899 1.00 0.00 C ATOM 559 C TRP A 42 -10.100 13.396 7.448 1.00 0.00 C ATOM 560 O TRP A 42 -10.382 13.463 8.645 1.00 0.00 O ATOM 561 CB TRP A 42 -7.778 13.057 6.584 1.00 0.00 C ATOM 562 CG TRP A 42 -6.518 13.661 6.042 1.00 0.00 C ATOM 563 CD1 TRP A 42 -5.511 14.239 6.761 1.00 0.00 C ATOM 564 CD2 TRP A 42 -6.132 13.747 4.666 1.00 0.00 C ATOM 565 NE1 TRP A 42 -4.522 14.680 5.914 1.00 0.00 N ATOM 566 CE2 TRP A 42 -4.879 14.390 4.624 1.00 0.00 C ATOM 567 CE3 TRP A 42 -6.722 13.343 3.465 1.00 0.00 C ATOM 568 CZ2 TRP A 42 -4.209 14.637 3.429 1.00 0.00 C ATOM 569 CZ3 TRP A 42 -6.056 13.589 2.280 1.00 0.00 C ATOM 570 CH2 TRP A 42 -4.810 14.230 2.268 1.00 0.00 C ATOM 0 H TRP A 42 -8.463 14.819 8.826 1.00 0.00 H new ATOM 0 HA TRP A 42 -9.133 14.611 5.981 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -7.544 12.499 7.491 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -8.170 12.341 5.861 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -5.494 14.335 7.837 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -3.662 15.147 6.200 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -7.682 12.847 3.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -3.249 15.132 3.418 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -6.504 13.282 1.346 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -4.314 14.406 1.325 1.00 0.00 H new ATOM 581 N ARG A 43 -10.839 12.731 6.567 1.00 0.00 N ATOM 582 CA ARG A 43 -12.051 12.024 6.964 1.00 0.00 C ATOM 583 C ARG A 43 -12.236 10.754 6.138 1.00 0.00 C ATOM 584 O ARG A 43 -12.055 10.761 4.920 1.00 0.00 O ATOM 585 CB ARG A 43 -13.272 12.932 6.803 1.00 0.00 C ATOM 586 CG ARG A 43 -13.377 14.006 7.873 1.00 0.00 C ATOM 587 CD ARG A 43 -14.716 14.724 7.812 1.00 0.00 C ATOM 588 NE ARG A 43 -14.960 15.316 6.500 1.00 0.00 N ATOM 589 CZ ARG A 43 -15.829 16.298 6.286 1.00 0.00 C ATOM 590 NH1 ARG A 43 -16.533 16.795 7.294 1.00 0.00 N ATOM 591 NH2 ARG A 43 -15.995 16.784 5.063 1.00 0.00 N ATOM 0 H ARG A 43 -10.620 12.667 5.573 1.00 0.00 H new ATOM 0 HA ARG A 43 -11.951 11.743 8.012 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -13.233 13.409 5.824 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -14.174 12.321 6.824 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -13.249 13.555 8.857 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.570 14.728 7.746 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -15.515 14.021 8.047 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -14.744 15.504 8.573 1.00 0.00 H new ATOM 0 HE ARG A 43 -14.434 14.956 5.704 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -16.408 16.423 8.236 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -17.200 17.549 7.128 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -15.455 16.404 4.286 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -16.662 17.538 4.900 1.00 0.00 H new ATOM 605 N LYS A 44 -12.597 9.666 6.809 1.00 0.00 N ATOM 606 CA LYS A 44 -12.807 8.388 6.139 1.00 0.00 C ATOM 607 C LYS A 44 -14.262 7.943 6.260 1.00 0.00 C ATOM 608 O LYS A 44 -14.668 7.387 7.280 1.00 0.00 O ATOM 609 CB LYS A 44 -11.886 7.320 6.732 1.00 0.00 C ATOM 610 CG LYS A 44 -10.466 7.376 6.195 1.00 0.00 C ATOM 611 CD LYS A 44 -9.515 6.549 7.044 1.00 0.00 C ATOM 612 CE LYS A 44 -9.556 5.079 6.654 1.00 0.00 C ATOM 613 NZ LYS A 44 -8.547 4.279 7.402 1.00 0.00 N ATOM 0 H LYS A 44 -12.750 9.643 7.817 1.00 0.00 H new ATOM 0 HA LYS A 44 -12.571 8.517 5.083 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.861 7.435 7.816 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.305 6.335 6.526 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -10.450 7.010 5.168 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -10.126 8.411 6.170 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -8.500 6.929 6.930 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -9.779 6.655 8.096 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -10.552 4.680 6.847 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -9.375 4.982 5.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -8.606 3.283 7.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -7.595 4.644 7.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -8.734 4.351 8.422 1.00 0.00 H new ATOM 627 N ASP A 45 -15.040 8.191 5.212 1.00 0.00 N ATOM 628 CA ASP A 45 -16.449 7.814 5.200 1.00 0.00 C ATOM 629 C ASP A 45 -17.173 8.379 6.418 1.00 0.00 C ATOM 630 O ASP A 45 -18.073 7.745 6.967 1.00 0.00 O ATOM 631 CB ASP A 45 -16.590 6.291 5.168 1.00 0.00 C ATOM 632 CG ASP A 45 -17.903 5.844 4.556 1.00 0.00 C ATOM 633 OD1 ASP A 45 -18.075 6.014 3.330 1.00 0.00 O ATOM 634 OD2 ASP A 45 -18.759 5.324 5.302 1.00 0.00 O ATOM 0 H ASP A 45 -14.719 8.651 4.360 1.00 0.00 H new ATOM 0 HA ASP A 45 -16.905 8.233 4.303 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -15.764 5.864 4.600 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -16.514 5.901 6.183 1.00 0.00 H new ATOM 639 N GLY A 46 -16.773 9.576 6.835 1.00 0.00 N ATOM 640 CA GLY A 46 -17.394 10.206 7.986 1.00 0.00 C ATOM 641 C GLY A 46 -16.604 9.991 9.262 1.00 0.00 C ATOM 642 O GLY A 46 -16.906 10.586 10.296 1.00 0.00 O ATOM 0 H GLY A 46 -16.030 10.121 6.397 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -17.495 11.275 7.801 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -18.401 9.809 8.114 1.00 0.00 H new ATOM 646 N VAL A 47 -15.589 9.135 9.190 1.00 0.00 N ATOM 647 CA VAL A 47 -14.753 8.841 10.348 1.00 0.00 C ATOM 648 C VAL A 47 -13.381 9.491 10.214 1.00 0.00 C ATOM 649 O VAL A 47 -12.541 9.040 9.434 1.00 0.00 O ATOM 650 CB VAL A 47 -14.573 7.324 10.540 1.00 0.00 C ATOM 651 CG1 VAL A 47 -13.756 7.037 11.790 1.00 0.00 C ATOM 652 CG2 VAL A 47 -15.927 6.632 10.608 1.00 0.00 C ATOM 0 H VAL A 47 -15.326 8.633 8.342 1.00 0.00 H new ATOM 0 HA VAL A 47 -15.263 9.252 11.219 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.030 6.928 9.682 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -13.639 5.960 11.909 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -12.774 7.500 11.697 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -14.268 7.445 12.661 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.781 5.560 10.744 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -16.497 7.030 11.447 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -16.473 6.809 9.682 1.00 0.00 H new ATOM 662 N LEU A 48 -13.158 10.554 10.981 1.00 0.00 N ATOM 663 CA LEU A 48 -11.886 11.267 10.949 1.00 0.00 C ATOM 664 C LEU A 48 -10.715 10.297 11.067 1.00 0.00 C ATOM 665 O LEU A 48 -10.870 9.176 11.551 1.00 0.00 O ATOM 666 CB LEU A 48 -11.827 12.296 12.079 1.00 0.00 C ATOM 667 CG LEU A 48 -12.329 13.699 11.737 1.00 0.00 C ATOM 668 CD1 LEU A 48 -13.841 13.776 11.882 1.00 0.00 C ATOM 669 CD2 LEU A 48 -11.653 14.738 12.620 1.00 0.00 C ATOM 0 H LEU A 48 -13.842 10.940 11.632 1.00 0.00 H new ATOM 0 HA LEU A 48 -11.811 11.783 9.992 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -12.411 11.918 12.918 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.794 12.374 12.418 1.00 0.00 H new ATOM 0 HG LEU A 48 -12.073 13.912 10.699 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -14.179 14.782 11.634 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -14.308 13.059 11.207 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -14.120 13.542 12.909 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -12.023 15.730 12.362 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -11.877 14.528 13.666 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -10.575 14.701 12.465 1.00 0.00 H new ATOM 681 N VAL A 49 -9.541 10.738 10.624 1.00 0.00 N ATOM 682 CA VAL A 49 -8.342 9.910 10.683 1.00 0.00 C ATOM 683 C VAL A 49 -7.704 9.966 12.066 1.00 0.00 C ATOM 684 O VAL A 49 -7.591 11.035 12.667 1.00 0.00 O ATOM 685 CB VAL A 49 -7.305 10.349 9.633 1.00 0.00 C ATOM 686 CG1 VAL A 49 -6.041 9.510 9.747 1.00 0.00 C ATOM 687 CG2 VAL A 49 -7.892 10.255 8.233 1.00 0.00 C ATOM 0 H VAL A 49 -9.395 11.663 10.221 1.00 0.00 H new ATOM 0 HA VAL A 49 -8.652 8.887 10.470 1.00 0.00 H new ATOM 0 HB VAL A 49 -7.040 11.389 9.822 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.320 9.835 8.997 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.611 9.633 10.741 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.285 8.460 9.585 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -7.145 10.569 7.504 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -8.187 9.225 8.030 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.765 10.903 8.160 1.00 0.00 H new ATOM 697 N SER A 50 -7.287 8.807 12.567 1.00 0.00 N ATOM 698 CA SER A 50 -6.662 8.723 13.882 1.00 0.00 C ATOM 699 C SER A 50 -5.141 8.751 13.763 1.00 0.00 C ATOM 700 O SER A 50 -4.526 7.799 13.281 1.00 0.00 O ATOM 701 CB SER A 50 -7.106 7.448 14.600 1.00 0.00 C ATOM 702 OG SER A 50 -8.273 7.676 15.370 1.00 0.00 O ATOM 0 H SER A 50 -7.371 7.914 12.082 1.00 0.00 H new ATOM 0 HA SER A 50 -6.979 9.588 14.464 1.00 0.00 H new ATOM 0 HB2 SER A 50 -7.297 6.663 13.868 1.00 0.00 H new ATOM 0 HB3 SER A 50 -6.304 7.093 15.247 1.00 0.00 H new ATOM 0 HG SER A 50 -8.537 6.845 15.818 1.00 0.00 H new ATOM 708 N THR A 51 -4.539 9.850 14.207 1.00 0.00 N ATOM 709 CA THR A 51 -3.091 10.004 14.151 1.00 0.00 C ATOM 710 C THR A 51 -2.426 9.414 15.389 1.00 0.00 C ATOM 711 O THR A 51 -1.529 10.022 15.972 1.00 0.00 O ATOM 712 CB THR A 51 -2.688 11.485 14.022 1.00 0.00 C ATOM 713 OG1 THR A 51 -3.479 12.286 14.906 1.00 0.00 O ATOM 714 CG2 THR A 51 -2.865 11.972 12.592 1.00 0.00 C ATOM 0 H THR A 51 -5.032 10.647 14.610 1.00 0.00 H new ATOM 0 HA THR A 51 -2.750 9.464 13.268 1.00 0.00 H new ATOM 0 HB THR A 51 -1.636 11.577 14.292 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.216 13.226 14.819 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.574 13.020 12.526 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.239 11.379 11.926 1.00 0.00 H new ATOM 0 HG23 THR A 51 -3.909 11.866 12.298 1.00 0.00 H new ATOM 722 N GLN A 52 -2.872 8.226 15.786 1.00 0.00 N ATOM 723 CA GLN A 52 -2.319 7.555 16.956 1.00 0.00 C ATOM 724 C GLN A 52 -1.478 6.350 16.546 1.00 0.00 C ATOM 725 O GLN A 52 -0.384 6.139 17.068 1.00 0.00 O ATOM 726 CB GLN A 52 -3.443 7.111 17.894 1.00 0.00 C ATOM 727 CG GLN A 52 -4.040 8.248 18.708 1.00 0.00 C ATOM 728 CD GLN A 52 -5.095 7.773 19.688 1.00 0.00 C ATOM 729 OE1 GLN A 52 -6.281 7.714 19.361 1.00 0.00 O ATOM 730 NE2 GLN A 52 -4.668 7.430 20.898 1.00 0.00 N ATOM 0 H GLN A 52 -3.614 7.709 15.315 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.676 8.263 17.479 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -4.232 6.643 17.306 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.059 6.351 18.574 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.245 8.756 19.254 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.481 8.981 18.032 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -3.676 7.495 21.126 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.332 7.102 21.599 1.00 0.00 H new ATOM 739 N ASP A 53 -1.997 5.564 15.609 1.00 0.00 N ATOM 740 CA ASP A 53 -1.293 4.381 15.128 1.00 0.00 C ATOM 741 C ASP A 53 -0.172 4.768 14.169 1.00 0.00 C ATOM 742 O ASP A 53 -0.393 5.491 13.198 1.00 0.00 O ATOM 743 CB ASP A 53 -2.268 3.429 14.434 1.00 0.00 C ATOM 744 CG ASP A 53 -1.755 2.002 14.395 1.00 0.00 C ATOM 745 OD1 ASP A 53 -2.031 1.247 15.350 1.00 0.00 O ATOM 746 OD2 ASP A 53 -1.077 1.642 13.410 1.00 0.00 O ATOM 0 H ASP A 53 -2.902 5.725 15.168 1.00 0.00 H new ATOM 0 HA ASP A 53 -0.853 3.876 15.988 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -3.226 3.453 14.953 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -2.447 3.776 13.416 1.00 0.00 H new ATOM 751 N SER A 54 1.033 4.282 14.449 1.00 0.00 N ATOM 752 CA SER A 54 2.191 4.581 13.615 1.00 0.00 C ATOM 753 C SER A 54 1.794 4.659 12.144 1.00 0.00 C ATOM 754 O SER A 54 2.173 5.592 11.436 1.00 0.00 O ATOM 755 CB SER A 54 3.273 3.517 13.807 1.00 0.00 C ATOM 756 OG SER A 54 3.708 3.469 15.155 1.00 0.00 O ATOM 0 H SER A 54 1.233 3.679 15.247 1.00 0.00 H new ATOM 0 HA SER A 54 2.587 5.550 13.919 1.00 0.00 H new ATOM 0 HB2 SER A 54 2.885 2.542 13.512 1.00 0.00 H new ATOM 0 HB3 SER A 54 4.120 3.733 13.156 1.00 0.00 H new ATOM 0 HG SER A 54 4.398 2.780 15.252 1.00 0.00 H new ATOM 762 N ARG A 55 1.030 3.671 11.690 1.00 0.00 N ATOM 763 CA ARG A 55 0.582 3.626 10.303 1.00 0.00 C ATOM 764 C ARG A 55 0.306 5.031 9.775 1.00 0.00 C ATOM 765 O ARG A 55 0.871 5.446 8.764 1.00 0.00 O ATOM 766 CB ARG A 55 -0.677 2.766 10.179 1.00 0.00 C ATOM 767 CG ARG A 55 -0.397 1.272 10.182 1.00 0.00 C ATOM 768 CD ARG A 55 -1.461 0.504 9.413 1.00 0.00 C ATOM 769 NE ARG A 55 -2.605 0.163 10.254 1.00 0.00 N ATOM 770 CZ ARG A 55 -3.767 -0.265 9.775 1.00 0.00 C ATOM 771 NH1 ARG A 55 -3.939 -0.404 8.468 1.00 0.00 N ATOM 772 NH2 ARG A 55 -4.762 -0.556 10.604 1.00 0.00 N ATOM 0 H ARG A 55 0.708 2.891 12.263 1.00 0.00 H new ATOM 0 HA ARG A 55 1.377 3.182 9.705 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -1.351 3.002 11.003 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.196 3.028 9.257 1.00 0.00 H new ATOM 0 HG2 ARG A 55 0.581 1.083 9.739 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -0.357 0.910 11.209 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -1.799 1.102 8.566 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -1.026 -0.409 9.005 1.00 0.00 H new ATOM 0 HE ARG A 55 -2.506 0.259 11.265 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -3.177 -0.182 7.827 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -4.833 -0.733 8.103 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -4.634 -0.451 11.611 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -5.654 -0.885 10.234 1.00 0.00 H new ATOM 786 N ILE A 56 -0.567 5.756 10.467 1.00 0.00 N ATOM 787 CA ILE A 56 -0.917 7.113 10.068 1.00 0.00 C ATOM 788 C ILE A 56 -0.052 8.140 10.792 1.00 0.00 C ATOM 789 O ILE A 56 -0.201 8.357 11.994 1.00 0.00 O ATOM 790 CB ILE A 56 -2.400 7.418 10.351 1.00 0.00 C ATOM 791 CG1 ILE A 56 -3.294 6.368 9.688 1.00 0.00 C ATOM 792 CG2 ILE A 56 -2.757 8.813 9.859 1.00 0.00 C ATOM 793 CD1 ILE A 56 -3.541 5.152 10.553 1.00 0.00 C ATOM 0 H ILE A 56 -1.044 5.426 11.306 1.00 0.00 H new ATOM 0 HA ILE A 56 -0.738 7.182 8.995 1.00 0.00 H new ATOM 0 HB ILE A 56 -2.565 7.381 11.428 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -4.251 6.825 9.435 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -2.835 6.051 8.752 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -3.808 9.014 10.066 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -2.139 9.549 10.373 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -2.580 8.876 8.785 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -4.182 4.450 10.020 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.591 4.671 10.785 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.029 5.457 11.479 1.00 0.00 H new ATOM 805 N LYS A 57 0.853 8.770 10.050 1.00 0.00 N ATOM 806 CA LYS A 57 1.741 9.777 10.619 1.00 0.00 C ATOM 807 C LYS A 57 2.045 10.872 9.601 1.00 0.00 C ATOM 808 O LYS A 57 2.368 10.586 8.448 1.00 0.00 O ATOM 809 CB LYS A 57 3.044 9.129 11.091 1.00 0.00 C ATOM 810 CG LYS A 57 4.018 10.110 11.721 1.00 0.00 C ATOM 811 CD LYS A 57 5.252 9.403 12.257 1.00 0.00 C ATOM 812 CE LYS A 57 6.472 10.312 12.224 1.00 0.00 C ATOM 813 NZ LYS A 57 6.468 11.287 13.350 1.00 0.00 N ATOM 0 H LYS A 57 0.991 8.601 9.054 1.00 0.00 H new ATOM 0 HA LYS A 57 1.237 10.229 11.473 1.00 0.00 H new ATOM 0 HB2 LYS A 57 2.810 8.347 11.814 1.00 0.00 H new ATOM 0 HB3 LYS A 57 3.527 8.644 10.243 1.00 0.00 H new ATOM 0 HG2 LYS A 57 4.316 10.854 10.982 1.00 0.00 H new ATOM 0 HG3 LYS A 57 3.524 10.646 12.531 1.00 0.00 H new ATOM 0 HD2 LYS A 57 5.069 9.074 13.280 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.447 8.509 11.665 1.00 0.00 H new ATOM 0 HE2 LYS A 57 7.377 9.707 12.271 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.498 10.851 11.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 7.315 11.888 13.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.617 11.882 13.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 6.469 10.773 14.254 1.00 0.00 H new ATOM 827 N GLN A 58 1.940 12.123 10.036 1.00 0.00 N ATOM 828 CA GLN A 58 2.205 13.260 9.161 1.00 0.00 C ATOM 829 C GLN A 58 3.693 13.364 8.840 1.00 0.00 C ATOM 830 O GLN A 58 4.543 13.105 9.693 1.00 0.00 O ATOM 831 CB GLN A 58 1.720 14.556 9.813 1.00 0.00 C ATOM 832 CG GLN A 58 0.220 14.771 9.694 1.00 0.00 C ATOM 833 CD GLN A 58 -0.163 16.238 9.717 1.00 0.00 C ATOM 834 OE1 GLN A 58 0.568 17.090 9.209 1.00 0.00 O ATOM 835 NE2 GLN A 58 -1.313 16.542 10.306 1.00 0.00 N ATOM 0 H GLN A 58 1.674 12.376 10.988 1.00 0.00 H new ATOM 0 HA GLN A 58 1.661 13.105 8.229 1.00 0.00 H new ATOM 0 HB2 GLN A 58 1.995 14.548 10.868 1.00 0.00 H new ATOM 0 HB3 GLN A 58 2.237 15.399 9.355 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.135 14.321 8.767 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.283 14.255 10.512 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -1.888 15.805 10.714 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.622 17.513 10.351 1.00 0.00 H new ATOM 844 N LEU A 59 4.000 13.745 7.605 1.00 0.00 N ATOM 845 CA LEU A 59 5.386 13.884 7.170 1.00 0.00 C ATOM 846 C LEU A 59 5.716 15.340 6.860 1.00 0.00 C ATOM 847 O LEU A 59 6.530 15.961 7.543 1.00 0.00 O ATOM 848 CB LEU A 59 5.644 13.017 5.937 1.00 0.00 C ATOM 849 CG LEU A 59 4.886 11.690 5.879 1.00 0.00 C ATOM 850 CD1 LEU A 59 4.840 11.163 4.454 1.00 0.00 C ATOM 851 CD2 LEU A 59 5.528 10.668 6.807 1.00 0.00 C ATOM 0 H LEU A 59 3.309 13.963 6.887 1.00 0.00 H new ATOM 0 HA LEU A 59 6.031 13.550 7.983 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.389 13.597 5.050 1.00 0.00 H new ATOM 0 HB3 LEU A 59 6.712 12.805 5.884 1.00 0.00 H new ATOM 0 HG LEU A 59 3.863 11.863 6.213 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.297 10.218 4.433 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.335 11.887 3.815 1.00 0.00 H new ATOM 0 HD13 LEU A 59 5.856 11.006 4.091 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.976 9.730 6.753 1.00 0.00 H new ATOM 0 HD22 LEU A 59 6.561 10.499 6.503 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.508 11.043 7.830 1.00 0.00 H new ATOM 863 N GLU A 60 5.077 15.879 5.826 1.00 0.00 N ATOM 864 CA GLU A 60 5.302 17.264 5.427 1.00 0.00 C ATOM 865 C GLU A 60 4.188 18.168 5.946 1.00 0.00 C ATOM 866 O GLU A 60 3.273 17.712 6.631 1.00 0.00 O ATOM 867 CB GLU A 60 5.393 17.370 3.903 1.00 0.00 C ATOM 868 CG GLU A 60 6.306 16.331 3.274 1.00 0.00 C ATOM 869 CD GLU A 60 7.754 16.780 3.225 1.00 0.00 C ATOM 870 OE1 GLU A 60 7.994 18.003 3.143 1.00 0.00 O ATOM 871 OE2 GLU A 60 8.647 15.908 3.270 1.00 0.00 O ATOM 0 H GLU A 60 4.400 15.378 5.250 1.00 0.00 H new ATOM 0 HA GLU A 60 6.245 17.593 5.864 1.00 0.00 H new ATOM 0 HB2 GLU A 60 4.394 17.267 3.480 1.00 0.00 H new ATOM 0 HB3 GLU A 60 5.751 18.365 3.637 1.00 0.00 H new ATOM 0 HG2 GLU A 60 6.237 15.402 3.839 1.00 0.00 H new ATOM 0 HG3 GLU A 60 5.962 16.115 2.262 1.00 0.00 H new ATOM 878 N ASN A 61 4.273 19.452 5.613 1.00 0.00 N ATOM 879 CA ASN A 61 3.273 20.421 6.046 1.00 0.00 C ATOM 880 C ASN A 61 1.961 20.223 5.292 1.00 0.00 C ATOM 881 O ASN A 61 1.800 20.703 4.171 1.00 0.00 O ATOM 882 CB ASN A 61 3.787 21.846 5.832 1.00 0.00 C ATOM 883 CG ASN A 61 4.682 21.961 4.613 1.00 0.00 C ATOM 884 OD1 ASN A 61 5.908 21.946 4.726 1.00 0.00 O ATOM 885 ND2 ASN A 61 4.071 22.076 3.440 1.00 0.00 N ATOM 0 H ASN A 61 5.024 19.845 5.045 1.00 0.00 H new ATOM 0 HA ASN A 61 3.088 20.264 7.109 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.939 22.522 5.722 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.338 22.167 6.716 1.00 0.00 H new ATOM 0 HD21 ASN A 61 4.621 22.157 2.584 1.00 0.00 H new ATOM 0 HD22 ASN A 61 3.052 22.084 3.394 1.00 0.00 H new ATOM 892 N GLY A 62 1.027 19.513 5.917 1.00 0.00 N ATOM 893 CA GLY A 62 -0.258 19.265 5.290 1.00 0.00 C ATOM 894 C GLY A 62 -0.257 18.008 4.442 1.00 0.00 C ATOM 895 O GLY A 62 -1.071 17.865 3.530 1.00 0.00 O ATOM 0 H GLY A 62 1.137 19.105 6.846 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -1.024 19.179 6.061 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -0.526 20.119 4.668 1.00 0.00 H new ATOM 899 N VAL A 63 0.662 17.095 4.742 1.00 0.00 N ATOM 900 CA VAL A 63 0.767 15.844 4.000 1.00 0.00 C ATOM 901 C VAL A 63 0.678 14.643 4.933 1.00 0.00 C ATOM 902 O VAL A 63 1.477 14.502 5.861 1.00 0.00 O ATOM 903 CB VAL A 63 2.087 15.770 3.209 1.00 0.00 C ATOM 904 CG1 VAL A 63 2.171 14.465 2.431 1.00 0.00 C ATOM 905 CG2 VAL A 63 2.217 16.965 2.277 1.00 0.00 C ATOM 0 H VAL A 63 1.344 17.198 5.493 1.00 0.00 H new ATOM 0 HA VAL A 63 -0.069 15.819 3.301 1.00 0.00 H new ATOM 0 HB VAL A 63 2.916 15.798 3.916 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.110 14.431 1.878 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.127 13.625 3.124 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.337 14.404 1.732 1.00 0.00 H new ATOM 0 HG21 VAL A 63 3.155 16.896 1.726 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.383 16.971 1.575 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.206 17.885 2.861 1.00 0.00 H new ATOM 915 N LEU A 64 -0.298 13.777 4.683 1.00 0.00 N ATOM 916 CA LEU A 64 -0.491 12.584 5.501 1.00 0.00 C ATOM 917 C LEU A 64 0.007 11.339 4.775 1.00 0.00 C ATOM 918 O LEU A 64 -0.007 11.279 3.546 1.00 0.00 O ATOM 919 CB LEU A 64 -1.970 12.422 5.859 1.00 0.00 C ATOM 920 CG LEU A 64 -2.291 11.375 6.925 1.00 0.00 C ATOM 921 CD1 LEU A 64 -2.190 11.981 8.316 1.00 0.00 C ATOM 922 CD2 LEU A 64 -3.677 10.789 6.697 1.00 0.00 C ATOM 0 H LEU A 64 -0.968 13.878 3.921 1.00 0.00 H new ATOM 0 HA LEU A 64 0.088 12.704 6.417 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.349 13.386 6.199 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -2.517 12.167 4.951 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.560 10.570 6.847 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.422 11.221 9.062 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.178 12.352 8.479 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.898 12.805 8.406 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.889 10.045 7.465 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.421 11.584 6.747 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.716 10.317 5.715 1.00 0.00 H new ATOM 934 N GLN A 65 0.445 10.347 5.544 1.00 0.00 N ATOM 935 CA GLN A 65 0.946 9.103 4.973 1.00 0.00 C ATOM 936 C GLN A 65 0.436 7.899 5.760 1.00 0.00 C ATOM 937 O GLN A 65 0.530 7.863 6.987 1.00 0.00 O ATOM 938 CB GLN A 65 2.475 9.105 4.956 1.00 0.00 C ATOM 939 CG GLN A 65 3.082 7.757 4.601 1.00 0.00 C ATOM 940 CD GLN A 65 4.501 7.602 5.111 1.00 0.00 C ATOM 941 OE1 GLN A 65 4.791 7.899 6.270 1.00 0.00 O ATOM 942 NE2 GLN A 65 5.394 7.135 4.247 1.00 0.00 N ATOM 0 H GLN A 65 0.463 10.381 6.563 1.00 0.00 H new ATOM 0 HA GLN A 65 0.578 9.028 3.950 1.00 0.00 H new ATOM 0 HB2 GLN A 65 2.821 9.850 4.239 1.00 0.00 H new ATOM 0 HB3 GLN A 65 2.840 9.412 5.936 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.462 6.963 5.017 1.00 0.00 H new ATOM 0 HG3 GLN A 65 3.074 7.633 3.518 1.00 0.00 H new ATOM 0 HE21 GLN A 65 5.110 6.901 3.296 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.365 7.010 4.534 1.00 0.00 H new ATOM 951 N ILE A 66 -0.103 6.917 5.045 1.00 0.00 N ATOM 952 CA ILE A 66 -0.626 5.713 5.677 1.00 0.00 C ATOM 953 C ILE A 66 -0.046 4.458 5.033 1.00 0.00 C ATOM 954 O ILE A 66 -0.367 4.128 3.892 1.00 0.00 O ATOM 955 CB ILE A 66 -2.163 5.655 5.592 1.00 0.00 C ATOM 956 CG1 ILE A 66 -2.777 6.909 6.218 1.00 0.00 C ATOM 957 CG2 ILE A 66 -2.685 4.403 6.281 1.00 0.00 C ATOM 958 CD1 ILE A 66 -2.978 8.039 5.232 1.00 0.00 C ATOM 0 H ILE A 66 -0.189 6.932 4.029 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.329 5.752 6.725 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.453 5.616 4.542 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -3.738 6.650 6.663 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -2.134 7.254 7.027 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.773 4.377 6.212 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.269 3.520 5.795 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.388 4.414 7.330 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.417 8.895 5.744 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.017 8.325 4.805 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.646 7.712 4.435 1.00 0.00 H new ATOM 970 N ARG A 67 0.810 3.762 5.774 1.00 0.00 N ATOM 971 CA ARG A 67 1.436 2.542 5.276 1.00 0.00 C ATOM 972 C ARG A 67 0.574 1.323 5.589 1.00 0.00 C ATOM 973 O ARG A 67 -0.286 1.367 6.469 1.00 0.00 O ATOM 974 CB ARG A 67 2.826 2.369 5.891 1.00 0.00 C ATOM 975 CG ARG A 67 3.747 3.556 5.657 1.00 0.00 C ATOM 976 CD ARG A 67 4.783 3.683 6.762 1.00 0.00 C ATOM 977 NE ARG A 67 4.171 3.990 8.053 1.00 0.00 N ATOM 978 CZ ARG A 67 4.832 3.958 9.205 1.00 0.00 C ATOM 979 NH1 ARG A 67 6.117 3.636 9.228 1.00 0.00 N ATOM 980 NH2 ARG A 67 4.206 4.251 10.338 1.00 0.00 N ATOM 0 H ARG A 67 1.086 4.022 6.721 1.00 0.00 H new ATOM 0 HA ARG A 67 1.534 2.629 4.194 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.722 2.207 6.964 1.00 0.00 H new ATOM 0 HB3 ARG A 67 3.289 1.473 5.476 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.250 3.444 4.696 1.00 0.00 H new ATOM 0 HG3 ARG A 67 3.157 4.471 5.603 1.00 0.00 H new ATOM 0 HD2 ARG A 67 5.346 2.753 6.840 1.00 0.00 H new ATOM 0 HD3 ARG A 67 5.495 4.466 6.503 1.00 0.00 H new ATOM 0 HE ARG A 67 3.183 4.243 8.071 1.00 0.00 H new ATOM 0 HH11 ARG A 67 6.602 3.412 8.359 1.00 0.00 H new ATOM 0 HH12 ARG A 67 6.621 3.613 10.114 1.00 0.00 H new ATOM 0 HH21 ARG A 67 3.217 4.501 10.324 1.00 0.00 H new ATOM 0 HH22 ARG A 67 4.714 4.226 11.222 1.00 0.00 H new ATOM 994 N TYR A 68 0.810 0.236 4.863 1.00 0.00 N ATOM 995 CA TYR A 68 0.054 -0.995 5.060 1.00 0.00 C ATOM 996 C TYR A 68 -1.425 -0.781 4.756 1.00 0.00 C ATOM 997 O TYR A 68 -2.291 -1.115 5.563 1.00 0.00 O ATOM 998 CB TYR A 68 0.223 -1.497 6.495 1.00 0.00 C ATOM 999 CG TYR A 68 1.667 -1.635 6.923 1.00 0.00 C ATOM 1000 CD1 TYR A 68 2.443 -2.702 6.486 1.00 0.00 C ATOM 1001 CD2 TYR A 68 2.256 -0.697 7.762 1.00 0.00 C ATOM 1002 CE1 TYR A 68 3.762 -2.832 6.875 1.00 0.00 C ATOM 1003 CE2 TYR A 68 3.575 -0.818 8.154 1.00 0.00 C ATOM 1004 CZ TYR A 68 4.324 -1.887 7.709 1.00 0.00 C ATOM 1005 OH TYR A 68 5.638 -2.012 8.097 1.00 0.00 O ATOM 0 H TYR A 68 1.519 0.182 4.132 1.00 0.00 H new ATOM 0 HA TYR A 68 0.443 -1.744 4.371 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -0.284 -0.811 7.173 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -0.270 -2.464 6.593 1.00 0.00 H new ATOM 0 HD1 TYR A 68 2.007 -3.442 5.831 1.00 0.00 H new ATOM 0 HD2 TYR A 68 1.673 0.141 8.114 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.350 -3.669 6.528 1.00 0.00 H new ATOM 0 HE2 TYR A 68 4.017 -0.079 8.806 1.00 0.00 H new ATOM 0 HH TYR A 68 5.879 -1.264 8.682 1.00 0.00 H new ATOM 1015 N ALA A 69 -1.706 -0.221 3.584 1.00 0.00 N ATOM 1016 CA ALA A 69 -3.080 0.037 3.170 1.00 0.00 C ATOM 1017 C ALA A 69 -3.830 -1.267 2.917 1.00 0.00 C ATOM 1018 O ALA A 69 -3.580 -1.958 1.929 1.00 0.00 O ATOM 1019 CB ALA A 69 -3.101 0.910 1.924 1.00 0.00 C ATOM 0 H ALA A 69 -1.000 0.063 2.904 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.584 0.566 3.979 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -4.133 1.094 1.626 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.609 1.859 2.137 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.575 0.402 1.115 1.00 0.00 H new ATOM 1025 N LYS A 70 -4.751 -1.598 3.816 1.00 0.00 N ATOM 1026 CA LYS A 70 -5.539 -2.818 3.690 1.00 0.00 C ATOM 1027 C LYS A 70 -6.909 -2.522 3.090 1.00 0.00 C ATOM 1028 O LYS A 70 -7.318 -1.364 2.992 1.00 0.00 O ATOM 1029 CB LYS A 70 -5.703 -3.486 5.058 1.00 0.00 C ATOM 1030 CG LYS A 70 -4.396 -3.657 5.812 1.00 0.00 C ATOM 1031 CD LYS A 70 -4.614 -3.647 7.315 1.00 0.00 C ATOM 1032 CE LYS A 70 -3.294 -3.657 8.070 1.00 0.00 C ATOM 1033 NZ LYS A 70 -2.500 -4.884 7.784 1.00 0.00 N ATOM 0 H LYS A 70 -4.970 -1.038 4.640 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.009 -3.496 3.021 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.387 -2.891 5.664 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -6.165 -4.464 4.922 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -3.925 -4.595 5.518 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -3.709 -2.856 5.538 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.187 -2.763 7.595 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.206 -4.516 7.604 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -2.713 -2.776 7.796 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.488 -3.591 9.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -1.666 -4.910 8.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.087 -5.725 7.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.192 -4.875 6.791 1.00 0.00 H new ATOM 1047 N LEU A 71 -7.615 -3.574 2.690 1.00 0.00 N ATOM 1048 CA LEU A 71 -8.941 -3.426 2.101 1.00 0.00 C ATOM 1049 C LEU A 71 -9.792 -2.452 2.910 1.00 0.00 C ATOM 1050 O LEU A 71 -10.432 -1.561 2.353 1.00 0.00 O ATOM 1051 CB LEU A 71 -9.639 -4.785 2.020 1.00 0.00 C ATOM 1052 CG LEU A 71 -9.085 -5.763 0.984 1.00 0.00 C ATOM 1053 CD1 LEU A 71 -9.820 -5.613 -0.339 1.00 0.00 C ATOM 1054 CD2 LEU A 71 -7.591 -5.549 0.793 1.00 0.00 C ATOM 0 H LEU A 71 -7.291 -4.539 2.763 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.821 -3.025 1.095 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.586 -5.257 3.001 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.694 -4.617 1.804 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.242 -6.777 1.351 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -9.412 -6.317 -1.064 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -10.880 -5.818 -0.191 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -9.695 -4.596 -0.711 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.214 -6.254 0.052 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.410 -4.530 0.449 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.076 -5.709 1.741 1.00 0.00 H new ATOM 1066 N GLY A 72 -9.791 -2.627 4.228 1.00 0.00 N ATOM 1067 CA GLY A 72 -10.565 -1.755 5.092 1.00 0.00 C ATOM 1068 C GLY A 72 -10.266 -0.289 4.853 1.00 0.00 C ATOM 1069 O GLY A 72 -11.152 0.558 4.965 1.00 0.00 O ATOM 0 H GLY A 72 -9.268 -3.357 4.713 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.627 -1.937 4.929 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -10.355 -2.001 6.133 1.00 0.00 H new ATOM 1073 N ASP A 73 -9.015 0.013 4.525 1.00 0.00 N ATOM 1074 CA ASP A 73 -8.601 1.388 4.270 1.00 0.00 C ATOM 1075 C ASP A 73 -9.474 2.027 3.195 1.00 0.00 C ATOM 1076 O ASP A 73 -9.893 3.178 3.324 1.00 0.00 O ATOM 1077 CB ASP A 73 -7.133 1.430 3.844 1.00 0.00 C ATOM 1078 CG ASP A 73 -6.211 0.813 4.878 1.00 0.00 C ATOM 1079 OD1 ASP A 73 -6.443 -0.354 5.257 1.00 0.00 O ATOM 1080 OD2 ASP A 73 -5.260 1.498 5.309 1.00 0.00 O ATOM 0 H ASP A 73 -8.269 -0.676 4.429 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.719 1.955 5.193 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -7.017 0.902 2.897 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -6.838 2.465 3.670 1.00 0.00 H new ATOM 1085 N THR A 74 -9.744 1.274 2.134 1.00 0.00 N ATOM 1086 CA THR A 74 -10.565 1.768 1.035 1.00 0.00 C ATOM 1087 C THR A 74 -11.690 2.661 1.548 1.00 0.00 C ATOM 1088 O THR A 74 -12.662 2.180 2.128 1.00 0.00 O ATOM 1089 CB THR A 74 -11.174 0.609 0.224 1.00 0.00 C ATOM 1090 OG1 THR A 74 -10.149 -0.316 -0.155 1.00 0.00 O ATOM 1091 CG2 THR A 74 -11.879 1.130 -1.019 1.00 0.00 C ATOM 0 H THR A 74 -9.406 0.319 2.012 1.00 0.00 H new ATOM 0 HA THR A 74 -9.910 2.350 0.387 1.00 0.00 H new ATOM 0 HB THR A 74 -11.906 0.101 0.852 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.992 -0.948 0.577 1.00 0.00 H new ATOM 0 HG21 THR A 74 -12.301 0.293 -1.576 1.00 0.00 H new ATOM 0 HG22 THR A 74 -12.678 1.811 -0.726 1.00 0.00 H new ATOM 0 HG23 THR A 74 -11.164 1.660 -1.648 1.00 0.00 H new ATOM 1099 N GLY A 75 -11.551 3.965 1.328 1.00 0.00 N ATOM 1100 CA GLY A 75 -12.563 4.904 1.774 1.00 0.00 C ATOM 1101 C GLY A 75 -12.453 6.248 1.082 1.00 0.00 C ATOM 1102 O GLY A 75 -11.610 6.433 0.203 1.00 0.00 O ATOM 0 H GLY A 75 -10.756 4.387 0.849 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -13.551 4.483 1.589 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -12.474 5.045 2.851 1.00 0.00 H new ATOM 1106 N ARG A 76 -13.305 7.187 1.477 1.00 0.00 N ATOM 1107 CA ARG A 76 -13.301 8.520 0.886 1.00 0.00 C ATOM 1108 C ARG A 76 -12.377 9.455 1.659 1.00 0.00 C ATOM 1109 O ARG A 76 -12.686 9.864 2.779 1.00 0.00 O ATOM 1110 CB ARG A 76 -14.719 9.094 0.860 1.00 0.00 C ATOM 1111 CG ARG A 76 -15.696 8.267 0.041 1.00 0.00 C ATOM 1112 CD ARG A 76 -17.063 8.930 -0.033 1.00 0.00 C ATOM 1113 NE ARG A 76 -17.914 8.556 1.094 1.00 0.00 N ATOM 1114 CZ ARG A 76 -18.965 9.266 1.488 1.00 0.00 C ATOM 1115 NH1 ARG A 76 -19.293 10.382 0.851 1.00 0.00 N ATOM 1116 NH2 ARG A 76 -19.691 8.860 2.522 1.00 0.00 N ATOM 0 H ARG A 76 -14.007 7.050 2.204 1.00 0.00 H new ATOM 0 HA ARG A 76 -12.932 8.435 -0.136 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -15.089 9.171 1.882 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.685 10.106 0.456 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -15.302 8.129 -0.966 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -15.795 7.276 0.483 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -16.940 10.013 -0.051 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -17.552 8.649 -0.966 1.00 0.00 H new ATOM 0 HE ARG A 76 -17.689 7.703 1.606 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -18.737 10.697 0.056 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -20.101 10.925 1.156 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -19.442 8.002 3.015 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -20.498 9.406 2.824 1.00 0.00 H new ATOM 1130 N TYR A 77 -11.241 9.788 1.056 1.00 0.00 N ATOM 1131 CA TYR A 77 -10.270 10.673 1.689 1.00 0.00 C ATOM 1132 C TYR A 77 -10.511 12.124 1.287 1.00 0.00 C ATOM 1133 O TYR A 77 -10.308 12.504 0.133 1.00 0.00 O ATOM 1134 CB TYR A 77 -8.847 10.256 1.311 1.00 0.00 C ATOM 1135 CG TYR A 77 -8.337 9.067 2.092 1.00 0.00 C ATOM 1136 CD1 TYR A 77 -7.675 9.237 3.301 1.00 0.00 C ATOM 1137 CD2 TYR A 77 -8.517 7.772 1.620 1.00 0.00 C ATOM 1138 CE1 TYR A 77 -7.206 8.153 4.018 1.00 0.00 C ATOM 1139 CE2 TYR A 77 -8.053 6.682 2.331 1.00 0.00 C ATOM 1140 CZ TYR A 77 -7.397 6.878 3.529 1.00 0.00 C ATOM 1141 OH TYR A 77 -6.933 5.795 4.240 1.00 0.00 O ATOM 0 H TYR A 77 -10.970 9.458 0.130 1.00 0.00 H new ATOM 0 HA TYR A 77 -10.391 10.590 2.769 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -8.817 10.021 0.247 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.176 11.100 1.470 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -7.524 10.234 3.688 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -9.028 7.615 0.682 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -6.693 8.304 4.956 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -8.203 5.682 1.951 1.00 0.00 H new ATOM 0 HH TYR A 77 -6.555 5.135 3.622 1.00 0.00 H new ATOM 1151 N THR A 78 -10.946 12.934 2.248 1.00 0.00 N ATOM 1152 CA THR A 78 -11.216 14.343 1.996 1.00 0.00 C ATOM 1153 C THR A 78 -10.400 15.234 2.926 1.00 0.00 C ATOM 1154 O THR A 78 -10.202 14.910 4.097 1.00 0.00 O ATOM 1155 CB THR A 78 -12.711 14.669 2.171 1.00 0.00 C ATOM 1156 OG1 THR A 78 -13.494 13.875 1.274 1.00 0.00 O ATOM 1157 CG2 THR A 78 -12.977 16.145 1.914 1.00 0.00 C ATOM 0 H THR A 78 -11.119 12.637 3.208 1.00 0.00 H new ATOM 0 HA THR A 78 -10.928 14.540 0.963 1.00 0.00 H new ATOM 0 HB THR A 78 -12.992 14.439 3.199 1.00 0.00 H new ATOM 0 HG1 THR A 78 -14.443 14.087 1.393 1.00 0.00 H new ATOM 0 HG21 THR A 78 -14.039 16.351 2.044 1.00 0.00 H new ATOM 0 HG22 THR A 78 -12.402 16.746 2.618 1.00 0.00 H new ATOM 0 HG23 THR A 78 -12.680 16.396 0.896 1.00 0.00 H new ATOM 1165 N CYS A 79 -9.930 16.359 2.398 1.00 0.00 N ATOM 1166 CA CYS A 79 -9.136 17.298 3.181 1.00 0.00 C ATOM 1167 C CYS A 79 -10.015 18.400 3.766 1.00 0.00 C ATOM 1168 O CYS A 79 -11.062 18.733 3.209 1.00 0.00 O ATOM 1169 CB CYS A 79 -8.036 17.915 2.315 1.00 0.00 C ATOM 1170 SG CYS A 79 -6.819 18.899 3.247 1.00 0.00 S ATOM 0 H CYS A 79 -10.085 16.643 1.431 1.00 0.00 H new ATOM 0 HA CYS A 79 -8.677 16.748 4.003 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -7.514 17.117 1.787 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -8.497 18.550 1.558 1.00 0.00 H new ATOM 1175 N ILE A 80 -9.583 18.960 4.890 1.00 0.00 N ATOM 1176 CA ILE A 80 -10.330 20.024 5.549 1.00 0.00 C ATOM 1177 C ILE A 80 -9.400 21.132 6.032 1.00 0.00 C ATOM 1178 O ILE A 80 -8.336 20.863 6.590 1.00 0.00 O ATOM 1179 CB ILE A 80 -11.137 19.488 6.746 1.00 0.00 C ATOM 1180 CG1 ILE A 80 -12.013 18.311 6.313 1.00 0.00 C ATOM 1181 CG2 ILE A 80 -11.988 20.595 7.350 1.00 0.00 C ATOM 1182 CD1 ILE A 80 -11.272 16.993 6.260 1.00 0.00 C ATOM 0 H ILE A 80 -8.719 18.695 5.364 1.00 0.00 H new ATOM 0 HA ILE A 80 -11.020 20.429 4.809 1.00 0.00 H new ATOM 0 HB ILE A 80 -10.440 19.137 7.507 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.852 18.220 7.003 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -12.432 18.523 5.329 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -12.552 20.200 8.195 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -11.343 21.405 7.691 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -12.679 20.974 6.597 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.955 16.204 5.946 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -10.450 17.066 5.548 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.876 16.758 7.248 1.00 0.00 H new ATOM 1194 N ALA A 81 -9.809 22.377 5.815 1.00 0.00 N ATOM 1195 CA ALA A 81 -9.014 23.526 6.231 1.00 0.00 C ATOM 1196 C ALA A 81 -9.852 24.509 7.041 1.00 0.00 C ATOM 1197 O ALA A 81 -10.637 25.276 6.483 1.00 0.00 O ATOM 1198 CB ALA A 81 -8.410 24.218 5.018 1.00 0.00 C ATOM 0 H ALA A 81 -10.687 22.616 5.353 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.207 23.166 6.869 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.819 25.074 5.344 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -7.769 23.518 4.481 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.208 24.558 4.358 1.00 0.00 H new ATOM 1204 N SER A 82 -9.681 24.481 8.358 1.00 0.00 N ATOM 1205 CA SER A 82 -10.426 25.367 9.245 1.00 0.00 C ATOM 1206 C SER A 82 -9.713 26.708 9.397 1.00 0.00 C ATOM 1207 O SER A 82 -8.504 26.760 9.624 1.00 0.00 O ATOM 1208 CB SER A 82 -10.608 24.715 10.617 1.00 0.00 C ATOM 1209 OG SER A 82 -10.922 25.683 11.604 1.00 0.00 O ATOM 0 H SER A 82 -9.033 23.854 8.835 1.00 0.00 H new ATOM 0 HA SER A 82 -11.406 25.544 8.802 1.00 0.00 H new ATOM 0 HB2 SER A 82 -11.403 23.971 10.567 1.00 0.00 H new ATOM 0 HB3 SER A 82 -9.696 24.188 10.897 1.00 0.00 H new ATOM 0 HG SER A 82 -11.035 25.241 12.471 1.00 0.00 H new ATOM 1215 N THR A 83 -10.472 27.792 9.271 1.00 0.00 N ATOM 1216 CA THR A 83 -9.915 29.133 9.392 1.00 0.00 C ATOM 1217 C THR A 83 -10.911 30.085 10.044 1.00 0.00 C ATOM 1218 O THR A 83 -12.115 29.831 10.082 1.00 0.00 O ATOM 1219 CB THR A 83 -9.505 29.698 8.019 1.00 0.00 C ATOM 1220 OG1 THR A 83 -10.341 29.149 6.994 1.00 0.00 O ATOM 1221 CG2 THR A 83 -8.048 29.381 7.717 1.00 0.00 C ATOM 0 H THR A 83 -11.475 27.767 9.085 1.00 0.00 H new ATOM 0 HA THR A 83 -9.029 29.051 10.022 1.00 0.00 H new ATOM 0 HB THR A 83 -9.627 30.781 8.045 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.258 29.065 7.330 1.00 0.00 H new ATOM 0 HG21 THR A 83 -7.781 29.790 6.742 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.413 29.825 8.483 1.00 0.00 H new ATOM 0 HG23 THR A 83 -7.905 28.300 7.709 1.00 0.00 H new ATOM 1229 N PRO A 84 -10.400 31.209 10.569 1.00 0.00 N ATOM 1230 CA PRO A 84 -11.229 32.223 11.228 1.00 0.00 C ATOM 1231 C PRO A 84 -12.121 32.972 10.244 1.00 0.00 C ATOM 1232 O PRO A 84 -12.841 33.895 10.622 1.00 0.00 O ATOM 1233 CB PRO A 84 -10.202 33.173 11.848 1.00 0.00 C ATOM 1234 CG PRO A 84 -8.982 33.012 11.008 1.00 0.00 C ATOM 1235 CD PRO A 84 -8.974 31.576 10.559 1.00 0.00 C ATOM 0 HA PRO A 84 -11.913 31.781 11.952 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -10.558 34.203 11.836 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -10.003 32.917 12.889 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -9.005 33.688 10.153 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -8.083 33.248 11.577 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -8.538 31.468 9.566 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -8.392 30.947 11.233 1.00 0.00 H new ATOM 1243 N SER A 85 -12.068 32.567 8.978 1.00 0.00 N ATOM 1244 CA SER A 85 -12.869 33.203 7.939 1.00 0.00 C ATOM 1245 C SER A 85 -13.846 32.207 7.321 1.00 0.00 C ATOM 1246 O SER A 85 -14.977 32.557 6.986 1.00 0.00 O ATOM 1247 CB SER A 85 -11.963 33.786 6.852 1.00 0.00 C ATOM 1248 OG SER A 85 -11.599 32.796 5.906 1.00 0.00 O ATOM 0 H SER A 85 -11.479 31.802 8.648 1.00 0.00 H new ATOM 0 HA SER A 85 -13.440 34.010 8.398 1.00 0.00 H new ATOM 0 HB2 SER A 85 -12.476 34.605 6.347 1.00 0.00 H new ATOM 0 HB3 SER A 85 -11.066 34.205 7.308 1.00 0.00 H new ATOM 0 HG SER A 85 -10.900 33.148 5.316 1.00 0.00 H new ATOM 1254 N GLY A 86 -13.400 30.963 7.174 1.00 0.00 N ATOM 1255 CA GLY A 86 -14.247 29.935 6.597 1.00 0.00 C ATOM 1256 C GLY A 86 -13.596 28.566 6.624 1.00 0.00 C ATOM 1257 O GLY A 86 -12.733 28.299 7.458 1.00 0.00 O ATOM 0 H GLY A 86 -12.468 30.649 7.444 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -15.190 29.897 7.143 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.485 30.201 5.567 1.00 0.00 H new ATOM 1261 N GLU A 87 -14.013 27.697 5.708 1.00 0.00 N ATOM 1262 CA GLU A 87 -13.466 26.347 5.633 1.00 0.00 C ATOM 1263 C GLU A 87 -13.725 25.731 4.261 1.00 0.00 C ATOM 1264 O GLU A 87 -14.820 25.848 3.713 1.00 0.00 O ATOM 1265 CB GLU A 87 -14.075 25.464 6.724 1.00 0.00 C ATOM 1266 CG GLU A 87 -13.335 24.154 6.931 1.00 0.00 C ATOM 1267 CD GLU A 87 -14.219 23.069 7.515 1.00 0.00 C ATOM 1268 OE1 GLU A 87 -15.347 22.890 7.011 1.00 0.00 O ATOM 1269 OE2 GLU A 87 -13.784 22.401 8.476 1.00 0.00 O ATOM 0 H GLU A 87 -14.726 27.903 5.009 1.00 0.00 H new ATOM 0 HA GLU A 87 -12.389 26.410 5.787 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -14.086 26.017 7.663 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -15.113 25.249 6.468 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -12.932 23.814 5.977 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -12.486 24.322 7.594 1.00 0.00 H new ATOM 1276 N ALA A 88 -12.708 25.075 3.712 1.00 0.00 N ATOM 1277 CA ALA A 88 -12.825 24.439 2.406 1.00 0.00 C ATOM 1278 C ALA A 88 -12.393 22.977 2.466 1.00 0.00 C ATOM 1279 O ALA A 88 -11.853 22.519 3.473 1.00 0.00 O ATOM 1280 CB ALA A 88 -11.998 25.194 1.376 1.00 0.00 C ATOM 0 H ALA A 88 -11.794 24.970 4.152 1.00 0.00 H new ATOM 0 HA ALA A 88 -13.873 24.469 2.107 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -12.094 24.708 0.405 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -12.355 26.221 1.305 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -10.951 25.194 1.679 1.00 0.00 H new ATOM 1286 N THR A 89 -12.635 22.249 1.381 1.00 0.00 N ATOM 1287 CA THR A 89 -12.273 20.839 1.311 1.00 0.00 C ATOM 1288 C THR A 89 -11.959 20.422 -0.122 1.00 0.00 C ATOM 1289 O THR A 89 -12.367 21.086 -1.074 1.00 0.00 O ATOM 1290 CB THR A 89 -13.399 19.942 1.860 1.00 0.00 C ATOM 1291 OG1 THR A 89 -14.508 19.938 0.954 1.00 0.00 O ATOM 1292 CG2 THR A 89 -13.856 20.424 3.228 1.00 0.00 C ATOM 0 H THR A 89 -13.080 22.613 0.538 1.00 0.00 H new ATOM 0 HA THR A 89 -11.383 20.710 1.927 1.00 0.00 H new ATOM 0 HB THR A 89 -13.010 18.929 1.961 1.00 0.00 H new ATOM 0 HG1 THR A 89 -15.219 19.364 1.309 1.00 0.00 H new ATOM 0 HG21 THR A 89 -14.651 19.775 3.595 1.00 0.00 H new ATOM 0 HG22 THR A 89 -13.016 20.397 3.922 1.00 0.00 H new ATOM 0 HG23 THR A 89 -14.229 21.445 3.148 1.00 0.00 H new ATOM 1300 N TRP A 90 -11.234 19.319 -0.266 1.00 0.00 N ATOM 1301 CA TRP A 90 -10.866 18.813 -1.584 1.00 0.00 C ATOM 1302 C TRP A 90 -11.415 17.407 -1.800 1.00 0.00 C ATOM 1303 O TRP A 90 -11.702 16.689 -0.843 1.00 0.00 O ATOM 1304 CB TRP A 90 -9.345 18.812 -1.746 1.00 0.00 C ATOM 1305 CG TRP A 90 -8.898 18.521 -3.147 1.00 0.00 C ATOM 1306 CD1 TRP A 90 -8.516 17.311 -3.651 1.00 0.00 C ATOM 1307 CD2 TRP A 90 -8.784 19.460 -4.222 1.00 0.00 C ATOM 1308 NE1 TRP A 90 -8.171 17.440 -4.974 1.00 0.00 N ATOM 1309 CE2 TRP A 90 -8.328 18.748 -5.349 1.00 0.00 C ATOM 1310 CE3 TRP A 90 -9.025 20.831 -4.343 1.00 0.00 C ATOM 1311 CZ2 TRP A 90 -8.108 19.364 -6.578 1.00 0.00 C ATOM 1312 CZ3 TRP A 90 -8.806 21.440 -5.564 1.00 0.00 C ATOM 1313 CH2 TRP A 90 -8.352 20.707 -6.669 1.00 0.00 C ATOM 0 H TRP A 90 -10.889 18.758 0.513 1.00 0.00 H new ATOM 0 HA TRP A 90 -11.303 19.472 -2.334 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -8.954 19.783 -1.441 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -8.915 18.070 -1.073 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -8.489 16.388 -3.091 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -7.850 16.684 -5.579 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -9.376 21.404 -3.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.757 18.801 -7.430 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -8.988 22.499 -5.669 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -8.192 21.212 -7.610 1.00 0.00 H new ATOM 1324 N SER A 91 -11.558 17.020 -3.064 1.00 0.00 N ATOM 1325 CA SER A 91 -12.075 15.700 -3.405 1.00 0.00 C ATOM 1326 C SER A 91 -10.935 14.727 -3.691 1.00 0.00 C ATOM 1327 O SER A 91 -10.025 15.030 -4.462 1.00 0.00 O ATOM 1328 CB SER A 91 -13.001 15.791 -4.619 1.00 0.00 C ATOM 1329 OG SER A 91 -12.278 16.134 -5.788 1.00 0.00 O ATOM 0 H SER A 91 -11.323 17.602 -3.868 1.00 0.00 H new ATOM 0 HA SER A 91 -12.642 15.327 -2.552 1.00 0.00 H new ATOM 0 HB2 SER A 91 -13.506 14.837 -4.767 1.00 0.00 H new ATOM 0 HB3 SER A 91 -13.775 16.536 -4.435 1.00 0.00 H new ATOM 0 HG SER A 91 -11.355 15.814 -5.708 1.00 0.00 H new ATOM 1335 N ALA A 92 -10.994 13.557 -3.065 1.00 0.00 N ATOM 1336 CA ALA A 92 -9.969 12.537 -3.253 1.00 0.00 C ATOM 1337 C ALA A 92 -10.429 11.189 -2.711 1.00 0.00 C ATOM 1338 O ALA A 92 -11.158 11.123 -1.721 1.00 0.00 O ATOM 1339 CB ALA A 92 -8.671 12.964 -2.582 1.00 0.00 C ATOM 0 H ALA A 92 -11.741 13.291 -2.423 1.00 0.00 H new ATOM 0 HA ALA A 92 -9.793 12.427 -4.323 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.914 12.194 -2.730 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -8.326 13.900 -3.020 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -8.842 13.104 -1.515 1.00 0.00 H new ATOM 1345 N TYR A 93 -10.000 10.116 -3.365 1.00 0.00 N ATOM 1346 CA TYR A 93 -10.371 8.768 -2.949 1.00 0.00 C ATOM 1347 C TYR A 93 -9.224 7.790 -3.185 1.00 0.00 C ATOM 1348 O TYR A 93 -8.489 7.903 -4.167 1.00 0.00 O ATOM 1349 CB TYR A 93 -11.616 8.303 -3.706 1.00 0.00 C ATOM 1350 CG TYR A 93 -12.194 7.008 -3.183 1.00 0.00 C ATOM 1351 CD1 TYR A 93 -11.499 5.812 -3.311 1.00 0.00 C ATOM 1352 CD2 TYR A 93 -13.436 6.980 -2.559 1.00 0.00 C ATOM 1353 CE1 TYR A 93 -12.024 4.626 -2.836 1.00 0.00 C ATOM 1354 CE2 TYR A 93 -13.968 5.799 -2.079 1.00 0.00 C ATOM 1355 CZ TYR A 93 -13.259 4.625 -2.220 1.00 0.00 C ATOM 1356 OH TYR A 93 -13.784 3.446 -1.743 1.00 0.00 O ATOM 0 H TYR A 93 -9.395 10.153 -4.185 1.00 0.00 H new ATOM 0 HA TYR A 93 -10.590 8.792 -1.882 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -12.378 9.081 -3.648 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -11.365 8.180 -4.760 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -10.531 5.809 -3.790 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -13.995 7.898 -2.448 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -11.471 3.705 -2.946 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -14.934 5.795 -1.596 1.00 0.00 H new ATOM 0 HH TYR A 93 -13.782 3.460 -0.763 1.00 0.00 H new ATOM 1366 N ILE A 94 -9.077 6.830 -2.278 1.00 0.00 N ATOM 1367 CA ILE A 94 -8.022 5.831 -2.388 1.00 0.00 C ATOM 1368 C ILE A 94 -8.597 4.419 -2.355 1.00 0.00 C ATOM 1369 O ILE A 94 -9.182 3.999 -1.358 1.00 0.00 O ATOM 1370 CB ILE A 94 -6.988 5.978 -1.256 1.00 0.00 C ATOM 1371 CG1 ILE A 94 -6.388 7.386 -1.264 1.00 0.00 C ATOM 1372 CG2 ILE A 94 -5.894 4.930 -1.399 1.00 0.00 C ATOM 1373 CD1 ILE A 94 -5.818 7.792 -2.605 1.00 0.00 C ATOM 0 H ILE A 94 -9.675 6.723 -1.459 1.00 0.00 H new ATOM 0 HA ILE A 94 -7.528 5.998 -3.345 1.00 0.00 H new ATOM 0 HB ILE A 94 -7.491 5.823 -0.302 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -7.157 8.102 -0.973 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -5.601 7.441 -0.512 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -5.171 5.047 -0.592 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -6.335 3.934 -1.350 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -5.391 5.057 -2.358 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -5.410 8.801 -2.537 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -5.026 7.099 -2.889 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -6.606 7.770 -3.357 1.00 0.00 H new ATOM 1385 N GLU A 95 -8.423 3.690 -3.454 1.00 0.00 N ATOM 1386 CA GLU A 95 -8.924 2.324 -3.550 1.00 0.00 C ATOM 1387 C GLU A 95 -7.806 1.315 -3.302 1.00 0.00 C ATOM 1388 O GLU A 95 -6.711 1.438 -3.852 1.00 0.00 O ATOM 1389 CB GLU A 95 -9.549 2.081 -4.926 1.00 0.00 C ATOM 1390 CG GLU A 95 -10.285 0.757 -5.035 1.00 0.00 C ATOM 1391 CD GLU A 95 -11.606 0.759 -4.291 1.00 0.00 C ATOM 1392 OE1 GLU A 95 -12.246 1.829 -4.222 1.00 0.00 O ATOM 1393 OE2 GLU A 95 -11.999 -0.309 -3.777 1.00 0.00 O ATOM 0 H GLU A 95 -7.940 4.022 -4.289 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.687 2.190 -2.783 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.242 2.892 -5.149 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -8.765 2.115 -5.683 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -10.465 0.532 -6.086 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.653 -0.039 -4.642 1.00 0.00 H new ATOM 1400 N VAL A 96 -8.089 0.319 -2.470 1.00 0.00 N ATOM 1401 CA VAL A 96 -7.108 -0.712 -2.149 1.00 0.00 C ATOM 1402 C VAL A 96 -7.462 -2.034 -2.820 1.00 0.00 C ATOM 1403 O VAL A 96 -8.476 -2.652 -2.498 1.00 0.00 O ATOM 1404 CB VAL A 96 -7.003 -0.932 -0.628 1.00 0.00 C ATOM 1405 CG1 VAL A 96 -6.076 -2.098 -0.320 1.00 0.00 C ATOM 1406 CG2 VAL A 96 -6.523 0.337 0.061 1.00 0.00 C ATOM 0 H VAL A 96 -8.990 0.203 -2.005 1.00 0.00 H new ATOM 0 HA VAL A 96 -6.146 -0.363 -2.525 1.00 0.00 H new ATOM 0 HB VAL A 96 -7.994 -1.175 -0.244 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -6.014 -2.238 0.759 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.466 -3.005 -0.782 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.083 -1.887 -0.716 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -6.454 0.164 1.135 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -5.542 0.612 -0.326 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.229 1.145 -0.132 1.00 0.00 H new ATOM 1416 N GLN A 97 -6.617 -2.463 -3.752 1.00 0.00 N ATOM 1417 CA GLN A 97 -6.841 -3.713 -4.469 1.00 0.00 C ATOM 1418 C GLN A 97 -5.890 -4.799 -3.977 1.00 0.00 C ATOM 1419 O GLN A 97 -4.712 -4.542 -3.732 1.00 0.00 O ATOM 1420 CB GLN A 97 -6.660 -3.503 -5.973 1.00 0.00 C ATOM 1421 CG GLN A 97 -7.299 -2.224 -6.490 1.00 0.00 C ATOM 1422 CD GLN A 97 -8.756 -2.411 -6.865 1.00 0.00 C ATOM 1423 OE1 GLN A 97 -9.359 -3.442 -6.567 1.00 0.00 O ATOM 1424 NE2 GLN A 97 -9.331 -1.411 -7.524 1.00 0.00 N ATOM 0 H GLN A 97 -5.771 -1.964 -4.028 1.00 0.00 H new ATOM 0 HA GLN A 97 -7.864 -4.036 -4.276 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -5.595 -3.486 -6.203 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -7.088 -4.353 -6.504 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -7.220 -1.449 -5.728 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -6.746 -1.872 -7.361 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -8.794 -0.574 -7.751 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -10.310 -1.480 -7.803 1.00 0.00 H new ATOM 1433 N GLU A 98 -6.411 -6.014 -3.835 1.00 0.00 N ATOM 1434 CA GLU A 98 -5.607 -7.139 -3.371 1.00 0.00 C ATOM 1435 C GLU A 98 -4.952 -7.861 -4.545 1.00 0.00 C ATOM 1436 O GLU A 98 -5.541 -7.984 -5.619 1.00 0.00 O ATOM 1437 CB GLU A 98 -6.473 -8.119 -2.575 1.00 0.00 C ATOM 1438 CG GLU A 98 -5.674 -9.033 -1.661 1.00 0.00 C ATOM 1439 CD GLU A 98 -6.518 -10.141 -1.062 1.00 0.00 C ATOM 1440 OE1 GLU A 98 -7.281 -10.779 -1.818 1.00 0.00 O ATOM 1441 OE2 GLU A 98 -6.415 -10.372 0.161 1.00 0.00 O ATOM 0 H GLU A 98 -7.385 -6.244 -4.034 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.822 -6.749 -2.723 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -7.188 -7.555 -1.976 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -7.050 -8.729 -3.270 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.850 -9.472 -2.223 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -5.233 -8.442 -0.858 1.00 0.00 H new ATOM 1448 N PHE A 99 -3.729 -8.334 -4.332 1.00 0.00 N ATOM 1449 CA PHE A 99 -2.991 -9.042 -5.373 1.00 0.00 C ATOM 1450 C PHE A 99 -2.350 -10.310 -4.818 1.00 0.00 C ATOM 1451 O PHE A 99 -2.173 -10.451 -3.608 1.00 0.00 O ATOM 1452 CB PHE A 99 -1.916 -8.134 -5.973 1.00 0.00 C ATOM 1453 CG PHE A 99 -0.639 -8.114 -5.183 1.00 0.00 C ATOM 1454 CD1 PHE A 99 0.329 -9.085 -5.381 1.00 0.00 C ATOM 1455 CD2 PHE A 99 -0.406 -7.123 -4.243 1.00 0.00 C ATOM 1456 CE1 PHE A 99 1.506 -9.070 -4.657 1.00 0.00 C ATOM 1457 CE2 PHE A 99 0.769 -7.102 -3.515 1.00 0.00 C ATOM 1458 CZ PHE A 99 1.725 -8.077 -3.722 1.00 0.00 C ATOM 0 H PHE A 99 -3.228 -8.240 -3.449 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.696 -9.325 -6.155 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.700 -8.463 -6.989 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.307 -7.119 -6.043 1.00 0.00 H new ATOM 0 HD1 PHE A 99 0.162 -9.864 -6.110 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -1.151 -6.359 -4.077 1.00 0.00 H new ATOM 0 HE1 PHE A 99 2.253 -9.833 -4.822 1.00 0.00 H new ATOM 0 HE2 PHE A 99 0.939 -6.324 -2.785 1.00 0.00 H new ATOM 0 HZ PHE A 99 2.643 -8.063 -3.153 1.00 0.00 H new ATOM 1468 N GLY A 100 -2.004 -11.231 -5.712 1.00 0.00 N ATOM 1469 CA GLY A 100 -1.386 -12.476 -5.293 1.00 0.00 C ATOM 1470 C GLY A 100 -2.227 -13.229 -4.281 1.00 0.00 C ATOM 1471 O GLY A 100 -1.708 -13.740 -3.289 1.00 0.00 O ATOM 0 H GLY A 100 -2.140 -11.138 -6.719 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -1.221 -13.108 -6.166 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -0.407 -12.265 -4.862 1.00 0.00 H new ATOM 1475 N VAL A 101 -3.531 -13.297 -4.531 1.00 0.00 N ATOM 1476 CA VAL A 101 -4.446 -13.992 -3.634 1.00 0.00 C ATOM 1477 C VAL A 101 -4.063 -15.460 -3.488 1.00 0.00 C ATOM 1478 O VAL A 101 -3.975 -16.205 -4.464 1.00 0.00 O ATOM 1479 CB VAL A 101 -5.900 -13.900 -4.134 1.00 0.00 C ATOM 1480 CG1 VAL A 101 -6.851 -14.536 -3.131 1.00 0.00 C ATOM 1481 CG2 VAL A 101 -6.282 -12.451 -4.397 1.00 0.00 C ATOM 0 H VAL A 101 -3.977 -12.879 -5.348 1.00 0.00 H new ATOM 0 HA VAL A 101 -4.371 -13.501 -2.663 1.00 0.00 H new ATOM 0 HB VAL A 101 -5.978 -14.449 -5.072 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -7.873 -14.461 -3.501 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -6.589 -15.586 -2.996 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -6.772 -14.017 -2.176 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -7.312 -12.405 -4.750 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -6.188 -11.877 -3.475 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -5.620 -12.032 -5.155 1.00 0.00 H new ATOM 1491 N PRO A 102 -3.829 -15.889 -2.238 1.00 0.00 N ATOM 1492 CA PRO A 102 -3.452 -17.272 -1.934 1.00 0.00 C ATOM 1493 C PRO A 102 -4.601 -18.249 -2.159 1.00 0.00 C ATOM 1494 O PRO A 102 -5.733 -17.842 -2.421 1.00 0.00 O ATOM 1495 CB PRO A 102 -3.078 -17.220 -0.450 1.00 0.00 C ATOM 1496 CG PRO A 102 -3.839 -16.059 0.091 1.00 0.00 C ATOM 1497 CD PRO A 102 -3.916 -15.056 -1.027 1.00 0.00 C ATOM 0 HA PRO A 102 -2.647 -17.626 -2.579 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -3.350 -18.144 0.060 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -2.004 -17.087 -0.317 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -4.835 -16.362 0.413 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -3.338 -15.635 0.961 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -4.846 -14.489 -0.995 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -3.101 -14.334 -0.976 1.00 0.00 H new ATOM 1505 N VAL A 103 -4.304 -19.541 -2.055 1.00 0.00 N ATOM 1506 CA VAL A 103 -5.312 -20.576 -2.245 1.00 0.00 C ATOM 1507 C VAL A 103 -5.420 -21.472 -1.017 1.00 0.00 C ATOM 1508 O VAL A 103 -4.685 -22.450 -0.884 1.00 0.00 O ATOM 1509 CB VAL A 103 -4.997 -21.447 -3.476 1.00 0.00 C ATOM 1510 CG1 VAL A 103 -6.045 -22.536 -3.642 1.00 0.00 C ATOM 1511 CG2 VAL A 103 -4.907 -20.587 -4.728 1.00 0.00 C ATOM 0 H VAL A 103 -3.372 -19.895 -1.840 1.00 0.00 H new ATOM 0 HA VAL A 103 -6.262 -20.066 -2.403 1.00 0.00 H new ATOM 0 HB VAL A 103 -4.030 -21.927 -3.322 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.806 -23.141 -4.517 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.056 -23.169 -2.755 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.026 -22.080 -3.774 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.684 -21.219 -5.588 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.857 -20.078 -4.889 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -4.115 -19.848 -4.606 1.00 0.00 H new ATOM 1521 N GLN A 104 -6.340 -21.130 -0.120 1.00 0.00 N ATOM 1522 CA GLN A 104 -6.543 -21.904 1.098 1.00 0.00 C ATOM 1523 C GLN A 104 -7.923 -22.553 1.107 1.00 0.00 C ATOM 1524 O GLN A 104 -8.905 -21.987 0.626 1.00 0.00 O ATOM 1525 CB GLN A 104 -6.379 -21.010 2.329 1.00 0.00 C ATOM 1526 CG GLN A 104 -7.319 -19.815 2.343 1.00 0.00 C ATOM 1527 CD GLN A 104 -7.126 -18.935 3.562 1.00 0.00 C ATOM 1528 OE1 GLN A 104 -6.493 -19.338 4.538 1.00 0.00 O ATOM 1529 NE2 GLN A 104 -7.672 -17.726 3.512 1.00 0.00 N ATOM 0 H GLN A 104 -6.956 -20.322 -0.214 1.00 0.00 H new ATOM 0 HA GLN A 104 -5.791 -22.692 1.127 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -6.549 -21.606 3.226 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -5.350 -20.653 2.374 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -7.160 -19.222 1.443 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -8.350 -20.168 2.314 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -8.188 -17.434 2.682 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -7.575 -17.090 4.303 1.00 0.00 H new ATOM 1538 N PRO A 105 -8.002 -23.769 1.667 1.00 0.00 N ATOM 1539 CA PRO A 105 -9.257 -24.522 1.752 1.00 0.00 C ATOM 1540 C PRO A 105 -10.241 -23.898 2.736 1.00 0.00 C ATOM 1541 O PRO A 105 -9.872 -23.105 3.602 1.00 0.00 O ATOM 1542 CB PRO A 105 -8.811 -25.901 2.244 1.00 0.00 C ATOM 1543 CG PRO A 105 -7.536 -25.649 2.972 1.00 0.00 C ATOM 1544 CD PRO A 105 -6.872 -24.504 2.260 1.00 0.00 C ATOM 0 HA PRO A 105 -9.784 -24.545 0.798 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -9.559 -26.349 2.899 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -8.662 -26.589 1.412 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.725 -25.402 4.017 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -6.901 -26.535 2.964 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -6.303 -23.879 2.948 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -6.176 -24.854 1.498 1.00 0.00 H new ATOM 1552 N PRO A 106 -11.525 -24.263 2.602 1.00 0.00 N ATOM 1553 CA PRO A 106 -12.588 -23.752 3.471 1.00 0.00 C ATOM 1554 C PRO A 106 -12.482 -24.288 4.895 1.00 0.00 C ATOM 1555 O PRO A 106 -11.556 -25.031 5.220 1.00 0.00 O ATOM 1556 CB PRO A 106 -13.868 -24.259 2.802 1.00 0.00 C ATOM 1557 CG PRO A 106 -13.445 -25.471 2.046 1.00 0.00 C ATOM 1558 CD PRO A 106 -12.037 -25.205 1.592 1.00 0.00 C ATOM 0 HA PRO A 106 -12.545 -22.668 3.573 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -14.632 -24.500 3.541 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -14.293 -23.506 2.138 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -13.491 -26.359 2.676 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -14.102 -25.649 1.195 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -11.446 -26.120 1.560 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -12.012 -24.774 0.591 1.00 0.00 H new ATOM 1566 N ARG A 107 -13.436 -23.908 5.738 1.00 0.00 N ATOM 1567 CA ARG A 107 -13.449 -24.351 7.127 1.00 0.00 C ATOM 1568 C ARG A 107 -14.501 -25.435 7.342 1.00 0.00 C ATOM 1569 O ARG A 107 -15.608 -25.376 6.806 1.00 0.00 O ATOM 1570 CB ARG A 107 -13.721 -23.169 8.059 1.00 0.00 C ATOM 1571 CG ARG A 107 -14.523 -23.541 9.296 1.00 0.00 C ATOM 1572 CD ARG A 107 -14.507 -22.423 10.326 1.00 0.00 C ATOM 1573 NE ARG A 107 -15.344 -22.733 11.483 1.00 0.00 N ATOM 1574 CZ ARG A 107 -14.949 -23.501 12.491 1.00 0.00 C ATOM 1575 NH1 ARG A 107 -13.735 -24.035 12.486 1.00 0.00 N ATOM 1576 NH2 ARG A 107 -15.768 -23.737 13.508 1.00 0.00 N ATOM 0 H ARG A 107 -14.210 -23.294 5.484 1.00 0.00 H new ATOM 0 HA ARG A 107 -12.469 -24.769 7.358 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -12.770 -22.736 8.369 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -14.258 -22.398 7.507 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -15.552 -23.761 9.012 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -14.113 -24.450 9.737 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -13.483 -22.248 10.656 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -14.855 -21.499 9.864 1.00 0.00 H new ATOM 0 HE ARG A 107 -16.284 -22.337 11.518 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -13.102 -23.856 11.706 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -13.434 -24.625 13.262 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -16.702 -23.328 13.516 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -15.463 -24.327 14.282 1.00 0.00 H new ATOM 1590 N PRO A 108 -14.150 -26.450 8.146 1.00 0.00 N ATOM 1591 CA PRO A 108 -15.049 -27.567 8.451 1.00 0.00 C ATOM 1592 C PRO A 108 -16.219 -27.144 9.333 1.00 0.00 C ATOM 1593 O PRO A 108 -16.037 -26.796 10.500 1.00 0.00 O ATOM 1594 CB PRO A 108 -14.148 -28.555 9.195 1.00 0.00 C ATOM 1595 CG PRO A 108 -13.071 -27.714 9.788 1.00 0.00 C ATOM 1596 CD PRO A 108 -12.847 -26.585 8.820 1.00 0.00 C ATOM 0 HA PRO A 108 -15.506 -27.980 7.552 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -14.701 -29.092 9.966 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -13.738 -29.304 8.518 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -13.365 -27.336 10.767 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -12.158 -28.292 9.931 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -12.563 -25.666 9.333 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -12.050 -26.814 8.112 1.00 0.00 H new ATOM 1604 N THR A 109 -17.423 -27.177 8.768 1.00 0.00 N ATOM 1605 CA THR A 109 -18.622 -26.797 9.503 1.00 0.00 C ATOM 1606 C THR A 109 -19.853 -27.509 8.953 1.00 0.00 C ATOM 1607 O THR A 109 -20.282 -27.249 7.829 1.00 0.00 O ATOM 1608 CB THR A 109 -18.857 -25.275 9.447 1.00 0.00 C ATOM 1609 OG1 THR A 109 -17.703 -24.584 9.938 1.00 0.00 O ATOM 1610 CG2 THR A 109 -20.076 -24.885 10.268 1.00 0.00 C ATOM 0 H THR A 109 -17.592 -27.463 7.804 1.00 0.00 H new ATOM 0 HA THR A 109 -18.465 -27.096 10.539 1.00 0.00 H new ATOM 0 HB THR A 109 -19.034 -24.994 8.409 1.00 0.00 H new ATOM 0 HG1 THR A 109 -17.859 -23.617 9.898 1.00 0.00 H new ATOM 0 HG21 THR A 109 -20.222 -23.806 10.213 1.00 0.00 H new ATOM 0 HG22 THR A 109 -20.957 -25.391 9.873 1.00 0.00 H new ATOM 0 HG23 THR A 109 -19.924 -25.178 11.307 1.00 0.00 H new ATOM 1618 N ASP A 110 -20.416 -28.409 9.752 1.00 0.00 N ATOM 1619 CA ASP A 110 -21.599 -29.158 9.345 1.00 0.00 C ATOM 1620 C ASP A 110 -22.693 -29.063 10.405 1.00 0.00 C ATOM 1621 O ASP A 110 -22.720 -29.821 11.374 1.00 0.00 O ATOM 1622 CB ASP A 110 -21.240 -30.624 9.095 1.00 0.00 C ATOM 1623 CG ASP A 110 -20.242 -31.155 10.105 1.00 0.00 C ATOM 1624 OD1 ASP A 110 -20.398 -30.855 11.307 1.00 0.00 O ATOM 1625 OD2 ASP A 110 -19.305 -31.871 9.694 1.00 0.00 O ATOM 0 H ASP A 110 -20.072 -28.637 10.685 1.00 0.00 H new ATOM 0 HA ASP A 110 -21.975 -28.721 8.420 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -22.146 -31.228 9.132 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -20.828 -30.728 8.091 1.00 0.00 H new ATOM 1630 N PRO A 111 -23.617 -28.109 10.218 1.00 0.00 N ATOM 1631 CA PRO A 111 -24.730 -27.892 11.147 1.00 0.00 C ATOM 1632 C PRO A 111 -25.749 -29.025 11.105 1.00 0.00 C ATOM 1633 O PRO A 111 -26.321 -29.397 12.130 1.00 0.00 O ATOM 1634 CB PRO A 111 -25.359 -26.589 10.649 1.00 0.00 C ATOM 1635 CG PRO A 111 -24.999 -26.522 9.204 1.00 0.00 C ATOM 1636 CD PRO A 111 -23.647 -27.170 9.084 1.00 0.00 C ATOM 0 HA PRO A 111 -24.394 -27.850 12.183 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -26.440 -26.593 10.788 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -24.971 -25.728 11.194 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -25.737 -27.042 8.593 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -24.969 -25.489 8.857 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -23.532 -27.687 8.131 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -22.843 -26.437 9.148 1.00 0.00 H new ATOM 1644 N ASN A 112 -25.972 -29.572 9.914 1.00 0.00 N ATOM 1645 CA ASN A 112 -26.923 -30.663 9.740 1.00 0.00 C ATOM 1646 C ASN A 112 -26.649 -31.788 10.733 1.00 0.00 C ATOM 1647 O ASN A 112 -27.571 -32.461 11.197 1.00 0.00 O ATOM 1648 CB ASN A 112 -26.855 -31.203 8.310 1.00 0.00 C ATOM 1649 CG ASN A 112 -27.761 -30.442 7.361 1.00 0.00 C ATOM 1650 OD1 ASN A 112 -28.691 -29.757 7.788 1.00 0.00 O ATOM 1651 ND2 ASN A 112 -27.492 -30.558 6.066 1.00 0.00 N ATOM 0 H ASN A 112 -25.507 -29.277 9.055 1.00 0.00 H new ATOM 0 HA ASN A 112 -27.923 -30.273 9.927 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -25.827 -31.146 7.951 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -27.135 -32.257 8.309 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -28.066 -30.068 5.380 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -26.711 -31.137 5.757 1.00 0.00 H new ATOM 1658 N LEU A 113 -25.376 -31.986 11.057 1.00 0.00 N ATOM 1659 CA LEU A 113 -24.979 -33.029 11.996 1.00 0.00 C ATOM 1660 C LEU A 113 -24.723 -32.445 13.382 1.00 0.00 C ATOM 1661 O LEU A 113 -24.172 -31.352 13.514 1.00 0.00 O ATOM 1662 CB LEU A 113 -23.724 -33.746 11.493 1.00 0.00 C ATOM 1663 CG LEU A 113 -22.829 -34.366 12.567 1.00 0.00 C ATOM 1664 CD1 LEU A 113 -23.468 -35.625 13.132 1.00 0.00 C ATOM 1665 CD2 LEU A 113 -21.451 -34.673 12.000 1.00 0.00 C ATOM 0 H LEU A 113 -24.601 -31.438 10.683 1.00 0.00 H new ATOM 0 HA LEU A 113 -25.796 -33.747 12.069 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -24.031 -34.534 10.805 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -23.129 -33.035 10.919 1.00 0.00 H new ATOM 0 HG LEU A 113 -22.714 -33.647 13.378 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -22.817 -36.053 13.895 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -24.432 -35.376 13.576 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -23.613 -36.350 12.331 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -20.827 -35.114 12.778 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -21.547 -35.374 11.171 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -20.990 -33.751 11.644 1.00 0.00 H new ATOM 1677 N ILE A 114 -25.125 -33.182 14.412 1.00 0.00 N ATOM 1678 CA ILE A 114 -24.937 -32.738 15.788 1.00 0.00 C ATOM 1679 C ILE A 114 -23.607 -33.233 16.348 1.00 0.00 C ATOM 1680 O ILE A 114 -23.320 -34.430 16.366 1.00 0.00 O ATOM 1681 CB ILE A 114 -26.078 -33.227 16.699 1.00 0.00 C ATOM 1682 CG1 ILE A 114 -27.378 -32.494 16.362 1.00 0.00 C ATOM 1683 CG2 ILE A 114 -25.713 -33.024 18.161 1.00 0.00 C ATOM 1684 CD1 ILE A 114 -28.622 -33.241 16.790 1.00 0.00 C ATOM 0 H ILE A 114 -25.583 -34.089 14.320 1.00 0.00 H new ATOM 0 HA ILE A 114 -24.939 -31.648 15.771 1.00 0.00 H new ATOM 0 HB ILE A 114 -26.229 -34.293 16.528 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -27.369 -31.515 16.842 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -27.420 -32.321 15.287 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -26.530 -33.375 18.792 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -24.809 -33.587 18.392 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -25.539 -31.965 18.349 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -29.505 -32.662 16.519 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -28.655 -34.209 16.290 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -28.603 -33.391 17.870 1.00 0.00 H new ATOM 1696 N PRO A 115 -22.776 -32.291 16.817 1.00 0.00 N ATOM 1697 CA PRO A 115 -21.464 -32.607 17.389 1.00 0.00 C ATOM 1698 C PRO A 115 -21.573 -33.320 18.733 1.00 0.00 C ATOM 1699 O PRO A 115 -22.644 -33.797 19.108 1.00 0.00 O ATOM 1700 CB PRO A 115 -20.812 -31.233 17.564 1.00 0.00 C ATOM 1701 CG PRO A 115 -21.955 -30.285 17.689 1.00 0.00 C ATOM 1702 CD PRO A 115 -23.053 -30.845 16.827 1.00 0.00 C ATOM 0 HA PRO A 115 -20.896 -33.286 16.753 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -20.177 -31.206 18.449 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -20.181 -30.982 16.711 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -22.279 -30.198 18.726 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -21.671 -29.286 17.359 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -24.038 -30.628 17.240 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -23.029 -30.424 15.822 1.00 0.00 H new ATOM 1710 N SER A 116 -20.459 -33.388 19.454 1.00 0.00 N ATOM 1711 CA SER A 116 -20.429 -34.045 20.755 1.00 0.00 C ATOM 1712 C SER A 116 -21.138 -33.198 21.808 1.00 0.00 C ATOM 1713 O SER A 116 -20.503 -32.445 22.545 1.00 0.00 O ATOM 1714 CB SER A 116 -18.985 -34.309 21.185 1.00 0.00 C ATOM 1715 OG SER A 116 -18.469 -35.469 20.555 1.00 0.00 O ATOM 0 H SER A 116 -19.565 -32.996 19.159 1.00 0.00 H new ATOM 0 HA SER A 116 -20.953 -34.997 20.665 1.00 0.00 H new ATOM 0 HB2 SER A 116 -18.365 -33.449 20.934 1.00 0.00 H new ATOM 0 HB3 SER A 116 -18.941 -34.429 22.267 1.00 0.00 H new ATOM 0 HG SER A 116 -17.544 -35.615 20.845 1.00 0.00 H new ATOM 1721 N ALA A 117 -22.459 -33.329 21.872 1.00 0.00 N ATOM 1722 CA ALA A 117 -23.255 -32.578 22.835 1.00 0.00 C ATOM 1723 C ALA A 117 -24.342 -33.453 23.450 1.00 0.00 C ATOM 1724 O ALA A 117 -24.888 -34.350 22.807 1.00 0.00 O ATOM 1725 CB ALA A 117 -23.872 -31.356 22.171 1.00 0.00 C ATOM 0 H ALA A 117 -23.000 -33.948 21.269 1.00 0.00 H new ATOM 0 HA ALA A 117 -22.594 -32.248 23.636 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -24.464 -30.805 22.902 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -23.081 -30.713 21.785 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -24.514 -31.674 21.350 1.00 0.00 H new ATOM 1731 N PRO A 118 -24.664 -33.189 24.725 1.00 0.00 N ATOM 1732 CA PRO A 118 -25.689 -33.943 25.454 1.00 0.00 C ATOM 1733 C PRO A 118 -27.095 -33.659 24.937 1.00 0.00 C ATOM 1734 O PRO A 118 -27.363 -33.781 23.742 1.00 0.00 O ATOM 1735 CB PRO A 118 -25.537 -33.444 26.894 1.00 0.00 C ATOM 1736 CG PRO A 118 -24.944 -32.084 26.763 1.00 0.00 C ATOM 1737 CD PRO A 118 -24.054 -32.135 25.552 1.00 0.00 C ATOM 0 HA PRO A 118 -25.559 -35.020 25.345 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -26.499 -33.409 27.404 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -24.892 -34.103 27.475 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -25.721 -31.329 26.644 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -24.375 -31.819 27.654 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -24.030 -31.178 25.030 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -23.026 -32.378 25.819 1.00 0.00 H new TER 1745 PRO A 118