USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 850 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 11 SER OG : rot -23:sc= -4.93! USER MOD Set 1.2: A 59 GLN : amide:sc= 0 X(o=-4.9,f=-4.9) USER MOD Set 2.1: A 16 THR OG1 : rot 104:sc= -5.14! USER MOD Set 2.2: A 84 TYR OH : rot -111:sc= -5.3! USER MOD Set 3.1: A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 17 SER OG : rot -160:sc= 0 USER MOD Set 4.1: A 5 HIS : no HE2:sc= -6.04! C(o=-6.7!,f=-14!) USER MOD Set 4.2: A 7 TYR OH : rot 82:sc= -0.713! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -120:sc= 0.847 (180deg=-0.508) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -145:sc= -0.0734 (180deg=-0.677) USER MOD Single : A 10 SER OG : rot 180:sc= -0.364 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= -0.366 USER MOD Single : A 22 LYS NZ :NH3+ 163:sc= -0.0382 (180deg=-0.294) USER MOD Single : A 23 MET CE :methyl -152:sc= -13.5! (180deg=-16.5!) USER MOD Single : A 26 GLN : amide:sc= -13.8! C(o=-14!,f=-27!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 ASN :FLIP amide:sc= 1.03 F(o=-0.045,f=1) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl -138:sc= -6.26! (180deg=-11!) USER MOD Single : A 68 GLN :FLIP amide:sc= -2 F(o=-3.8!,f=-2) USER MOD Single : A 73 ASN : amide:sc= -0.737 X(o=-0.74,f=-0.62) USER MOD Single : A 74 LYS NZ :NH3+ -160:sc= -0.12 (180deg=-0.791) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ -176:sc= -2.57 (180deg=-2.63!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -0.181 X(o=-0.18,f=-0.0016) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.968 16.451 13.527 1.00 0.00 N ATOM 2 CA MET A 1 9.705 15.137 12.910 1.00 0.00 C ATOM 3 C MET A 1 8.189 14.953 12.673 1.00 0.00 C ATOM 4 O MET A 1 7.401 15.177 13.601 1.00 0.00 O ATOM 5 CB MET A 1 10.239 14.005 13.816 1.00 0.00 C ATOM 6 CG MET A 1 11.630 14.290 14.349 1.00 0.00 C ATOM 7 SD MET A 1 11.728 15.214 15.921 1.00 0.00 S ATOM 8 CE MET A 1 11.720 13.844 17.074 1.00 0.00 C ATOM 0 H1 MET A 1 10.589 17.008 12.906 1.00 0.00 H new ATOM 0 H2 MET A 1 9.069 16.957 13.663 1.00 0.00 H new ATOM 0 H3 MET A 1 10.432 16.315 14.448 1.00 0.00 H new ATOM 0 HA MET A 1 10.220 15.093 11.950 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.556 13.862 14.653 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.254 13.071 13.254 1.00 0.00 H new ATOM 0 HG2 MET A 1 12.146 13.339 14.480 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.178 14.849 13.590 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.775 14.226 18.093 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.802 13.270 16.951 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.579 13.201 16.881 1.00 0.00 H new ATOM 18 N GLU A 2 7.814 14.675 11.409 1.00 0.00 N ATOM 19 CA GLU A 2 6.419 14.445 10.972 1.00 0.00 C ATOM 20 C GLU A 2 6.327 13.314 9.977 1.00 0.00 C ATOM 21 O GLU A 2 6.996 13.295 8.930 1.00 0.00 O ATOM 22 CB GLU A 2 5.796 15.766 10.451 1.00 0.00 C ATOM 23 CG GLU A 2 5.265 16.610 11.646 1.00 0.00 C ATOM 24 CD GLU A 2 3.866 17.187 11.423 1.00 0.00 C ATOM 25 OE1 GLU A 2 3.482 17.380 10.242 1.00 0.00 O ATOM 26 OE2 GLU A 2 3.152 17.429 12.450 1.00 0.00 O ATOM 0 H GLU A 2 8.486 14.602 10.645 1.00 0.00 H new ATOM 0 HA GLU A 2 5.829 14.128 11.832 1.00 0.00 H new ATOM 0 HB2 GLU A 2 6.541 16.335 9.895 1.00 0.00 H new ATOM 0 HB3 GLU A 2 4.982 15.546 9.760 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.252 15.988 12.541 1.00 0.00 H new ATOM 0 HG3 GLU A 2 5.959 17.429 11.837 1.00 0.00 H new ATOM 33 N LYS A 3 5.569 12.222 10.355 1.00 0.00 N ATOM 34 CA LYS A 3 5.588 10.951 9.684 1.00 0.00 C ATOM 35 C LYS A 3 4.378 10.696 8.747 1.00 0.00 C ATOM 36 O LYS A 3 3.407 11.418 8.743 1.00 0.00 O ATOM 37 CB LYS A 3 5.801 9.744 10.597 1.00 0.00 C ATOM 38 CG LYS A 3 7.006 10.022 11.558 1.00 0.00 C ATOM 39 CD LYS A 3 8.326 9.400 11.093 1.00 0.00 C ATOM 40 CE LYS A 3 9.310 10.554 10.729 1.00 0.00 C ATOM 41 NZ LYS A 3 10.546 10.429 11.516 1.00 0.00 N ATOM 0 H LYS A 3 4.932 12.245 11.152 1.00 0.00 H new ATOM 0 HA LYS A 3 6.476 11.046 9.059 1.00 0.00 H new ATOM 0 HB2 LYS A 3 4.898 9.549 11.176 1.00 0.00 H new ATOM 0 HB3 LYS A 3 5.996 8.853 10.000 1.00 0.00 H new ATOM 0 HG2 LYS A 3 7.138 11.099 11.657 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.764 9.638 12.549 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.749 8.774 11.879 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.159 8.757 10.229 1.00 0.00 H new ATOM 0 HE2 LYS A 3 9.542 10.523 9.665 1.00 0.00 H new ATOM 0 HE3 LYS A 3 8.841 11.518 10.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 11.196 11.202 11.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 10.319 10.481 12.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 10.999 9.516 11.309 1.00 0.00 H new ATOM 55 N LYS A 4 4.555 9.643 7.889 1.00 0.00 N ATOM 56 CA LYS A 4 3.687 9.348 6.748 1.00 0.00 C ATOM 57 C LYS A 4 3.662 7.818 6.466 1.00 0.00 C ATOM 58 O LYS A 4 4.466 7.083 7.005 1.00 0.00 O ATOM 59 CB LYS A 4 4.148 10.094 5.474 1.00 0.00 C ATOM 60 CG LYS A 4 2.958 10.969 4.954 1.00 0.00 C ATOM 61 CD LYS A 4 2.861 12.319 5.678 1.00 0.00 C ATOM 62 CE LYS A 4 3.068 13.426 4.631 1.00 0.00 C ATOM 63 NZ LYS A 4 4.416 13.272 4.008 1.00 0.00 N ATOM 0 H LYS A 4 5.322 8.978 7.990 1.00 0.00 H new ATOM 0 HA LYS A 4 2.685 9.691 7.006 1.00 0.00 H new ATOM 0 HB2 LYS A 4 5.012 10.721 5.694 1.00 0.00 H new ATOM 0 HB3 LYS A 4 4.457 9.382 4.709 1.00 0.00 H new ATOM 0 HG2 LYS A 4 3.078 11.142 3.885 1.00 0.00 H new ATOM 0 HG3 LYS A 4 2.024 10.422 5.085 1.00 0.00 H new ATOM 0 HD2 LYS A 4 1.889 12.425 6.160 1.00 0.00 H new ATOM 0 HD3 LYS A 4 3.615 12.388 6.462 1.00 0.00 H new ATOM 0 HE2 LYS A 4 2.293 13.369 3.867 1.00 0.00 H new ATOM 0 HE3 LYS A 4 2.981 14.406 5.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 4.810 14.211 3.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 5.047 12.771 4.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 4.331 12.726 3.127 1.00 0.00 H new ATOM 77 N HIS A 5 2.612 7.409 5.699 1.00 0.00 N ATOM 78 CA HIS A 5 2.046 6.040 5.758 1.00 0.00 C ATOM 79 C HIS A 5 1.746 5.494 4.366 1.00 0.00 C ATOM 80 O HIS A 5 0.720 5.840 3.733 1.00 0.00 O ATOM 81 CB HIS A 5 0.856 5.939 6.703 1.00 0.00 C ATOM 82 CG HIS A 5 1.230 5.950 8.195 1.00 0.00 C ATOM 83 ND1 HIS A 5 0.349 6.078 9.230 1.00 0.00 N ATOM 84 CD2 HIS A 5 2.468 5.985 8.704 1.00 0.00 C ATOM 85 CE1 HIS A 5 1.101 6.186 10.368 1.00 0.00 C ATOM 86 NE2 HIS A 5 2.368 5.861 10.050 1.00 0.00 N ATOM 0 H HIS A 5 2.141 8.017 5.029 1.00 0.00 H new ATOM 0 HA HIS A 5 2.815 5.397 6.186 1.00 0.00 H new ATOM 0 HB2 HIS A 5 0.178 6.769 6.504 1.00 0.00 H new ATOM 0 HB3 HIS A 5 0.310 5.021 6.484 1.00 0.00 H new ATOM 0 HD1 HIS A 5 -0.669 6.091 9.167 1.00 0.00 H new ATOM 0 HD2 HIS A 5 3.384 6.093 8.142 1.00 0.00 H new ATOM 0 HE1 HIS A 5 0.743 6.479 11.344 1.00 0.00 H new ATOM 94 N ILE A 6 2.619 4.570 3.916 1.00 0.00 N ATOM 95 CA ILE A 6 2.312 3.542 2.871 1.00 0.00 C ATOM 96 C ILE A 6 1.698 2.298 3.537 1.00 0.00 C ATOM 97 O ILE A 6 2.378 1.477 4.137 1.00 0.00 O ATOM 98 CB ILE A 6 3.615 3.237 2.064 1.00 0.00 C ATOM 99 CG1 ILE A 6 4.185 4.473 1.364 1.00 0.00 C ATOM 100 CG2 ILE A 6 3.397 2.037 1.106 1.00 0.00 C ATOM 101 CD1 ILE A 6 4.263 4.378 -0.183 1.00 0.00 C ATOM 0 H ILE A 6 3.575 4.507 4.267 1.00 0.00 H new ATOM 0 HA ILE A 6 1.572 3.909 2.160 1.00 0.00 H new ATOM 0 HB ILE A 6 4.385 2.944 2.778 1.00 0.00 H new ATOM 0 HG12 ILE A 6 3.573 5.335 1.629 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.186 4.661 1.752 1.00 0.00 H new ATOM 0 HG21 ILE A 6 4.316 1.841 0.553 1.00 0.00 H new ATOM 0 HG22 ILE A 6 3.126 1.154 1.685 1.00 0.00 H new ATOM 0 HG23 ILE A 6 2.596 2.272 0.406 1.00 0.00 H new ATOM 0 HD11 ILE A 6 4.680 5.302 -0.584 1.00 0.00 H new ATOM 0 HD12 ILE A 6 4.901 3.540 -0.464 1.00 0.00 H new ATOM 0 HD13 ILE A 6 3.263 4.225 -0.589 1.00 0.00 H new ATOM 113 N TYR A 7 0.338 2.174 3.411 1.00 0.00 N ATOM 114 CA TYR A 7 -0.471 1.066 3.902 1.00 0.00 C ATOM 115 C TYR A 7 -0.826 0.078 2.828 1.00 0.00 C ATOM 116 O TYR A 7 -1.139 0.381 1.680 1.00 0.00 O ATOM 117 CB TYR A 7 -1.741 1.569 4.706 1.00 0.00 C ATOM 118 CG TYR A 7 -1.384 2.064 6.115 1.00 0.00 C ATOM 119 CD1 TYR A 7 -0.040 2.318 6.461 1.00 0.00 C ATOM 120 CD2 TYR A 7 -2.418 2.157 7.043 1.00 0.00 C ATOM 121 CE1 TYR A 7 0.208 2.961 7.685 1.00 0.00 C ATOM 122 CE2 TYR A 7 -2.196 2.898 8.203 1.00 0.00 C ATOM 123 CZ TYR A 7 -0.863 3.215 8.547 1.00 0.00 C ATOM 124 OH TYR A 7 -0.629 3.796 9.755 1.00 0.00 O ATOM 0 H TYR A 7 -0.223 2.885 2.942 1.00 0.00 H new ATOM 0 HA TYR A 7 0.155 0.521 4.609 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.223 2.375 4.152 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.465 0.757 4.782 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.770 2.028 5.808 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -3.366 1.669 6.869 1.00 0.00 H new ATOM 0 HE1 TYR A 7 1.211 3.255 7.956 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -3.020 3.221 8.822 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.556 4.767 9.643 1.00 0.00 H new ATOM 134 N LEU A 8 -0.783 -1.266 3.221 1.00 0.00 N ATOM 135 CA LEU A 8 -0.712 -2.415 2.355 1.00 0.00 C ATOM 136 C LEU A 8 -1.819 -3.425 2.667 1.00 0.00 C ATOM 137 O LEU A 8 -1.603 -4.344 3.463 1.00 0.00 O ATOM 138 CB LEU A 8 0.674 -3.081 2.593 1.00 0.00 C ATOM 139 CG LEU A 8 1.657 -3.174 1.413 1.00 0.00 C ATOM 140 CD1 LEU A 8 2.754 -2.123 1.412 1.00 0.00 C ATOM 141 CD2 LEU A 8 2.151 -4.635 1.196 1.00 0.00 C ATOM 0 H LEU A 8 -0.800 -1.531 4.206 1.00 0.00 H new ATOM 0 HA LEU A 8 -0.840 -2.101 1.319 1.00 0.00 H new ATOM 0 HB2 LEU A 8 1.170 -2.535 3.395 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.497 -4.093 2.957 1.00 0.00 H new ATOM 0 HG LEU A 8 1.088 -2.910 0.522 1.00 0.00 H new ATOM 0 HD11 LEU A 8 3.397 -2.269 0.544 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.306 -1.130 1.370 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.347 -2.215 2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 8 2.844 -4.664 0.355 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.658 -4.985 2.095 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.298 -5.280 0.986 1.00 0.00 H new ATOM 153 N PHE A 9 -3.061 -3.204 2.154 1.00 0.00 N ATOM 154 CA PHE A 9 -4.340 -3.650 2.641 1.00 0.00 C ATOM 155 C PHE A 9 -4.758 -5.017 2.094 1.00 0.00 C ATOM 156 O PHE A 9 -5.693 -5.164 1.339 1.00 0.00 O ATOM 157 CB PHE A 9 -5.396 -2.540 2.343 1.00 0.00 C ATOM 158 CG PHE A 9 -5.323 -1.307 3.255 1.00 0.00 C ATOM 159 CD1 PHE A 9 -5.974 -1.301 4.501 1.00 0.00 C ATOM 160 CD2 PHE A 9 -4.501 -0.227 2.865 1.00 0.00 C ATOM 161 CE1 PHE A 9 -5.690 -0.265 5.422 1.00 0.00 C ATOM 162 CE2 PHE A 9 -4.383 0.890 3.708 1.00 0.00 C ATOM 163 CZ PHE A 9 -4.921 0.840 4.993 1.00 0.00 C ATOM 0 H PHE A 9 -3.171 -2.651 1.304 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.266 -3.805 3.717 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.276 -2.215 1.309 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.391 -2.976 2.427 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -6.682 -2.077 4.752 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -3.968 -0.260 1.926 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -6.055 -0.318 6.437 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -3.879 1.781 3.363 1.00 0.00 H new ATOM 0 HZ PHE A 9 -4.747 1.661 5.673 1.00 0.00 H new ATOM 173 N SER A 10 -3.971 -6.100 2.430 1.00 0.00 N ATOM 174 CA SER A 10 -4.409 -7.484 2.441 1.00 0.00 C ATOM 175 C SER A 10 -5.307 -7.873 1.266 1.00 0.00 C ATOM 176 O SER A 10 -5.366 -7.231 0.204 1.00 0.00 O ATOM 177 CB SER A 10 -5.111 -7.778 3.786 1.00 0.00 C ATOM 178 OG SER A 10 -4.757 -9.064 4.296 1.00 0.00 O ATOM 0 H SER A 10 -2.994 -5.995 2.703 1.00 0.00 H new ATOM 0 HA SER A 10 -3.516 -8.098 2.327 1.00 0.00 H new ATOM 0 HB2 SER A 10 -4.841 -7.011 4.513 1.00 0.00 H new ATOM 0 HB3 SER A 10 -6.191 -7.724 3.652 1.00 0.00 H new ATOM 0 HG SER A 10 -5.217 -9.216 5.148 1.00 0.00 H new ATOM 184 N SER A 11 -6.077 -8.987 1.483 1.00 0.00 N ATOM 185 CA SER A 11 -6.600 -9.854 0.409 1.00 0.00 C ATOM 186 C SER A 11 -6.629 -11.343 0.913 1.00 0.00 C ATOM 187 O SER A 11 -7.675 -11.972 0.939 1.00 0.00 O ATOM 188 CB SER A 11 -5.718 -9.786 -0.837 1.00 0.00 C ATOM 189 OG SER A 11 -6.430 -10.184 -2.023 1.00 0.00 O ATOM 0 H SER A 11 -6.345 -9.297 2.417 1.00 0.00 H new ATOM 0 HA SER A 11 -7.602 -9.508 0.154 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.345 -8.770 -0.962 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.849 -10.430 -0.702 1.00 0.00 H new ATOM 0 HG SER A 11 -7.188 -10.753 -1.774 1.00 0.00 H new ATOM 195 N ALA A 12 -5.442 -11.781 1.367 1.00 0.00 N ATOM 196 CA ALA A 12 -5.145 -13.167 1.760 1.00 0.00 C ATOM 197 C ALA A 12 -4.181 -13.193 2.957 1.00 0.00 C ATOM 198 O ALA A 12 -3.451 -14.163 3.181 1.00 0.00 O ATOM 199 CB ALA A 12 -4.552 -13.984 0.605 1.00 0.00 C ATOM 0 H ALA A 12 -4.639 -11.161 1.473 1.00 0.00 H new ATOM 0 HA ALA A 12 -6.093 -13.626 2.042 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -4.350 -15.000 0.944 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -5.261 -14.012 -0.222 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -3.623 -13.521 0.271 1.00 0.00 H new ATOM 205 N GLY A 13 -4.207 -12.100 3.750 1.00 0.00 N ATOM 206 CA GLY A 13 -3.309 -11.826 4.860 1.00 0.00 C ATOM 207 C GLY A 13 -1.910 -12.388 4.738 1.00 0.00 C ATOM 208 O GLY A 13 -1.640 -13.556 5.107 1.00 0.00 O ATOM 0 H GLY A 13 -4.893 -11.357 3.615 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -3.235 -10.745 4.983 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -3.759 -12.221 5.771 1.00 0.00 H new ATOM 212 N MET A 14 -0.949 -11.596 4.184 1.00 0.00 N ATOM 213 CA MET A 14 0.491 -11.687 4.424 1.00 0.00 C ATOM 214 C MET A 14 1.254 -12.432 3.314 1.00 0.00 C ATOM 215 O MET A 14 2.291 -13.057 3.522 1.00 0.00 O ATOM 216 CB MET A 14 0.834 -12.201 5.805 1.00 0.00 C ATOM 217 CG MET A 14 0.318 -11.270 6.917 1.00 0.00 C ATOM 218 SD MET A 14 1.150 -11.618 8.553 1.00 0.00 S ATOM 219 CE MET A 14 0.726 -10.100 9.408 1.00 0.00 C ATOM 0 H MET A 14 -1.184 -10.848 3.531 1.00 0.00 H new ATOM 0 HA MET A 14 0.845 -10.657 4.387 1.00 0.00 H new ATOM 0 HB2 MET A 14 0.406 -13.195 5.938 1.00 0.00 H new ATOM 0 HB3 MET A 14 1.915 -12.305 5.894 1.00 0.00 H new ATOM 0 HG2 MET A 14 0.494 -10.232 6.633 1.00 0.00 H new ATOM 0 HG3 MET A 14 -0.760 -11.393 7.024 1.00 0.00 H new ATOM 0 HE1 MET A 14 1.141 -10.122 10.416 1.00 0.00 H new ATOM 0 HE2 MET A 14 1.137 -9.249 8.864 1.00 0.00 H new ATOM 0 HE3 MET A 14 -0.358 -10.005 9.464 1.00 0.00 H new ATOM 229 N SER A 15 0.704 -12.309 2.073 1.00 0.00 N ATOM 230 CA SER A 15 1.568 -12.223 0.828 1.00 0.00 C ATOM 231 C SER A 15 1.859 -10.731 0.493 1.00 0.00 C ATOM 232 O SER A 15 2.169 -10.383 -0.648 1.00 0.00 O ATOM 233 CB SER A 15 0.756 -12.868 -0.289 1.00 0.00 C ATOM 234 OG SER A 15 1.423 -14.039 -0.839 1.00 0.00 O ATOM 0 H SER A 15 -0.299 -12.267 1.895 1.00 0.00 H new ATOM 0 HA SER A 15 2.527 -12.724 0.962 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.224 -13.155 0.093 1.00 0.00 H new ATOM 0 HB3 SER A 15 0.588 -12.140 -1.083 1.00 0.00 H new ATOM 0 HG SER A 15 0.871 -14.426 -1.551 1.00 0.00 H new ATOM 240 N THR A 16 1.719 -9.894 1.536 1.00 0.00 N ATOM 241 CA THR A 16 1.616 -8.422 1.541 1.00 0.00 C ATOM 242 C THR A 16 2.592 -7.770 2.516 1.00 0.00 C ATOM 243 O THR A 16 3.304 -6.791 2.196 1.00 0.00 O ATOM 244 CB THR A 16 0.213 -7.873 1.806 1.00 0.00 C ATOM 245 OG1 THR A 16 0.016 -6.608 1.115 1.00 0.00 O ATOM 246 CG2 THR A 16 -0.238 -7.876 3.250 1.00 0.00 C ATOM 0 H THR A 16 1.670 -10.264 2.485 1.00 0.00 H new ATOM 0 HA THR A 16 1.879 -8.155 0.518 1.00 0.00 H new ATOM 0 HB THR A 16 -0.475 -8.597 1.370 1.00 0.00 H new ATOM 0 HG1 THR A 16 -0.542 -6.752 0.322 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.245 -7.465 3.317 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.236 -8.898 3.630 1.00 0.00 H new ATOM 0 HG23 THR A 16 0.442 -7.267 3.845 1.00 0.00 H new ATOM 254 N SER A 17 2.592 -8.292 3.776 1.00 0.00 N ATOM 255 CA SER A 17 3.371 -7.751 4.909 1.00 0.00 C ATOM 256 C SER A 17 4.867 -7.593 4.551 1.00 0.00 C ATOM 257 O SER A 17 5.485 -6.543 4.776 1.00 0.00 O ATOM 258 CB SER A 17 3.223 -8.757 6.089 1.00 0.00 C ATOM 259 OG SER A 17 2.833 -8.050 7.271 1.00 0.00 O ATOM 0 H SER A 17 2.040 -9.112 4.028 1.00 0.00 H new ATOM 0 HA SER A 17 2.996 -6.762 5.171 1.00 0.00 H new ATOM 0 HB2 SER A 17 2.479 -9.515 5.844 1.00 0.00 H new ATOM 0 HB3 SER A 17 4.166 -9.278 6.258 1.00 0.00 H new ATOM 0 HG SER A 17 3.042 -8.592 8.060 1.00 0.00 H new ATOM 265 N LEU A 18 5.417 -8.675 3.898 1.00 0.00 N ATOM 266 CA LEU A 18 6.845 -8.878 3.607 1.00 0.00 C ATOM 267 C LEU A 18 7.231 -7.978 2.391 1.00 0.00 C ATOM 268 O LEU A 18 8.401 -7.797 2.113 1.00 0.00 O ATOM 269 CB LEU A 18 7.049 -10.347 3.317 1.00 0.00 C ATOM 270 CG LEU A 18 6.950 -11.381 4.447 1.00 0.00 C ATOM 271 CD1 LEU A 18 5.964 -12.540 4.193 1.00 0.00 C ATOM 272 CD2 LEU A 18 8.360 -11.947 4.824 1.00 0.00 C ATOM 0 H LEU A 18 4.840 -9.444 3.557 1.00 0.00 H new ATOM 0 HA LEU A 18 7.483 -8.599 4.445 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.321 -10.630 2.556 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.037 -10.453 2.868 1.00 0.00 H new ATOM 0 HG LEU A 18 6.535 -10.823 5.286 1.00 0.00 H new ATOM 0 HD11 LEU A 18 5.968 -13.215 5.049 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.960 -12.139 4.051 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.267 -13.086 3.299 1.00 0.00 H new ATOM 0 HD21 LEU A 18 8.256 -12.677 5.627 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.804 -12.427 3.952 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.003 -11.131 5.156 1.00 0.00 H new ATOM 284 N LEU A 19 6.201 -7.467 1.671 1.00 0.00 N ATOM 285 CA LEU A 19 6.340 -6.348 0.699 1.00 0.00 C ATOM 286 C LEU A 19 6.834 -5.090 1.500 1.00 0.00 C ATOM 287 O LEU A 19 7.802 -4.490 1.160 1.00 0.00 O ATOM 288 CB LEU A 19 4.883 -6.047 0.227 1.00 0.00 C ATOM 289 CG LEU A 19 4.288 -6.949 -0.880 1.00 0.00 C ATOM 290 CD1 LEU A 19 3.907 -6.118 -2.165 1.00 0.00 C ATOM 291 CD2 LEU A 19 5.219 -8.124 -1.241 1.00 0.00 C ATOM 0 H LEU A 19 5.247 -7.819 1.747 1.00 0.00 H new ATOM 0 HA LEU A 19 7.019 -6.579 -0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.229 -6.107 1.097 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.850 -5.016 -0.126 1.00 0.00 H new ATOM 0 HG LEU A 19 3.372 -7.376 -0.471 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.492 -6.786 -2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 19 3.167 -5.362 -1.903 1.00 0.00 H new ATOM 0 HD13 LEU A 19 4.798 -5.631 -2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.757 -8.728 -2.022 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.173 -7.736 -1.599 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.386 -8.740 -0.358 1.00 0.00 H new ATOM 303 N VAL A 20 6.026 -4.704 2.528 1.00 0.00 N ATOM 304 CA VAL A 20 6.390 -3.713 3.562 1.00 0.00 C ATOM 305 C VAL A 20 7.896 -3.849 3.865 1.00 0.00 C ATOM 306 O VAL A 20 8.722 -3.047 3.438 1.00 0.00 O ATOM 307 CB VAL A 20 5.440 -3.765 4.747 1.00 0.00 C ATOM 308 CG1 VAL A 20 6.045 -4.149 6.121 1.00 0.00 C ATOM 309 CG2 VAL A 20 4.608 -2.440 4.910 1.00 0.00 C ATOM 0 H VAL A 20 5.088 -5.084 2.656 1.00 0.00 H new ATOM 0 HA VAL A 20 6.255 -2.692 3.206 1.00 0.00 H new ATOM 0 HB VAL A 20 4.795 -4.598 4.468 1.00 0.00 H new ATOM 0 HG11 VAL A 20 5.260 -4.148 6.877 1.00 0.00 H new ATOM 0 HG12 VAL A 20 6.488 -5.143 6.059 1.00 0.00 H new ATOM 0 HG13 VAL A 20 6.813 -3.426 6.395 1.00 0.00 H new ATOM 0 HG21 VAL A 20 3.945 -2.530 5.771 1.00 0.00 H new ATOM 0 HG22 VAL A 20 5.287 -1.600 5.061 1.00 0.00 H new ATOM 0 HG23 VAL A 20 4.015 -2.270 4.012 1.00 0.00 H new ATOM 319 N SER A 21 8.212 -4.871 4.703 1.00 0.00 N ATOM 320 CA SER A 21 9.550 -4.987 5.321 1.00 0.00 C ATOM 321 C SER A 21 10.675 -4.821 4.279 1.00 0.00 C ATOM 322 O SER A 21 11.729 -4.255 4.523 1.00 0.00 O ATOM 323 CB SER A 21 9.691 -6.246 6.106 1.00 0.00 C ATOM 324 OG SER A 21 8.647 -7.215 5.944 1.00 0.00 O ATOM 0 H SER A 21 7.564 -5.615 4.961 1.00 0.00 H new ATOM 0 HA SER A 21 9.651 -4.164 6.029 1.00 0.00 H new ATOM 0 HB2 SER A 21 10.637 -6.714 5.835 1.00 0.00 H new ATOM 0 HB3 SER A 21 9.755 -5.985 7.162 1.00 0.00 H new ATOM 0 HG SER A 21 8.839 -7.999 6.500 1.00 0.00 H new ATOM 330 N LYS A 22 10.315 -5.242 3.028 1.00 0.00 N ATOM 331 CA LYS A 22 11.271 -5.082 1.876 1.00 0.00 C ATOM 332 C LYS A 22 11.212 -3.529 1.532 1.00 0.00 C ATOM 333 O LYS A 22 12.170 -2.840 1.578 1.00 0.00 O ATOM 334 CB LYS A 22 10.723 -5.861 0.664 1.00 0.00 C ATOM 335 CG LYS A 22 11.550 -7.135 0.461 1.00 0.00 C ATOM 336 CD LYS A 22 10.895 -8.423 0.961 1.00 0.00 C ATOM 337 CE LYS A 22 11.842 -9.592 0.720 1.00 0.00 C ATOM 338 NZ LYS A 22 13.021 -9.517 1.616 1.00 0.00 N ATOM 0 H LYS A 22 9.421 -5.673 2.794 1.00 0.00 H new ATOM 0 HA LYS A 22 12.275 -5.438 2.108 1.00 0.00 H new ATOM 0 HB2 LYS A 22 9.676 -6.116 0.825 1.00 0.00 H new ATOM 0 HB3 LYS A 22 10.766 -5.240 -0.231 1.00 0.00 H new ATOM 0 HG2 LYS A 22 11.764 -7.244 -0.602 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.507 -7.012 0.968 1.00 0.00 H new ATOM 0 HD2 LYS A 22 10.664 -8.339 2.023 1.00 0.00 H new ATOM 0 HD3 LYS A 22 9.951 -8.591 0.442 1.00 0.00 H new ATOM 0 HE2 LYS A 22 11.315 -10.531 0.886 1.00 0.00 H new ATOM 0 HE3 LYS A 22 12.170 -9.590 -0.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 13.494 -10.443 1.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.684 -8.800 1.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 12.713 -9.255 2.574 1.00 0.00 H new ATOM 352 N MET A 23 9.943 -3.150 1.179 1.00 0.00 N ATOM 353 CA MET A 23 9.543 -1.753 0.891 1.00 0.00 C ATOM 354 C MET A 23 10.209 -0.749 1.855 1.00 0.00 C ATOM 355 O MET A 23 11.092 -0.003 1.501 1.00 0.00 O ATOM 356 CB MET A 23 8.028 -1.584 0.899 1.00 0.00 C ATOM 357 CG MET A 23 7.386 -1.661 -0.477 1.00 0.00 C ATOM 358 SD MET A 23 6.482 -0.099 -0.985 1.00 0.00 S ATOM 359 CE MET A 23 4.913 -0.408 -0.214 1.00 0.00 C ATOM 0 H MET A 23 9.175 -3.815 1.089 1.00 0.00 H new ATOM 0 HA MET A 23 9.900 -1.532 -0.115 1.00 0.00 H new ATOM 0 HB2 MET A 23 7.591 -2.354 1.535 1.00 0.00 H new ATOM 0 HB3 MET A 23 7.783 -0.622 1.349 1.00 0.00 H new ATOM 0 HG2 MET A 23 8.158 -1.878 -1.215 1.00 0.00 H new ATOM 0 HG3 MET A 23 6.685 -2.496 -0.494 1.00 0.00 H new ATOM 0 HE1 MET A 23 4.127 0.101 -0.772 1.00 0.00 H new ATOM 0 HE2 MET A 23 4.716 -1.480 -0.207 1.00 0.00 H new ATOM 0 HE3 MET A 23 4.931 -0.035 0.810 1.00 0.00 H new ATOM 369 N ARG A 24 9.669 -0.766 3.109 1.00 0.00 N ATOM 370 CA ARG A 24 10.168 0.027 4.234 1.00 0.00 C ATOM 371 C ARG A 24 11.697 0.197 4.231 1.00 0.00 C ATOM 372 O ARG A 24 12.208 1.265 4.632 1.00 0.00 O ATOM 373 CB ARG A 24 9.586 -0.320 5.562 1.00 0.00 C ATOM 374 CG ARG A 24 8.906 -1.666 5.732 1.00 0.00 C ATOM 375 CD ARG A 24 8.932 -2.168 7.213 1.00 0.00 C ATOM 376 NE ARG A 24 7.911 -1.392 7.967 1.00 0.00 N ATOM 377 CZ ARG A 24 7.843 -1.254 9.312 1.00 0.00 C ATOM 378 NH1 ARG A 24 8.706 -1.890 10.126 1.00 0.00 N ATOM 379 NH2 ARG A 24 6.935 -0.432 9.870 1.00 0.00 N ATOM 0 H ARG A 24 8.865 -1.344 3.352 1.00 0.00 H new ATOM 0 HA ARG A 24 9.773 1.026 4.053 1.00 0.00 H new ATOM 0 HB2 ARG A 24 10.386 -0.259 6.299 1.00 0.00 H new ATOM 0 HB3 ARG A 24 8.859 0.452 5.816 1.00 0.00 H new ATOM 0 HG2 ARG A 24 7.872 -1.592 5.395 1.00 0.00 H new ATOM 0 HG3 ARG A 24 9.397 -2.401 5.094 1.00 0.00 H new ATOM 0 HD2 ARG A 24 8.714 -3.235 7.260 1.00 0.00 H new ATOM 0 HD3 ARG A 24 9.921 -2.025 7.649 1.00 0.00 H new ATOM 0 HE ARG A 24 7.193 -0.919 7.418 1.00 0.00 H new ATOM 0 HH11 ARG A 24 9.430 -2.491 9.732 1.00 0.00 H new ATOM 0 HH12 ARG A 24 8.636 -1.771 11.137 1.00 0.00 H new ATOM 0 HH21 ARG A 24 6.291 0.093 9.279 1.00 0.00 H new ATOM 0 HH22 ARG A 24 6.891 -0.334 10.884 1.00 0.00 H new ATOM 393 N ALA A 25 12.409 -0.874 3.814 1.00 0.00 N ATOM 394 CA ALA A 25 13.808 -0.808 3.384 1.00 0.00 C ATOM 395 C ALA A 25 14.102 0.366 2.437 1.00 0.00 C ATOM 396 O ALA A 25 14.804 1.301 2.775 1.00 0.00 O ATOM 397 CB ALA A 25 14.328 -2.118 2.855 1.00 0.00 C ATOM 0 H ALA A 25 12.017 -1.814 3.769 1.00 0.00 H new ATOM 0 HA ALA A 25 14.372 -0.604 4.294 1.00 0.00 H new ATOM 0 HB1 ALA A 25 15.369 -2.001 2.554 1.00 0.00 H new ATOM 0 HB2 ALA A 25 14.259 -2.878 3.633 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.733 -2.425 1.994 1.00 0.00 H new ATOM 403 N GLN A 26 13.560 0.287 1.189 1.00 0.00 N ATOM 404 CA GLN A 26 13.435 1.420 0.248 1.00 0.00 C ATOM 405 C GLN A 26 13.399 2.760 1.078 1.00 0.00 C ATOM 406 O GLN A 26 14.247 3.625 1.001 1.00 0.00 O ATOM 407 CB GLN A 26 12.369 1.323 -0.730 1.00 0.00 C ATOM 408 CG GLN A 26 11.509 0.171 -1.054 1.00 0.00 C ATOM 409 CD GLN A 26 12.130 -1.211 -1.161 1.00 0.00 C ATOM 410 OE1 GLN A 26 11.614 -2.231 -0.658 1.00 0.00 O ATOM 411 NE2 GLN A 26 13.265 -1.340 -1.872 1.00 0.00 N ATOM 0 H GLN A 26 13.193 -0.586 0.809 1.00 0.00 H new ATOM 0 HA GLN A 26 14.317 1.398 -0.392 1.00 0.00 H new ATOM 0 HB2 GLN A 26 11.677 2.123 -0.468 1.00 0.00 H new ATOM 0 HB3 GLN A 26 12.833 1.600 -1.677 1.00 0.00 H new ATOM 0 HG2 GLN A 26 10.728 0.122 -0.296 1.00 0.00 H new ATOM 0 HG3 GLN A 26 11.019 0.385 -2.004 1.00 0.00 H new ATOM 0 HE21 GLN A 26 13.701 -0.518 -2.290 1.00 0.00 H new ATOM 0 HE22 GLN A 26 13.689 -2.260 -1.993 1.00 0.00 H new ATOM 420 N ALA A 27 12.267 2.887 1.851 1.00 0.00 N ATOM 421 CA ALA A 27 11.841 4.130 2.475 1.00 0.00 C ATOM 422 C ALA A 27 12.951 4.775 3.336 1.00 0.00 C ATOM 423 O ALA A 27 13.306 5.924 3.176 1.00 0.00 O ATOM 424 CB ALA A 27 10.567 3.963 3.292 1.00 0.00 C ATOM 0 H ALA A 27 11.640 2.105 2.042 1.00 0.00 H new ATOM 0 HA ALA A 27 11.625 4.809 1.650 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.292 4.919 3.737 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.761 3.619 2.643 1.00 0.00 H new ATOM 0 HB3 ALA A 27 10.735 3.231 4.082 1.00 0.00 H new ATOM 430 N GLU A 28 13.477 3.960 4.272 1.00 0.00 N ATOM 431 CA GLU A 28 14.559 4.308 5.217 1.00 0.00 C ATOM 432 C GLU A 28 15.935 4.297 4.450 1.00 0.00 C ATOM 433 O GLU A 28 16.834 5.057 4.757 1.00 0.00 O ATOM 434 CB GLU A 28 14.617 3.385 6.399 1.00 0.00 C ATOM 435 CG GLU A 28 13.257 3.050 7.020 1.00 0.00 C ATOM 436 CD GLU A 28 13.413 2.322 8.402 1.00 0.00 C ATOM 437 OE1 GLU A 28 13.625 3.030 9.420 1.00 0.00 O ATOM 438 OE2 GLU A 28 13.358 1.077 8.364 1.00 0.00 O ATOM 0 H GLU A 28 13.147 3.003 4.396 1.00 0.00 H new ATOM 0 HA GLU A 28 14.350 5.303 5.610 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.100 2.457 6.094 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.249 3.836 7.164 1.00 0.00 H new ATOM 0 HG2 GLU A 28 12.683 3.967 7.154 1.00 0.00 H new ATOM 0 HG3 GLU A 28 12.691 2.417 6.337 1.00 0.00 H new ATOM 445 N LYS A 29 16.033 3.330 3.512 1.00 0.00 N ATOM 446 CA LYS A 29 17.159 3.301 2.533 1.00 0.00 C ATOM 447 C LYS A 29 17.296 4.682 1.815 1.00 0.00 C ATOM 448 O LYS A 29 18.356 5.047 1.373 1.00 0.00 O ATOM 449 CB LYS A 29 16.851 2.203 1.476 1.00 0.00 C ATOM 450 CG LYS A 29 17.765 2.387 0.244 1.00 0.00 C ATOM 451 CD LYS A 29 18.238 0.998 -0.351 1.00 0.00 C ATOM 452 CE LYS A 29 16.944 0.301 -0.844 1.00 0.00 C ATOM 453 NZ LYS A 29 17.251 -0.727 -1.848 1.00 0.00 N ATOM 0 H LYS A 29 15.363 2.569 3.406 1.00 0.00 H new ATOM 0 HA LYS A 29 18.092 3.088 3.054 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.005 1.215 1.910 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.805 2.259 1.175 1.00 0.00 H new ATOM 0 HG2 LYS A 29 17.232 2.948 -0.523 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.637 2.978 0.524 1.00 0.00 H new ATOM 0 HD2 LYS A 29 18.944 1.141 -1.169 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.744 0.398 0.405 1.00 0.00 H new ATOM 0 HE2 LYS A 29 16.427 -0.153 0.001 1.00 0.00 H new ATOM 0 HE3 LYS A 29 16.268 1.041 -1.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 16.369 -1.179 -2.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 17.724 -0.286 -2.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 17.878 -1.444 -1.430 1.00 0.00 H new ATOM 467 N TYR A 30 16.123 5.343 1.710 1.00 0.00 N ATOM 468 CA TYR A 30 15.917 6.613 0.951 1.00 0.00 C ATOM 469 C TYR A 30 15.861 7.808 1.929 1.00 0.00 C ATOM 470 O TYR A 30 15.886 8.961 1.547 1.00 0.00 O ATOM 471 CB TYR A 30 14.601 6.497 0.156 1.00 0.00 C ATOM 472 CG TYR A 30 14.573 5.488 -0.973 1.00 0.00 C ATOM 473 CD1 TYR A 30 15.685 4.662 -1.139 1.00 0.00 C ATOM 474 CD2 TYR A 30 13.456 5.361 -1.811 1.00 0.00 C ATOM 475 CE1 TYR A 30 15.703 3.755 -2.224 1.00 0.00 C ATOM 476 CE2 TYR A 30 13.603 4.692 -3.024 1.00 0.00 C ATOM 477 CZ TYR A 30 14.653 3.800 -3.167 1.00 0.00 C ATOM 478 OH TYR A 30 14.660 2.936 -4.211 1.00 0.00 O ATOM 0 H TYR A 30 15.270 5.008 2.157 1.00 0.00 H new ATOM 0 HA TYR A 30 16.745 6.780 0.262 1.00 0.00 H new ATOM 0 HB2 TYR A 30 13.803 6.247 0.855 1.00 0.00 H new ATOM 0 HB3 TYR A 30 14.367 7.478 -0.259 1.00 0.00 H new ATOM 0 HD1 TYR A 30 16.517 4.714 -0.452 1.00 0.00 H new ATOM 0 HD2 TYR A 30 12.501 5.774 -1.522 1.00 0.00 H new ATOM 0 HE1 TYR A 30 16.506 3.040 -2.329 1.00 0.00 H new ATOM 0 HE2 TYR A 30 12.913 4.865 -3.836 1.00 0.00 H new ATOM 0 HH TYR A 30 13.870 3.092 -4.770 1.00 0.00 H new ATOM 488 N GLU A 31 15.753 7.449 3.221 1.00 0.00 N ATOM 489 CA GLU A 31 15.773 8.426 4.342 1.00 0.00 C ATOM 490 C GLU A 31 14.372 9.048 4.554 1.00 0.00 C ATOM 491 O GLU A 31 14.170 10.042 5.220 1.00 0.00 O ATOM 492 CB GLU A 31 16.825 9.523 4.105 1.00 0.00 C ATOM 493 CG GLU A 31 17.009 10.403 5.314 1.00 0.00 C ATOM 494 CD GLU A 31 16.318 11.777 5.246 1.00 0.00 C ATOM 495 OE1 GLU A 31 15.966 12.157 4.065 1.00 0.00 O ATOM 496 OE2 GLU A 31 16.120 12.413 6.295 1.00 0.00 O ATOM 0 H GLU A 31 15.650 6.480 3.524 1.00 0.00 H new ATOM 0 HA GLU A 31 16.049 7.887 5.248 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.777 9.061 3.845 1.00 0.00 H new ATOM 0 HB3 GLU A 31 16.525 10.135 3.254 1.00 0.00 H new ATOM 0 HG2 GLU A 31 16.635 9.871 6.189 1.00 0.00 H new ATOM 0 HG3 GLU A 31 18.077 10.560 5.468 1.00 0.00 H new ATOM 503 N VAL A 32 13.370 8.421 3.844 1.00 0.00 N ATOM 504 CA VAL A 32 12.018 8.977 3.663 1.00 0.00 C ATOM 505 C VAL A 32 11.245 8.958 4.974 1.00 0.00 C ATOM 506 O VAL A 32 11.440 8.128 5.867 1.00 0.00 O ATOM 507 CB VAL A 32 11.353 8.234 2.492 1.00 0.00 C ATOM 508 CG1 VAL A 32 9.788 8.306 2.513 1.00 0.00 C ATOM 509 CG2 VAL A 32 11.915 8.508 1.132 1.00 0.00 C ATOM 0 H VAL A 32 13.499 7.517 3.389 1.00 0.00 H new ATOM 0 HA VAL A 32 12.045 10.033 3.393 1.00 0.00 H new ATOM 0 HB VAL A 32 11.631 7.198 2.687 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.387 7.761 1.659 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.416 7.860 3.435 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.471 9.348 2.460 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.367 7.929 0.389 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.821 9.570 0.907 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.967 8.224 1.109 1.00 0.00 H new ATOM 519 N PRO A 33 10.368 10.001 5.178 1.00 0.00 N ATOM 520 CA PRO A 33 9.487 10.143 6.311 1.00 0.00 C ATOM 521 C PRO A 33 8.203 9.314 6.474 1.00 0.00 C ATOM 522 O PRO A 33 7.378 9.547 7.373 1.00 0.00 O ATOM 523 CB PRO A 33 9.292 11.633 6.528 1.00 0.00 C ATOM 524 CG PRO A 33 9.340 12.168 5.059 1.00 0.00 C ATOM 525 CD PRO A 33 10.375 11.245 4.370 1.00 0.00 C ATOM 0 HA PRO A 33 10.015 9.629 7.114 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.343 11.856 7.016 1.00 0.00 H new ATOM 0 HB3 PRO A 33 10.078 12.064 7.148 1.00 0.00 H new ATOM 0 HG2 PRO A 33 8.364 12.106 4.577 1.00 0.00 H new ATOM 0 HG3 PRO A 33 9.648 13.213 5.023 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.100 11.046 3.334 1.00 0.00 H new ATOM 0 HD3 PRO A 33 11.365 11.702 4.355 1.00 0.00 H new ATOM 533 N VAL A 34 8.150 8.213 5.701 1.00 0.00 N ATOM 534 CA VAL A 34 7.021 7.308 5.556 1.00 0.00 C ATOM 535 C VAL A 34 7.323 5.938 6.243 1.00 0.00 C ATOM 536 O VAL A 34 8.387 5.361 6.065 1.00 0.00 O ATOM 537 CB VAL A 34 6.533 7.185 4.128 1.00 0.00 C ATOM 538 CG1 VAL A 34 7.390 6.362 3.162 1.00 0.00 C ATOM 539 CG2 VAL A 34 5.043 6.688 4.047 1.00 0.00 C ATOM 0 H VAL A 34 8.946 7.925 5.133 1.00 0.00 H new ATOM 0 HA VAL A 34 6.174 7.747 6.084 1.00 0.00 H new ATOM 0 HB VAL A 34 6.620 8.214 3.780 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.925 6.357 2.176 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.384 6.803 3.092 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.472 5.339 3.529 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.740 6.616 3.003 1.00 0.00 H new ATOM 0 HG22 VAL A 34 4.960 5.708 4.517 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.395 7.395 4.565 1.00 0.00 H new ATOM 549 N ILE A 35 6.382 5.505 7.074 1.00 0.00 N ATOM 550 CA ILE A 35 6.234 4.100 7.593 1.00 0.00 C ATOM 551 C ILE A 35 5.272 3.346 6.632 1.00 0.00 C ATOM 552 O ILE A 35 4.190 3.806 6.302 1.00 0.00 O ATOM 553 CB ILE A 35 5.564 4.207 9.036 1.00 0.00 C ATOM 554 CG1 ILE A 35 6.284 5.131 9.944 1.00 0.00 C ATOM 555 CG2 ILE A 35 5.019 2.910 9.547 1.00 0.00 C ATOM 556 CD1 ILE A 35 5.617 6.536 10.170 1.00 0.00 C ATOM 0 H ILE A 35 5.659 6.128 7.435 1.00 0.00 H new ATOM 0 HA ILE A 35 7.188 3.577 7.652 1.00 0.00 H new ATOM 0 HB ILE A 35 4.621 4.747 8.951 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.394 4.644 10.913 1.00 0.00 H new ATOM 0 HG13 ILE A 35 7.288 5.287 9.549 1.00 0.00 H new ATOM 0 HG21 ILE A 35 4.580 3.063 10.533 1.00 0.00 H new ATOM 0 HG22 ILE A 35 4.255 2.541 8.863 1.00 0.00 H new ATOM 0 HG23 ILE A 35 5.825 2.180 9.618 1.00 0.00 H new ATOM 0 HD11 ILE A 35 6.231 7.125 10.851 1.00 0.00 H new ATOM 0 HD12 ILE A 35 5.532 7.056 9.216 1.00 0.00 H new ATOM 0 HD13 ILE A 35 4.624 6.403 10.600 1.00 0.00 H new ATOM 568 N ILE A 36 5.738 2.155 6.213 1.00 0.00 N ATOM 569 CA ILE A 36 5.011 1.154 5.405 1.00 0.00 C ATOM 570 C ILE A 36 4.376 0.088 6.278 1.00 0.00 C ATOM 571 O ILE A 36 5.091 -0.776 6.853 1.00 0.00 O ATOM 572 CB ILE A 36 5.989 0.581 4.301 1.00 0.00 C ATOM 573 CG1 ILE A 36 6.989 1.645 3.840 1.00 0.00 C ATOM 574 CG2 ILE A 36 5.164 -0.050 3.147 1.00 0.00 C ATOM 575 CD1 ILE A 36 7.451 1.624 2.391 1.00 0.00 C ATOM 0 H ILE A 36 6.683 1.847 6.441 1.00 0.00 H new ATOM 0 HA ILE A 36 4.173 1.624 4.890 1.00 0.00 H new ATOM 0 HB ILE A 36 6.598 -0.217 4.726 1.00 0.00 H new ATOM 0 HG12 ILE A 36 6.547 2.622 4.033 1.00 0.00 H new ATOM 0 HG13 ILE A 36 7.874 1.565 4.472 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.841 -0.443 2.389 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.549 -0.860 3.540 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.522 0.710 2.701 1.00 0.00 H new ATOM 0 HD11 ILE A 36 8.156 2.438 2.222 1.00 0.00 H new ATOM 0 HD12 ILE A 36 7.938 0.672 2.178 1.00 0.00 H new ATOM 0 HD13 ILE A 36 6.591 1.746 1.733 1.00 0.00 H new ATOM 587 N GLU A 37 3.025 0.105 6.406 1.00 0.00 N ATOM 588 CA GLU A 37 2.203 -0.808 7.159 1.00 0.00 C ATOM 589 C GLU A 37 1.127 -1.518 6.247 1.00 0.00 C ATOM 590 O GLU A 37 0.521 -0.885 5.448 1.00 0.00 O ATOM 591 CB GLU A 37 1.483 -0.155 8.332 1.00 0.00 C ATOM 592 CG GLU A 37 2.438 0.227 9.499 1.00 0.00 C ATOM 593 CD GLU A 37 3.047 -1.014 10.189 1.00 0.00 C ATOM 594 OE1 GLU A 37 2.424 -2.109 10.044 1.00 0.00 O ATOM 595 OE2 GLU A 37 4.095 -0.841 10.850 1.00 0.00 O ATOM 0 H GLU A 37 2.464 0.819 5.942 1.00 0.00 H new ATOM 0 HA GLU A 37 2.903 -1.543 7.555 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.970 0.741 7.982 1.00 0.00 H new ATOM 0 HB3 GLU A 37 0.718 -0.835 8.705 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.241 0.858 9.117 1.00 0.00 H new ATOM 0 HG3 GLU A 37 1.891 0.817 10.234 1.00 0.00 H new ATOM 602 N ALA A 38 1.079 -2.852 6.412 1.00 0.00 N ATOM 603 CA ALA A 38 0.209 -3.764 5.650 1.00 0.00 C ATOM 604 C ALA A 38 -0.996 -4.237 6.469 1.00 0.00 C ATOM 605 O ALA A 38 -0.871 -4.752 7.587 1.00 0.00 O ATOM 606 CB ALA A 38 1.010 -4.988 5.159 1.00 0.00 C ATOM 0 H ALA A 38 1.659 -3.337 7.096 1.00 0.00 H new ATOM 0 HA ALA A 38 -0.167 -3.202 4.795 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.352 -5.652 4.598 1.00 0.00 H new ATOM 0 HB2 ALA A 38 1.825 -4.655 4.516 1.00 0.00 H new ATOM 0 HB3 ALA A 38 1.419 -5.523 6.016 1.00 0.00 H new ATOM 612 N PHE A 39 -2.216 -4.015 5.911 1.00 0.00 N ATOM 613 CA PHE A 39 -3.521 -3.968 6.586 1.00 0.00 C ATOM 614 C PHE A 39 -4.491 -4.968 5.968 1.00 0.00 C ATOM 615 O PHE A 39 -4.287 -5.522 4.914 1.00 0.00 O ATOM 616 CB PHE A 39 -4.066 -2.511 6.529 1.00 0.00 C ATOM 617 CG PHE A 39 -3.541 -1.556 7.626 1.00 0.00 C ATOM 618 CD1 PHE A 39 -2.218 -1.104 7.495 1.00 0.00 C ATOM 619 CD2 PHE A 39 -4.314 -1.218 8.749 1.00 0.00 C ATOM 620 CE1 PHE A 39 -1.731 -0.177 8.466 1.00 0.00 C ATOM 621 CE2 PHE A 39 -3.717 -0.585 9.836 1.00 0.00 C ATOM 622 CZ PHE A 39 -2.418 -0.029 9.655 1.00 0.00 C ATOM 0 H PHE A 39 -2.309 -3.854 4.908 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.406 -4.255 7.631 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -3.818 -2.088 5.556 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -5.153 -2.546 6.594 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -1.589 -1.446 6.686 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -5.369 -1.449 8.769 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -0.839 0.400 8.273 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -4.223 -0.518 10.788 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.961 0.520 10.465 1.00 0.00 H new ATOM 632 N PRO A 40 -5.592 -5.291 6.722 1.00 0.00 N ATOM 633 CA PRO A 40 -6.816 -5.935 6.211 1.00 0.00 C ATOM 634 C PRO A 40 -7.974 -4.998 5.751 1.00 0.00 C ATOM 635 O PRO A 40 -8.715 -4.419 6.529 1.00 0.00 O ATOM 636 CB PRO A 40 -7.233 -6.874 7.362 1.00 0.00 C ATOM 637 CG PRO A 40 -6.829 -6.112 8.620 1.00 0.00 C ATOM 638 CD PRO A 40 -5.670 -5.194 8.201 1.00 0.00 C ATOM 0 HA PRO A 40 -6.600 -6.441 5.270 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.304 -7.077 7.344 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -6.725 -7.836 7.297 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.665 -5.532 9.011 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.519 -6.797 9.409 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -5.851 -4.167 8.516 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -4.735 -5.509 8.663 1.00 0.00 H new ATOM 646 N GLU A 41 -8.116 -4.995 4.406 1.00 0.00 N ATOM 647 CA GLU A 41 -8.873 -4.006 3.628 1.00 0.00 C ATOM 648 C GLU A 41 -9.883 -3.214 4.431 1.00 0.00 C ATOM 649 O GLU A 41 -9.845 -1.942 4.394 1.00 0.00 O ATOM 650 CB GLU A 41 -9.497 -4.640 2.383 1.00 0.00 C ATOM 651 CG GLU A 41 -10.495 -5.753 2.739 1.00 0.00 C ATOM 652 CD GLU A 41 -10.666 -6.824 1.658 1.00 0.00 C ATOM 653 OE1 GLU A 41 -9.671 -7.212 0.981 1.00 0.00 O ATOM 654 OE2 GLU A 41 -11.865 -7.246 1.502 1.00 0.00 O ATOM 0 H GLU A 41 -7.688 -5.710 3.818 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.140 -3.266 3.305 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -10.005 -3.871 1.801 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -8.709 -5.049 1.751 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -10.169 -6.234 3.661 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.466 -5.301 2.942 1.00 0.00 H new ATOM 661 N THR A 42 -10.822 -3.870 5.141 1.00 0.00 N ATOM 662 CA THR A 42 -11.717 -3.372 6.208 1.00 0.00 C ATOM 663 C THR A 42 -11.446 -1.931 6.611 1.00 0.00 C ATOM 664 O THR A 42 -12.349 -1.088 6.715 1.00 0.00 O ATOM 665 CB THR A 42 -11.944 -4.251 7.402 1.00 0.00 C ATOM 666 OG1 THR A 42 -11.998 -3.528 8.644 1.00 0.00 O ATOM 667 CG2 THR A 42 -11.028 -5.504 7.443 1.00 0.00 C ATOM 0 H THR A 42 -10.990 -4.860 4.965 1.00 0.00 H new ATOM 0 HA THR A 42 -12.677 -3.410 5.692 1.00 0.00 H new ATOM 0 HB THR A 42 -12.948 -4.653 7.268 1.00 0.00 H new ATOM 0 HG1 THR A 42 -12.149 -4.155 9.381 1.00 0.00 H new ATOM 0 HG21 THR A 42 -11.252 -6.089 8.335 1.00 0.00 H new ATOM 0 HG22 THR A 42 -11.204 -6.113 6.556 1.00 0.00 H new ATOM 0 HG23 THR A 42 -9.984 -5.191 7.467 1.00 0.00 H new ATOM 675 N LEU A 43 -10.166 -1.641 6.957 1.00 0.00 N ATOM 676 CA LEU A 43 -9.680 -0.570 7.804 1.00 0.00 C ATOM 677 C LEU A 43 -9.297 0.650 6.928 1.00 0.00 C ATOM 678 O LEU A 43 -9.213 1.770 7.407 1.00 0.00 O ATOM 679 CB LEU A 43 -8.362 -1.138 8.452 1.00 0.00 C ATOM 680 CG LEU A 43 -8.333 -1.381 9.944 1.00 0.00 C ATOM 681 CD1 LEU A 43 -9.718 -1.363 10.650 1.00 0.00 C ATOM 682 CD2 LEU A 43 -7.527 -2.665 10.310 1.00 0.00 C ATOM 0 H LEU A 43 -9.396 -2.213 6.610 1.00 0.00 H new ATOM 0 HA LEU A 43 -10.424 -0.259 8.537 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.132 -2.082 7.959 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.553 -0.448 8.214 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.808 -0.512 10.342 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -9.585 -1.547 11.716 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.187 -0.390 10.506 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -10.354 -2.139 10.224 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -7.532 -2.802 11.391 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.986 -3.531 9.833 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.499 -2.561 9.962 1.00 0.00 H new ATOM 694 N ALA A 44 -9.003 0.378 5.621 1.00 0.00 N ATOM 695 CA ALA A 44 -8.340 1.304 4.699 1.00 0.00 C ATOM 696 C ALA A 44 -9.021 2.701 4.781 1.00 0.00 C ATOM 697 O ALA A 44 -8.431 3.725 4.700 1.00 0.00 O ATOM 698 CB ALA A 44 -8.457 0.793 3.236 1.00 0.00 C ATOM 0 H ALA A 44 -9.233 -0.516 5.187 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.289 1.373 4.981 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -7.959 1.493 2.565 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -7.985 -0.186 3.154 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -9.509 0.713 2.961 1.00 0.00 H new ATOM 704 N GLY A 45 -10.375 2.621 4.980 1.00 0.00 N ATOM 705 CA GLY A 45 -11.234 3.822 5.231 1.00 0.00 C ATOM 706 C GLY A 45 -10.614 4.725 6.306 1.00 0.00 C ATOM 707 O GLY A 45 -10.238 5.882 6.060 1.00 0.00 O ATOM 0 H GLY A 45 -10.891 1.741 4.971 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -11.359 4.385 4.306 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.228 3.504 5.547 1.00 0.00 H new ATOM 711 N GLU A 46 -10.510 4.189 7.532 1.00 0.00 N ATOM 712 CA GLU A 46 -10.079 4.853 8.760 1.00 0.00 C ATOM 713 C GLU A 46 -8.535 4.790 8.936 1.00 0.00 C ATOM 714 O GLU A 46 -7.923 5.681 9.532 1.00 0.00 O ATOM 715 CB GLU A 46 -10.764 4.229 9.987 1.00 0.00 C ATOM 716 CG GLU A 46 -12.260 4.593 10.092 1.00 0.00 C ATOM 717 CD GLU A 46 -12.615 5.261 11.456 1.00 0.00 C ATOM 718 OE1 GLU A 46 -11.717 5.420 12.281 1.00 0.00 O ATOM 719 OE2 GLU A 46 -13.842 5.556 11.571 1.00 0.00 O ATOM 0 H GLU A 46 -10.743 3.210 7.697 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.372 5.900 8.678 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -10.662 3.145 9.941 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.251 4.560 10.890 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -12.524 5.270 9.279 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -12.860 3.692 9.965 1.00 0.00 H new ATOM 726 N LYS A 47 -7.974 3.685 8.432 1.00 0.00 N ATOM 727 CA LYS A 47 -6.475 3.412 8.568 1.00 0.00 C ATOM 728 C LYS A 47 -5.728 4.038 7.382 1.00 0.00 C ATOM 729 O LYS A 47 -4.776 4.802 7.520 1.00 0.00 O ATOM 730 CB LYS A 47 -6.228 1.913 8.593 1.00 0.00 C ATOM 731 CG LYS A 47 -5.593 1.486 9.934 1.00 0.00 C ATOM 732 CD LYS A 47 -6.076 2.267 11.177 1.00 0.00 C ATOM 733 CE LYS A 47 -5.683 1.506 12.447 1.00 0.00 C ATOM 734 NZ LYS A 47 -5.077 2.421 13.443 1.00 0.00 N ATOM 0 H LYS A 47 -8.491 2.961 7.933 1.00 0.00 H new ATOM 0 HA LYS A 47 -6.112 3.852 9.497 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.168 1.382 8.445 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -5.571 1.634 7.769 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -5.795 0.427 10.091 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.511 1.596 9.855 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -5.635 3.264 11.187 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -7.157 2.398 11.139 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -6.563 1.026 12.876 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.977 0.714 12.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -4.818 1.884 14.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -4.225 2.860 13.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -5.762 3.162 13.695 1.00 0.00 H new ATOM 748 N GLY A 48 -6.199 3.643 6.159 1.00 0.00 N ATOM 749 CA GLY A 48 -5.724 4.246 4.886 1.00 0.00 C ATOM 750 C GLY A 48 -6.003 5.729 4.811 1.00 0.00 C ATOM 751 O GLY A 48 -5.465 6.446 3.931 1.00 0.00 O ATOM 0 H GLY A 48 -6.902 2.914 6.035 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.652 4.075 4.784 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.208 3.745 4.047 1.00 0.00 H new ATOM 755 N GLN A 49 -6.932 6.239 5.636 1.00 0.00 N ATOM 756 CA GLN A 49 -7.057 7.652 6.054 1.00 0.00 C ATOM 757 C GLN A 49 -5.721 8.089 6.746 1.00 0.00 C ATOM 758 O GLN A 49 -5.115 9.068 6.378 1.00 0.00 O ATOM 759 CB GLN A 49 -8.198 7.700 7.106 1.00 0.00 C ATOM 760 CG GLN A 49 -8.081 8.942 8.046 1.00 0.00 C ATOM 761 CD GLN A 49 -9.441 9.382 8.602 1.00 0.00 C ATOM 762 OE1 GLN A 49 -10.194 10.194 8.063 1.00 0.00 O ATOM 763 NE2 GLN A 49 -9.822 8.808 9.776 1.00 0.00 N ATOM 0 H GLN A 49 -7.654 5.651 6.052 1.00 0.00 H new ATOM 0 HA GLN A 49 -7.262 8.306 5.207 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -9.161 7.722 6.595 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.176 6.790 7.705 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -7.412 8.707 8.874 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -7.631 9.769 7.497 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.211 8.133 10.236 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -10.719 9.052 10.196 1.00 0.00 H new ATOM 772 N ASN A 50 -5.348 7.312 7.815 1.00 0.00 N ATOM 773 CA ASN A 50 -4.058 7.417 8.520 1.00 0.00 C ATOM 774 C ASN A 50 -2.874 7.066 7.651 1.00 0.00 C ATOM 775 O ASN A 50 -1.693 7.200 8.024 1.00 0.00 O ATOM 776 CB ASN A 50 -4.098 6.586 9.814 1.00 0.00 C ATOM 777 CG ASN A 50 -4.961 7.200 10.932 1.00 0.00 C ATOM 778 OD1 ASN A 50 -4.388 8.174 11.652 1.00 0.00 O flip ATOM 779 ND2 ASN A 50 -6.100 6.821 11.217 1.00 0.00 N flip ATOM 0 H ASN A 50 -5.955 6.590 8.203 1.00 0.00 H new ATOM 0 HA ASN A 50 -3.913 8.464 8.784 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -4.478 5.591 9.582 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.080 6.460 10.183 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -6.542 6.080 10.673 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -6.600 7.249 11.997 1.00 0.00 H new ATOM 786 N ALA A 51 -3.172 6.538 6.423 1.00 0.00 N ATOM 787 CA ALA A 51 -2.250 6.523 5.277 1.00 0.00 C ATOM 788 C ALA A 51 -2.064 7.930 4.695 1.00 0.00 C ATOM 789 O ALA A 51 -2.745 8.886 5.042 1.00 0.00 O ATOM 790 CB ALA A 51 -2.786 5.573 4.176 1.00 0.00 C ATOM 0 H ALA A 51 -4.074 6.110 6.215 1.00 0.00 H new ATOM 0 HA ALA A 51 -1.283 6.166 5.630 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.096 5.569 3.332 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.874 4.564 4.578 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -3.765 5.918 3.843 1.00 0.00 H new ATOM 796 N ASP A 52 -1.038 8.054 3.827 1.00 0.00 N ATOM 797 CA ASP A 52 -0.833 9.120 2.820 1.00 0.00 C ATOM 798 C ASP A 52 -0.798 8.563 1.389 1.00 0.00 C ATOM 799 O ASP A 52 -0.636 9.309 0.419 1.00 0.00 O ATOM 800 CB ASP A 52 0.537 9.799 3.105 1.00 0.00 C ATOM 801 CG ASP A 52 0.475 11.351 3.174 1.00 0.00 C ATOM 802 OD1 ASP A 52 -0.605 11.854 3.579 1.00 0.00 O ATOM 803 OD2 ASP A 52 1.526 11.986 2.860 1.00 0.00 O ATOM 0 H ASP A 52 -0.282 7.370 3.808 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.664 9.822 2.894 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.929 9.420 4.049 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.243 9.509 2.327 1.00 0.00 H new ATOM 808 N VAL A 53 -0.730 7.193 1.309 1.00 0.00 N ATOM 809 CA VAL A 53 -0.305 6.456 0.115 1.00 0.00 C ATOM 810 C VAL A 53 -0.670 4.956 0.325 1.00 0.00 C ATOM 811 O VAL A 53 0.116 4.182 0.910 1.00 0.00 O ATOM 812 CB VAL A 53 1.094 6.743 -0.319 1.00 0.00 C ATOM 813 CG1 VAL A 53 1.374 6.904 -1.827 1.00 0.00 C ATOM 814 CG2 VAL A 53 1.814 7.842 0.499 1.00 0.00 C ATOM 0 H VAL A 53 -0.975 6.584 2.090 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.853 6.811 -0.758 1.00 0.00 H new ATOM 0 HB VAL A 53 1.543 5.781 -0.074 1.00 0.00 H new ATOM 0 HG11 VAL A 53 2.434 7.109 -1.981 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.103 5.986 -2.348 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.784 7.732 -2.220 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.823 7.981 0.112 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.261 8.778 0.417 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.865 7.542 1.546 1.00 0.00 H new ATOM 824 N VAL A 54 -1.881 4.568 -0.072 1.00 0.00 N ATOM 825 CA VAL A 54 -2.569 3.318 0.260 1.00 0.00 C ATOM 826 C VAL A 54 -2.383 2.297 -0.864 1.00 0.00 C ATOM 827 O VAL A 54 -2.459 2.650 -2.065 1.00 0.00 O ATOM 828 CB VAL A 54 -4.030 3.602 0.649 1.00 0.00 C ATOM 829 CG1 VAL A 54 -4.924 2.318 0.709 1.00 0.00 C ATOM 830 CG2 VAL A 54 -4.145 4.408 1.948 1.00 0.00 C ATOM 0 H VAL A 54 -2.449 5.160 -0.678 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.123 2.857 1.141 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.420 4.216 -0.163 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.940 2.595 0.989 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -4.936 1.837 -0.269 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.519 1.627 1.449 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.197 4.581 2.177 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.683 3.852 2.763 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.638 5.365 1.828 1.00 0.00 H new ATOM 840 N LEU A 55 -2.030 1.046 -0.544 1.00 0.00 N ATOM 841 CA LEU A 55 -1.934 -0.138 -1.406 1.00 0.00 C ATOM 842 C LEU A 55 -2.914 -1.219 -0.902 1.00 0.00 C ATOM 843 O LEU A 55 -3.023 -1.463 0.295 1.00 0.00 O ATOM 844 CB LEU A 55 -0.488 -0.646 -1.252 1.00 0.00 C ATOM 845 CG LEU A 55 0.684 0.272 -1.628 1.00 0.00 C ATOM 846 CD1 LEU A 55 1.954 -0.465 -2.131 1.00 0.00 C ATOM 847 CD2 LEU A 55 0.271 1.366 -2.661 1.00 0.00 C ATOM 0 H LEU A 55 -1.780 0.816 0.418 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.178 0.091 -2.443 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.354 -0.936 -0.210 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.396 -1.553 -1.849 1.00 0.00 H new ATOM 0 HG LEU A 55 0.951 0.746 -0.683 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.727 0.265 -2.372 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.318 -1.135 -1.352 1.00 0.00 H new ATOM 0 HD13 LEU A 55 1.710 -1.043 -3.022 1.00 0.00 H new ATOM 0 HD21 LEU A 55 1.134 1.990 -2.895 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -0.089 0.889 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -0.520 1.985 -2.238 1.00 0.00 H new ATOM 859 N LEU A 56 -3.692 -1.843 -1.840 1.00 0.00 N ATOM 860 CA LEU A 56 -4.749 -2.846 -1.589 1.00 0.00 C ATOM 861 C LEU A 56 -4.549 -4.064 -2.503 1.00 0.00 C ATOM 862 O LEU A 56 -4.343 -3.923 -3.704 1.00 0.00 O ATOM 863 CB LEU A 56 -6.097 -2.157 -1.846 1.00 0.00 C ATOM 864 CG LEU A 56 -6.174 -0.612 -1.650 1.00 0.00 C ATOM 865 CD1 LEU A 56 -7.417 0.009 -2.365 1.00 0.00 C ATOM 866 CD2 LEU A 56 -6.120 -0.241 -0.157 1.00 0.00 C ATOM 0 H LEU A 56 -3.585 -1.643 -2.834 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.713 -3.213 -0.563 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.397 -2.380 -2.870 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.837 -2.615 -1.190 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.296 -0.177 -2.127 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -7.430 1.087 -2.202 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.361 -0.195 -3.434 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.328 -0.431 -1.959 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.175 0.842 -0.049 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.960 -0.701 0.363 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.186 -0.601 0.274 1.00 0.00 H new ATOM 878 N GLY A 57 -4.555 -5.272 -1.902 1.00 0.00 N ATOM 879 CA GLY A 57 -4.311 -6.563 -2.573 1.00 0.00 C ATOM 880 C GLY A 57 -4.803 -6.638 -4.007 1.00 0.00 C ATOM 881 O GLY A 57 -5.770 -5.924 -4.369 1.00 0.00 O ATOM 0 H GLY A 57 -4.736 -5.378 -0.904 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -3.240 -6.767 -2.560 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -4.793 -7.353 -1.997 1.00 0.00 H new ATOM 885 N PRO A 58 -4.166 -7.458 -4.853 1.00 0.00 N ATOM 886 CA PRO A 58 -4.448 -7.687 -6.280 1.00 0.00 C ATOM 887 C PRO A 58 -5.270 -8.939 -6.690 1.00 0.00 C ATOM 888 O PRO A 58 -5.442 -9.260 -7.866 1.00 0.00 O ATOM 889 CB PRO A 58 -3.058 -7.654 -6.931 1.00 0.00 C ATOM 890 CG PRO A 58 -2.265 -8.497 -5.882 1.00 0.00 C ATOM 891 CD PRO A 58 -2.847 -8.128 -4.531 1.00 0.00 C ATOM 0 HA PRO A 58 -5.141 -6.919 -6.623 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -3.049 -8.104 -7.924 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -2.668 -6.642 -7.036 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -2.373 -9.564 -6.076 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.199 -8.271 -5.924 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.992 -9.010 -3.908 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.185 -7.457 -3.984 1.00 0.00 H new ATOM 899 N GLN A 59 -5.880 -9.524 -5.625 1.00 0.00 N ATOM 900 CA GLN A 59 -7.095 -10.370 -5.713 1.00 0.00 C ATOM 901 C GLN A 59 -8.305 -9.613 -5.147 1.00 0.00 C ATOM 902 O GLN A 59 -9.458 -10.056 -5.334 1.00 0.00 O ATOM 903 CB GLN A 59 -6.820 -11.625 -4.848 1.00 0.00 C ATOM 904 CG GLN A 59 -5.351 -12.062 -4.844 1.00 0.00 C ATOM 905 CD GLN A 59 -5.089 -13.204 -3.839 1.00 0.00 C ATOM 906 OE1 GLN A 59 -5.485 -14.374 -3.983 1.00 0.00 O ATOM 907 NE2 GLN A 59 -4.383 -12.873 -2.744 1.00 0.00 N ATOM 0 H GLN A 59 -5.535 -9.418 -4.671 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.314 -10.635 -6.747 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -7.133 -11.424 -3.823 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.434 -12.448 -5.213 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -5.067 -12.388 -5.845 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -4.720 -11.209 -4.596 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -4.055 -11.915 -2.619 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -4.175 -13.579 -2.038 1.00 0.00 H new ATOM 916 N ILE A 60 -8.050 -8.522 -4.401 1.00 0.00 N ATOM 917 CA ILE A 60 -9.067 -7.704 -3.687 1.00 0.00 C ATOM 918 C ILE A 60 -9.306 -6.386 -4.435 1.00 0.00 C ATOM 919 O ILE A 60 -10.041 -5.498 -3.926 1.00 0.00 O ATOM 920 CB ILE A 60 -8.765 -7.568 -2.185 1.00 0.00 C ATOM 921 CG1 ILE A 60 -9.499 -6.404 -1.514 1.00 0.00 C ATOM 922 CG2 ILE A 60 -7.248 -7.596 -1.872 1.00 0.00 C ATOM 923 CD1 ILE A 60 -8.635 -5.208 -1.079 1.00 0.00 C ATOM 0 H ILE A 60 -7.102 -8.168 -4.270 1.00 0.00 H new ATOM 0 HA ILE A 60 -10.022 -8.229 -3.699 1.00 0.00 H new ATOM 0 HB ILE A 60 -9.181 -8.464 -1.724 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -10.263 -6.041 -2.201 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -10.017 -6.788 -0.635 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.096 -7.496 -0.797 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.824 -8.541 -2.212 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -6.755 -6.771 -2.386 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -9.268 -4.450 -0.618 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -7.887 -5.542 -0.360 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -8.137 -4.783 -1.950 1.00 0.00 H new ATOM 935 N ALA A 61 -8.720 -6.249 -5.616 1.00 0.00 N ATOM 936 CA ALA A 61 -8.958 -5.160 -6.588 1.00 0.00 C ATOM 937 C ALA A 61 -10.288 -4.449 -6.346 1.00 0.00 C ATOM 938 O ALA A 61 -10.365 -3.211 -6.252 1.00 0.00 O ATOM 939 CB ALA A 61 -8.893 -5.714 -8.022 1.00 0.00 C ATOM 0 H ALA A 61 -8.029 -6.921 -5.951 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.172 -4.417 -6.451 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -9.069 -4.906 -8.732 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -7.908 -6.146 -8.201 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -9.655 -6.483 -8.150 1.00 0.00 H new ATOM 945 N TYR A 62 -11.384 -5.231 -6.280 1.00 0.00 N ATOM 946 CA TYR A 62 -12.795 -4.800 -6.347 1.00 0.00 C ATOM 947 C TYR A 62 -13.155 -3.760 -5.301 1.00 0.00 C ATOM 948 O TYR A 62 -14.159 -3.013 -5.419 1.00 0.00 O ATOM 949 CB TYR A 62 -13.722 -6.051 -6.270 1.00 0.00 C ATOM 950 CG TYR A 62 -13.761 -6.697 -4.879 1.00 0.00 C ATOM 951 CD1 TYR A 62 -12.654 -6.609 -4.022 1.00 0.00 C ATOM 952 CD2 TYR A 62 -14.904 -7.400 -4.520 1.00 0.00 C ATOM 953 CE1 TYR A 62 -12.637 -7.354 -2.830 1.00 0.00 C ATOM 954 CE2 TYR A 62 -14.938 -8.029 -3.262 1.00 0.00 C ATOM 955 CZ TYR A 62 -13.780 -8.094 -2.485 1.00 0.00 C ATOM 956 OH TYR A 62 -13.782 -8.874 -1.371 1.00 0.00 O ATOM 0 H TYR A 62 -11.303 -6.242 -6.172 1.00 0.00 H new ATOM 0 HA TYR A 62 -12.946 -4.300 -7.304 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -14.733 -5.763 -6.557 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.383 -6.790 -6.996 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -11.819 -5.972 -4.277 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -15.748 -7.462 -5.191 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -11.764 -7.357 -2.194 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -15.859 -8.461 -2.898 1.00 0.00 H new ATOM 0 HH TYR A 62 -14.653 -9.315 -1.282 1.00 0.00 H new ATOM 966 N MET A 63 -12.356 -3.706 -4.211 1.00 0.00 N ATOM 967 CA MET A 63 -12.656 -3.078 -2.935 1.00 0.00 C ATOM 968 C MET A 63 -12.149 -1.609 -2.892 1.00 0.00 C ATOM 969 O MET A 63 -12.720 -0.767 -2.214 1.00 0.00 O ATOM 970 CB MET A 63 -12.040 -3.846 -1.741 1.00 0.00 C ATOM 971 CG MET A 63 -12.950 -5.012 -1.279 1.00 0.00 C ATOM 972 SD MET A 63 -13.953 -4.557 0.202 1.00 0.00 S ATOM 973 CE MET A 63 -12.641 -4.024 1.309 1.00 0.00 C ATOM 0 H MET A 63 -11.429 -4.131 -4.215 1.00 0.00 H new ATOM 0 HA MET A 63 -13.742 -3.097 -2.843 1.00 0.00 H new ATOM 0 HB2 MET A 63 -11.063 -4.237 -2.025 1.00 0.00 H new ATOM 0 HB3 MET A 63 -11.879 -3.159 -0.910 1.00 0.00 H new ATOM 0 HG2 MET A 63 -13.615 -5.298 -2.094 1.00 0.00 H new ATOM 0 HG3 MET A 63 -12.336 -5.882 -1.048 1.00 0.00 H new ATOM 0 HE1 MET A 63 -12.833 -4.407 2.311 1.00 0.00 H new ATOM 0 HE2 MET A 63 -11.685 -4.407 0.951 1.00 0.00 H new ATOM 0 HE3 MET A 63 -12.608 -2.935 1.336 1.00 0.00 H new ATOM 983 N LEU A 64 -11.025 -1.383 -3.605 1.00 0.00 N ATOM 984 CA LEU A 64 -10.362 -0.082 -3.834 1.00 0.00 C ATOM 985 C LEU A 64 -11.441 0.971 -4.162 1.00 0.00 C ATOM 986 O LEU A 64 -11.340 2.119 -3.724 1.00 0.00 O ATOM 987 CB LEU A 64 -9.467 -0.303 -5.081 1.00 0.00 C ATOM 988 CG LEU A 64 -9.494 0.730 -6.219 1.00 0.00 C ATOM 989 CD1 LEU A 64 -8.958 2.122 -5.839 1.00 0.00 C ATOM 990 CD2 LEU A 64 -8.916 0.177 -7.538 1.00 0.00 C ATOM 0 H LEU A 64 -10.528 -2.147 -4.062 1.00 0.00 H new ATOM 0 HA LEU A 64 -9.790 0.259 -2.971 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -8.436 -0.382 -4.735 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -9.734 -1.269 -5.509 1.00 0.00 H new ATOM 0 HG LEU A 64 -10.552 0.910 -6.408 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.016 2.783 -6.704 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.557 2.533 -5.027 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -7.920 2.037 -5.517 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.960 0.949 -8.306 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -7.879 -0.123 -7.384 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.500 -0.687 -7.857 1.00 0.00 H new ATOM 1002 N PRO A 65 -12.453 0.592 -4.954 1.00 0.00 N ATOM 1003 CA PRO A 65 -13.679 1.415 -5.240 1.00 0.00 C ATOM 1004 C PRO A 65 -14.417 1.963 -3.938 1.00 0.00 C ATOM 1005 O PRO A 65 -14.765 3.078 -3.796 1.00 0.00 O ATOM 1006 CB PRO A 65 -14.596 0.450 -6.005 1.00 0.00 C ATOM 1007 CG PRO A 65 -13.575 -0.299 -6.879 1.00 0.00 C ATOM 1008 CD PRO A 65 -12.419 -0.566 -5.869 1.00 0.00 C ATOM 0 HA PRO A 65 -13.413 2.317 -5.792 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -15.137 -0.221 -5.337 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -15.342 0.976 -6.601 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -13.985 -1.224 -7.284 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -13.246 0.301 -7.727 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -12.570 -1.502 -5.331 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -11.458 -0.642 -6.377 1.00 0.00 H new ATOM 1016 N GLU A 66 -14.385 0.960 -3.006 1.00 0.00 N ATOM 1017 CA GLU A 66 -15.037 1.069 -1.679 1.00 0.00 C ATOM 1018 C GLU A 66 -14.056 1.703 -0.676 1.00 0.00 C ATOM 1019 O GLU A 66 -14.424 2.477 0.192 1.00 0.00 O ATOM 1020 CB GLU A 66 -15.442 -0.359 -1.196 1.00 0.00 C ATOM 1021 CG GLU A 66 -16.832 -0.397 -0.602 1.00 0.00 C ATOM 1022 CD GLU A 66 -17.787 -1.414 -1.198 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -17.730 -1.610 -2.460 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -18.608 -2.021 -0.442 1.00 0.00 O ATOM 0 H GLU A 66 -13.911 0.070 -3.159 1.00 0.00 H new ATOM 0 HA GLU A 66 -15.926 1.696 -1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.390 -1.051 -2.036 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -14.723 -0.705 -0.453 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -16.743 -0.595 0.466 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -17.276 0.593 -0.706 1.00 0.00 H new ATOM 1031 N ILE A 67 -12.763 1.300 -0.779 1.00 0.00 N ATOM 1032 CA ILE A 67 -11.609 2.007 -0.181 1.00 0.00 C ATOM 1033 C ILE A 67 -11.793 3.543 -0.312 1.00 0.00 C ATOM 1034 O ILE A 67 -11.850 4.263 0.656 1.00 0.00 O ATOM 1035 CB ILE A 67 -10.260 1.481 -0.670 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -10.008 -0.003 -0.380 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -9.061 2.384 -0.288 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -10.377 -0.544 0.982 1.00 0.00 C ATOM 0 H ILE A 67 -12.493 0.459 -1.290 1.00 0.00 H new ATOM 0 HA ILE A 67 -11.588 1.786 0.886 1.00 0.00 H new ATOM 0 HB ILE A 67 -10.340 1.540 -1.755 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -10.551 -0.583 -1.126 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -8.947 -0.196 -0.537 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -8.139 1.945 -0.669 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -9.198 3.374 -0.722 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -9.001 2.469 0.797 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.138 -1.606 1.029 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.815 -0.011 1.749 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.445 -0.405 1.152 1.00 0.00 H new ATOM 1050 N GLN A 68 -11.898 3.984 -1.591 1.00 0.00 N ATOM 1051 CA GLN A 68 -12.036 5.374 -2.013 1.00 0.00 C ATOM 1052 C GLN A 68 -13.379 5.981 -1.566 1.00 0.00 C ATOM 1053 O GLN A 68 -13.484 7.184 -1.323 1.00 0.00 O ATOM 1054 CB GLN A 68 -11.884 5.421 -3.540 1.00 0.00 C ATOM 1055 CG GLN A 68 -10.537 4.943 -4.082 1.00 0.00 C ATOM 1056 CD GLN A 68 -9.640 6.101 -4.555 1.00 0.00 C ATOM 1057 OE1 GLN A 68 -8.982 6.782 -3.590 1.00 0.00 O flip ATOM 1058 NE2 GLN A 68 -9.535 6.488 -5.728 1.00 0.00 N flip ATOM 0 H GLN A 68 -11.887 3.340 -2.382 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.261 5.977 -1.539 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -12.672 4.813 -3.985 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.047 6.446 -3.873 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -10.017 4.380 -3.306 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.707 4.258 -4.913 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.021 5.991 -6.474 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -8.962 7.303 -5.947 1.00 0.00 H new ATOM 1067 N ARG A 69 -14.456 5.145 -1.491 1.00 0.00 N ATOM 1068 CA ARG A 69 -15.836 5.572 -1.201 1.00 0.00 C ATOM 1069 C ARG A 69 -15.977 6.026 0.251 1.00 0.00 C ATOM 1070 O ARG A 69 -16.874 6.775 0.620 1.00 0.00 O ATOM 1071 CB ARG A 69 -16.821 4.425 -1.500 1.00 0.00 C ATOM 1072 CG ARG A 69 -17.889 4.863 -2.547 1.00 0.00 C ATOM 1073 CD ARG A 69 -17.251 5.188 -3.892 1.00 0.00 C ATOM 1074 NE ARG A 69 -17.487 4.096 -4.851 1.00 0.00 N ATOM 1075 CZ ARG A 69 -17.840 4.242 -6.152 1.00 0.00 C ATOM 1076 NH1 ARG A 69 -17.834 5.463 -6.742 1.00 0.00 N ATOM 1077 NH2 ARG A 69 -18.126 3.168 -6.924 1.00 0.00 N ATOM 0 H ARG A 69 -14.375 4.138 -1.635 1.00 0.00 H new ATOM 0 HA ARG A 69 -16.072 6.420 -1.845 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -16.274 3.560 -1.874 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -17.315 4.116 -0.579 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -18.623 4.068 -2.674 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -18.426 5.736 -2.177 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -17.664 6.118 -4.282 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -16.180 5.343 -3.765 1.00 0.00 H new ATOM 0 HE ARG A 69 -17.375 3.143 -4.505 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -17.561 6.287 -6.206 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -18.102 5.557 -7.722 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -18.078 2.229 -6.529 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -18.390 3.298 -7.901 1.00 0.00 H new ATOM 1091 N LEU A 70 -15.072 5.479 1.125 1.00 0.00 N ATOM 1092 CA LEU A 70 -14.851 5.923 2.504 1.00 0.00 C ATOM 1093 C LEU A 70 -13.792 7.052 2.466 1.00 0.00 C ATOM 1094 O LEU A 70 -14.014 8.116 2.988 1.00 0.00 O ATOM 1095 CB LEU A 70 -14.208 4.683 3.226 1.00 0.00 C ATOM 1096 CG LEU A 70 -15.118 3.438 3.382 1.00 0.00 C ATOM 1097 CD1 LEU A 70 -14.405 2.082 3.152 1.00 0.00 C ATOM 1098 CD2 LEU A 70 -15.829 3.478 4.782 1.00 0.00 C ATOM 0 H LEU A 70 -14.471 4.698 0.863 1.00 0.00 H new ATOM 0 HA LEU A 70 -15.760 6.273 2.993 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -13.316 4.389 2.673 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -13.880 4.995 4.218 1.00 0.00 H new ATOM 0 HG LEU A 70 -15.858 3.496 2.583 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -15.119 1.269 3.282 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -14.000 2.051 2.141 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -13.594 1.971 3.871 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -16.469 2.602 4.890 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -15.078 3.479 5.572 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -16.435 4.381 4.857 1.00 0.00 H new ATOM 1110 N LEU A 71 -12.626 6.762 1.850 1.00 0.00 N ATOM 1111 CA LEU A 71 -11.358 7.520 1.938 1.00 0.00 C ATOM 1112 C LEU A 71 -10.994 8.006 0.520 1.00 0.00 C ATOM 1113 O LEU A 71 -10.111 7.494 -0.156 1.00 0.00 O ATOM 1114 CB LEU A 71 -10.329 6.532 2.470 1.00 0.00 C ATOM 1115 CG LEU A 71 -8.968 6.327 1.869 1.00 0.00 C ATOM 1116 CD1 LEU A 71 -8.038 7.593 1.935 1.00 0.00 C ATOM 1117 CD2 LEU A 71 -8.249 5.048 2.343 1.00 0.00 C ATOM 0 H LEU A 71 -12.539 5.947 1.243 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.415 8.393 2.588 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.163 6.799 3.514 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.814 5.556 2.464 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.182 6.169 0.812 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.075 7.361 1.480 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.505 8.416 1.395 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.888 7.880 2.976 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.274 4.978 1.860 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -8.117 5.084 3.424 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -8.847 4.176 2.080 1.00 0.00 H new ATOM 1129 N PRO A 72 -11.757 9.029 0.029 1.00 0.00 N ATOM 1130 CA PRO A 72 -11.873 9.420 -1.377 1.00 0.00 C ATOM 1131 C PRO A 72 -10.775 10.247 -2.045 1.00 0.00 C ATOM 1132 O PRO A 72 -10.556 10.220 -3.261 1.00 0.00 O ATOM 1133 CB PRO A 72 -13.265 10.026 -1.530 1.00 0.00 C ATOM 1134 CG PRO A 72 -13.384 10.769 -0.163 1.00 0.00 C ATOM 1135 CD PRO A 72 -12.798 9.726 0.822 1.00 0.00 C ATOM 0 HA PRO A 72 -11.717 8.507 -1.952 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.334 10.704 -2.381 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -14.038 9.269 -1.662 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -12.819 11.701 -0.154 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.417 11.021 0.076 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -12.374 10.205 1.704 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -13.563 9.033 1.172 1.00 0.00 H new ATOM 1143 N ASN A 73 -9.945 10.856 -1.143 1.00 0.00 N ATOM 1144 CA ASN A 73 -9.070 11.989 -1.453 1.00 0.00 C ATOM 1145 C ASN A 73 -7.600 11.688 -1.106 1.00 0.00 C ATOM 1146 O ASN A 73 -6.917 12.457 -0.388 1.00 0.00 O ATOM 1147 CB ASN A 73 -9.556 13.267 -0.720 1.00 0.00 C ATOM 1148 CG ASN A 73 -11.056 13.521 -0.853 1.00 0.00 C ATOM 1149 OD1 ASN A 73 -11.714 13.340 -1.904 1.00 0.00 O ATOM 1150 ND2 ASN A 73 -11.710 13.988 0.255 1.00 0.00 N ATOM 0 H ASN A 73 -9.878 10.555 -0.171 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.122 12.161 -2.528 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -9.303 13.187 0.337 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -9.015 14.128 -1.113 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -12.711 14.180 0.213 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -11.197 14.143 1.123 1.00 0.00 H new ATOM 1157 N LYS A 74 -7.108 10.531 -1.562 1.00 0.00 N ATOM 1158 CA LYS A 74 -5.740 10.027 -1.320 1.00 0.00 C ATOM 1159 C LYS A 74 -5.202 9.235 -2.514 1.00 0.00 C ATOM 1160 O LYS A 74 -5.934 8.937 -3.474 1.00 0.00 O ATOM 1161 CB LYS A 74 -5.748 9.122 -0.057 1.00 0.00 C ATOM 1162 CG LYS A 74 -5.778 9.962 1.220 1.00 0.00 C ATOM 1163 CD LYS A 74 -4.925 9.422 2.377 1.00 0.00 C ATOM 1164 CE LYS A 74 -5.314 10.154 3.686 1.00 0.00 C ATOM 1165 NZ LYS A 74 -5.561 11.599 3.370 1.00 0.00 N ATOM 0 H LYS A 74 -7.666 9.893 -2.130 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.085 10.885 -1.172 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -6.616 8.463 -0.083 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -4.864 8.485 -0.056 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -5.441 10.970 0.981 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -6.811 10.043 1.558 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -5.079 8.349 2.488 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -3.867 9.572 2.164 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -6.207 9.704 4.120 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.517 10.059 4.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -5.488 12.162 4.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -4.854 11.930 2.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -6.513 11.708 2.966 1.00 0.00 H new ATOM 1179 N PRO A 75 -3.888 8.948 -2.469 1.00 0.00 N ATOM 1180 CA PRO A 75 -3.178 8.038 -3.424 1.00 0.00 C ATOM 1181 C PRO A 75 -3.076 6.553 -3.074 1.00 0.00 C ATOM 1182 O PRO A 75 -2.025 6.030 -2.724 1.00 0.00 O ATOM 1183 CB PRO A 75 -1.834 8.725 -3.662 1.00 0.00 C ATOM 1184 CG PRO A 75 -1.530 9.330 -2.286 1.00 0.00 C ATOM 1185 CD PRO A 75 -2.900 9.675 -1.682 1.00 0.00 C ATOM 0 HA PRO A 75 -3.778 7.929 -4.327 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.065 8.018 -3.975 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.899 9.489 -4.437 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -0.990 8.623 -1.656 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.905 10.219 -2.377 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -2.947 9.383 -0.633 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.084 10.749 -1.723 1.00 0.00 H new ATOM 1193 N VAL A 76 -4.229 5.855 -3.308 1.00 0.00 N ATOM 1194 CA VAL A 76 -4.448 4.438 -3.159 1.00 0.00 C ATOM 1195 C VAL A 76 -4.155 3.692 -4.506 1.00 0.00 C ATOM 1196 O VAL A 76 -4.393 4.178 -5.599 1.00 0.00 O ATOM 1197 CB VAL A 76 -5.814 4.127 -2.576 1.00 0.00 C ATOM 1198 CG1 VAL A 76 -6.945 5.119 -3.013 1.00 0.00 C ATOM 1199 CG2 VAL A 76 -6.288 2.677 -2.812 1.00 0.00 C ATOM 0 H VAL A 76 -5.072 6.332 -3.628 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.737 4.056 -2.426 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.645 4.259 -1.507 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.887 4.823 -2.551 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.686 6.129 -2.695 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.050 5.096 -4.098 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -7.272 2.538 -2.364 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.346 2.483 -3.883 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -5.581 1.984 -2.356 1.00 0.00 H new ATOM 1209 N GLU A 77 -3.517 2.510 -4.344 1.00 0.00 N ATOM 1210 CA GLU A 77 -3.219 1.554 -5.434 1.00 0.00 C ATOM 1211 C GLU A 77 -3.208 0.091 -4.941 1.00 0.00 C ATOM 1212 O GLU A 77 -2.752 -0.213 -3.857 1.00 0.00 O ATOM 1213 CB GLU A 77 -1.880 1.884 -6.095 1.00 0.00 C ATOM 1214 CG GLU A 77 -1.978 3.040 -7.103 1.00 0.00 C ATOM 1215 CD GLU A 77 -1.230 2.755 -8.418 1.00 0.00 C ATOM 1216 OE1 GLU A 77 -0.855 1.585 -8.693 1.00 0.00 O ATOM 1217 OE2 GLU A 77 -1.041 3.750 -9.173 1.00 0.00 O ATOM 0 H GLU A 77 -3.189 2.188 -3.433 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.020 1.655 -6.167 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -1.154 2.142 -5.324 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -1.503 0.996 -6.603 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.028 3.235 -7.323 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -1.574 3.945 -6.650 1.00 0.00 H new ATOM 1224 N VAL A 78 -3.808 -0.781 -5.793 1.00 0.00 N ATOM 1225 CA VAL A 78 -3.665 -2.238 -5.754 1.00 0.00 C ATOM 1226 C VAL A 78 -2.319 -2.662 -6.389 1.00 0.00 C ATOM 1227 O VAL A 78 -1.825 -2.018 -7.331 1.00 0.00 O ATOM 1228 CB VAL A 78 -4.886 -2.941 -6.352 1.00 0.00 C ATOM 1229 CG1 VAL A 78 -5.561 -2.241 -7.543 1.00 0.00 C ATOM 1230 CG2 VAL A 78 -4.612 -4.449 -6.665 1.00 0.00 C ATOM 0 H VAL A 78 -4.421 -0.467 -6.545 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.633 -2.566 -4.715 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.620 -2.873 -5.549 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.412 -2.834 -7.879 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -5.905 -1.253 -7.237 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -4.845 -2.139 -8.359 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -5.509 -4.902 -7.087 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.794 -4.529 -7.381 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -4.342 -4.968 -5.745 1.00 0.00 H new ATOM 1240 N ILE A 79 -1.699 -3.675 -5.801 1.00 0.00 N ATOM 1241 CA ILE A 79 -0.373 -4.262 -6.151 1.00 0.00 C ATOM 1242 C ILE A 79 -0.523 -5.048 -7.463 1.00 0.00 C ATOM 1243 O ILE A 79 -1.598 -5.081 -8.092 1.00 0.00 O ATOM 1244 CB ILE A 79 0.165 -5.125 -4.938 1.00 0.00 C ATOM 1245 CG1 ILE A 79 -0.123 -4.414 -3.611 1.00 0.00 C ATOM 1246 CG2 ILE A 79 1.590 -5.589 -5.118 1.00 0.00 C ATOM 1247 CD1 ILE A 79 0.291 -5.292 -2.364 1.00 0.00 C ATOM 0 H ILE A 79 -2.123 -4.157 -5.008 1.00 0.00 H new ATOM 0 HA ILE A 79 0.379 -3.491 -6.322 1.00 0.00 H new ATOM 0 HB ILE A 79 -0.391 -6.062 -4.912 1.00 0.00 H new ATOM 0 HG12 ILE A 79 0.417 -3.468 -3.583 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.185 -4.177 -3.550 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.894 -6.175 -4.250 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.662 -6.205 -6.015 1.00 0.00 H new ATOM 0 HG23 ILE A 79 2.245 -4.723 -5.219 1.00 0.00 H new ATOM 0 HD11 ILE A 79 0.069 -4.748 -1.446 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -0.268 -6.227 -2.376 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.359 -5.507 -2.409 1.00 0.00 H new ATOM 1259 N ASP A 80 0.586 -5.695 -7.852 1.00 0.00 N ATOM 1260 CA ASP A 80 0.644 -6.919 -8.681 1.00 0.00 C ATOM 1261 C ASP A 80 0.615 -8.185 -7.721 1.00 0.00 C ATOM 1262 O ASP A 80 0.749 -8.079 -6.550 1.00 0.00 O ATOM 1263 CB ASP A 80 1.894 -6.916 -9.514 1.00 0.00 C ATOM 1264 CG ASP A 80 1.728 -6.503 -11.013 1.00 0.00 C ATOM 1265 OD1 ASP A 80 0.539 -6.553 -11.477 1.00 0.00 O ATOM 1266 OD2 ASP A 80 2.749 -6.085 -11.571 1.00 0.00 O ATOM 0 H ASP A 80 1.515 -5.367 -7.587 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.212 -6.955 -9.355 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.612 -6.240 -9.051 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.329 -7.915 -9.481 1.00 0.00 H new ATOM 1271 N SER A 81 0.268 -9.306 -8.414 1.00 0.00 N ATOM 1272 CA SER A 81 -0.221 -10.550 -7.766 1.00 0.00 C ATOM 1273 C SER A 81 0.905 -11.595 -7.680 1.00 0.00 C ATOM 1274 O SER A 81 0.987 -12.403 -6.748 1.00 0.00 O ATOM 1275 CB SER A 81 -1.387 -11.051 -8.635 1.00 0.00 C ATOM 1276 OG SER A 81 -1.818 -12.341 -8.331 1.00 0.00 O ATOM 0 H SER A 81 0.320 -9.369 -9.431 1.00 0.00 H new ATOM 0 HA SER A 81 -0.549 -10.369 -6.742 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.227 -10.365 -8.525 1.00 0.00 H new ATOM 0 HB3 SER A 81 -1.084 -11.019 -9.682 1.00 0.00 H new ATOM 0 HG SER A 81 -2.560 -12.586 -8.923 1.00 0.00 H new ATOM 1282 N LEU A 82 1.823 -11.525 -8.692 1.00 0.00 N ATOM 1283 CA LEU A 82 3.129 -12.201 -8.754 1.00 0.00 C ATOM 1284 C LEU A 82 4.162 -11.475 -7.920 1.00 0.00 C ATOM 1285 O LEU A 82 4.794 -12.095 -7.044 1.00 0.00 O ATOM 1286 CB LEU A 82 3.530 -12.127 -10.277 1.00 0.00 C ATOM 1287 CG LEU A 82 3.279 -13.373 -11.127 1.00 0.00 C ATOM 1288 CD1 LEU A 82 2.213 -13.250 -12.204 1.00 0.00 C ATOM 1289 CD2 LEU A 82 4.526 -14.167 -11.476 1.00 0.00 C ATOM 0 H LEU A 82 1.648 -10.962 -9.524 1.00 0.00 H new ATOM 0 HA LEU A 82 3.078 -13.219 -8.369 1.00 0.00 H new ATOM 0 HB2 LEU A 82 2.989 -11.295 -10.729 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.591 -11.886 -10.336 1.00 0.00 H new ATOM 0 HG LEU A 82 2.767 -14.045 -10.438 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.126 -14.196 -12.739 1.00 0.00 H new ATOM 0 HD12 LEU A 82 1.256 -13.004 -11.743 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.492 -12.462 -12.903 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.250 -15.032 -12.080 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.213 -13.536 -12.039 1.00 0.00 H new ATOM 0 HD23 LEU A 82 5.011 -14.504 -10.560 1.00 0.00 H new ATOM 1301 N LEU A 83 4.408 -10.169 -8.180 1.00 0.00 N ATOM 1302 CA LEU A 83 5.361 -9.297 -7.460 1.00 0.00 C ATOM 1303 C LEU A 83 4.951 -9.304 -5.967 1.00 0.00 C ATOM 1304 O LEU A 83 5.797 -9.339 -5.100 1.00 0.00 O ATOM 1305 CB LEU A 83 5.075 -7.857 -8.023 1.00 0.00 C ATOM 1306 CG LEU A 83 5.808 -7.436 -9.280 1.00 0.00 C ATOM 1307 CD1 LEU A 83 7.302 -7.113 -9.135 1.00 0.00 C ATOM 1308 CD2 LEU A 83 5.514 -8.407 -10.461 1.00 0.00 C ATOM 0 H LEU A 83 3.926 -9.675 -8.931 1.00 0.00 H new ATOM 0 HA LEU A 83 6.401 -9.604 -7.574 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.005 -7.778 -8.216 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.311 -7.137 -7.239 1.00 0.00 H new ATOM 0 HG LEU A 83 5.384 -6.460 -9.514 1.00 0.00 H new ATOM 0 HD11 LEU A 83 7.708 -6.826 -10.105 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.430 -6.291 -8.430 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.830 -7.992 -8.767 1.00 0.00 H new ATOM 0 HD21 LEU A 83 6.055 -8.076 -11.347 1.00 0.00 H new ATOM 0 HD22 LEU A 83 5.836 -9.413 -10.194 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.444 -8.412 -10.670 1.00 0.00 H new ATOM 1320 N TYR A 84 3.613 -9.296 -5.721 1.00 0.00 N ATOM 1321 CA TYR A 84 2.982 -9.497 -4.417 1.00 0.00 C ATOM 1322 C TYR A 84 3.587 -10.691 -3.687 1.00 0.00 C ATOM 1323 O TYR A 84 4.405 -10.514 -2.730 1.00 0.00 O ATOM 1324 CB TYR A 84 1.443 -9.632 -4.596 1.00 0.00 C ATOM 1325 CG TYR A 84 0.662 -9.507 -3.283 1.00 0.00 C ATOM 1326 CD1 TYR A 84 1.074 -8.605 -2.290 1.00 0.00 C ATOM 1327 CD2 TYR A 84 -0.471 -10.316 -3.132 1.00 0.00 C ATOM 1328 CE1 TYR A 84 0.232 -8.396 -1.178 1.00 0.00 C ATOM 1329 CE2 TYR A 84 -1.157 -10.291 -1.904 1.00 0.00 C ATOM 1330 CZ TYR A 84 -0.797 -9.296 -0.938 1.00 0.00 C ATOM 1331 OH TYR A 84 -1.486 -9.258 0.212 1.00 0.00 O ATOM 0 H TYR A 84 2.931 -9.142 -6.464 1.00 0.00 H new ATOM 0 HA TYR A 84 3.174 -8.626 -3.790 1.00 0.00 H new ATOM 0 HB2 TYR A 84 1.097 -8.866 -5.290 1.00 0.00 H new ATOM 0 HB3 TYR A 84 1.221 -10.597 -5.051 1.00 0.00 H new ATOM 0 HD1 TYR A 84 2.015 -8.082 -2.375 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.811 -10.946 -3.941 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.385 -7.550 -0.524 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -1.938 -11.006 -1.694 1.00 0.00 H new ATOM 0 HH TYR A 84 -1.277 -10.053 0.745 1.00 0.00 H new ATOM 1341 N GLY A 85 3.167 -11.921 -4.063 1.00 0.00 N ATOM 1342 CA GLY A 85 3.359 -13.146 -3.289 1.00 0.00 C ATOM 1343 C GLY A 85 4.647 -13.906 -3.644 1.00 0.00 C ATOM 1344 O GLY A 85 4.798 -15.104 -3.269 1.00 0.00 O ATOM 0 H GLY A 85 2.672 -12.082 -4.940 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.376 -12.896 -2.228 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.504 -13.803 -3.448 1.00 0.00 H new ATOM 1348 N LYS A 86 5.582 -13.268 -4.355 1.00 0.00 N ATOM 1349 CA LYS A 86 7.027 -13.594 -4.306 1.00 0.00 C ATOM 1350 C LYS A 86 7.851 -12.443 -3.686 1.00 0.00 C ATOM 1351 O LYS A 86 9.067 -12.507 -3.553 1.00 0.00 O ATOM 1352 CB LYS A 86 7.600 -14.118 -5.572 1.00 0.00 C ATOM 1353 CG LYS A 86 6.574 -14.334 -6.699 1.00 0.00 C ATOM 1354 CD LYS A 86 6.973 -13.645 -8.039 1.00 0.00 C ATOM 1355 CE LYS A 86 7.385 -12.191 -7.696 1.00 0.00 C ATOM 1356 NZ LYS A 86 7.256 -11.334 -8.876 1.00 0.00 N ATOM 0 H LYS A 86 5.363 -12.501 -4.991 1.00 0.00 H new ATOM 0 HA LYS A 86 7.105 -14.447 -3.631 1.00 0.00 H new ATOM 0 HB2 LYS A 86 8.365 -13.426 -5.923 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.098 -15.065 -5.365 1.00 0.00 H new ATOM 0 HG2 LYS A 86 6.454 -15.404 -6.871 1.00 0.00 H new ATOM 0 HG3 LYS A 86 5.605 -13.952 -6.377 1.00 0.00 H new ATOM 0 HD2 LYS A 86 7.796 -14.177 -8.516 1.00 0.00 H new ATOM 0 HD3 LYS A 86 6.139 -13.654 -8.741 1.00 0.00 H new ATOM 0 HE2 LYS A 86 6.758 -11.809 -6.890 1.00 0.00 H new ATOM 0 HE3 LYS A 86 8.414 -12.173 -7.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 7.599 -10.379 -8.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.820 -11.729 -9.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 6.257 -11.284 -9.162 1.00 0.00 H new ATOM 1370 N VAL A 87 7.106 -11.373 -3.271 1.00 0.00 N ATOM 1371 CA VAL A 87 7.556 -10.385 -2.285 1.00 0.00 C ATOM 1372 C VAL A 87 8.565 -9.427 -2.901 1.00 0.00 C ATOM 1373 O VAL A 87 9.778 -9.634 -2.878 1.00 0.00 O ATOM 1374 CB VAL A 87 8.001 -11.101 -0.991 1.00 0.00 C ATOM 1375 CG1 VAL A 87 9.503 -11.040 -0.716 1.00 0.00 C ATOM 1376 CG2 VAL A 87 7.151 -10.683 0.211 1.00 0.00 C ATOM 0 H VAL A 87 6.168 -11.186 -3.626 1.00 0.00 H new ATOM 0 HA VAL A 87 6.734 -9.737 -1.980 1.00 0.00 H new ATOM 0 HB VAL A 87 7.811 -12.160 -1.165 1.00 0.00 H new ATOM 0 HG11 VAL A 87 9.725 -11.568 0.211 1.00 0.00 H new ATOM 0 HG12 VAL A 87 10.043 -11.509 -1.539 1.00 0.00 H new ATOM 0 HG13 VAL A 87 9.814 -9.999 -0.625 1.00 0.00 H new ATOM 0 HG21 VAL A 87 7.496 -11.209 1.101 1.00 0.00 H new ATOM 0 HG22 VAL A 87 7.244 -9.608 0.366 1.00 0.00 H new ATOM 0 HG23 VAL A 87 6.107 -10.934 0.023 1.00 0.00 H new ATOM 1386 N ASP A 88 8.047 -8.349 -3.565 1.00 0.00 N ATOM 1387 CA ASP A 88 8.706 -7.125 -3.991 1.00 0.00 C ATOM 1388 C ASP A 88 8.297 -5.879 -3.178 1.00 0.00 C ATOM 1389 O ASP A 88 7.178 -5.429 -3.189 1.00 0.00 O ATOM 1390 CB ASP A 88 8.444 -6.850 -5.501 1.00 0.00 C ATOM 1391 CG ASP A 88 7.124 -6.133 -5.770 1.00 0.00 C ATOM 1392 OD1 ASP A 88 6.081 -6.840 -5.724 1.00 0.00 O ATOM 1393 OD2 ASP A 88 7.169 -4.897 -6.064 1.00 0.00 O ATOM 0 H ASP A 88 7.062 -8.339 -3.829 1.00 0.00 H new ATOM 0 HA ASP A 88 9.768 -7.295 -3.812 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.262 -6.250 -5.900 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.450 -7.797 -6.041 1.00 0.00 H new ATOM 1398 N GLY A 89 9.274 -5.440 -2.365 1.00 0.00 N ATOM 1399 CA GLY A 89 9.399 -3.960 -1.979 1.00 0.00 C ATOM 1400 C GLY A 89 10.685 -3.462 -2.733 1.00 0.00 C ATOM 1401 O GLY A 89 11.796 -3.806 -2.390 1.00 0.00 O ATOM 0 H GLY A 89 9.987 -6.043 -1.955 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.518 -3.395 -2.283 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.500 -3.839 -0.900 1.00 0.00 H new ATOM 1405 N LEU A 90 10.426 -2.798 -3.865 1.00 0.00 N ATOM 1406 CA LEU A 90 11.347 -1.966 -4.643 1.00 0.00 C ATOM 1407 C LEU A 90 10.566 -1.484 -5.918 1.00 0.00 C ATOM 1408 O LEU A 90 10.769 -0.414 -6.388 1.00 0.00 O ATOM 1409 CB LEU A 90 12.485 -2.911 -5.119 1.00 0.00 C ATOM 1410 CG LEU A 90 13.785 -2.262 -5.653 1.00 0.00 C ATOM 1411 CD1 LEU A 90 15.033 -2.549 -4.796 1.00 0.00 C ATOM 1412 CD2 LEU A 90 13.997 -2.590 -7.150 1.00 0.00 C ATOM 0 H LEU A 90 9.500 -2.831 -4.291 1.00 0.00 H new ATOM 0 HA LEU A 90 11.730 -1.120 -4.072 1.00 0.00 H new ATOM 0 HB2 LEU A 90 12.753 -3.560 -4.285 1.00 0.00 H new ATOM 0 HB3 LEU A 90 12.083 -3.551 -5.904 1.00 0.00 H new ATOM 0 HG LEU A 90 13.644 -1.185 -5.565 1.00 0.00 H new ATOM 0 HD11 LEU A 90 15.900 -2.058 -5.239 1.00 0.00 H new ATOM 0 HD12 LEU A 90 14.877 -2.168 -3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 90 15.207 -3.624 -4.755 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.917 -2.121 -7.498 1.00 0.00 H new ATOM 0 HD22 LEU A 90 14.068 -3.670 -7.279 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.155 -2.210 -7.729 1.00 0.00 H new ATOM 1424 N GLY A 91 9.740 -2.414 -6.460 1.00 0.00 N ATOM 1425 CA GLY A 91 8.718 -2.093 -7.478 1.00 0.00 C ATOM 1426 C GLY A 91 7.381 -1.695 -6.852 1.00 0.00 C ATOM 1427 O GLY A 91 6.556 -0.988 -7.477 1.00 0.00 O ATOM 0 H GLY A 91 9.766 -3.401 -6.203 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.078 -1.280 -8.108 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.570 -2.957 -8.126 1.00 0.00 H new ATOM 1431 N VAL A 92 7.109 -2.170 -5.619 1.00 0.00 N ATOM 1432 CA VAL A 92 6.042 -1.778 -4.737 1.00 0.00 C ATOM 1433 C VAL A 92 6.130 -0.350 -4.229 1.00 0.00 C ATOM 1434 O VAL A 92 5.092 0.364 -4.131 1.00 0.00 O ATOM 1435 CB VAL A 92 5.762 -2.864 -3.649 1.00 0.00 C ATOM 1436 CG1 VAL A 92 4.810 -2.405 -2.524 1.00 0.00 C ATOM 1437 CG2 VAL A 92 5.165 -4.124 -4.368 1.00 0.00 C ATOM 0 H VAL A 92 7.690 -2.896 -5.201 1.00 0.00 H new ATOM 0 HA VAL A 92 5.139 -1.739 -5.346 1.00 0.00 H new ATOM 0 HB VAL A 92 6.709 -3.083 -3.156 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.670 -3.218 -1.812 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.240 -1.544 -2.012 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.847 -2.128 -2.953 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.959 -4.900 -3.631 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.239 -3.850 -4.874 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.881 -4.499 -5.099 1.00 0.00 H new ATOM 1447 N LEU A 93 7.322 0.078 -3.766 1.00 0.00 N ATOM 1448 CA LEU A 93 7.725 1.461 -3.584 1.00 0.00 C ATOM 1449 C LEU A 93 7.541 2.287 -4.867 1.00 0.00 C ATOM 1450 O LEU A 93 6.699 3.216 -4.888 1.00 0.00 O ATOM 1451 CB LEU A 93 9.209 1.460 -3.140 1.00 0.00 C ATOM 1452 CG LEU A 93 9.884 2.863 -3.014 1.00 0.00 C ATOM 1453 CD1 LEU A 93 9.417 3.716 -1.864 1.00 0.00 C ATOM 1454 CD2 LEU A 93 11.382 2.781 -3.214 1.00 0.00 C ATOM 0 H LEU A 93 8.058 -0.576 -3.499 1.00 0.00 H new ATOM 0 HA LEU A 93 7.095 1.928 -2.827 1.00 0.00 H new ATOM 0 HB2 LEU A 93 9.279 0.956 -2.176 1.00 0.00 H new ATOM 0 HB3 LEU A 93 9.781 0.866 -3.853 1.00 0.00 H new ATOM 0 HG LEU A 93 9.508 3.450 -3.852 1.00 0.00 H new ATOM 0 HD11 LEU A 93 9.952 4.666 -1.874 1.00 0.00 H new ATOM 0 HD12 LEU A 93 8.347 3.901 -1.959 1.00 0.00 H new ATOM 0 HD13 LEU A 93 9.613 3.199 -0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 93 11.817 3.776 -3.119 1.00 0.00 H new ATOM 0 HD22 LEU A 93 11.814 2.123 -2.460 1.00 0.00 H new ATOM 0 HD23 LEU A 93 11.595 2.385 -4.207 1.00 0.00 H new ATOM 1466 N LYS A 94 8.359 2.044 -5.928 1.00 0.00 N ATOM 1467 CA LYS A 94 8.299 2.747 -7.217 1.00 0.00 C ATOM 1468 C LYS A 94 6.873 3.120 -7.638 1.00 0.00 C ATOM 1469 O LYS A 94 6.630 4.241 -8.133 1.00 0.00 O ATOM 1470 CB LYS A 94 9.035 1.991 -8.326 1.00 0.00 C ATOM 1471 CG LYS A 94 9.949 2.920 -9.139 1.00 0.00 C ATOM 1472 CD LYS A 94 11.142 3.482 -8.328 1.00 0.00 C ATOM 1473 CE LYS A 94 10.936 5.003 -8.145 1.00 0.00 C ATOM 1474 NZ LYS A 94 12.148 5.610 -7.603 1.00 0.00 N ATOM 0 H LYS A 94 9.092 1.335 -5.898 1.00 0.00 H new ATOM 0 HA LYS A 94 8.826 3.688 -7.060 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.629 1.189 -7.887 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.309 1.523 -8.990 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.332 2.375 -10.002 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.358 3.751 -9.524 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.207 2.989 -7.358 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.080 3.286 -8.848 1.00 0.00 H new ATOM 0 HE2 LYS A 94 10.686 5.462 -9.102 1.00 0.00 H new ATOM 0 HE3 LYS A 94 10.096 5.186 -7.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.000 6.632 -7.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 12.368 5.182 -6.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.940 5.449 -8.258 1.00 0.00 H new ATOM 1488 N ALA A 95 5.946 2.155 -7.502 1.00 0.00 N ATOM 1489 CA ALA A 95 4.545 2.257 -7.905 1.00 0.00 C ATOM 1490 C ALA A 95 3.752 3.287 -7.046 1.00 0.00 C ATOM 1491 O ALA A 95 2.867 3.971 -7.509 1.00 0.00 O ATOM 1492 CB ALA A 95 3.826 0.914 -7.878 1.00 0.00 C ATOM 0 H ALA A 95 6.169 1.249 -7.091 1.00 0.00 H new ATOM 0 HA ALA A 95 4.572 2.611 -8.936 1.00 0.00 H new ATOM 0 HB1 ALA A 95 2.789 1.050 -8.186 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.320 0.223 -8.561 1.00 0.00 H new ATOM 0 HB3 ALA A 95 3.853 0.507 -6.867 1.00 0.00 H new ATOM 1498 N ALA A 96 4.103 3.309 -5.735 1.00 0.00 N ATOM 1499 CA ALA A 96 3.702 4.344 -4.780 1.00 0.00 C ATOM 1500 C ALA A 96 4.119 5.758 -5.209 1.00 0.00 C ATOM 1501 O ALA A 96 3.274 6.670 -5.295 1.00 0.00 O ATOM 1502 CB ALA A 96 4.265 4.026 -3.385 1.00 0.00 C ATOM 0 H ALA A 96 4.686 2.586 -5.315 1.00 0.00 H new ATOM 0 HA ALA A 96 2.612 4.335 -4.751 1.00 0.00 H new ATOM 0 HB1 ALA A 96 3.960 4.803 -2.684 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.881 3.063 -3.049 1.00 0.00 H new ATOM 0 HB3 ALA A 96 5.353 3.987 -3.432 1.00 0.00 H new ATOM 1508 N VAL A 97 5.422 5.964 -5.484 1.00 0.00 N ATOM 1509 CA VAL A 97 6.037 7.190 -5.998 1.00 0.00 C ATOM 1510 C VAL A 97 5.283 7.678 -7.251 1.00 0.00 C ATOM 1511 O VAL A 97 4.996 8.845 -7.414 1.00 0.00 O ATOM 1512 CB VAL A 97 7.541 6.985 -6.209 1.00 0.00 C ATOM 1513 CG1 VAL A 97 8.232 8.031 -7.108 1.00 0.00 C ATOM 1514 CG2 VAL A 97 8.321 6.790 -4.887 1.00 0.00 C ATOM 0 H VAL A 97 6.112 5.227 -5.342 1.00 0.00 H new ATOM 0 HA VAL A 97 5.948 7.991 -5.264 1.00 0.00 H new ATOM 0 HB VAL A 97 7.581 6.050 -6.767 1.00 0.00 H new ATOM 0 HG11 VAL A 97 9.293 7.795 -7.192 1.00 0.00 H new ATOM 0 HG12 VAL A 97 7.777 8.017 -8.099 1.00 0.00 H new ATOM 0 HG13 VAL A 97 8.115 9.022 -6.669 1.00 0.00 H new ATOM 0 HG21 VAL A 97 9.379 6.650 -5.106 1.00 0.00 H new ATOM 0 HG22 VAL A 97 8.194 7.670 -4.257 1.00 0.00 H new ATOM 0 HG23 VAL A 97 7.939 5.912 -4.366 1.00 0.00 H new ATOM 1524 N ALA A 98 4.973 6.720 -8.162 1.00 0.00 N ATOM 1525 CA ALA A 98 4.119 6.884 -9.326 1.00 0.00 C ATOM 1526 C ALA A 98 2.658 7.253 -8.940 1.00 0.00 C ATOM 1527 O ALA A 98 1.946 7.832 -9.754 1.00 0.00 O ATOM 1528 CB ALA A 98 4.118 5.622 -10.187 1.00 0.00 C ATOM 0 H ALA A 98 5.340 5.771 -8.084 1.00 0.00 H new ATOM 0 HA ALA A 98 4.535 7.713 -9.899 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.471 5.772 -11.051 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.133 5.412 -10.525 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.750 4.781 -9.600 1.00 0.00 H new ATOM 1534 N ALA A 99 2.269 6.864 -7.692 1.00 0.00 N ATOM 1535 CA ALA A 99 0.959 7.188 -7.103 1.00 0.00 C ATOM 1536 C ALA A 99 0.980 8.585 -6.435 1.00 0.00 C ATOM 1537 O ALA A 99 -0.051 9.134 -6.118 1.00 0.00 O ATOM 1538 CB ALA A 99 0.563 6.110 -6.088 1.00 0.00 C ATOM 0 H ALA A 99 2.866 6.315 -7.073 1.00 0.00 H new ATOM 0 HA ALA A 99 0.217 7.213 -7.901 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.407 6.356 -5.656 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.503 5.144 -6.588 1.00 0.00 H new ATOM 0 HB3 ALA A 99 1.311 6.063 -5.297 1.00 0.00 H new ATOM 1544 N ILE A 100 2.210 9.062 -6.183 1.00 0.00 N ATOM 1545 CA ILE A 100 2.524 10.420 -5.617 1.00 0.00 C ATOM 1546 C ILE A 100 2.291 11.461 -6.766 1.00 0.00 C ATOM 1547 O ILE A 100 1.933 12.587 -6.571 1.00 0.00 O ATOM 1548 CB ILE A 100 4.045 10.418 -5.195 1.00 0.00 C ATOM 1549 CG1 ILE A 100 4.245 9.737 -3.827 1.00 0.00 C ATOM 1550 CG2 ILE A 100 4.699 11.762 -5.374 1.00 0.00 C ATOM 1551 CD1 ILE A 100 5.236 10.375 -2.861 1.00 0.00 C ATOM 0 H ILE A 100 3.049 8.512 -6.366 1.00 0.00 H new ATOM 0 HA ILE A 100 1.903 10.666 -4.755 1.00 0.00 H new ATOM 0 HB ILE A 100 4.600 9.790 -5.892 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.276 9.688 -3.331 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.564 8.710 -4.006 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.744 11.702 -5.068 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.644 12.057 -6.422 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.184 12.502 -4.761 1.00 0.00 H new ATOM 0 HD11 ILE A 100 5.275 9.791 -1.941 1.00 0.00 H new ATOM 0 HD12 ILE A 100 6.225 10.399 -3.318 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.918 11.392 -2.632 1.00 0.00 H new ATOM 1563 N LYS A 101 2.607 10.931 -7.990 1.00 0.00 N ATOM 1564 CA LYS A 101 2.356 11.684 -9.250 1.00 0.00 C ATOM 1565 C LYS A 101 1.056 11.273 -9.925 1.00 0.00 C ATOM 1566 O LYS A 101 0.679 11.804 -10.980 1.00 0.00 O ATOM 1567 CB LYS A 101 3.564 11.489 -10.213 1.00 0.00 C ATOM 1568 CG LYS A 101 3.311 12.234 -11.539 1.00 0.00 C ATOM 1569 CD LYS A 101 4.611 12.702 -12.232 1.00 0.00 C ATOM 1570 CE LYS A 101 4.656 14.248 -12.235 1.00 0.00 C ATOM 1571 NZ LYS A 101 3.795 14.756 -13.343 1.00 0.00 N ATOM 0 H LYS A 101 3.025 10.010 -8.123 1.00 0.00 H new ATOM 0 HA LYS A 101 2.251 12.739 -8.997 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.475 11.862 -9.746 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.717 10.427 -10.407 1.00 0.00 H new ATOM 0 HG2 LYS A 101 2.761 11.581 -12.216 1.00 0.00 H new ATOM 0 HG3 LYS A 101 2.677 13.100 -11.347 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.480 12.302 -11.710 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.650 12.323 -13.253 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.307 14.637 -11.278 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.681 14.595 -12.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 3.819 15.796 -13.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.148 14.393 -14.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.817 14.434 -13.198 1.00 0.00 H new ATOM 1585 N LYS A 102 0.343 10.295 -9.310 1.00 0.00 N ATOM 1586 CA LYS A 102 -1.111 10.086 -9.518 1.00 0.00 C ATOM 1587 C LYS A 102 -1.955 10.875 -8.470 1.00 0.00 C ATOM 1588 O LYS A 102 -3.183 10.942 -8.586 1.00 0.00 O ATOM 1589 CB LYS A 102 -1.462 8.605 -9.477 1.00 0.00 C ATOM 1590 CG LYS A 102 -2.958 8.372 -9.799 1.00 0.00 C ATOM 1591 CD LYS A 102 -3.248 7.288 -10.852 1.00 0.00 C ATOM 1592 CE LYS A 102 -4.558 7.628 -11.580 1.00 0.00 C ATOM 1593 NZ LYS A 102 -4.337 7.814 -13.018 1.00 0.00 N ATOM 0 H LYS A 102 0.760 9.631 -8.658 1.00 0.00 H new ATOM 0 HA LYS A 102 -1.357 10.471 -10.508 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.845 8.063 -10.194 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.233 8.202 -8.490 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -3.473 8.104 -8.876 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -3.388 9.312 -10.143 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.426 7.228 -11.566 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.327 6.312 -10.374 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -5.282 6.829 -11.422 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -4.987 8.536 -11.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.240 8.042 -13.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -3.664 8.593 -13.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -3.950 6.939 -13.426 1.00 0.00 H new ATOM 1607 N ALA A 103 -1.238 11.421 -7.460 1.00 0.00 N ATOM 1608 CA ALA A 103 -1.800 12.327 -6.456 1.00 0.00 C ATOM 1609 C ALA A 103 -2.690 13.418 -7.107 1.00 0.00 C ATOM 1610 O ALA A 103 -3.684 13.854 -6.542 1.00 0.00 O ATOM 1611 CB ALA A 103 -0.703 12.993 -5.612 1.00 0.00 C ATOM 0 H ALA A 103 -0.244 11.237 -7.326 1.00 0.00 H new ATOM 0 HA ALA A 103 -2.419 11.715 -5.800 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.161 13.657 -4.879 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -0.125 12.226 -5.096 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -0.043 13.569 -6.261 1.00 0.00 H new ATOM 1617 N ALA A 104 -2.251 13.844 -8.331 1.00 0.00 N ATOM 1618 CA ALA A 104 -2.999 14.751 -9.206 1.00 0.00 C ATOM 1619 C ALA A 104 -2.417 14.779 -10.634 1.00 0.00 C ATOM 1620 O ALA A 104 -1.678 13.871 -11.024 1.00 0.00 O ATOM 1621 CB ALA A 104 -3.048 16.175 -8.620 1.00 0.00 C ATOM 0 H ALA A 104 -1.356 13.554 -8.725 1.00 0.00 H new ATOM 0 HA ALA A 104 -4.017 14.366 -9.267 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -3.609 16.825 -9.291 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -3.536 16.151 -7.646 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -2.033 16.558 -8.508 1.00 0.00 H new ATOM 1627 N ALA A 105 -2.825 15.786 -11.414 1.00 0.00 N ATOM 1628 CA ALA A 105 -2.485 15.996 -12.832 1.00 0.00 C ATOM 1629 C ALA A 105 -3.688 15.676 -13.746 1.00 0.00 C ATOM 1630 O ALA A 105 -4.171 16.493 -14.503 1.00 0.00 O ATOM 1631 CB ALA A 105 -1.265 15.194 -13.260 1.00 0.00 C ATOM 0 H ALA A 105 -3.436 16.520 -11.056 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.235 17.051 -12.940 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -1.056 15.384 -14.313 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -0.405 15.492 -12.660 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -1.459 14.131 -13.114 1.00 0.00 H new ATOM 1637 N ASN A 106 -4.101 14.364 -13.692 1.00 0.00 N ATOM 1638 CA ASN A 106 -5.074 13.761 -14.621 1.00 0.00 C ATOM 1639 C ASN A 106 -6.539 14.033 -14.158 1.00 0.00 C ATOM 1640 O ASN A 106 -6.702 14.463 -12.986 1.00 0.00 O ATOM 1641 CB ASN A 106 -4.838 12.244 -14.748 1.00 0.00 C ATOM 1642 CG ASN A 106 -4.144 11.798 -16.028 1.00 0.00 C ATOM 1643 OD1 ASN A 106 -3.148 11.066 -16.050 1.00 0.00 O ATOM 1644 ND2 ASN A 106 -4.652 12.272 -17.199 1.00 0.00 N ATOM 0 H ASN A 106 -3.755 13.708 -12.992 1.00 0.00 H new ATOM 0 HA ASN A 106 -4.929 14.225 -15.597 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -4.242 11.913 -13.897 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -5.800 11.736 -14.680 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -4.211 12.022 -18.084 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -5.473 12.877 -17.191 1.00 0.00 H new TER 1651 ASN A 106