USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 872 hydrogens (29 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 10 THR OG1 : rot -71:sc= 1.84 USER MOD Set 1.2: A 12 SER OG : rot -40:sc= 0.509 USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.0809 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 160:sc= -0.549 USER MOD Single : A 15 LYS NZ :NH3+ -113:sc= -0.0301 (180deg=-0.351) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.375 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.939 K(o=-0.94,f=-7.8!) USER MOD Single : A 32 THR OG1 : rot -160:sc= -3.15! USER MOD Single : A 34 SER OG : rot 180:sc= -1.83! USER MOD Single : A 36 HIS :FLIP no HD1:sc= -0.898 F(o=-2.2,f=-0.9) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 167:sc= 0.331 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.997 X(o=-1,f=-0.55) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -170:sc= -1.61 USER MOD Single : A 50 SER OG : rot 97:sc= 0.776 USER MOD Single : A 51 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.087) USER MOD Single : A 54 ASN : amide:sc= -0.533 X(o=-0.53,f=-0.17) USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN : amide:sc= -1.89 K(o=-1.9,f=-3.6!) USER MOD Single : A 77 MET CE :methyl -166:sc= -3.75 (180deg=-4.83!) USER MOD Single : A 78 LYS NZ :NH3+ -117:sc= -0.0555 (180deg=-2.25!) USER MOD Single : A 86 THR OG1 : rot -170:sc= -0.211 USER MOD Single : A 90 GLN : amide:sc= -0.757 K(o=-0.76,f=-2.8!) USER MOD Single : A 93 TYR OH : rot 15:sc= -0.0515 USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.0161 USER MOD Single : A 130 JZF OH : rot 70:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.843 -16.300 19.197 1.00 0.00 N ATOM 2 CA GLY A 1 10.820 -15.275 19.303 1.00 0.00 C ATOM 3 C GLY A 1 10.493 -14.643 17.964 1.00 0.00 C ATOM 4 O GLY A 1 10.941 -15.099 16.912 1.00 0.00 O ATOM 0 H1 GLY A 1 11.475 -17.198 19.572 1.00 0.00 H new ATOM 0 H2 GLY A 1 12.108 -16.424 18.199 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.680 -16.013 19.744 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.915 -15.711 19.726 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.155 -14.502 19.994 1.00 0.00 H new ATOM 8 N PRO A 2 9.692 -13.568 17.993 1.00 0.00 N ATOM 9 CA PRO A 2 9.286 -12.850 16.782 1.00 0.00 C ATOM 10 C PRO A 2 10.444 -12.092 16.142 1.00 0.00 C ATOM 11 O PRO A 2 11.561 -12.095 16.657 1.00 0.00 O ATOM 12 CB PRO A 2 8.222 -11.873 17.287 1.00 0.00 C ATOM 13 CG PRO A 2 8.551 -11.666 18.726 1.00 0.00 C ATOM 14 CD PRO A 2 9.121 -12.970 19.212 1.00 0.00 C ATOM 0 HA PRO A 2 8.927 -13.528 16.008 1.00 0.00 H new ATOM 0 HB2 PRO A 2 8.253 -10.934 16.735 1.00 0.00 H new ATOM 0 HB3 PRO A 2 7.219 -12.282 17.165 1.00 0.00 H new ATOM 0 HG2 PRO A 2 9.270 -10.856 18.849 1.00 0.00 H new ATOM 0 HG3 PRO A 2 7.662 -11.393 19.294 1.00 0.00 H new ATOM 0 HD2 PRO A 2 9.881 -12.816 19.978 1.00 0.00 H new ATOM 0 HD3 PRO A 2 8.352 -13.607 19.650 1.00 0.00 H new ATOM 22 N GLY A 3 10.169 -11.440 15.016 1.00 0.00 N ATOM 23 CA GLY A 3 11.198 -10.686 14.324 1.00 0.00 C ATOM 24 C GLY A 3 10.630 -9.775 13.255 1.00 0.00 C ATOM 25 O GLY A 3 10.765 -8.554 13.335 1.00 0.00 O ATOM 0 H GLY A 3 9.252 -11.421 14.571 1.00 0.00 H new ATOM 0 HA2 GLY A 3 11.755 -10.090 15.047 1.00 0.00 H new ATOM 0 HA3 GLY A 3 11.906 -11.378 13.868 1.00 0.00 H new ATOM 29 N SER A 4 9.993 -10.368 12.251 1.00 0.00 N ATOM 30 CA SER A 4 9.407 -9.602 11.157 1.00 0.00 C ATOM 31 C SER A 4 7.884 -9.685 11.192 1.00 0.00 C ATOM 32 O SER A 4 7.286 -10.575 10.589 1.00 0.00 O ATOM 33 CB SER A 4 9.927 -10.112 9.812 1.00 0.00 C ATOM 34 OG SER A 4 11.150 -9.485 9.466 1.00 0.00 O ATOM 0 H SER A 4 9.869 -11.377 12.172 1.00 0.00 H new ATOM 0 HA SER A 4 9.700 -8.559 11.278 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.069 -11.192 9.859 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.185 -9.922 9.036 1.00 0.00 H new ATOM 0 HG SER A 4 11.462 -9.830 8.603 1.00 0.00 H new ATOM 40 N MET A 5 7.263 -8.749 11.902 1.00 0.00 N ATOM 41 CA MET A 5 5.809 -8.714 12.015 1.00 0.00 C ATOM 42 C MET A 5 5.163 -8.495 10.650 1.00 0.00 C ATOM 43 O MET A 5 5.527 -7.572 9.920 1.00 0.00 O ATOM 44 CB MET A 5 5.377 -7.609 12.980 1.00 0.00 C ATOM 45 CG MET A 5 5.858 -6.225 12.574 1.00 0.00 C ATOM 46 SD MET A 5 6.062 -5.120 13.984 1.00 0.00 S ATOM 47 CE MET A 5 7.846 -5.095 14.139 1.00 0.00 C ATOM 0 H MET A 5 7.743 -8.005 12.408 1.00 0.00 H new ATOM 0 HA MET A 5 5.477 -9.676 12.405 1.00 0.00 H new ATOM 0 HB2 MET A 5 4.289 -7.601 13.047 1.00 0.00 H new ATOM 0 HB3 MET A 5 5.756 -7.839 13.976 1.00 0.00 H new ATOM 0 HG2 MET A 5 6.808 -6.315 12.047 1.00 0.00 H new ATOM 0 HG3 MET A 5 5.146 -5.788 11.875 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.130 -4.451 14.972 1.00 0.00 H new ATOM 0 HE2 MET A 5 8.210 -6.106 14.322 1.00 0.00 H new ATOM 0 HE3 MET A 5 8.286 -4.712 13.218 1.00 0.00 H new ATOM 57 N THR A 6 4.202 -9.349 10.311 1.00 0.00 N ATOM 58 CA THR A 6 3.507 -9.249 9.034 1.00 0.00 C ATOM 59 C THR A 6 2.088 -9.796 9.136 1.00 0.00 C ATOM 60 O THR A 6 1.646 -10.208 10.209 1.00 0.00 O ATOM 61 CB THR A 6 4.259 -10.009 7.924 1.00 0.00 C ATOM 62 OG1 THR A 6 4.514 -11.355 8.339 1.00 0.00 O ATOM 63 CG2 THR A 6 5.572 -9.318 7.590 1.00 0.00 C ATOM 0 H THR A 6 3.888 -10.118 10.903 1.00 0.00 H new ATOM 0 HA THR A 6 3.468 -8.190 8.778 1.00 0.00 H new ATOM 0 HB THR A 6 3.634 -10.017 7.031 1.00 0.00 H new ATOM 0 HG1 THR A 6 4.991 -11.832 7.628 1.00 0.00 H new ATOM 0 HG21 THR A 6 6.085 -9.872 6.804 1.00 0.00 H new ATOM 0 HG22 THR A 6 5.372 -8.303 7.247 1.00 0.00 H new ATOM 0 HG23 THR A 6 6.201 -9.283 8.479 1.00 0.00 H new ATOM 71 N VAL A 7 1.377 -9.797 8.013 1.00 0.00 N ATOM 72 CA VAL A 7 0.007 -10.295 7.977 1.00 0.00 C ATOM 73 C VAL A 7 -0.026 -11.818 8.032 1.00 0.00 C ATOM 74 O VAL A 7 0.494 -12.494 7.144 1.00 0.00 O ATOM 75 CB VAL A 7 -0.728 -9.823 6.708 1.00 0.00 C ATOM 76 CG1 VAL A 7 -2.203 -10.191 6.777 1.00 0.00 C ATOM 77 CG2 VAL A 7 -0.553 -8.324 6.518 1.00 0.00 C ATOM 0 H VAL A 7 1.727 -9.459 7.117 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.500 -9.891 8.854 1.00 0.00 H new ATOM 0 HB VAL A 7 -0.292 -10.329 5.847 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.706 -9.850 5.872 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -2.304 -11.273 6.862 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -2.657 -9.714 7.646 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.079 -8.008 5.617 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.962 -7.798 7.380 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.507 -8.091 6.420 1.00 0.00 H new ATOM 87 N VAL A 8 -0.640 -12.354 9.083 1.00 0.00 N ATOM 88 CA VAL A 8 -0.743 -13.798 9.254 1.00 0.00 C ATOM 89 C VAL A 8 -1.851 -14.378 8.382 1.00 0.00 C ATOM 90 O VAL A 8 -3.003 -13.950 8.456 1.00 0.00 O ATOM 91 CB VAL A 8 -1.013 -14.171 10.724 1.00 0.00 C ATOM 92 CG1 VAL A 8 -0.928 -15.677 10.917 1.00 0.00 C ATOM 93 CG2 VAL A 8 -0.038 -13.451 11.644 1.00 0.00 C ATOM 0 H VAL A 8 -1.073 -11.809 9.829 1.00 0.00 H new ATOM 0 HA VAL A 8 0.214 -14.222 8.949 1.00 0.00 H new ATOM 0 HB VAL A 8 -2.023 -13.852 10.982 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -1.122 -15.921 11.961 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -1.670 -16.167 10.286 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.068 -16.023 10.642 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.243 -13.726 12.679 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.982 -13.737 11.388 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.154 -12.374 11.525 1.00 0.00 H new ATOM 103 N THR A 9 -1.495 -15.356 7.555 1.00 0.00 N ATOM 104 CA THR A 9 -2.458 -15.995 6.668 1.00 0.00 C ATOM 105 C THR A 9 -2.836 -17.382 7.174 1.00 0.00 C ATOM 106 O THR A 9 -2.014 -18.086 7.762 1.00 0.00 O ATOM 107 CB THR A 9 -1.907 -16.116 5.234 1.00 0.00 C ATOM 108 OG1 THR A 9 -1.447 -14.840 4.776 1.00 0.00 O ATOM 109 CG2 THR A 9 -2.973 -16.647 4.288 1.00 0.00 C ATOM 0 H THR A 9 -0.546 -15.723 7.481 1.00 0.00 H new ATOM 0 HA THR A 9 -3.345 -15.362 6.656 1.00 0.00 H new ATOM 0 HB THR A 9 -1.073 -16.818 5.247 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.824 -14.965 4.030 1.00 0.00 H new ATOM 0 HG21 THR A 9 -2.561 -16.724 3.282 1.00 0.00 H new ATOM 0 HG22 THR A 9 -3.299 -17.632 4.623 1.00 0.00 H new ATOM 0 HG23 THR A 9 -3.824 -15.966 4.280 1.00 0.00 H new ATOM 117 N THR A 10 -4.086 -17.772 6.942 1.00 0.00 N ATOM 118 CA THR A 10 -4.573 -19.075 7.375 1.00 0.00 C ATOM 119 C THR A 10 -4.547 -20.080 6.229 1.00 0.00 C ATOM 120 O THR A 10 -4.165 -19.747 5.108 1.00 0.00 O ATOM 121 CB THR A 10 -6.007 -18.983 7.930 1.00 0.00 C ATOM 122 OG1 THR A 10 -6.904 -18.552 6.900 1.00 0.00 O ATOM 123 CG2 THR A 10 -6.073 -18.016 9.103 1.00 0.00 C ATOM 0 H THR A 10 -4.779 -17.203 6.456 1.00 0.00 H new ATOM 0 HA THR A 10 -3.906 -19.414 8.168 1.00 0.00 H new ATOM 0 HB THR A 10 -6.302 -19.973 8.278 1.00 0.00 H new ATOM 0 HG1 THR A 10 -6.745 -17.605 6.703 1.00 0.00 H new ATOM 0 HG21 THR A 10 -7.095 -17.968 9.478 1.00 0.00 H new ATOM 0 HG22 THR A 10 -5.411 -18.362 9.897 1.00 0.00 H new ATOM 0 HG23 THR A 10 -5.760 -17.025 8.775 1.00 0.00 H new ATOM 131 N GLU A 11 -4.956 -21.312 6.519 1.00 0.00 N ATOM 132 CA GLU A 11 -4.979 -22.365 5.511 1.00 0.00 C ATOM 133 C GLU A 11 -6.102 -22.131 4.505 1.00 0.00 C ATOM 134 O GLU A 11 -6.009 -22.541 3.348 1.00 0.00 O ATOM 135 CB GLU A 11 -5.151 -23.733 6.175 1.00 0.00 C ATOM 136 CG GLU A 11 -3.875 -24.269 6.803 1.00 0.00 C ATOM 137 CD GLU A 11 -4.119 -25.491 7.667 1.00 0.00 C ATOM 138 OE1 GLU A 11 -4.161 -26.610 7.114 1.00 0.00 O ATOM 139 OE2 GLU A 11 -4.268 -25.328 8.896 1.00 0.00 O ATOM 0 H GLU A 11 -5.275 -21.604 7.443 1.00 0.00 H new ATOM 0 HA GLU A 11 -4.028 -22.344 4.979 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.921 -23.661 6.943 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.508 -24.446 5.432 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -3.165 -24.521 6.015 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -3.416 -23.487 7.408 1.00 0.00 H new ATOM 146 N SER A 12 -7.164 -21.471 4.956 1.00 0.00 N ATOM 147 CA SER A 12 -8.308 -21.186 4.097 1.00 0.00 C ATOM 148 C SER A 12 -7.947 -20.148 3.038 1.00 0.00 C ATOM 149 O SER A 12 -8.423 -20.210 1.905 1.00 0.00 O ATOM 150 CB SER A 12 -9.489 -20.688 4.933 1.00 0.00 C ATOM 151 OG SER A 12 -9.153 -19.505 5.637 1.00 0.00 O ATOM 0 H SER A 12 -7.256 -21.124 5.911 1.00 0.00 H new ATOM 0 HA SER A 12 -8.592 -22.110 3.594 1.00 0.00 H new ATOM 0 HB2 SER A 12 -10.344 -20.498 4.284 1.00 0.00 H new ATOM 0 HB3 SER A 12 -9.791 -21.462 5.639 1.00 0.00 H new ATOM 0 HG SER A 12 -8.238 -19.578 5.981 1.00 0.00 H new ATOM 157 N GLY A 13 -7.101 -19.195 3.417 1.00 0.00 N ATOM 158 CA GLY A 13 -6.690 -18.157 2.489 1.00 0.00 C ATOM 159 C GLY A 13 -6.820 -16.767 3.080 1.00 0.00 C ATOM 160 O GLY A 13 -6.025 -15.877 2.773 1.00 0.00 O ATOM 0 H GLY A 13 -6.693 -19.123 4.349 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -5.655 -18.327 2.193 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.295 -18.222 1.585 1.00 0.00 H new ATOM 164 N LEU A 14 -7.825 -16.578 3.928 1.00 0.00 N ATOM 165 CA LEU A 14 -8.057 -15.285 4.563 1.00 0.00 C ATOM 166 C LEU A 14 -6.968 -14.976 5.585 1.00 0.00 C ATOM 167 O LEU A 14 -6.496 -15.866 6.293 1.00 0.00 O ATOM 168 CB LEU A 14 -9.429 -15.267 5.240 1.00 0.00 C ATOM 169 CG LEU A 14 -9.680 -14.116 6.215 1.00 0.00 C ATOM 170 CD1 LEU A 14 -11.132 -13.667 6.148 1.00 0.00 C ATOM 171 CD2 LEU A 14 -9.312 -14.527 7.633 1.00 0.00 C ATOM 0 H LEU A 14 -8.492 -17.303 4.192 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.030 -14.518 3.789 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -10.194 -15.234 4.465 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.560 -16.207 5.777 1.00 0.00 H new ATOM 0 HG LEU A 14 -9.047 -13.277 5.926 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -11.292 -12.847 6.848 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -11.363 -13.331 5.137 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -11.783 -14.501 6.410 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -9.497 -13.695 8.313 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -9.918 -15.382 7.933 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -8.257 -14.798 7.671 1.00 0.00 H new ATOM 183 N LYS A 15 -6.575 -13.709 5.658 1.00 0.00 N ATOM 184 CA LYS A 15 -5.544 -13.281 6.596 1.00 0.00 C ATOM 185 C LYS A 15 -6.143 -12.429 7.711 1.00 0.00 C ATOM 186 O LYS A 15 -7.246 -11.900 7.576 1.00 0.00 O ATOM 187 CB LYS A 15 -4.456 -12.491 5.865 1.00 0.00 C ATOM 188 CG LYS A 15 -4.025 -13.122 4.552 1.00 0.00 C ATOM 189 CD LYS A 15 -2.887 -12.349 3.909 1.00 0.00 C ATOM 190 CE LYS A 15 -2.541 -12.904 2.535 1.00 0.00 C ATOM 191 NZ LYS A 15 -3.657 -12.722 1.566 1.00 0.00 N ATOM 0 H LYS A 15 -6.955 -12.960 5.079 1.00 0.00 H new ATOM 0 HA LYS A 15 -5.101 -14.172 7.041 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.819 -11.482 5.671 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.587 -12.397 6.516 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -3.713 -14.152 4.727 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -4.873 -13.158 3.869 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -3.165 -11.299 3.819 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -2.008 -12.392 4.552 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.647 -12.407 2.157 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -2.304 -13.964 2.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -4.046 -13.651 1.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -4.404 -12.143 2.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.302 -12.245 0.713 1.00 0.00 H new ATOM 205 N TYR A 16 -5.408 -12.299 8.810 1.00 0.00 N ATOM 206 CA TYR A 16 -5.867 -11.512 9.948 1.00 0.00 C ATOM 207 C TYR A 16 -4.690 -10.879 10.683 1.00 0.00 C ATOM 208 O TYR A 16 -3.670 -11.528 10.917 1.00 0.00 O ATOM 209 CB TYR A 16 -6.672 -12.387 10.909 1.00 0.00 C ATOM 210 CG TYR A 16 -5.815 -13.270 11.787 1.00 0.00 C ATOM 211 CD1 TYR A 16 -4.935 -14.191 11.231 1.00 0.00 C ATOM 212 CD2 TYR A 16 -5.884 -13.185 13.172 1.00 0.00 C ATOM 213 CE1 TYR A 16 -4.150 -15.001 12.028 1.00 0.00 C ATOM 214 CE2 TYR A 16 -5.101 -13.989 13.977 1.00 0.00 C ATOM 215 CZ TYR A 16 -4.236 -14.896 13.401 1.00 0.00 C ATOM 216 OH TYR A 16 -3.456 -15.700 14.200 1.00 0.00 O ATOM 0 H TYR A 16 -4.492 -12.729 8.937 1.00 0.00 H new ATOM 0 HA TYR A 16 -6.507 -10.715 9.571 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -7.286 -11.747 11.542 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -7.353 -13.013 10.333 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -4.864 -14.275 10.157 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -6.562 -12.478 13.627 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -3.473 -15.712 11.579 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -5.166 -13.908 15.052 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.637 -15.499 15.142 1.00 0.00 H new ATOM 226 N GLU A 17 -4.839 -9.609 11.045 1.00 0.00 N ATOM 227 CA GLU A 17 -3.789 -8.888 11.754 1.00 0.00 C ATOM 228 C GLU A 17 -4.372 -8.060 12.895 1.00 0.00 C ATOM 229 O GLU A 17 -5.176 -7.154 12.671 1.00 0.00 O ATOM 230 CB GLU A 17 -3.022 -7.981 10.790 1.00 0.00 C ATOM 231 CG GLU A 17 -1.535 -7.893 11.089 1.00 0.00 C ATOM 232 CD GLU A 17 -0.761 -7.184 9.995 1.00 0.00 C ATOM 233 OE1 GLU A 17 -1.264 -6.166 9.475 1.00 0.00 O ATOM 234 OE2 GLU A 17 0.349 -7.648 9.659 1.00 0.00 O ATOM 0 H GLU A 17 -5.677 -9.058 10.859 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.101 -9.621 12.176 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.158 -8.348 9.773 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.451 -6.980 10.827 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -1.388 -7.367 12.032 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.134 -8.898 11.219 1.00 0.00 H new ATOM 241 N ASP A 18 -3.961 -8.376 14.118 1.00 0.00 N ATOM 242 CA ASP A 18 -4.442 -7.661 15.295 1.00 0.00 C ATOM 243 C ASP A 18 -4.199 -6.162 15.157 1.00 0.00 C ATOM 244 O ASP A 18 -3.145 -5.734 14.683 1.00 0.00 O ATOM 245 CB ASP A 18 -3.753 -8.188 16.555 1.00 0.00 C ATOM 246 CG ASP A 18 -2.255 -7.952 16.537 1.00 0.00 C ATOM 247 OD1 ASP A 18 -1.551 -8.664 15.791 1.00 0.00 O ATOM 248 OD2 ASP A 18 -1.787 -7.056 17.271 1.00 0.00 O ATOM 0 H ASP A 18 -3.296 -9.122 14.321 1.00 0.00 H new ATOM 0 HA ASP A 18 -5.515 -7.831 15.379 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -4.184 -7.703 17.431 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -3.949 -9.256 16.653 1.00 0.00 H new ATOM 253 N LEU A 19 -5.179 -5.368 15.572 1.00 0.00 N ATOM 254 CA LEU A 19 -5.073 -3.915 15.494 1.00 0.00 C ATOM 255 C LEU A 19 -5.317 -3.277 16.858 1.00 0.00 C ATOM 256 O LEU A 19 -4.678 -2.287 17.216 1.00 0.00 O ATOM 257 CB LEU A 19 -6.072 -3.365 14.475 1.00 0.00 C ATOM 258 CG LEU A 19 -5.676 -3.503 13.004 1.00 0.00 C ATOM 259 CD1 LEU A 19 -6.764 -2.941 12.103 1.00 0.00 C ATOM 260 CD2 LEU A 19 -4.350 -2.804 12.742 1.00 0.00 C ATOM 0 H LEU A 19 -6.057 -5.706 15.966 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.062 -3.666 15.173 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -7.026 -3.871 14.622 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -6.234 -2.309 14.689 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.557 -4.562 12.777 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.464 -3.048 11.060 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.693 -3.486 12.271 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -6.916 -1.886 12.330 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.083 -2.912 11.691 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.442 -1.746 12.986 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.573 -3.253 13.361 1.00 0.00 H new ATOM 272 N THR A 20 -6.244 -3.852 17.617 1.00 0.00 N ATOM 273 CA THR A 20 -6.572 -3.341 18.942 1.00 0.00 C ATOM 274 C THR A 20 -7.170 -4.433 19.821 1.00 0.00 C ATOM 275 O THR A 20 -8.189 -5.030 19.476 1.00 0.00 O ATOM 276 CB THR A 20 -7.562 -2.164 18.861 1.00 0.00 C ATOM 277 OG1 THR A 20 -7.241 -1.329 17.742 1.00 0.00 O ATOM 278 CG2 THR A 20 -7.531 -1.341 20.139 1.00 0.00 C ATOM 0 H THR A 20 -6.781 -4.672 17.337 1.00 0.00 H new ATOM 0 HA THR A 20 -5.639 -2.992 19.385 1.00 0.00 H new ATOM 0 HB THR A 20 -8.565 -2.571 18.734 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.876 -0.584 17.697 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.238 -0.516 20.058 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.805 -1.972 20.985 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.527 -0.945 20.292 1.00 0.00 H new ATOM 286 N GLU A 21 -6.530 -4.689 20.957 1.00 0.00 N ATOM 287 CA GLU A 21 -7.000 -5.711 21.885 1.00 0.00 C ATOM 288 C GLU A 21 -8.477 -5.510 22.213 1.00 0.00 C ATOM 289 O GLU A 21 -9.028 -4.429 22.007 1.00 0.00 O ATOM 290 CB GLU A 21 -6.172 -5.683 23.172 1.00 0.00 C ATOM 291 CG GLU A 21 -6.251 -4.362 23.918 1.00 0.00 C ATOM 292 CD GLU A 21 -5.918 -4.503 25.390 1.00 0.00 C ATOM 293 OE1 GLU A 21 -6.383 -5.479 26.014 1.00 0.00 O ATOM 294 OE2 GLU A 21 -5.190 -3.636 25.918 1.00 0.00 O ATOM 0 H GLU A 21 -5.685 -4.203 21.257 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.881 -6.683 21.406 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.512 -6.483 23.830 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.130 -5.891 22.928 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.565 -3.649 23.461 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.255 -3.950 23.814 1.00 0.00 H new ATOM 301 N GLY A 22 -9.112 -6.560 22.724 1.00 0.00 N ATOM 302 CA GLY A 22 -10.519 -6.480 23.071 1.00 0.00 C ATOM 303 C GLY A 22 -10.940 -7.568 24.039 1.00 0.00 C ATOM 304 O GLY A 22 -10.658 -8.746 23.820 1.00 0.00 O ATOM 0 H GLY A 22 -8.677 -7.465 22.904 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -10.726 -5.505 23.512 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -11.119 -6.553 22.164 1.00 0.00 H new ATOM 308 N SER A 23 -11.617 -7.173 25.113 1.00 0.00 N ATOM 309 CA SER A 23 -12.074 -8.123 26.120 1.00 0.00 C ATOM 310 C SER A 23 -13.597 -8.195 26.148 1.00 0.00 C ATOM 311 O SER A 23 -14.252 -7.443 26.869 1.00 0.00 O ATOM 312 CB SER A 23 -11.545 -7.728 27.501 1.00 0.00 C ATOM 313 OG SER A 23 -10.136 -7.581 27.484 1.00 0.00 O ATOM 0 H SER A 23 -11.861 -6.202 25.308 1.00 0.00 H new ATOM 0 HA SER A 23 -11.686 -9.107 25.858 1.00 0.00 H new ATOM 0 HB2 SER A 23 -12.008 -6.793 27.817 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.826 -8.486 28.232 1.00 0.00 H new ATOM 0 HG SER A 23 -9.823 -7.327 28.377 1.00 0.00 H new ATOM 319 N GLY A 24 -14.155 -9.106 25.357 1.00 0.00 N ATOM 320 CA GLY A 24 -15.597 -9.261 25.305 1.00 0.00 C ATOM 321 C GLY A 24 -16.017 -10.687 25.009 1.00 0.00 C ATOM 322 O GLY A 24 -15.618 -11.616 25.710 1.00 0.00 O ATOM 0 H GLY A 24 -13.634 -9.740 24.751 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -16.027 -8.949 26.257 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.003 -8.600 24.540 1.00 0.00 H new ATOM 326 N ALA A 25 -16.826 -10.860 23.969 1.00 0.00 N ATOM 327 CA ALA A 25 -17.301 -12.183 23.582 1.00 0.00 C ATOM 328 C ALA A 25 -17.286 -12.349 22.066 1.00 0.00 C ATOM 329 O ALA A 25 -17.545 -11.401 21.327 1.00 0.00 O ATOM 330 CB ALA A 25 -18.701 -12.422 24.128 1.00 0.00 C ATOM 0 H ALA A 25 -17.166 -10.101 23.379 1.00 0.00 H new ATOM 0 HA ALA A 25 -16.626 -12.924 24.009 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -19.043 -13.414 23.831 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -18.684 -12.355 25.216 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -19.381 -11.669 23.729 1.00 0.00 H new ATOM 336 N GLU A 26 -16.981 -13.560 21.612 1.00 0.00 N ATOM 337 CA GLU A 26 -16.931 -13.849 20.183 1.00 0.00 C ATOM 338 C GLU A 26 -18.337 -13.989 19.607 1.00 0.00 C ATOM 339 O GLU A 26 -19.192 -14.660 20.185 1.00 0.00 O ATOM 340 CB GLU A 26 -16.133 -15.130 19.927 1.00 0.00 C ATOM 341 CG GLU A 26 -15.593 -15.237 18.510 1.00 0.00 C ATOM 342 CD GLU A 26 -15.045 -16.616 18.198 1.00 0.00 C ATOM 343 OE1 GLU A 26 -15.805 -17.598 18.322 1.00 0.00 O ATOM 344 OE2 GLU A 26 -13.855 -16.712 17.831 1.00 0.00 O ATOM 0 H GLU A 26 -16.765 -14.356 22.212 1.00 0.00 H new ATOM 0 HA GLU A 26 -16.435 -13.015 19.687 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -15.300 -15.176 20.629 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -16.769 -15.991 20.131 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -16.387 -14.997 17.803 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -14.806 -14.496 18.368 1.00 0.00 H new ATOM 351 N ALA A 27 -18.568 -13.350 18.465 1.00 0.00 N ATOM 352 CA ALA A 27 -19.869 -13.403 17.810 1.00 0.00 C ATOM 353 C ALA A 27 -20.244 -14.837 17.450 1.00 0.00 C ATOM 354 O ALA A 27 -19.374 -15.688 17.267 1.00 0.00 O ATOM 355 CB ALA A 27 -19.870 -12.527 16.566 1.00 0.00 C ATOM 0 H ALA A 27 -17.871 -12.790 17.974 1.00 0.00 H new ATOM 0 HA ALA A 27 -20.615 -13.024 18.508 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -20.848 -12.576 16.087 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -19.655 -11.496 16.847 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -19.108 -12.880 15.872 1.00 0.00 H new ATOM 361 N ARG A 28 -21.543 -15.097 17.349 1.00 0.00 N ATOM 362 CA ARG A 28 -22.032 -16.428 17.013 1.00 0.00 C ATOM 363 C ARG A 28 -23.137 -16.352 15.963 1.00 0.00 C ATOM 364 O ARG A 28 -23.997 -15.473 16.015 1.00 0.00 O ATOM 365 CB ARG A 28 -22.552 -17.136 18.266 1.00 0.00 C ATOM 366 CG ARG A 28 -21.502 -17.300 19.352 1.00 0.00 C ATOM 367 CD ARG A 28 -20.691 -18.571 19.156 1.00 0.00 C ATOM 368 NE ARG A 28 -21.410 -19.756 19.618 1.00 0.00 N ATOM 369 CZ ARG A 28 -21.508 -20.103 20.896 1.00 0.00 C ATOM 370 NH1 ARG A 28 -20.937 -19.361 21.834 1.00 0.00 N ATOM 371 NH2 ARG A 28 -22.180 -21.196 21.238 1.00 0.00 N ATOM 0 H ARG A 28 -22.276 -14.403 17.495 1.00 0.00 H new ATOM 0 HA ARG A 28 -21.201 -16.999 16.600 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -23.394 -16.573 18.668 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -22.931 -18.119 17.987 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -20.835 -16.438 19.348 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -21.987 -17.324 20.328 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -20.445 -18.685 18.100 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -19.748 -18.486 19.696 1.00 0.00 H new ATOM 0 HE ARG A 28 -21.861 -20.349 18.921 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -20.420 -18.520 21.575 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -21.014 -19.630 22.815 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -22.621 -21.769 20.519 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -22.255 -21.462 22.220 1.00 0.00 H new ATOM 385 N ALA A 29 -23.107 -17.279 15.012 1.00 0.00 N ATOM 386 CA ALA A 29 -24.107 -17.318 13.951 1.00 0.00 C ATOM 387 C ALA A 29 -25.513 -17.440 14.527 1.00 0.00 C ATOM 388 O ALA A 29 -25.825 -18.398 15.233 1.00 0.00 O ATOM 389 CB ALA A 29 -23.822 -18.471 13.000 1.00 0.00 C ATOM 0 H ALA A 29 -22.401 -18.013 14.954 1.00 0.00 H new ATOM 0 HA ALA A 29 -24.050 -16.381 13.396 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -24.576 -18.488 12.213 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -22.836 -18.340 12.555 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -23.850 -19.412 13.550 1.00 0.00 H new ATOM 395 N GLY A 30 -26.360 -16.462 14.220 1.00 0.00 N ATOM 396 CA GLY A 30 -27.724 -16.478 14.717 1.00 0.00 C ATOM 397 C GLY A 30 -28.018 -15.314 15.642 1.00 0.00 C ATOM 398 O GLY A 30 -29.175 -14.939 15.827 1.00 0.00 O ATOM 0 H GLY A 30 -26.126 -15.659 13.636 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -28.415 -16.452 13.874 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -27.903 -17.413 15.247 1.00 0.00 H new ATOM 402 N GLN A 31 -26.969 -14.743 16.224 1.00 0.00 N ATOM 403 CA GLN A 31 -27.122 -13.616 17.137 1.00 0.00 C ATOM 404 C GLN A 31 -26.787 -12.301 16.440 1.00 0.00 C ATOM 405 O GLN A 31 -25.909 -12.249 15.578 1.00 0.00 O ATOM 406 CB GLN A 31 -26.225 -13.800 18.363 1.00 0.00 C ATOM 407 CG GLN A 31 -24.837 -13.205 18.196 1.00 0.00 C ATOM 408 CD GLN A 31 -23.945 -13.458 19.395 1.00 0.00 C ATOM 409 OE1 GLN A 31 -23.175 -14.419 19.420 1.00 0.00 O ATOM 410 NE2 GLN A 31 -24.044 -12.595 20.399 1.00 0.00 N ATOM 0 H GLN A 31 -26.004 -15.042 16.080 1.00 0.00 H new ATOM 0 HA GLN A 31 -28.163 -13.581 17.459 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -26.706 -13.342 19.227 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -26.131 -14.865 18.578 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -24.370 -13.626 17.306 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -24.924 -12.131 18.033 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -24.695 -11.812 20.337 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -23.469 -12.714 21.233 1.00 0.00 H new ATOM 419 N THR A 32 -27.492 -11.240 16.819 1.00 0.00 N ATOM 420 CA THR A 32 -27.270 -9.925 16.229 1.00 0.00 C ATOM 421 C THR A 32 -26.237 -9.134 17.023 1.00 0.00 C ATOM 422 O THR A 32 -26.265 -9.117 18.254 1.00 0.00 O ATOM 423 CB THR A 32 -28.578 -9.114 16.158 1.00 0.00 C ATOM 424 OG1 THR A 32 -29.636 -9.936 15.652 1.00 0.00 O ATOM 425 CG2 THR A 32 -28.408 -7.892 15.268 1.00 0.00 C ATOM 0 H THR A 32 -28.221 -11.265 17.532 1.00 0.00 H new ATOM 0 HA THR A 32 -26.898 -10.090 15.218 1.00 0.00 H new ATOM 0 HB THR A 32 -28.828 -8.779 17.165 1.00 0.00 H new ATOM 0 HG1 THR A 32 -30.358 -9.367 15.312 1.00 0.00 H new ATOM 0 HG21 THR A 32 -29.344 -7.335 15.233 1.00 0.00 H new ATOM 0 HG22 THR A 32 -27.621 -7.255 15.671 1.00 0.00 H new ATOM 0 HG23 THR A 32 -28.137 -8.210 14.261 1.00 0.00 H new ATOM 433 N VAL A 33 -25.326 -8.477 16.312 1.00 0.00 N ATOM 434 CA VAL A 33 -24.285 -7.682 16.951 1.00 0.00 C ATOM 435 C VAL A 33 -23.893 -6.491 16.083 1.00 0.00 C ATOM 436 O VAL A 33 -24.200 -6.450 14.891 1.00 0.00 O ATOM 437 CB VAL A 33 -23.031 -8.527 17.240 1.00 0.00 C ATOM 438 CG1 VAL A 33 -23.394 -9.762 18.050 1.00 0.00 C ATOM 439 CG2 VAL A 33 -22.339 -8.915 15.941 1.00 0.00 C ATOM 0 H VAL A 33 -25.288 -8.480 15.293 1.00 0.00 H new ATOM 0 HA VAL A 33 -24.696 -7.322 17.894 1.00 0.00 H new ATOM 0 HB VAL A 33 -22.338 -7.927 17.829 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -22.495 -10.347 18.244 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -23.841 -9.458 18.997 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -24.107 -10.368 17.490 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -21.455 -9.512 16.164 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -23.023 -9.497 15.324 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -22.043 -8.014 15.404 1.00 0.00 H new ATOM 449 N SER A 34 -23.213 -5.523 16.688 1.00 0.00 N ATOM 450 CA SER A 34 -22.782 -4.328 15.972 1.00 0.00 C ATOM 451 C SER A 34 -21.270 -4.336 15.763 1.00 0.00 C ATOM 452 O SER A 34 -20.501 -4.468 16.715 1.00 0.00 O ATOM 453 CB SER A 34 -23.195 -3.071 16.738 1.00 0.00 C ATOM 454 OG SER A 34 -24.271 -2.411 16.093 1.00 0.00 O ATOM 0 H SER A 34 -22.948 -5.543 17.673 1.00 0.00 H new ATOM 0 HA SER A 34 -23.267 -4.325 14.996 1.00 0.00 H new ATOM 0 HB2 SER A 34 -23.485 -3.339 17.754 1.00 0.00 H new ATOM 0 HB3 SER A 34 -22.344 -2.394 16.818 1.00 0.00 H new ATOM 0 HG SER A 34 -24.517 -1.611 16.603 1.00 0.00 H new ATOM 460 N VAL A 35 -20.852 -4.195 14.509 1.00 0.00 N ATOM 461 CA VAL A 35 -19.433 -4.184 14.173 1.00 0.00 C ATOM 462 C VAL A 35 -19.125 -3.126 13.120 1.00 0.00 C ATOM 463 O VAL A 35 -20.020 -2.659 12.414 1.00 0.00 O ATOM 464 CB VAL A 35 -18.969 -5.559 13.656 1.00 0.00 C ATOM 465 CG1 VAL A 35 -19.462 -6.669 14.572 1.00 0.00 C ATOM 466 CG2 VAL A 35 -19.449 -5.780 12.230 1.00 0.00 C ATOM 0 H VAL A 35 -21.476 -4.087 13.709 1.00 0.00 H new ATOM 0 HA VAL A 35 -18.892 -3.947 15.089 1.00 0.00 H new ATOM 0 HB VAL A 35 -17.879 -5.579 13.656 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -19.124 -7.633 14.190 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -19.064 -6.516 15.575 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -20.551 -6.654 14.608 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -19.113 -6.756 11.880 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -20.538 -5.740 12.202 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -19.041 -5.003 11.584 1.00 0.00 H new ATOM 476 N HIS A 36 -17.853 -2.753 13.018 1.00 0.00 N ATOM 477 CA HIS A 36 -17.426 -1.750 12.049 1.00 0.00 C ATOM 478 C HIS A 36 -16.587 -2.385 10.944 1.00 0.00 C ATOM 479 O HIS A 36 -15.667 -3.157 11.216 1.00 0.00 O ATOM 480 CB HIS A 36 -16.627 -0.647 12.743 1.00 0.00 C ATOM 481 CG HIS A 36 -17.456 0.538 13.134 1.00 0.00 C ATOM 482 ND1 HIS A 36 -17.519 1.229 14.296 1.00 0.00 N flip ATOM 483 CD2 HIS A 36 -18.355 1.141 12.281 1.00 0.00 C flip ATOM 484 CE1 HIS A 36 -18.444 2.229 14.125 1.00 0.00 C flip ATOM 485 NE2 HIS A 36 -18.934 2.154 12.901 1.00 0.00 N flip ATOM 0 H HIS A 36 -17.101 -3.130 13.594 1.00 0.00 H new ATOM 0 HA HIS A 36 -18.317 -1.313 11.598 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -16.153 -1.059 13.634 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -15.827 -0.317 12.080 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -18.555 0.834 11.265 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -18.725 2.958 14.870 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -19.640 2.773 12.502 1.00 0.00 H new ATOM 493 N TYR A 37 -16.910 -2.055 9.699 1.00 0.00 N ATOM 494 CA TYR A 37 -16.188 -2.596 8.553 1.00 0.00 C ATOM 495 C TYR A 37 -15.496 -1.483 7.771 1.00 0.00 C ATOM 496 O TYR A 37 -16.110 -0.471 7.432 1.00 0.00 O ATOM 497 CB TYR A 37 -17.144 -3.361 7.636 1.00 0.00 C ATOM 498 CG TYR A 37 -18.168 -2.479 6.958 1.00 0.00 C ATOM 499 CD1 TYR A 37 -19.286 -2.024 7.647 1.00 0.00 C ATOM 500 CD2 TYR A 37 -18.018 -2.100 5.630 1.00 0.00 C ATOM 501 CE1 TYR A 37 -20.225 -1.219 7.031 1.00 0.00 C ATOM 502 CE2 TYR A 37 -18.951 -1.295 5.007 1.00 0.00 C ATOM 503 CZ TYR A 37 -20.053 -0.857 5.711 1.00 0.00 C ATOM 504 OH TYR A 37 -20.985 -0.054 5.095 1.00 0.00 O ATOM 0 H TYR A 37 -17.667 -1.416 9.457 1.00 0.00 H new ATOM 0 HA TYR A 37 -15.427 -3.281 8.925 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -16.564 -3.882 6.874 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -17.662 -4.123 8.219 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -19.423 -2.304 8.681 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -17.156 -2.441 5.075 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -21.089 -0.875 7.580 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -18.818 -1.010 3.974 1.00 0.00 H new ATOM 0 HH TYR A 37 -20.715 0.108 4.167 1.00 0.00 H new ATOM 514 N THR A 38 -14.212 -1.679 7.487 1.00 0.00 N ATOM 515 CA THR A 38 -13.435 -0.694 6.746 1.00 0.00 C ATOM 516 C THR A 38 -12.744 -1.329 5.545 1.00 0.00 C ATOM 517 O THR A 38 -11.792 -2.094 5.696 1.00 0.00 O ATOM 518 CB THR A 38 -12.373 -0.027 7.641 1.00 0.00 C ATOM 519 OG1 THR A 38 -12.659 -0.289 9.019 1.00 0.00 O ATOM 520 CG2 THR A 38 -12.331 1.475 7.403 1.00 0.00 C ATOM 0 H THR A 38 -13.689 -2.511 7.759 1.00 0.00 H new ATOM 0 HA THR A 38 -14.136 0.065 6.399 1.00 0.00 H new ATOM 0 HB THR A 38 -11.400 -0.447 7.387 1.00 0.00 H new ATOM 0 HG1 THR A 38 -11.880 -0.053 9.565 1.00 0.00 H new ATOM 0 HG21 THR A 38 -11.574 1.924 8.046 1.00 0.00 H new ATOM 0 HG22 THR A 38 -12.084 1.671 6.360 1.00 0.00 H new ATOM 0 HG23 THR A 38 -13.305 1.907 7.633 1.00 0.00 H new ATOM 528 N GLY A 39 -13.230 -1.007 4.349 1.00 0.00 N ATOM 529 CA GLY A 39 -12.646 -1.555 3.139 1.00 0.00 C ATOM 530 C GLY A 39 -11.268 -0.993 2.854 1.00 0.00 C ATOM 531 O GLY A 39 -11.130 0.174 2.486 1.00 0.00 O ATOM 0 H GLY A 39 -14.017 -0.377 4.197 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -12.581 -2.639 3.230 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -13.303 -1.344 2.295 1.00 0.00 H new ATOM 535 N TRP A 40 -10.245 -1.823 3.026 1.00 0.00 N ATOM 536 CA TRP A 40 -8.870 -1.400 2.786 1.00 0.00 C ATOM 537 C TRP A 40 -8.250 -2.190 1.638 1.00 0.00 C ATOM 538 O TRP A 40 -8.576 -3.359 1.428 1.00 0.00 O ATOM 539 CB TRP A 40 -8.032 -1.577 4.053 1.00 0.00 C ATOM 540 CG TRP A 40 -8.457 -0.680 5.176 1.00 0.00 C ATOM 541 CD1 TRP A 40 -9.284 0.403 5.092 1.00 0.00 C ATOM 542 CD2 TRP A 40 -8.073 -0.789 6.551 1.00 0.00 C ATOM 543 NE1 TRP A 40 -9.438 0.974 6.332 1.00 0.00 N ATOM 544 CE2 TRP A 40 -8.706 0.262 7.244 1.00 0.00 C ATOM 545 CE3 TRP A 40 -7.258 -1.671 7.265 1.00 0.00 C ATOM 546 CZ2 TRP A 40 -8.547 0.452 8.614 1.00 0.00 C ATOM 547 CZ3 TRP A 40 -7.101 -1.482 8.625 1.00 0.00 C ATOM 548 CH2 TRP A 40 -7.743 -0.428 9.288 1.00 0.00 C ATOM 0 H TRP A 40 -10.342 -2.792 3.330 1.00 0.00 H new ATOM 0 HA TRP A 40 -8.883 -0.345 2.512 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -8.097 -2.614 4.381 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -6.986 -1.382 3.818 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -9.749 0.759 4.184 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -10.006 1.796 6.540 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -6.759 -2.487 6.763 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -9.040 1.264 9.127 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -6.473 -2.158 9.186 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -7.601 -0.307 10.352 1.00 0.00 H new ATOM 559 N LEU A 41 -7.357 -1.544 0.896 1.00 0.00 N ATOM 560 CA LEU A 41 -6.691 -2.187 -0.232 1.00 0.00 C ATOM 561 C LEU A 41 -5.484 -2.993 0.236 1.00 0.00 C ATOM 562 O LEU A 41 -4.979 -2.792 1.341 1.00 0.00 O ATOM 563 CB LEU A 41 -6.253 -1.138 -1.256 1.00 0.00 C ATOM 564 CG LEU A 41 -6.964 -1.183 -2.609 1.00 0.00 C ATOM 565 CD1 LEU A 41 -8.150 -0.231 -2.621 1.00 0.00 C ATOM 566 CD2 LEU A 41 -5.995 -0.845 -3.732 1.00 0.00 C ATOM 0 H LEU A 41 -7.077 -0.576 1.055 1.00 0.00 H new ATOM 0 HA LEU A 41 -7.400 -2.869 -0.701 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.404 -0.150 -0.821 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.182 -1.251 -1.427 1.00 0.00 H new ATOM 0 HG LEU A 41 -7.336 -2.195 -2.769 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.643 -0.277 -3.592 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.855 -0.519 -1.841 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.802 0.786 -2.438 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.518 -0.882 -4.687 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.593 0.156 -3.577 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -5.178 -1.567 -3.737 1.00 0.00 H new ATOM 578 N THR A 42 -5.023 -3.905 -0.614 1.00 0.00 N ATOM 579 CA THR A 42 -3.874 -4.741 -0.289 1.00 0.00 C ATOM 580 C THR A 42 -2.606 -3.905 -0.156 1.00 0.00 C ATOM 581 O THR A 42 -1.592 -4.376 0.360 1.00 0.00 O ATOM 582 CB THR A 42 -3.649 -5.827 -1.358 1.00 0.00 C ATOM 583 OG1 THR A 42 -3.043 -5.252 -2.521 1.00 0.00 O ATOM 584 CG2 THR A 42 -4.964 -6.491 -1.740 1.00 0.00 C ATOM 0 H THR A 42 -5.428 -4.084 -1.533 1.00 0.00 H new ATOM 0 HA THR A 42 -4.092 -5.220 0.665 1.00 0.00 H new ATOM 0 HB THR A 42 -2.986 -6.585 -0.941 1.00 0.00 H new ATOM 0 HG1 THR A 42 -2.902 -5.949 -3.195 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.780 -7.254 -2.496 1.00 0.00 H new ATOM 0 HG22 THR A 42 -5.408 -6.953 -0.858 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.647 -5.742 -2.140 1.00 0.00 H new ATOM 592 N ASP A 43 -2.670 -2.664 -0.623 1.00 0.00 N ATOM 593 CA ASP A 43 -1.527 -1.761 -0.555 1.00 0.00 C ATOM 594 C ASP A 43 -1.510 -1.005 0.770 1.00 0.00 C ATOM 595 O ASP A 43 -0.475 -0.490 1.190 1.00 0.00 O ATOM 596 CB ASP A 43 -1.560 -0.771 -1.720 1.00 0.00 C ATOM 597 CG ASP A 43 -1.502 -1.463 -3.068 1.00 0.00 C ATOM 598 OD1 ASP A 43 -0.722 -2.428 -3.206 1.00 0.00 O ATOM 599 OD2 ASP A 43 -2.234 -1.037 -3.986 1.00 0.00 O ATOM 0 H ASP A 43 -3.502 -2.260 -1.053 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.619 -2.360 -0.624 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -2.470 -0.174 -1.660 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.720 -0.082 -1.632 1.00 0.00 H new ATOM 604 N GLY A 44 -2.666 -0.942 1.424 1.00 0.00 N ATOM 605 CA GLY A 44 -2.763 -0.246 2.694 1.00 0.00 C ATOM 606 C GLY A 44 -3.572 1.032 2.595 1.00 0.00 C ATOM 607 O GLY A 44 -3.666 1.790 3.559 1.00 0.00 O ATOM 0 H GLY A 44 -3.537 -1.360 1.097 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.220 -0.905 3.432 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.761 -0.011 3.053 1.00 0.00 H new ATOM 611 N GLN A 45 -4.155 1.272 1.425 1.00 0.00 N ATOM 612 CA GLN A 45 -4.957 2.469 1.203 1.00 0.00 C ATOM 613 C GLN A 45 -6.439 2.177 1.412 1.00 0.00 C ATOM 614 O GLN A 45 -6.955 1.161 0.945 1.00 0.00 O ATOM 615 CB GLN A 45 -4.726 3.009 -0.209 1.00 0.00 C ATOM 616 CG GLN A 45 -5.141 2.043 -1.306 1.00 0.00 C ATOM 617 CD GLN A 45 -4.487 2.355 -2.638 1.00 0.00 C ATOM 618 OE1 GLN A 45 -5.145 2.810 -3.574 1.00 0.00 O ATOM 619 NE2 GLN A 45 -3.185 2.112 -2.730 1.00 0.00 N ATOM 0 H GLN A 45 -4.087 0.654 0.617 1.00 0.00 H new ATOM 0 HA GLN A 45 -4.648 3.222 1.927 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -5.280 3.940 -0.328 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -3.670 3.249 -0.329 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -4.882 1.027 -1.007 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.224 2.074 -1.422 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -2.679 1.735 -1.929 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -2.691 2.303 -3.602 1.00 0.00 H new ATOM 628 N LYS A 46 -7.120 3.074 2.117 1.00 0.00 N ATOM 629 CA LYS A 46 -8.544 2.914 2.387 1.00 0.00 C ATOM 630 C LYS A 46 -9.376 3.290 1.165 1.00 0.00 C ATOM 631 O LYS A 46 -9.007 4.182 0.401 1.00 0.00 O ATOM 632 CB LYS A 46 -8.957 3.776 3.583 1.00 0.00 C ATOM 633 CG LYS A 46 -10.450 3.756 3.861 1.00 0.00 C ATOM 634 CD LYS A 46 -10.833 4.773 4.922 1.00 0.00 C ATOM 635 CE LYS A 46 -11.998 5.640 4.468 1.00 0.00 C ATOM 636 NZ LYS A 46 -11.577 6.647 3.455 1.00 0.00 N ATOM 0 H LYS A 46 -6.709 3.920 2.512 1.00 0.00 H new ATOM 0 HA LYS A 46 -8.728 1.865 2.621 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -8.426 3.430 4.470 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -8.643 4.804 3.405 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -10.995 3.966 2.941 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -10.747 2.759 4.187 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -11.100 4.256 5.844 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -9.974 5.405 5.149 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -12.780 5.007 4.048 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.429 6.150 5.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -12.398 7.218 3.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.849 7.267 3.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.189 6.160 2.622 1.00 0.00 H new ATOM 650 N PHE A 47 -10.501 2.605 0.987 1.00 0.00 N ATOM 651 CA PHE A 47 -11.385 2.868 -0.142 1.00 0.00 C ATOM 652 C PHE A 47 -12.844 2.642 0.246 1.00 0.00 C ATOM 653 O PHE A 47 -13.713 2.510 -0.616 1.00 0.00 O ATOM 654 CB PHE A 47 -11.016 1.971 -1.325 1.00 0.00 C ATOM 655 CG PHE A 47 -11.432 0.539 -1.146 1.00 0.00 C ATOM 656 CD1 PHE A 47 -10.671 -0.326 -0.376 1.00 0.00 C ATOM 657 CD2 PHE A 47 -12.584 0.058 -1.746 1.00 0.00 C ATOM 658 CE1 PHE A 47 -11.051 -1.644 -0.209 1.00 0.00 C ATOM 659 CE2 PHE A 47 -12.970 -1.259 -1.582 1.00 0.00 C ATOM 660 CZ PHE A 47 -12.201 -2.111 -0.813 1.00 0.00 C ATOM 0 H PHE A 47 -10.822 1.864 1.610 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.262 3.911 -0.433 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -11.481 2.366 -2.228 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -9.938 2.011 -1.478 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -9.770 0.034 0.099 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -13.188 0.720 -2.349 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -10.449 -2.308 0.393 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -13.871 -1.621 -2.054 1.00 0.00 H new ATOM 0 HZ PHE A 47 -12.499 -3.141 -0.685 1.00 0.00 H new ATOM 670 N ASP A 48 -13.104 2.600 1.548 1.00 0.00 N ATOM 671 CA ASP A 48 -14.456 2.391 2.051 1.00 0.00 C ATOM 672 C ASP A 48 -14.476 2.399 3.576 1.00 0.00 C ATOM 673 O ASP A 48 -13.727 1.665 4.220 1.00 0.00 O ATOM 674 CB ASP A 48 -15.019 1.068 1.528 1.00 0.00 C ATOM 675 CG ASP A 48 -16.361 1.240 0.843 1.00 0.00 C ATOM 676 OD1 ASP A 48 -17.346 1.557 1.541 1.00 0.00 O ATOM 677 OD2 ASP A 48 -16.425 1.056 -0.391 1.00 0.00 O ATOM 0 H ASP A 48 -12.396 2.708 2.274 1.00 0.00 H new ATOM 0 HA ASP A 48 -15.081 3.210 1.693 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -14.310 0.627 0.827 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -15.125 0.368 2.357 1.00 0.00 H new ATOM 682 N SER A 49 -15.337 3.235 4.147 1.00 0.00 N ATOM 683 CA SER A 49 -15.451 3.343 5.597 1.00 0.00 C ATOM 684 C SER A 49 -16.905 3.545 6.014 1.00 0.00 C ATOM 685 O SER A 49 -17.599 4.412 5.485 1.00 0.00 O ATOM 686 CB SER A 49 -14.595 4.502 6.112 1.00 0.00 C ATOM 687 OG SER A 49 -13.310 4.052 6.504 1.00 0.00 O ATOM 0 H SER A 49 -15.966 3.848 3.628 1.00 0.00 H new ATOM 0 HA SER A 49 -15.091 2.412 6.036 1.00 0.00 H new ATOM 0 HB2 SER A 49 -14.497 5.259 5.334 1.00 0.00 H new ATOM 0 HB3 SER A 49 -15.091 4.977 6.958 1.00 0.00 H new ATOM 0 HG SER A 49 -12.840 4.773 6.973 1.00 0.00 H new ATOM 693 N SER A 50 -17.358 2.737 6.967 1.00 0.00 N ATOM 694 CA SER A 50 -18.729 2.823 7.454 1.00 0.00 C ATOM 695 C SER A 50 -18.948 4.114 8.236 1.00 0.00 C ATOM 696 O SER A 50 -20.084 4.510 8.500 1.00 0.00 O ATOM 697 CB SER A 50 -19.056 1.617 8.337 1.00 0.00 C ATOM 698 OG SER A 50 -20.456 1.457 8.485 1.00 0.00 O ATOM 0 H SER A 50 -16.795 2.015 7.417 1.00 0.00 H new ATOM 0 HA SER A 50 -19.395 2.824 6.591 1.00 0.00 H new ATOM 0 HB2 SER A 50 -18.628 0.715 7.899 1.00 0.00 H new ATOM 0 HB3 SER A 50 -18.596 1.745 9.317 1.00 0.00 H new ATOM 0 HG SER A 50 -20.779 0.793 7.841 1.00 0.00 H new ATOM 704 N LYS A 51 -17.852 4.768 8.605 1.00 0.00 N ATOM 705 CA LYS A 51 -17.921 6.016 9.356 1.00 0.00 C ATOM 706 C LYS A 51 -18.718 7.068 8.591 1.00 0.00 C ATOM 707 O LYS A 51 -19.231 8.021 9.178 1.00 0.00 O ATOM 708 CB LYS A 51 -16.512 6.539 9.646 1.00 0.00 C ATOM 709 CG LYS A 51 -15.818 5.817 10.787 1.00 0.00 C ATOM 710 CD LYS A 51 -14.311 5.788 10.595 1.00 0.00 C ATOM 711 CE LYS A 51 -13.644 6.994 11.239 1.00 0.00 C ATOM 712 NZ LYS A 51 -13.703 8.195 10.361 1.00 0.00 N ATOM 0 H LYS A 51 -16.904 4.454 8.396 1.00 0.00 H new ATOM 0 HA LYS A 51 -18.429 5.816 10.299 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -15.906 6.444 8.745 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -16.569 7.602 9.881 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -16.056 6.311 11.729 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -16.196 4.797 10.857 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -13.906 4.873 11.027 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -14.079 5.768 9.530 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -14.131 7.214 12.189 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -12.603 6.758 11.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -13.071 8.931 10.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -13.402 7.937 9.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -14.677 8.557 10.333 1.00 0.00 H new ATOM 726 N ASP A 52 -18.818 6.889 7.278 1.00 0.00 N ATOM 727 CA ASP A 52 -19.555 7.821 6.433 1.00 0.00 C ATOM 728 C ASP A 52 -20.961 8.054 6.978 1.00 0.00 C ATOM 729 O ASP A 52 -21.535 9.129 6.802 1.00 0.00 O ATOM 730 CB ASP A 52 -19.632 7.293 5.000 1.00 0.00 C ATOM 731 CG ASP A 52 -20.257 8.292 4.047 1.00 0.00 C ATOM 732 OD1 ASP A 52 -19.580 9.282 3.698 1.00 0.00 O ATOM 733 OD2 ASP A 52 -21.423 8.086 3.651 1.00 0.00 O ATOM 0 H ASP A 52 -18.398 6.107 6.776 1.00 0.00 H new ATOM 0 HA ASP A 52 -19.022 8.772 6.433 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -18.629 7.044 4.654 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -20.213 6.371 4.987 1.00 0.00 H new ATOM 738 N ARG A 53 -21.509 7.040 7.640 1.00 0.00 N ATOM 739 CA ARG A 53 -22.848 7.134 8.209 1.00 0.00 C ATOM 740 C ARG A 53 -22.785 7.468 9.696 1.00 0.00 C ATOM 741 O ARG A 53 -23.770 7.910 10.286 1.00 0.00 O ATOM 742 CB ARG A 53 -23.607 5.822 8.001 1.00 0.00 C ATOM 743 CG ARG A 53 -25.097 5.930 8.279 1.00 0.00 C ATOM 744 CD ARG A 53 -25.803 6.762 7.220 1.00 0.00 C ATOM 745 NE ARG A 53 -27.226 6.447 7.134 1.00 0.00 N ATOM 746 CZ ARG A 53 -28.051 7.004 6.254 1.00 0.00 C ATOM 747 NH1 ARG A 53 -27.595 7.899 5.389 1.00 0.00 N ATOM 748 NH2 ARG A 53 -29.333 6.665 6.239 1.00 0.00 N ATOM 0 H ARG A 53 -21.046 6.144 7.795 1.00 0.00 H new ATOM 0 HA ARG A 53 -23.378 7.937 7.697 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -23.461 5.486 6.974 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -23.179 5.058 8.650 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -25.535 4.933 8.311 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -25.254 6.379 9.260 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -25.679 7.820 7.449 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -25.334 6.589 6.251 1.00 0.00 H new ATOM 0 HE ARG A 53 -27.608 5.761 7.786 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -26.609 8.161 5.398 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -28.230 8.326 4.714 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -29.686 5.976 6.903 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -29.966 7.093 5.563 1.00 0.00 H new ATOM 762 N ASN A 54 -21.619 7.252 10.297 1.00 0.00 N ATOM 763 CA ASN A 54 -21.427 7.528 11.716 1.00 0.00 C ATOM 764 C ASN A 54 -22.320 6.633 12.570 1.00 0.00 C ATOM 765 O ASN A 54 -23.211 7.115 13.270 1.00 0.00 O ATOM 766 CB ASN A 54 -21.724 8.999 12.015 1.00 0.00 C ATOM 767 CG ASN A 54 -21.163 9.929 10.957 1.00 0.00 C ATOM 768 OD1 ASN A 54 -21.908 10.518 10.173 1.00 0.00 O ATOM 769 ND2 ASN A 54 -19.842 10.065 10.929 1.00 0.00 N ATOM 0 H ASN A 54 -20.793 6.887 9.823 1.00 0.00 H new ATOM 0 HA ASN A 54 -20.387 7.316 11.965 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -22.802 9.142 12.086 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -21.303 9.262 12.986 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -19.407 10.677 10.239 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -19.263 9.558 11.598 1.00 0.00 H new ATOM 776 N ASP A 55 -22.076 5.329 12.506 1.00 0.00 N ATOM 777 CA ASP A 55 -22.856 4.366 13.275 1.00 0.00 C ATOM 778 C ASP A 55 -22.346 2.947 13.046 1.00 0.00 C ATOM 779 O ASP A 55 -21.908 2.587 11.954 1.00 0.00 O ATOM 780 CB ASP A 55 -24.335 4.457 12.895 1.00 0.00 C ATOM 781 CG ASP A 55 -25.072 3.153 13.124 1.00 0.00 C ATOM 782 OD1 ASP A 55 -24.925 2.235 12.290 1.00 0.00 O ATOM 783 OD2 ASP A 55 -25.798 3.050 14.135 1.00 0.00 O ATOM 0 H ASP A 55 -21.344 4.914 11.929 1.00 0.00 H new ATOM 0 HA ASP A 55 -22.745 4.607 14.332 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -24.809 5.246 13.478 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -24.421 4.740 11.846 1.00 0.00 H new ATOM 788 N PRO A 56 -22.402 2.121 14.101 1.00 0.00 N ATOM 789 CA PRO A 56 -21.949 0.728 14.041 1.00 0.00 C ATOM 790 C PRO A 56 -22.864 -0.143 13.186 1.00 0.00 C ATOM 791 O PRO A 56 -24.088 -0.019 13.245 1.00 0.00 O ATOM 792 CB PRO A 56 -21.994 0.276 15.503 1.00 0.00 C ATOM 793 CG PRO A 56 -23.011 1.158 16.141 1.00 0.00 C ATOM 794 CD PRO A 56 -22.912 2.482 15.435 1.00 0.00 C ATOM 0 HA PRO A 56 -20.964 0.640 13.584 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -22.274 -0.774 15.584 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -21.020 0.384 15.981 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -24.011 0.736 16.041 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -22.817 1.269 17.208 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -23.881 2.978 15.374 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -22.237 3.164 15.952 1.00 0.00 H new ATOM 802 N PHE A 57 -22.264 -1.023 12.393 1.00 0.00 N ATOM 803 CA PHE A 57 -23.026 -1.914 11.525 1.00 0.00 C ATOM 804 C PHE A 57 -23.652 -3.051 12.328 1.00 0.00 C ATOM 805 O PHE A 57 -22.979 -4.018 12.684 1.00 0.00 O ATOM 806 CB PHE A 57 -22.125 -2.486 10.429 1.00 0.00 C ATOM 807 CG PHE A 57 -22.876 -2.933 9.207 1.00 0.00 C ATOM 808 CD1 PHE A 57 -23.623 -2.029 8.468 1.00 0.00 C ATOM 809 CD2 PHE A 57 -22.838 -4.256 8.799 1.00 0.00 C ATOM 810 CE1 PHE A 57 -24.315 -2.437 7.343 1.00 0.00 C ATOM 811 CE2 PHE A 57 -23.528 -4.670 7.676 1.00 0.00 C ATOM 812 CZ PHE A 57 -24.269 -3.759 6.947 1.00 0.00 C ATOM 0 H PHE A 57 -21.252 -1.139 12.333 1.00 0.00 H new ATOM 0 HA PHE A 57 -23.826 -1.335 11.063 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -21.394 -1.731 10.140 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -21.568 -3.331 10.833 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -23.665 -0.994 8.775 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -22.262 -4.973 9.366 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -24.891 -1.722 6.774 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -23.488 -5.704 7.368 1.00 0.00 H new ATOM 0 HZ PHE A 57 -24.811 -4.080 6.070 1.00 0.00 H new ATOM 822 N ALA A 58 -24.945 -2.925 12.610 1.00 0.00 N ATOM 823 CA ALA A 58 -25.663 -3.941 13.370 1.00 0.00 C ATOM 824 C ALA A 58 -26.409 -4.894 12.443 1.00 0.00 C ATOM 825 O ALA A 58 -27.222 -4.469 11.621 1.00 0.00 O ATOM 826 CB ALA A 58 -26.630 -3.286 14.345 1.00 0.00 C ATOM 0 H ALA A 58 -25.516 -2.130 12.324 1.00 0.00 H new ATOM 0 HA ALA A 58 -24.933 -4.521 13.934 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -27.159 -4.057 14.906 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -26.076 -2.651 15.036 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -27.349 -2.681 13.793 1.00 0.00 H new ATOM 832 N PHE A 59 -26.128 -6.186 12.579 1.00 0.00 N ATOM 833 CA PHE A 59 -26.771 -7.200 11.752 1.00 0.00 C ATOM 834 C PHE A 59 -26.723 -8.566 12.430 1.00 0.00 C ATOM 835 O PHE A 59 -26.091 -8.732 13.473 1.00 0.00 O ATOM 836 CB PHE A 59 -26.096 -7.274 10.381 1.00 0.00 C ATOM 837 CG PHE A 59 -24.762 -7.965 10.406 1.00 0.00 C ATOM 838 CD1 PHE A 59 -23.682 -7.391 11.057 1.00 0.00 C ATOM 839 CD2 PHE A 59 -24.589 -9.189 9.780 1.00 0.00 C ATOM 840 CE1 PHE A 59 -22.454 -8.024 11.082 1.00 0.00 C ATOM 841 CE2 PHE A 59 -23.363 -9.827 9.801 1.00 0.00 C ATOM 842 CZ PHE A 59 -22.295 -9.244 10.454 1.00 0.00 C ATOM 0 H PHE A 59 -25.459 -6.555 13.255 1.00 0.00 H new ATOM 0 HA PHE A 59 -27.815 -6.916 11.620 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -26.755 -7.798 9.688 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -25.966 -6.263 9.994 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -23.801 -6.438 11.551 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -25.422 -9.650 9.270 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -21.620 -7.565 11.592 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -23.241 -10.780 9.308 1.00 0.00 H new ATOM 0 HZ PHE A 59 -21.337 -9.741 10.474 1.00 0.00 H new ATOM 852 N VAL A 60 -27.396 -9.542 11.829 1.00 0.00 N ATOM 853 CA VAL A 60 -27.430 -10.894 12.374 1.00 0.00 C ATOM 854 C VAL A 60 -26.344 -11.765 11.752 1.00 0.00 C ATOM 855 O VAL A 60 -26.224 -11.848 10.529 1.00 0.00 O ATOM 856 CB VAL A 60 -28.800 -11.559 12.141 1.00 0.00 C ATOM 857 CG1 VAL A 60 -28.806 -12.978 12.688 1.00 0.00 C ATOM 858 CG2 VAL A 60 -29.908 -10.730 12.774 1.00 0.00 C ATOM 0 H VAL A 60 -27.925 -9.422 10.965 1.00 0.00 H new ATOM 0 HA VAL A 60 -27.253 -10.807 13.446 1.00 0.00 H new ATOM 0 HB VAL A 60 -28.982 -11.609 11.067 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -29.782 -13.431 12.514 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -28.038 -13.565 12.184 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -28.602 -12.956 13.758 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -30.869 -11.214 12.600 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -29.733 -10.647 13.847 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -29.917 -9.735 12.329 1.00 0.00 H new ATOM 868 N LEU A 61 -25.554 -12.412 12.602 1.00 0.00 N ATOM 869 CA LEU A 61 -24.476 -13.278 12.136 1.00 0.00 C ATOM 870 C LEU A 61 -25.033 -14.552 11.510 1.00 0.00 C ATOM 871 O LEU A 61 -26.102 -15.027 11.891 1.00 0.00 O ATOM 872 CB LEU A 61 -23.543 -13.631 13.296 1.00 0.00 C ATOM 873 CG LEU A 61 -22.257 -14.370 12.921 1.00 0.00 C ATOM 874 CD1 LEU A 61 -21.506 -13.617 11.834 1.00 0.00 C ATOM 875 CD2 LEU A 61 -21.375 -14.560 14.147 1.00 0.00 C ATOM 0 H LEU A 61 -25.639 -12.354 13.617 1.00 0.00 H new ATOM 0 HA LEU A 61 -23.912 -12.739 11.375 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -23.272 -12.710 13.812 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -24.096 -14.244 14.008 1.00 0.00 H new ATOM 0 HG LEU A 61 -22.525 -15.353 12.534 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -20.594 -14.158 11.580 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -22.136 -13.532 10.948 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -21.249 -12.620 12.193 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -20.465 -15.087 13.862 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -21.115 -13.586 14.563 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -21.913 -15.142 14.895 1.00 0.00 H new ATOM 887 N GLY A 62 -24.299 -15.102 10.548 1.00 0.00 N ATOM 888 CA GLY A 62 -24.735 -16.318 9.885 1.00 0.00 C ATOM 889 C GLY A 62 -26.009 -16.119 9.089 1.00 0.00 C ATOM 890 O GLY A 62 -26.814 -17.039 8.952 1.00 0.00 O ATOM 0 H GLY A 62 -23.410 -14.728 10.216 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -23.946 -16.669 9.220 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -24.894 -17.098 10.630 1.00 0.00 H new ATOM 894 N GLY A 63 -26.194 -14.912 8.562 1.00 0.00 N ATOM 895 CA GLY A 63 -27.382 -14.617 7.783 1.00 0.00 C ATOM 896 C GLY A 63 -27.266 -15.091 6.347 1.00 0.00 C ATOM 897 O GLY A 63 -28.125 -15.822 5.856 1.00 0.00 O ATOM 0 H GLY A 63 -25.542 -14.134 8.661 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -28.246 -15.090 8.250 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -27.563 -13.542 7.794 1.00 0.00 H new ATOM 901 N GLY A 64 -26.201 -14.671 5.671 1.00 0.00 N ATOM 902 CA GLY A 64 -25.997 -15.065 4.289 1.00 0.00 C ATOM 903 C GLY A 64 -26.091 -13.894 3.332 1.00 0.00 C ATOM 904 O GLY A 64 -26.327 -14.077 2.138 1.00 0.00 O ATOM 0 H GLY A 64 -25.476 -14.065 6.055 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -25.018 -15.534 4.189 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -26.739 -15.815 4.015 1.00 0.00 H new ATOM 908 N MET A 65 -25.909 -12.687 3.857 1.00 0.00 N ATOM 909 CA MET A 65 -25.976 -11.480 3.040 1.00 0.00 C ATOM 910 C MET A 65 -24.577 -10.991 2.678 1.00 0.00 C ATOM 911 O MET A 65 -24.373 -10.388 1.624 1.00 0.00 O ATOM 912 CB MET A 65 -26.738 -10.380 3.779 1.00 0.00 C ATOM 913 CG MET A 65 -27.437 -9.398 2.853 1.00 0.00 C ATOM 914 SD MET A 65 -27.914 -7.873 3.690 1.00 0.00 S ATOM 915 CE MET A 65 -26.601 -6.774 3.163 1.00 0.00 C ATOM 0 H MET A 65 -25.714 -12.518 4.844 1.00 0.00 H new ATOM 0 HA MET A 65 -26.506 -11.723 2.119 1.00 0.00 H new ATOM 0 HB2 MET A 65 -27.478 -10.839 4.434 1.00 0.00 H new ATOM 0 HB3 MET A 65 -26.043 -9.834 4.417 1.00 0.00 H new ATOM 0 HG2 MET A 65 -26.778 -9.159 2.019 1.00 0.00 H new ATOM 0 HG3 MET A 65 -28.325 -9.870 2.432 1.00 0.00 H new ATOM 0 HE1 MET A 65 -26.755 -5.787 3.599 1.00 0.00 H new ATOM 0 HE2 MET A 65 -25.641 -7.170 3.493 1.00 0.00 H new ATOM 0 HE3 MET A 65 -26.607 -6.695 2.076 1.00 0.00 H new ATOM 925 N VAL A 66 -23.616 -11.254 3.558 1.00 0.00 N ATOM 926 CA VAL A 66 -22.237 -10.841 3.330 1.00 0.00 C ATOM 927 C VAL A 66 -21.435 -11.949 2.658 1.00 0.00 C ATOM 928 O VAL A 66 -21.939 -13.052 2.445 1.00 0.00 O ATOM 929 CB VAL A 66 -21.544 -10.448 4.649 1.00 0.00 C ATOM 930 CG1 VAL A 66 -22.352 -9.389 5.383 1.00 0.00 C ATOM 931 CG2 VAL A 66 -21.334 -11.673 5.525 1.00 0.00 C ATOM 0 H VAL A 66 -23.768 -11.751 4.436 1.00 0.00 H new ATOM 0 HA VAL A 66 -22.271 -9.972 2.673 1.00 0.00 H new ATOM 0 HB VAL A 66 -20.567 -10.026 4.414 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -21.847 -9.125 6.312 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -22.445 -8.503 4.756 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -23.344 -9.780 5.608 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -20.843 -11.377 6.452 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -22.298 -12.127 5.753 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -20.709 -12.394 4.998 1.00 0.00 H new ATOM 941 N ILE A 67 -20.184 -11.649 2.326 1.00 0.00 N ATOM 942 CA ILE A 67 -19.311 -12.621 1.679 1.00 0.00 C ATOM 943 C ILE A 67 -18.665 -13.547 2.704 1.00 0.00 C ATOM 944 O ILE A 67 -18.635 -13.247 3.897 1.00 0.00 O ATOM 945 CB ILE A 67 -18.206 -11.928 0.860 1.00 0.00 C ATOM 946 CG1 ILE A 67 -17.214 -11.228 1.791 1.00 0.00 C ATOM 947 CG2 ILE A 67 -18.815 -10.935 -0.118 1.00 0.00 C ATOM 948 CD1 ILE A 67 -16.144 -10.449 1.059 1.00 0.00 C ATOM 0 H ILE A 67 -19.752 -10.740 2.494 1.00 0.00 H new ATOM 0 HA ILE A 67 -19.936 -13.208 1.006 1.00 0.00 H new ATOM 0 HB ILE A 67 -17.668 -12.685 0.290 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -17.760 -10.551 2.447 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -16.738 -11.974 2.428 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -18.021 -10.454 -0.689 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -19.485 -11.459 -0.799 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -19.375 -10.179 0.432 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -15.477 -9.980 1.782 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -15.572 -11.125 0.423 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -16.611 -9.680 0.443 1.00 0.00 H new ATOM 960 N LYS A 68 -18.145 -14.674 2.229 1.00 0.00 N ATOM 961 CA LYS A 68 -17.495 -15.644 3.102 1.00 0.00 C ATOM 962 C LYS A 68 -16.522 -14.955 4.053 1.00 0.00 C ATOM 963 O LYS A 68 -16.560 -15.174 5.263 1.00 0.00 O ATOM 964 CB LYS A 68 -16.755 -16.694 2.270 1.00 0.00 C ATOM 965 CG LYS A 68 -17.668 -17.750 1.671 1.00 0.00 C ATOM 966 CD LYS A 68 -16.910 -19.029 1.357 1.00 0.00 C ATOM 967 CE LYS A 68 -16.747 -19.898 2.595 1.00 0.00 C ATOM 968 NZ LYS A 68 -17.954 -20.732 2.851 1.00 0.00 N ATOM 0 H LYS A 68 -18.161 -14.938 1.244 1.00 0.00 H new ATOM 0 HA LYS A 68 -18.266 -16.136 3.694 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -16.215 -16.194 1.466 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -16.010 -17.183 2.897 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -18.479 -17.968 2.366 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -18.124 -17.363 0.760 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.441 -19.588 0.586 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -15.928 -18.782 0.953 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -15.878 -20.545 2.473 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -16.553 -19.264 3.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -17.803 -21.309 3.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -18.779 -20.115 2.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -18.124 -21.355 2.036 1.00 0.00 H new ATOM 982 N GLY A 69 -15.650 -14.119 3.496 1.00 0.00 N ATOM 983 CA GLY A 69 -14.680 -13.409 4.309 1.00 0.00 C ATOM 984 C GLY A 69 -15.323 -12.674 5.469 1.00 0.00 C ATOM 985 O GLY A 69 -14.780 -12.648 6.573 1.00 0.00 O ATOM 0 H GLY A 69 -15.598 -13.921 2.497 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -13.945 -14.117 4.694 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -14.140 -12.696 3.686 1.00 0.00 H new ATOM 989 N TRP A 70 -16.480 -12.073 5.217 1.00 0.00 N ATOM 990 CA TRP A 70 -17.196 -11.332 6.249 1.00 0.00 C ATOM 991 C TRP A 70 -17.727 -12.272 7.325 1.00 0.00 C ATOM 992 O TRP A 70 -17.427 -12.109 8.508 1.00 0.00 O ATOM 993 CB TRP A 70 -18.351 -10.542 5.630 1.00 0.00 C ATOM 994 CG TRP A 70 -17.939 -9.197 5.111 1.00 0.00 C ATOM 995 CD1 TRP A 70 -16.898 -8.927 4.269 1.00 0.00 C ATOM 996 CD2 TRP A 70 -18.559 -7.940 5.402 1.00 0.00 C ATOM 997 NE1 TRP A 70 -16.834 -7.577 4.019 1.00 0.00 N ATOM 998 CE2 TRP A 70 -17.842 -6.950 4.702 1.00 0.00 C ATOM 999 CE3 TRP A 70 -19.651 -7.554 6.184 1.00 0.00 C ATOM 1000 CZ2 TRP A 70 -18.183 -5.601 4.763 1.00 0.00 C ATOM 1001 CZ3 TRP A 70 -19.988 -6.215 6.244 1.00 0.00 C ATOM 1002 CH2 TRP A 70 -19.256 -5.252 5.537 1.00 0.00 C ATOM 0 H TRP A 70 -16.942 -12.084 4.308 1.00 0.00 H new ATOM 0 HA TRP A 70 -16.497 -10.637 6.713 1.00 0.00 H new ATOM 0 HB2 TRP A 70 -18.782 -11.122 4.814 1.00 0.00 H new ATOM 0 HB3 TRP A 70 -19.134 -10.411 6.377 1.00 0.00 H new ATOM 0 HD1 TRP A 70 -16.224 -9.665 3.860 1.00 0.00 H new ATOM 0 HE1 TRP A 70 -16.147 -7.117 3.422 1.00 0.00 H new ATOM 0 HE3 TRP A 70 -20.222 -8.289 6.732 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 -17.620 -4.857 4.219 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 -20.830 -5.906 6.846 1.00 0.00 H new ATOM 0 HH2 TRP A 70 -19.544 -4.213 5.604 1.00 0.00 H new ATOM 1013 N ASP A 71 -18.517 -13.255 6.909 1.00 0.00 N ATOM 1014 CA ASP A 71 -19.089 -14.223 7.838 1.00 0.00 C ATOM 1015 C ASP A 71 -17.998 -14.883 8.675 1.00 0.00 C ATOM 1016 O ASP A 71 -18.135 -15.025 9.890 1.00 0.00 O ATOM 1017 CB ASP A 71 -19.879 -15.289 7.076 1.00 0.00 C ATOM 1018 CG ASP A 71 -20.637 -16.219 8.002 1.00 0.00 C ATOM 1019 OD1 ASP A 71 -21.175 -15.736 9.020 1.00 0.00 O ATOM 1020 OD2 ASP A 71 -20.693 -17.432 7.708 1.00 0.00 O ATOM 0 H ASP A 71 -18.776 -13.403 5.934 1.00 0.00 H new ATOM 0 HA ASP A 71 -19.764 -13.691 8.508 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -20.582 -14.802 6.400 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -19.195 -15.873 6.460 1.00 0.00 H new ATOM 1025 N GLU A 72 -16.915 -15.284 8.017 1.00 0.00 N ATOM 1026 CA GLU A 72 -15.801 -15.930 8.701 1.00 0.00 C ATOM 1027 C GLU A 72 -15.190 -15.000 9.744 1.00 0.00 C ATOM 1028 O GLU A 72 -14.868 -15.420 10.855 1.00 0.00 O ATOM 1029 CB GLU A 72 -14.732 -16.357 7.693 1.00 0.00 C ATOM 1030 CG GLU A 72 -13.887 -17.529 8.161 1.00 0.00 C ATOM 1031 CD GLU A 72 -13.245 -18.282 7.011 1.00 0.00 C ATOM 1032 OE1 GLU A 72 -13.408 -17.846 5.852 1.00 0.00 O ATOM 1033 OE2 GLU A 72 -12.580 -19.306 7.271 1.00 0.00 O ATOM 0 H GLU A 72 -16.785 -15.173 7.011 1.00 0.00 H new ATOM 0 HA GLU A 72 -16.184 -16.815 9.209 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -15.216 -16.622 6.753 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -14.079 -15.509 7.487 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -13.109 -17.166 8.832 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -14.510 -18.214 8.736 1.00 0.00 H new ATOM 1040 N GLY A 73 -15.032 -13.731 9.378 1.00 0.00 N ATOM 1041 CA GLY A 73 -14.459 -12.761 10.292 1.00 0.00 C ATOM 1042 C GLY A 73 -15.381 -12.442 11.452 1.00 0.00 C ATOM 1043 O GLY A 73 -14.978 -12.516 12.613 1.00 0.00 O ATOM 0 H GLY A 73 -15.291 -13.358 8.465 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -13.514 -13.144 10.678 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -14.233 -11.844 9.749 1.00 0.00 H new ATOM 1047 N VAL A 74 -16.622 -12.086 11.139 1.00 0.00 N ATOM 1048 CA VAL A 74 -17.605 -11.754 12.164 1.00 0.00 C ATOM 1049 C VAL A 74 -17.796 -12.912 13.136 1.00 0.00 C ATOM 1050 O VAL A 74 -18.026 -12.704 14.327 1.00 0.00 O ATOM 1051 CB VAL A 74 -18.966 -11.391 11.541 1.00 0.00 C ATOM 1052 CG1 VAL A 74 -19.942 -10.940 12.617 1.00 0.00 C ATOM 1053 CG2 VAL A 74 -18.795 -10.314 10.480 1.00 0.00 C ATOM 0 H VAL A 74 -16.971 -12.020 10.183 1.00 0.00 H new ATOM 0 HA VAL A 74 -17.220 -10.889 12.704 1.00 0.00 H new ATOM 0 HB VAL A 74 -19.376 -12.280 11.062 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -20.898 -10.688 12.158 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -20.086 -11.745 13.338 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -19.542 -10.064 13.127 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -19.766 -10.069 10.050 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -18.364 -9.422 10.934 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -18.132 -10.678 9.695 1.00 0.00 H new ATOM 1063 N GLN A 75 -17.699 -14.133 12.620 1.00 0.00 N ATOM 1064 CA GLN A 75 -17.862 -15.326 13.444 1.00 0.00 C ATOM 1065 C GLN A 75 -16.588 -15.625 14.226 1.00 0.00 C ATOM 1066 O GLN A 75 -16.524 -16.595 14.980 1.00 0.00 O ATOM 1067 CB GLN A 75 -18.234 -16.526 12.572 1.00 0.00 C ATOM 1068 CG GLN A 75 -19.617 -16.422 11.950 1.00 0.00 C ATOM 1069 CD GLN A 75 -19.874 -17.499 10.915 1.00 0.00 C ATOM 1070 OE1 GLN A 75 -20.891 -18.192 10.963 1.00 0.00 O ATOM 1071 NE2 GLN A 75 -18.952 -17.646 9.971 1.00 0.00 N ATOM 0 H GLN A 75 -17.509 -14.323 11.636 1.00 0.00 H new ATOM 0 HA GLN A 75 -18.667 -15.140 14.155 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -17.495 -16.630 11.778 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -18.184 -17.432 13.175 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -20.370 -16.491 12.735 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -19.729 -15.443 11.485 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -18.124 -17.050 9.969 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -19.071 -18.355 9.248 1.00 0.00 H new ATOM 1080 N GLY A 76 -15.574 -14.785 14.041 1.00 0.00 N ATOM 1081 CA GLY A 76 -14.314 -14.978 14.735 1.00 0.00 C ATOM 1082 C GLY A 76 -13.915 -13.769 15.558 1.00 0.00 C ATOM 1083 O GLY A 76 -13.012 -13.847 16.391 1.00 0.00 O ATOM 0 H GLY A 76 -15.603 -13.974 13.423 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -14.391 -15.848 15.387 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -13.531 -15.193 14.008 1.00 0.00 H new ATOM 1087 N MET A 77 -14.589 -12.647 15.324 1.00 0.00 N ATOM 1088 CA MET A 77 -14.299 -11.416 16.051 1.00 0.00 C ATOM 1089 C MET A 77 -14.980 -11.417 17.415 1.00 0.00 C ATOM 1090 O MET A 77 -15.973 -12.114 17.625 1.00 0.00 O ATOM 1091 CB MET A 77 -14.754 -10.201 15.240 1.00 0.00 C ATOM 1092 CG MET A 77 -13.906 -9.941 14.007 1.00 0.00 C ATOM 1093 SD MET A 77 -12.372 -9.073 14.389 1.00 0.00 S ATOM 1094 CE MET A 77 -13.009 -7.539 15.060 1.00 0.00 C ATOM 0 H MET A 77 -15.339 -12.565 14.637 1.00 0.00 H new ATOM 0 HA MET A 77 -13.221 -11.358 16.204 1.00 0.00 H new ATOM 0 HB2 MET A 77 -15.790 -10.346 14.934 1.00 0.00 H new ATOM 0 HB3 MET A 77 -14.731 -9.318 15.879 1.00 0.00 H new ATOM 0 HG2 MET A 77 -13.671 -10.890 13.525 1.00 0.00 H new ATOM 0 HG3 MET A 77 -14.482 -9.354 13.292 1.00 0.00 H new ATOM 0 HE1 MET A 77 -12.206 -6.803 15.112 1.00 0.00 H new ATOM 0 HE2 MET A 77 -13.805 -7.163 14.417 1.00 0.00 H new ATOM 0 HE3 MET A 77 -13.404 -7.716 16.060 1.00 0.00 H new ATOM 1104 N LYS A 78 -14.441 -10.631 18.341 1.00 0.00 N ATOM 1105 CA LYS A 78 -14.997 -10.540 19.686 1.00 0.00 C ATOM 1106 C LYS A 78 -15.281 -9.089 20.060 1.00 0.00 C ATOM 1107 O LYS A 78 -14.577 -8.176 19.626 1.00 0.00 O ATOM 1108 CB LYS A 78 -14.035 -11.161 20.701 1.00 0.00 C ATOM 1109 CG LYS A 78 -13.680 -12.606 20.398 1.00 0.00 C ATOM 1110 CD LYS A 78 -12.305 -12.967 20.935 1.00 0.00 C ATOM 1111 CE LYS A 78 -11.971 -14.428 20.675 1.00 0.00 C ATOM 1112 NZ LYS A 78 -12.806 -15.344 21.501 1.00 0.00 N ATOM 0 H LYS A 78 -13.619 -10.047 18.184 1.00 0.00 H new ATOM 0 HA LYS A 78 -15.937 -11.091 19.702 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -13.120 -10.569 20.731 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -14.482 -11.106 21.693 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -14.428 -13.265 20.838 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -13.705 -12.770 19.321 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -11.552 -12.332 20.468 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -12.268 -12.769 22.006 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -12.122 -14.653 19.619 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -10.917 -14.604 20.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -12.195 -15.884 22.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -13.488 -14.787 22.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -13.319 -16.001 20.879 1.00 0.00 H new ATOM 1126 N VAL A 79 -16.315 -8.882 20.869 1.00 0.00 N ATOM 1127 CA VAL A 79 -16.690 -7.542 21.304 1.00 0.00 C ATOM 1128 C VAL A 79 -15.486 -6.786 21.855 1.00 0.00 C ATOM 1129 O VAL A 79 -14.776 -7.281 22.729 1.00 0.00 O ATOM 1130 CB VAL A 79 -17.790 -7.588 22.381 1.00 0.00 C ATOM 1131 CG1 VAL A 79 -18.123 -6.185 22.865 1.00 0.00 C ATOM 1132 CG2 VAL A 79 -19.032 -8.285 21.844 1.00 0.00 C ATOM 0 H VAL A 79 -16.908 -9.626 21.237 1.00 0.00 H new ATOM 0 HA VAL A 79 -17.073 -7.020 20.427 1.00 0.00 H new ATOM 0 HB VAL A 79 -17.419 -8.161 23.231 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -18.902 -6.238 23.625 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -17.231 -5.726 23.291 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -18.475 -5.585 22.026 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -19.799 -8.309 22.618 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -19.408 -7.742 20.977 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -18.780 -9.304 21.552 1.00 0.00 H new ATOM 1142 N GLY A 80 -15.263 -5.582 21.338 1.00 0.00 N ATOM 1143 CA GLY A 80 -14.144 -4.776 21.790 1.00 0.00 C ATOM 1144 C GLY A 80 -12.853 -5.122 21.074 1.00 0.00 C ATOM 1145 O GLY A 80 -11.808 -4.532 21.345 1.00 0.00 O ATOM 0 H GLY A 80 -15.837 -5.150 20.614 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -14.372 -3.722 21.632 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -14.010 -4.916 22.863 1.00 0.00 H new ATOM 1149 N GLY A 81 -12.926 -6.082 20.158 1.00 0.00 N ATOM 1150 CA GLY A 81 -11.747 -6.490 19.417 1.00 0.00 C ATOM 1151 C GLY A 81 -11.683 -5.864 18.038 1.00 0.00 C ATOM 1152 O GLY A 81 -12.692 -5.783 17.337 1.00 0.00 O ATOM 0 H GLY A 81 -13.780 -6.584 19.916 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -10.855 -6.214 19.979 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -11.740 -7.576 19.320 1.00 0.00 H new ATOM 1156 N VAL A 82 -10.494 -5.416 17.647 1.00 0.00 N ATOM 1157 CA VAL A 82 -10.302 -4.792 16.344 1.00 0.00 C ATOM 1158 C VAL A 82 -9.070 -5.354 15.642 1.00 0.00 C ATOM 1159 O VAL A 82 -7.995 -5.446 16.233 1.00 0.00 O ATOM 1160 CB VAL A 82 -10.156 -3.264 16.468 1.00 0.00 C ATOM 1161 CG1 VAL A 82 -10.235 -2.607 15.099 1.00 0.00 C ATOM 1162 CG2 VAL A 82 -11.220 -2.703 17.400 1.00 0.00 C ATOM 0 H VAL A 82 -9.649 -5.474 18.215 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.189 -5.017 15.752 1.00 0.00 H new ATOM 0 HB VAL A 82 -9.177 -3.043 16.894 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.130 -1.527 15.207 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.434 -2.988 14.466 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.198 -2.834 14.642 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.103 -1.622 17.477 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.209 -2.934 17.004 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.111 -3.151 18.388 1.00 0.00 H new ATOM 1172 N ARG A 83 -9.235 -5.726 14.377 1.00 0.00 N ATOM 1173 CA ARG A 83 -8.137 -6.279 13.594 1.00 0.00 C ATOM 1174 C ARG A 83 -8.465 -6.253 12.104 1.00 0.00 C ATOM 1175 O ARG A 83 -9.627 -6.356 11.712 1.00 0.00 O ATOM 1176 CB ARG A 83 -7.838 -7.712 14.036 1.00 0.00 C ATOM 1177 CG ARG A 83 -9.050 -8.629 13.992 1.00 0.00 C ATOM 1178 CD ARG A 83 -8.640 -10.089 13.877 1.00 0.00 C ATOM 1179 NE ARG A 83 -7.580 -10.436 14.820 1.00 0.00 N ATOM 1180 CZ ARG A 83 -7.794 -10.691 16.105 1.00 0.00 C ATOM 1181 NH1 ARG A 83 -9.023 -10.639 16.599 1.00 0.00 N ATOM 1182 NH2 ARG A 83 -6.777 -10.999 16.900 1.00 0.00 N ATOM 0 H ARG A 83 -10.119 -5.654 13.873 1.00 0.00 H new ATOM 0 HA ARG A 83 -7.255 -5.662 13.765 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -7.057 -8.125 13.397 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -7.443 -7.695 15.052 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -9.647 -8.488 14.893 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -9.681 -8.359 13.145 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -9.507 -10.724 14.057 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -8.302 -10.292 12.861 1.00 0.00 H new ATOM 0 HE ARG A 83 -6.622 -10.485 14.472 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -9.807 -10.403 15.991 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -9.184 -10.835 17.587 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.830 -11.040 16.524 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -6.943 -11.195 17.887 1.00 0.00 H new ATOM 1196 N ARG A 84 -7.432 -6.114 11.278 1.00 0.00 N ATOM 1197 CA ARG A 84 -7.611 -6.073 9.832 1.00 0.00 C ATOM 1198 C ARG A 84 -7.478 -7.468 9.228 1.00 0.00 C ATOM 1199 O ARG A 84 -6.440 -8.118 9.361 1.00 0.00 O ATOM 1200 CB ARG A 84 -6.586 -5.131 9.197 1.00 0.00 C ATOM 1201 CG ARG A 84 -5.157 -5.399 9.639 1.00 0.00 C ATOM 1202 CD ARG A 84 -4.167 -4.525 8.884 1.00 0.00 C ATOM 1203 NE ARG A 84 -4.144 -3.157 9.395 1.00 0.00 N ATOM 1204 CZ ARG A 84 -3.193 -2.278 9.097 1.00 0.00 C ATOM 1205 NH1 ARG A 84 -2.195 -2.622 8.296 1.00 0.00 N ATOM 1206 NH2 ARG A 84 -3.241 -1.051 9.601 1.00 0.00 N ATOM 0 H ARG A 84 -6.463 -6.028 11.586 1.00 0.00 H new ATOM 0 HA ARG A 84 -8.614 -5.700 9.625 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -6.645 -5.222 8.112 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -6.847 -4.102 9.446 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -5.065 -5.214 10.709 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -4.915 -6.449 9.475 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -3.169 -4.958 8.961 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.428 -4.512 7.826 1.00 0.00 H new ATOM 0 HE ARG A 84 -4.899 -2.860 10.014 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -2.155 -3.564 7.906 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -1.467 -1.945 8.069 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -4.008 -0.782 10.217 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -2.511 -0.377 9.372 1.00 0.00 H new ATOM 1220 N LEU A 85 -8.535 -7.923 8.564 1.00 0.00 N ATOM 1221 CA LEU A 85 -8.538 -9.241 7.940 1.00 0.00 C ATOM 1222 C LEU A 85 -8.550 -9.123 6.419 1.00 0.00 C ATOM 1223 O LEU A 85 -9.361 -8.393 5.848 1.00 0.00 O ATOM 1224 CB LEU A 85 -9.749 -10.048 8.410 1.00 0.00 C ATOM 1225 CG LEU A 85 -9.733 -10.491 9.873 1.00 0.00 C ATOM 1226 CD1 LEU A 85 -10.541 -9.530 10.732 1.00 0.00 C ATOM 1227 CD2 LEU A 85 -10.272 -11.908 10.007 1.00 0.00 C ATOM 0 H LEU A 85 -9.401 -7.398 8.444 1.00 0.00 H new ATOM 0 HA LEU A 85 -7.627 -9.759 8.239 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -10.646 -9.451 8.242 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.834 -10.936 7.783 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.701 -10.480 10.224 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -10.518 -9.862 11.770 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -10.112 -8.530 10.661 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -11.573 -9.508 10.381 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.253 -12.207 11.055 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -11.297 -11.944 9.638 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.652 -12.590 9.424 1.00 0.00 H new ATOM 1239 N THR A 86 -7.647 -9.848 5.767 1.00 0.00 N ATOM 1240 CA THR A 86 -7.554 -9.826 4.313 1.00 0.00 C ATOM 1241 C THR A 86 -8.514 -10.831 3.685 1.00 0.00 C ATOM 1242 O THR A 86 -8.348 -12.041 3.838 1.00 0.00 O ATOM 1243 CB THR A 86 -6.122 -10.136 3.836 1.00 0.00 C ATOM 1244 OG1 THR A 86 -5.178 -9.369 4.592 1.00 0.00 O ATOM 1245 CG2 THR A 86 -5.966 -9.825 2.355 1.00 0.00 C ATOM 0 H THR A 86 -6.969 -10.458 6.224 1.00 0.00 H new ATOM 0 HA THR A 86 -7.826 -8.819 3.995 1.00 0.00 H new ATOM 0 HB THR A 86 -5.933 -11.198 3.990 1.00 0.00 H new ATOM 0 HG1 THR A 86 -4.291 -9.448 4.184 1.00 0.00 H new ATOM 0 HG21 THR A 86 -4.947 -10.052 2.041 1.00 0.00 H new ATOM 0 HG22 THR A 86 -6.666 -10.431 1.780 1.00 0.00 H new ATOM 0 HG23 THR A 86 -6.173 -8.769 2.181 1.00 0.00 H new ATOM 1253 N ILE A 87 -9.517 -10.321 2.979 1.00 0.00 N ATOM 1254 CA ILE A 87 -10.503 -11.175 2.327 1.00 0.00 C ATOM 1255 C ILE A 87 -10.145 -11.409 0.863 1.00 0.00 C ATOM 1256 O ILE A 87 -10.267 -10.521 0.019 1.00 0.00 O ATOM 1257 CB ILE A 87 -11.915 -10.566 2.407 1.00 0.00 C ATOM 1258 CG1 ILE A 87 -12.348 -10.417 3.867 1.00 0.00 C ATOM 1259 CG2 ILE A 87 -12.907 -11.428 1.641 1.00 0.00 C ATOM 1260 CD1 ILE A 87 -13.646 -9.660 4.038 1.00 0.00 C ATOM 0 H ILE A 87 -9.669 -9.321 2.844 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.496 -12.127 2.857 1.00 0.00 H new ATOM 0 HB ILE A 87 -11.894 -9.576 1.951 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -12.454 -11.408 4.309 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.562 -9.903 4.420 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -13.901 -10.985 1.707 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -12.605 -11.489 0.595 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -12.927 -12.429 2.071 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -13.891 -9.593 5.098 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -13.539 -8.657 3.626 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -14.445 -10.184 3.513 1.00 0.00 H new ATOM 1272 N PRO A 88 -9.692 -12.633 0.553 1.00 0.00 N ATOM 1273 CA PRO A 88 -9.309 -13.014 -0.809 1.00 0.00 C ATOM 1274 C PRO A 88 -10.511 -13.115 -1.742 1.00 0.00 C ATOM 1275 O PRO A 88 -11.665 -13.060 -1.316 1.00 0.00 O ATOM 1276 CB PRO A 88 -8.659 -14.387 -0.624 1.00 0.00 C ATOM 1277 CG PRO A 88 -9.266 -14.928 0.624 1.00 0.00 C ATOM 1278 CD PRO A 88 -9.521 -13.740 1.509 1.00 0.00 C ATOM 0 HA PRO A 88 -8.653 -12.275 -1.270 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -8.859 -15.037 -1.476 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -7.576 -14.303 -0.534 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -10.193 -15.460 0.408 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -8.596 -15.638 1.108 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -10.410 -13.881 2.124 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -8.688 -13.559 2.189 1.00 0.00 H new ATOM 1286 N PRO A 89 -10.238 -13.266 -3.047 1.00 0.00 N ATOM 1287 CA PRO A 89 -11.284 -13.379 -4.067 1.00 0.00 C ATOM 1288 C PRO A 89 -12.046 -14.696 -3.974 1.00 0.00 C ATOM 1289 O PRO A 89 -13.247 -14.749 -4.236 1.00 0.00 O ATOM 1290 CB PRO A 89 -10.506 -13.303 -5.383 1.00 0.00 C ATOM 1291 CG PRO A 89 -9.137 -13.780 -5.041 1.00 0.00 C ATOM 1292 CD PRO A 89 -8.886 -13.339 -3.626 1.00 0.00 C ATOM 0 HA PRO A 89 -12.043 -12.604 -3.959 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -10.963 -13.928 -6.150 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -10.485 -12.285 -5.772 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -9.068 -14.864 -5.130 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -8.396 -13.357 -5.719 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -8.257 -14.049 -3.089 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -8.380 -12.374 -3.589 1.00 0.00 H new ATOM 1300 N GLN A 90 -11.339 -15.757 -3.597 1.00 0.00 N ATOM 1301 CA GLN A 90 -11.950 -17.075 -3.470 1.00 0.00 C ATOM 1302 C GLN A 90 -12.961 -17.098 -2.328 1.00 0.00 C ATOM 1303 O GLN A 90 -13.734 -18.047 -2.189 1.00 0.00 O ATOM 1304 CB GLN A 90 -10.875 -18.138 -3.236 1.00 0.00 C ATOM 1305 CG GLN A 90 -9.919 -17.798 -2.104 1.00 0.00 C ATOM 1306 CD GLN A 90 -9.381 -19.031 -1.404 1.00 0.00 C ATOM 1307 OE1 GLN A 90 -9.844 -20.146 -1.643 1.00 0.00 O ATOM 1308 NE2 GLN A 90 -8.398 -18.835 -0.533 1.00 0.00 N ATOM 0 H GLN A 90 -10.344 -15.730 -3.374 1.00 0.00 H new ATOM 0 HA GLN A 90 -12.474 -17.296 -4.400 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -11.359 -19.090 -3.018 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -10.304 -18.273 -4.154 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -9.086 -17.217 -2.499 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -10.432 -17.167 -1.378 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -8.045 -17.893 -0.366 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -7.996 -19.627 -0.031 1.00 0.00 H new ATOM 1317 N LEU A 91 -12.950 -16.049 -1.514 1.00 0.00 N ATOM 1318 CA LEU A 91 -13.867 -15.948 -0.383 1.00 0.00 C ATOM 1319 C LEU A 91 -14.651 -14.641 -0.433 1.00 0.00 C ATOM 1320 O LEU A 91 -15.370 -14.301 0.506 1.00 0.00 O ATOM 1321 CB LEU A 91 -13.095 -16.044 0.934 1.00 0.00 C ATOM 1322 CG LEU A 91 -12.825 -17.457 1.452 1.00 0.00 C ATOM 1323 CD1 LEU A 91 -11.581 -18.037 0.797 1.00 0.00 C ATOM 1324 CD2 LEU A 91 -12.679 -17.451 2.967 1.00 0.00 C ATOM 0 H LEU A 91 -12.317 -15.256 -1.615 1.00 0.00 H new ATOM 0 HA LEU A 91 -14.573 -16.776 -0.444 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -12.139 -15.535 0.810 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -13.649 -15.498 1.698 1.00 0.00 H new ATOM 0 HG LEU A 91 -13.675 -18.087 1.192 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -11.405 -19.043 1.178 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -11.724 -18.078 -0.283 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -10.722 -17.407 1.026 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -12.487 -18.465 3.318 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -11.847 -16.806 3.250 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -13.598 -17.078 3.420 1.00 0.00 H new ATOM 1336 N GLY A 92 -14.508 -13.912 -1.536 1.00 0.00 N ATOM 1337 CA GLY A 92 -15.210 -12.651 -1.688 1.00 0.00 C ATOM 1338 C GLY A 92 -15.917 -12.539 -3.024 1.00 0.00 C ATOM 1339 O GLY A 92 -17.047 -13.002 -3.177 1.00 0.00 O ATOM 0 H GLY A 92 -13.919 -14.172 -2.327 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -15.939 -12.545 -0.885 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -14.501 -11.829 -1.585 1.00 0.00 H new ATOM 1343 N TYR A 93 -15.251 -11.921 -3.993 1.00 0.00 N ATOM 1344 CA TYR A 93 -15.824 -11.745 -5.322 1.00 0.00 C ATOM 1345 C TYR A 93 -15.498 -12.936 -6.218 1.00 0.00 C ATOM 1346 O TYR A 93 -16.382 -13.704 -6.595 1.00 0.00 O ATOM 1347 CB TYR A 93 -15.303 -10.456 -5.959 1.00 0.00 C ATOM 1348 CG TYR A 93 -15.871 -9.200 -5.338 1.00 0.00 C ATOM 1349 CD1 TYR A 93 -17.224 -9.100 -5.039 1.00 0.00 C ATOM 1350 CD2 TYR A 93 -15.054 -8.114 -5.048 1.00 0.00 C ATOM 1351 CE1 TYR A 93 -17.747 -7.954 -4.472 1.00 0.00 C ATOM 1352 CE2 TYR A 93 -15.568 -6.965 -4.480 1.00 0.00 C ATOM 1353 CZ TYR A 93 -16.915 -6.890 -4.194 1.00 0.00 C ATOM 1354 OH TYR A 93 -17.432 -5.747 -3.627 1.00 0.00 O ATOM 0 H TYR A 93 -14.314 -11.534 -3.883 1.00 0.00 H new ATOM 0 HA TYR A 93 -16.907 -11.678 -5.217 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -14.216 -10.433 -5.875 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -15.541 -10.465 -7.023 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -17.878 -9.932 -5.253 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -13.999 -8.170 -5.271 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -18.802 -7.892 -4.248 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -14.919 -6.130 -4.261 1.00 0.00 H new ATOM 0 HH TYR A 93 -18.326 -5.934 -3.272 1.00 0.00 H new ATOM 1364 N GLY A 94 -14.220 -13.083 -6.554 1.00 0.00 N ATOM 1365 CA GLY A 94 -13.798 -14.183 -7.402 1.00 0.00 C ATOM 1366 C GLY A 94 -13.373 -13.721 -8.782 1.00 0.00 C ATOM 1367 O GLY A 94 -13.292 -12.521 -9.044 1.00 0.00 O ATOM 0 H GLY A 94 -13.470 -12.460 -6.254 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.969 -14.707 -6.926 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.615 -14.898 -7.497 1.00 0.00 H new ATOM 1371 N ALA A 95 -13.099 -14.675 -9.665 1.00 0.00 N ATOM 1372 CA ALA A 95 -12.680 -14.360 -11.025 1.00 0.00 C ATOM 1373 C ALA A 95 -13.767 -13.594 -11.771 1.00 0.00 C ATOM 1374 O ALA A 95 -13.504 -12.964 -12.796 1.00 0.00 O ATOM 1375 CB ALA A 95 -12.320 -15.633 -11.776 1.00 0.00 C ATOM 0 H ALA A 95 -13.160 -15.673 -9.463 1.00 0.00 H new ATOM 0 HA ALA A 95 -11.797 -13.723 -10.967 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.009 -15.382 -12.790 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -11.504 -16.141 -11.262 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -13.189 -16.290 -11.815 1.00 0.00 H new ATOM 1381 N ARG A 96 -14.989 -13.653 -11.251 1.00 0.00 N ATOM 1382 CA ARG A 96 -16.116 -12.966 -11.869 1.00 0.00 C ATOM 1383 C ARG A 96 -15.948 -11.452 -11.777 1.00 0.00 C ATOM 1384 O ARG A 96 -16.613 -10.699 -12.486 1.00 0.00 O ATOM 1385 CB ARG A 96 -17.426 -13.386 -11.200 1.00 0.00 C ATOM 1386 CG ARG A 96 -18.649 -13.197 -12.082 1.00 0.00 C ATOM 1387 CD ARG A 96 -18.801 -14.339 -13.075 1.00 0.00 C ATOM 1388 NE ARG A 96 -18.062 -14.092 -14.310 1.00 0.00 N ATOM 1389 CZ ARG A 96 -18.393 -13.153 -15.190 1.00 0.00 C ATOM 1390 NH1 ARG A 96 -19.445 -12.376 -14.971 1.00 0.00 N ATOM 1391 NH2 ARG A 96 -17.671 -12.989 -16.291 1.00 0.00 N ATOM 0 H ARG A 96 -15.223 -14.170 -10.403 1.00 0.00 H new ATOM 0 HA ARG A 96 -16.147 -13.247 -12.922 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -17.356 -14.434 -10.910 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -17.557 -12.810 -10.284 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -19.542 -13.133 -11.460 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -18.568 -12.253 -12.621 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -18.448 -15.264 -12.620 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -19.857 -14.480 -13.306 1.00 0.00 H new ATOM 0 HE ARG A 96 -17.247 -14.672 -14.508 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -20.002 -12.498 -14.125 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -19.697 -11.656 -15.648 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -16.861 -13.584 -16.463 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -17.926 -12.268 -16.966 1.00 0.00 H new ATOM 1405 N GLY A 97 -15.053 -11.014 -10.896 1.00 0.00 N ATOM 1406 CA GLY A 97 -14.814 -9.593 -10.727 1.00 0.00 C ATOM 1407 C GLY A 97 -16.094 -8.811 -10.507 1.00 0.00 C ATOM 1408 O GLY A 97 -17.159 -9.395 -10.311 1.00 0.00 O ATOM 0 H GLY A 97 -14.490 -11.618 -10.297 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -14.147 -9.438 -9.879 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -14.303 -9.206 -11.609 1.00 0.00 H new ATOM 1412 N ALA A 98 -15.990 -7.487 -10.537 1.00 0.00 N ATOM 1413 CA ALA A 98 -17.148 -6.625 -10.340 1.00 0.00 C ATOM 1414 C ALA A 98 -17.342 -5.686 -11.526 1.00 0.00 C ATOM 1415 O ALA A 98 -17.449 -4.472 -11.358 1.00 0.00 O ATOM 1416 CB ALA A 98 -17.000 -5.828 -9.052 1.00 0.00 C ATOM 0 H ALA A 98 -15.115 -6.988 -10.696 1.00 0.00 H new ATOM 0 HA ALA A 98 -18.032 -7.258 -10.263 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -17.872 -5.188 -8.918 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.919 -6.513 -8.208 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.103 -5.211 -9.107 1.00 0.00 H new ATOM 1422 N GLY A 99 -17.386 -6.257 -12.726 1.00 0.00 N ATOM 1423 CA GLY A 99 -17.566 -5.455 -13.923 1.00 0.00 C ATOM 1424 C GLY A 99 -16.327 -4.658 -14.279 1.00 0.00 C ATOM 1425 O GLY A 99 -15.213 -5.179 -14.239 1.00 0.00 O ATOM 0 H GLY A 99 -17.300 -7.260 -12.891 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -17.827 -6.106 -14.757 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -18.403 -4.773 -13.777 1.00 0.00 H new ATOM 1429 N GLY A 100 -16.521 -3.391 -14.630 1.00 0.00 N ATOM 1430 CA GLY A 100 -15.401 -2.542 -14.992 1.00 0.00 C ATOM 1431 C GLY A 100 -14.392 -2.404 -13.869 1.00 0.00 C ATOM 1432 O GLY A 100 -13.250 -2.002 -14.096 1.00 0.00 O ATOM 0 H GLY A 100 -17.434 -2.937 -14.670 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -14.907 -2.953 -15.872 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -15.771 -1.554 -15.267 1.00 0.00 H new ATOM 1436 N VAL A 101 -14.813 -2.736 -12.653 1.00 0.00 N ATOM 1437 CA VAL A 101 -13.937 -2.646 -11.490 1.00 0.00 C ATOM 1438 C VAL A 101 -13.800 -3.999 -10.800 1.00 0.00 C ATOM 1439 O VAL A 101 -14.668 -4.863 -10.928 1.00 0.00 O ATOM 1440 CB VAL A 101 -14.459 -1.614 -10.473 1.00 0.00 C ATOM 1441 CG1 VAL A 101 -15.744 -2.106 -9.824 1.00 0.00 C ATOM 1442 CG2 VAL A 101 -13.400 -1.320 -9.421 1.00 0.00 C ATOM 0 H VAL A 101 -15.755 -3.070 -12.447 1.00 0.00 H new ATOM 0 HA VAL A 101 -12.960 -2.325 -11.853 1.00 0.00 H new ATOM 0 HB VAL A 101 -14.679 -0.687 -11.003 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -16.098 -1.364 -9.109 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -16.503 -2.261 -10.591 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -15.553 -3.046 -9.307 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -13.786 -0.589 -8.711 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -13.146 -2.239 -8.893 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -12.508 -0.921 -9.904 1.00 0.00 H new ATOM 1452 N ILE A 102 -12.706 -4.175 -10.068 1.00 0.00 N ATOM 1453 CA ILE A 102 -12.456 -5.422 -9.356 1.00 0.00 C ATOM 1454 C ILE A 102 -12.160 -6.560 -10.328 1.00 0.00 C ATOM 1455 O ILE A 102 -13.053 -7.291 -10.756 1.00 0.00 O ATOM 1456 CB ILE A 102 -13.654 -5.815 -8.472 1.00 0.00 C ATOM 1457 CG1 ILE A 102 -14.159 -4.601 -7.690 1.00 0.00 C ATOM 1458 CG2 ILE A 102 -13.265 -6.939 -7.522 1.00 0.00 C ATOM 1459 CD1 ILE A 102 -13.066 -3.860 -6.952 1.00 0.00 C ATOM 0 H ILE A 102 -11.978 -3.470 -9.952 1.00 0.00 H new ATOM 0 HA ILE A 102 -11.586 -5.254 -8.721 1.00 0.00 H new ATOM 0 HB ILE A 102 -14.460 -6.170 -9.115 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -14.651 -3.914 -8.379 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -14.913 -4.928 -6.974 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -14.122 -7.206 -6.904 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -12.948 -7.809 -8.098 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -12.446 -6.608 -6.883 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -13.497 -3.012 -6.420 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -12.589 -4.532 -6.238 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -12.324 -3.502 -7.665 1.00 0.00 H new ATOM 1471 N PRO A 103 -10.876 -6.716 -10.683 1.00 0.00 N ATOM 1472 CA PRO A 103 -10.433 -7.765 -11.606 1.00 0.00 C ATOM 1473 C PRO A 103 -10.534 -9.158 -10.993 1.00 0.00 C ATOM 1474 O PRO A 103 -10.812 -9.320 -9.805 1.00 0.00 O ATOM 1475 CB PRO A 103 -8.969 -7.405 -11.875 1.00 0.00 C ATOM 1476 CG PRO A 103 -8.542 -6.633 -10.674 1.00 0.00 C ATOM 1477 CD PRO A 103 -9.759 -5.881 -10.211 1.00 0.00 C ATOM 0 HA PRO A 103 -11.049 -7.804 -12.504 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -8.360 -8.299 -12.008 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -8.868 -6.812 -12.784 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -8.174 -7.298 -9.893 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -7.730 -5.948 -10.919 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -9.773 -5.767 -9.127 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -9.798 -4.879 -10.637 1.00 0.00 H new ATOM 1485 N PRO A 104 -10.305 -10.188 -11.821 1.00 0.00 N ATOM 1486 CA PRO A 104 -10.364 -11.585 -11.382 1.00 0.00 C ATOM 1487 C PRO A 104 -9.213 -11.949 -10.451 1.00 0.00 C ATOM 1488 O PRO A 104 -8.047 -11.728 -10.775 1.00 0.00 O ATOM 1489 CB PRO A 104 -10.264 -12.373 -12.690 1.00 0.00 C ATOM 1490 CG PRO A 104 -9.550 -11.461 -13.627 1.00 0.00 C ATOM 1491 CD PRO A 104 -9.969 -10.067 -13.250 1.00 0.00 C ATOM 0 HA PRO A 104 -11.268 -11.795 -10.811 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -9.716 -13.305 -12.550 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -11.251 -12.637 -13.070 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -8.470 -11.580 -13.540 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -9.813 -11.681 -14.662 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -9.167 -9.348 -13.415 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -10.824 -9.731 -13.837 1.00 0.00 H new ATOM 1499 N ASN A 105 -9.548 -12.509 -9.293 1.00 0.00 N ATOM 1500 CA ASN A 105 -8.541 -12.904 -8.315 1.00 0.00 C ATOM 1501 C ASN A 105 -8.043 -11.695 -7.528 1.00 0.00 C ATOM 1502 O ASN A 105 -7.064 -11.784 -6.789 1.00 0.00 O ATOM 1503 CB ASN A 105 -7.366 -13.592 -9.012 1.00 0.00 C ATOM 1504 CG ASN A 105 -6.747 -14.683 -8.159 1.00 0.00 C ATOM 1505 OD1 ASN A 105 -5.626 -14.543 -7.669 1.00 0.00 O ATOM 1506 ND2 ASN A 105 -7.476 -15.779 -7.979 1.00 0.00 N ATOM 0 H ASN A 105 -10.509 -12.699 -9.009 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.002 -13.604 -7.618 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -7.706 -14.021 -9.955 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -6.606 -12.850 -9.255 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -7.111 -16.547 -7.416 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -8.400 -15.852 -8.404 1.00 0.00 H new ATOM 1513 N ALA A 106 -8.726 -10.567 -7.693 1.00 0.00 N ATOM 1514 CA ALA A 106 -8.355 -9.341 -6.997 1.00 0.00 C ATOM 1515 C ALA A 106 -8.669 -9.439 -5.508 1.00 0.00 C ATOM 1516 O ALA A 106 -9.833 -9.436 -5.106 1.00 0.00 O ATOM 1517 CB ALA A 106 -9.070 -8.148 -7.612 1.00 0.00 C ATOM 0 H ALA A 106 -9.539 -10.477 -8.302 1.00 0.00 H new ATOM 0 HA ALA A 106 -7.280 -9.201 -7.106 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -8.784 -7.239 -7.082 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -8.792 -8.059 -8.662 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -10.148 -8.289 -7.533 1.00 0.00 H new ATOM 1523 N THR A 107 -7.624 -9.527 -4.691 1.00 0.00 N ATOM 1524 CA THR A 107 -7.788 -9.628 -3.247 1.00 0.00 C ATOM 1525 C THR A 107 -8.166 -8.281 -2.641 1.00 0.00 C ATOM 1526 O THR A 107 -7.725 -7.231 -3.111 1.00 0.00 O ATOM 1527 CB THR A 107 -6.503 -10.140 -2.569 1.00 0.00 C ATOM 1528 OG1 THR A 107 -6.096 -11.378 -3.163 1.00 0.00 O ATOM 1529 CG2 THR A 107 -6.719 -10.334 -1.076 1.00 0.00 C ATOM 0 H THR A 107 -6.654 -9.530 -5.006 1.00 0.00 H new ATOM 0 HA THR A 107 -8.592 -10.342 -3.070 1.00 0.00 H new ATOM 0 HB THR A 107 -5.721 -9.394 -2.712 1.00 0.00 H new ATOM 0 HG1 THR A 107 -5.278 -11.696 -2.728 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.798 -10.696 -0.619 1.00 0.00 H new ATOM 0 HG22 THR A 107 -7.000 -9.383 -0.622 1.00 0.00 H new ATOM 0 HG23 THR A 107 -7.514 -11.062 -0.915 1.00 0.00 H new ATOM 1537 N LEU A 108 -8.985 -8.317 -1.596 1.00 0.00 N ATOM 1538 CA LEU A 108 -9.423 -7.098 -0.924 1.00 0.00 C ATOM 1539 C LEU A 108 -9.302 -7.237 0.590 1.00 0.00 C ATOM 1540 O LEU A 108 -9.587 -8.294 1.151 1.00 0.00 O ATOM 1541 CB LEU A 108 -10.869 -6.773 -1.305 1.00 0.00 C ATOM 1542 CG LEU A 108 -11.216 -6.895 -2.789 1.00 0.00 C ATOM 1543 CD1 LEU A 108 -12.723 -6.852 -2.990 1.00 0.00 C ATOM 1544 CD2 LEU A 108 -10.538 -5.791 -3.587 1.00 0.00 C ATOM 0 H LEU A 108 -9.359 -9.177 -1.195 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.777 -6.282 -1.248 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -11.529 -7.434 -0.743 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -11.088 -5.755 -0.984 1.00 0.00 H new ATOM 0 HG LEU A 108 -10.849 -7.856 -3.151 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -12.951 -6.940 -4.052 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -13.186 -7.678 -2.450 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -13.114 -5.907 -2.612 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -10.796 -5.893 -4.641 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -10.875 -4.820 -3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -9.457 -5.868 -3.469 1.00 0.00 H new ATOM 1556 N VAL A 109 -8.879 -6.161 1.246 1.00 0.00 N ATOM 1557 CA VAL A 109 -8.724 -6.161 2.696 1.00 0.00 C ATOM 1558 C VAL A 109 -9.876 -5.427 3.372 1.00 0.00 C ATOM 1559 O VAL A 109 -10.446 -4.491 2.809 1.00 0.00 O ATOM 1560 CB VAL A 109 -7.395 -5.508 3.118 1.00 0.00 C ATOM 1561 CG1 VAL A 109 -6.913 -6.084 4.440 1.00 0.00 C ATOM 1562 CG2 VAL A 109 -6.344 -5.690 2.033 1.00 0.00 C ATOM 0 H VAL A 109 -8.637 -5.278 0.796 1.00 0.00 H new ATOM 0 HA VAL A 109 -8.725 -7.203 3.014 1.00 0.00 H new ATOM 0 HB VAL A 109 -7.562 -4.440 3.254 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -5.973 -5.610 4.722 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -7.659 -5.897 5.212 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -6.761 -7.158 4.335 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -5.411 -5.222 2.348 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -6.177 -6.754 1.863 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -6.690 -5.225 1.110 1.00 0.00 H new ATOM 1572 N PHE A 110 -10.214 -5.856 4.583 1.00 0.00 N ATOM 1573 CA PHE A 110 -11.300 -5.240 5.337 1.00 0.00 C ATOM 1574 C PHE A 110 -11.003 -5.262 6.834 1.00 0.00 C ATOM 1575 O PHE A 110 -10.604 -6.288 7.383 1.00 0.00 O ATOM 1576 CB PHE A 110 -12.619 -5.962 5.057 1.00 0.00 C ATOM 1577 CG PHE A 110 -13.306 -5.493 3.807 1.00 0.00 C ATOM 1578 CD1 PHE A 110 -12.960 -6.018 2.572 1.00 0.00 C ATOM 1579 CD2 PHE A 110 -14.296 -4.526 3.866 1.00 0.00 C ATOM 1580 CE1 PHE A 110 -13.591 -5.588 1.419 1.00 0.00 C ATOM 1581 CE2 PHE A 110 -14.930 -4.093 2.717 1.00 0.00 C ATOM 1582 CZ PHE A 110 -14.576 -4.624 1.492 1.00 0.00 C ATOM 0 H PHE A 110 -9.752 -6.628 5.064 1.00 0.00 H new ATOM 0 HA PHE A 110 -11.388 -4.202 5.016 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -12.428 -7.032 4.977 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -13.289 -5.820 5.905 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -12.189 -6.771 2.509 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -14.576 -4.106 4.821 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -13.313 -6.006 0.463 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -15.702 -3.340 2.777 1.00 0.00 H new ATOM 0 HZ PHE A 110 -15.069 -4.285 0.593 1.00 0.00 H new ATOM 1592 N GLU A 111 -11.200 -4.121 7.487 1.00 0.00 N ATOM 1593 CA GLU A 111 -10.952 -4.009 8.920 1.00 0.00 C ATOM 1594 C GLU A 111 -12.238 -4.224 9.713 1.00 0.00 C ATOM 1595 O GLU A 111 -13.249 -3.565 9.470 1.00 0.00 O ATOM 1596 CB GLU A 111 -10.359 -2.638 9.252 1.00 0.00 C ATOM 1597 CG GLU A 111 -10.107 -2.427 10.735 1.00 0.00 C ATOM 1598 CD GLU A 111 -11.186 -1.592 11.397 1.00 0.00 C ATOM 1599 OE1 GLU A 111 -11.181 -0.358 11.206 1.00 0.00 O ATOM 1600 OE2 GLU A 111 -12.034 -2.172 12.106 1.00 0.00 O ATOM 0 H GLU A 111 -11.530 -3.262 7.047 1.00 0.00 H new ATOM 0 HA GLU A 111 -10.238 -4.783 9.201 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -9.420 -2.517 8.712 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -11.035 -1.862 8.893 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.047 -3.396 11.231 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -9.141 -1.939 10.870 1.00 0.00 H new ATOM 1607 N VAL A 112 -12.192 -5.154 10.663 1.00 0.00 N ATOM 1608 CA VAL A 112 -13.352 -5.457 11.493 1.00 0.00 C ATOM 1609 C VAL A 112 -13.144 -4.975 12.924 1.00 0.00 C ATOM 1610 O VAL A 112 -12.114 -5.249 13.538 1.00 0.00 O ATOM 1611 CB VAL A 112 -13.650 -6.968 11.510 1.00 0.00 C ATOM 1612 CG1 VAL A 112 -15.074 -7.226 11.979 1.00 0.00 C ATOM 1613 CG2 VAL A 112 -13.416 -7.572 10.133 1.00 0.00 C ATOM 0 H VAL A 112 -11.364 -5.710 10.876 1.00 0.00 H new ATOM 0 HA VAL A 112 -14.201 -4.932 11.055 1.00 0.00 H new ATOM 0 HB VAL A 112 -12.969 -7.448 12.213 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -15.266 -8.299 11.985 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -15.203 -6.829 12.986 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -15.774 -6.735 11.303 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -13.631 -8.640 10.163 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -14.072 -7.090 9.408 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -12.377 -7.419 9.840 1.00 0.00 H new ATOM 1623 N GLU A 113 -14.131 -4.255 13.449 1.00 0.00 N ATOM 1624 CA GLU A 113 -14.056 -3.735 14.809 1.00 0.00 C ATOM 1625 C GLU A 113 -15.357 -3.993 15.564 1.00 0.00 C ATOM 1626 O GLU A 113 -16.355 -3.300 15.359 1.00 0.00 O ATOM 1627 CB GLU A 113 -13.754 -2.235 14.789 1.00 0.00 C ATOM 1628 CG GLU A 113 -14.021 -1.542 16.115 1.00 0.00 C ATOM 1629 CD GLU A 113 -13.270 -0.232 16.250 1.00 0.00 C ATOM 1630 OE1 GLU A 113 -12.721 0.246 15.235 1.00 0.00 O ATOM 1631 OE2 GLU A 113 -13.230 0.315 17.372 1.00 0.00 O ATOM 0 H GLU A 113 -14.991 -4.019 12.954 1.00 0.00 H new ATOM 0 HA GLU A 113 -13.248 -4.255 15.325 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -12.709 -2.087 14.515 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -14.357 -1.762 14.014 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -15.090 -1.355 16.214 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -13.736 -2.206 16.931 1.00 0.00 H new ATOM 1638 N LEU A 114 -15.339 -4.995 16.436 1.00 0.00 N ATOM 1639 CA LEU A 114 -16.517 -5.346 17.221 1.00 0.00 C ATOM 1640 C LEU A 114 -16.802 -4.286 18.280 1.00 0.00 C ATOM 1641 O LEU A 114 -15.918 -3.911 19.052 1.00 0.00 O ATOM 1642 CB LEU A 114 -16.322 -6.709 17.888 1.00 0.00 C ATOM 1643 CG LEU A 114 -17.566 -7.593 17.985 1.00 0.00 C ATOM 1644 CD1 LEU A 114 -18.789 -6.757 18.328 1.00 0.00 C ATOM 1645 CD2 LEU A 114 -17.784 -8.352 16.684 1.00 0.00 C ATOM 0 H LEU A 114 -14.522 -5.578 16.617 1.00 0.00 H new ATOM 0 HA LEU A 114 -17.371 -5.397 16.545 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -15.555 -7.254 17.337 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -15.937 -6.547 18.895 1.00 0.00 H new ATOM 0 HG LEU A 114 -17.411 -8.318 18.784 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -19.665 -7.403 18.393 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -18.633 -6.260 19.285 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -18.947 -6.008 17.552 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -18.674 -8.976 16.771 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -17.917 -7.643 15.867 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -16.918 -8.982 16.481 1.00 0.00 H new ATOM 1657 N LEU A 115 -18.041 -3.808 18.313 1.00 0.00 N ATOM 1658 CA LEU A 115 -18.444 -2.792 19.279 1.00 0.00 C ATOM 1659 C LEU A 115 -19.231 -3.414 20.428 1.00 0.00 C ATOM 1660 O LEU A 115 -18.977 -3.123 21.597 1.00 0.00 O ATOM 1661 CB LEU A 115 -19.286 -1.714 18.594 1.00 0.00 C ATOM 1662 CG LEU A 115 -18.628 -0.998 17.413 1.00 0.00 C ATOM 1663 CD1 LEU A 115 -19.109 -1.588 16.097 1.00 0.00 C ATOM 1664 CD2 LEU A 115 -18.916 0.495 17.468 1.00 0.00 C ATOM 0 H LEU A 115 -18.784 -4.108 17.682 1.00 0.00 H new ATOM 0 HA LEU A 115 -17.542 -2.336 19.686 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -20.212 -2.171 18.246 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -19.560 -0.967 19.339 1.00 0.00 H new ATOM 0 HG LEU A 115 -17.550 -1.142 17.479 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -18.631 -1.066 15.268 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -18.851 -2.646 16.057 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -20.190 -1.475 16.021 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -18.440 0.989 16.621 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -19.993 0.660 17.426 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -18.521 0.908 18.396 1.00 0.00 H new ATOM 1676 N ASP A 116 -20.184 -4.274 20.087 1.00 0.00 N ATOM 1677 CA ASP A 116 -21.006 -4.941 21.090 1.00 0.00 C ATOM 1678 C ASP A 116 -21.964 -5.932 20.436 1.00 0.00 C ATOM 1679 O ASP A 116 -22.109 -5.957 19.213 1.00 0.00 O ATOM 1680 CB ASP A 116 -21.794 -3.911 21.902 1.00 0.00 C ATOM 1681 CG ASP A 116 -21.995 -4.340 23.341 1.00 0.00 C ATOM 1682 OD1 ASP A 116 -21.112 -5.038 23.881 1.00 0.00 O ATOM 1683 OD2 ASP A 116 -23.037 -3.979 23.929 1.00 0.00 O ATOM 0 H ASP A 116 -20.407 -4.526 19.124 1.00 0.00 H new ATOM 0 HA ASP A 116 -20.344 -5.491 21.759 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -21.268 -2.956 21.881 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -22.766 -3.750 21.435 1.00 0.00 H new ATOM 1688 N VAL A 117 -22.616 -6.748 21.258 1.00 0.00 N ATOM 1689 CA VAL A 117 -23.560 -7.741 20.760 1.00 0.00 C ATOM 1690 C VAL A 117 -24.990 -7.382 21.148 1.00 0.00 C ATOM 1691 O VAL A 117 -25.217 -6.940 22.273 1.00 0.00 O ATOM 1692 CB VAL A 117 -23.231 -9.147 21.296 1.00 0.00 C ATOM 1693 CG1 VAL A 117 -21.816 -9.548 20.911 1.00 0.00 C ATOM 1694 CG2 VAL A 117 -23.417 -9.197 22.805 1.00 0.00 C ATOM 0 H VAL A 117 -22.508 -6.741 22.272 1.00 0.00 H new ATOM 0 HA VAL A 117 -23.472 -7.745 19.674 1.00 0.00 H new ATOM 0 HB VAL A 117 -23.920 -9.860 20.844 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -21.602 -10.544 21.298 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -21.722 -9.553 19.825 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -21.108 -8.835 21.333 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -23.181 -10.197 23.168 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -22.753 -8.473 23.278 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -24.451 -8.956 23.052 1.00 0.00 H new TER 1704 VAL A 117 HETATM 1705 N1 JZF A 130 -21.460 -6.536 -0.084 1.00 0.00 N HETATM 1706 O1 JZF A 130 -20.139 -3.486 -4.470 1.00 0.00 O HETATM 1707 C2 JZF A 130 -20.181 -6.961 -0.332 1.00 0.00 C HETATM 1708 O2 JZF A 130 -19.910 -8.142 -0.405 1.00 0.00 O HETATM 1709 C3 JZF A 130 -19.066 -5.946 -0.507 1.00 0.00 C HETATM 1710 O3 JZF A 130 -22.963 -4.870 0.169 1.00 0.00 O HETATM 1711 C4 JZF A 130 -19.587 -4.630 -1.102 1.00 0.00 C HETATM 1712 O4 JZF A 130 -24.020 -7.157 -1.712 1.00 0.00 O HETATM 1713 C5 JZF A 130 -20.770 -4.136 -0.253 1.00 0.00 C HETATM 1714 O5 JZF A 130 -22.980 -9.168 -1.568 1.00 0.00 O HETATM 1715 C6 JZF A 130 -21.818 -5.213 -0.051 1.00 0.00 C HETATM 1716 C7 JZF A 130 -18.467 -3.575 -1.369 1.00 0.00 C HETATM 1717 C8 JZF A 130 -18.694 -2.367 -2.332 1.00 0.00 C HETATM 1718 C9 JZF A 130 -18.065 -2.462 -3.767 1.00 0.00 C HETATM 1719 OH JZF A 130 -18.385 -1.128 -1.685 1.00 0.00 O HETATM 1720 C10 JZF A 130 -18.990 -3.192 -4.743 1.00 0.00 C HETATM 1721 C11 JZF A 130 -18.425 -3.382 -6.147 1.00 0.00 C HETATM 1722 C12 JZF A 130 -18.025 -2.012 -6.747 1.00 0.00 C HETATM 1723 C13 JZF A 130 -17.089 -1.205 -5.816 1.00 0.00 C HETATM 1724 C14 JZF A 130 -17.712 -1.083 -4.404 1.00 0.00 C HETATM 1725 C15 JZF A 130 -22.517 -7.559 0.127 1.00 0.00 C HETATM 1726 C16 JZF A 130 -21.997 -9.364 -2.610 1.00 0.00 C HETATM 1727 C17 JZF A 130 -21.306 -10.714 -2.365 1.00 0.00 C HETATM 1728 C18 JZF A 130 -19.420 -4.097 -7.090 1.00 0.00 C HETATM 1729 C19 JZF A 130 -15.657 -1.794 -5.780 1.00 0.00 C HETATM 1730 C21 JZF A 130 -23.258 -7.916 -1.144 1.00 0.00 C HETATM 0 H319 JZF A 130 -15.695 -2.821 -5.417 1.00 0.00 H new HETATM 0 H318 JZF A 130 -19.660 -5.081 -6.688 1.00 0.00 H new HETATM 0 H317 JZF A 130 -20.821 -10.703 -1.389 1.00 0.00 H new HETATM 0 H219 JZF A 130 -15.232 -1.780 -6.784 1.00 0.00 H new HETATM 0 H218 JZF A 130 -20.333 -3.506 -7.171 1.00 0.00 H new HETATM 0 H217 JZF A 130 -22.047 -11.513 -2.393 1.00 0.00 H new HETATM 0 H216 JZF A 130 -22.474 -9.353 -3.590 1.00 0.00 H new HETATM 0 H215 JZF A 130 -22.065 -8.460 0.543 1.00 0.00 H new HETATM 0 H214 JZF A 130 -18.615 -0.476 -4.464 1.00 0.00 H new HETATM 0 H212 JZF A 130 -17.530 -2.170 -7.705 1.00 0.00 H new HETATM 0 H1OH JZF A 130 -17.417 -1.064 -1.546 1.00 0.00 H new HETATM 0 H13A JZF A 130 -16.988 -0.199 -6.224 1.00 0.00 H new HETATM 0 H119 JZF A 130 -15.034 -1.196 -5.114 1.00 0.00 H new HETATM 0 H118 JZF A 130 -18.970 -4.208 -8.077 1.00 0.00 H new HETATM 0 H117 JZF A 130 -20.558 -10.886 -3.139 1.00 0.00 H new HETATM 0 H116 JZF A 130 -21.266 -8.555 -2.601 1.00 0.00 H new HETATM 0 H115 JZF A 130 -23.230 -7.190 0.865 1.00 0.00 H new HETATM 0 H114 JZF A 130 -17.016 -0.556 -3.751 1.00 0.00 H new HETATM 0 H112 JZF A 130 -18.925 -1.430 -6.945 1.00 0.00 H new HETATM 0 H9 JZF A 130 -17.140 -3.017 -3.610 1.00 0.00 H new HETATM 0 H8 JZF A 130 -19.761 -2.411 -2.548 1.00 0.00 H new HETATM 0 H4 JZF A 130 -19.963 -4.813 -2.109 1.00 0.00 H new HETATM 0 H27 JZF A 130 -18.186 -3.160 -0.401 1.00 0.00 H new HETATM 0 H25 JZF A 130 -20.404 -3.801 0.717 1.00 0.00 H new HETATM 0 H23 JZF A 130 -18.598 -5.750 0.457 1.00 0.00 H new HETATM 0 H17 JZF A 130 -17.601 -4.121 -1.745 1.00 0.00 H new HETATM 0 H15 JZF A 130 -21.227 -3.273 -0.737 1.00 0.00 H new HETATM 0 H13 JZF A 130 -18.295 -6.360 -1.157 1.00 0.00 H new HETATM 0 H11 JZF A 130 -17.545 -4.019 -6.057 1.00 0.00 H new