USER MOD reduce.3.24.130724 H: found=0, std=0, add=853, rem=0, adj=19 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 4:sc= -4.33! USER MOD Set 1.2: A 59 GLN : amide:sc= -10.5! C(o=-15!,f=-19!) USER MOD Set 2.1: A 5 HIS :FLIP no HE2:sc= -2.14! F(o=-2.7,f=-1.6!) USER MOD Set 2.2: A 7 TYR OH : rot 135:sc= 0.536 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 150:sc= -0.0295 (180deg=-1.07) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 175:sc= -0.184! USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 160:sc= -0.308 USER MOD Single : A 16 THR OG1 : rot -3:sc= -7.57! USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -157:sc= -0.0289 (180deg=-0.272) USER MOD Single : A 23 MET CE :methyl -131:sc= -5.62! (180deg=-10.1!) USER MOD Single : A 26 GLN : amide:sc= -21.1! C(o=-21!,f=-32!) USER MOD Single : A 29 LYS NZ :NH3+ -161:sc= 0.151 (180deg=-0.261) 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 : amide:sc= -0.0139 K(o=-0.014,f=-1.3!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl 149:sc= -7.1! (180deg=-9.56!) USER MOD Single : A 68 GLN : amide:sc= -2.52 K(o=-2.5,f=-4.6!) USER MOD Single : A 73 ASN : amide:sc= -1.01 X(o=-1,f=-0.71) USER MOD Single : A 74 LYS NZ :NH3+ -179:sc= 1.45 (180deg=1.4) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot -46:sc= 1.21 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.0771 X(o=-0.077,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.806 17.157 6.016 1.00 0.00 N ATOM 2 CA MET A 1 9.720 17.985 5.411 1.00 0.00 C ATOM 3 C MET A 1 8.480 17.122 5.155 1.00 0.00 C ATOM 4 O MET A 1 8.079 16.916 4.001 1.00 0.00 O ATOM 5 CB MET A 1 10.197 18.642 4.139 1.00 0.00 C ATOM 6 CG MET A 1 10.437 20.153 4.317 1.00 0.00 C ATOM 7 SD MET A 1 12.182 20.570 4.804 1.00 0.00 S ATOM 8 CE MET A 1 11.858 21.440 6.323 1.00 0.00 C ATOM 0 H1 MET A 1 11.642 17.752 6.186 1.00 0.00 H new ATOM 0 H2 MET A 1 10.476 16.758 6.918 1.00 0.00 H new ATOM 0 H3 MET A 1 11.056 16.385 5.366 1.00 0.00 H new ATOM 0 HA MET A 1 9.449 18.775 6.112 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.121 18.166 3.811 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.460 18.484 3.352 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.196 20.664 3.385 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.754 20.535 5.076 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.800 21.769 6.762 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.230 22.308 6.119 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.345 20.777 7.020 1.00 0.00 H new ATOM 18 N GLU A 2 7.886 16.596 6.243 1.00 0.00 N ATOM 19 CA GLU A 2 6.595 15.888 6.275 1.00 0.00 C ATOM 20 C GLU A 2 6.705 14.445 5.771 1.00 0.00 C ATOM 21 O GLU A 2 6.706 14.187 4.563 1.00 0.00 O ATOM 22 CB GLU A 2 5.559 16.670 5.405 1.00 0.00 C ATOM 23 CG GLU A 2 4.211 16.008 5.396 1.00 0.00 C ATOM 24 CD GLU A 2 3.313 16.340 4.187 1.00 0.00 C ATOM 25 OE1 GLU A 2 3.911 16.816 3.179 1.00 0.00 O ATOM 26 OE2 GLU A 2 2.087 16.101 4.251 1.00 0.00 O ATOM 0 H GLU A 2 8.315 16.657 7.167 1.00 0.00 H new ATOM 0 HA GLU A 2 6.268 15.843 7.314 1.00 0.00 H new ATOM 0 HB2 GLU A 2 5.460 17.686 5.787 1.00 0.00 H new ATOM 0 HB3 GLU A 2 5.930 16.748 4.383 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.356 14.928 5.432 1.00 0.00 H new ATOM 0 HG3 GLU A 2 3.682 16.289 6.307 1.00 0.00 H new ATOM 33 N LYS A 3 6.951 13.499 6.721 1.00 0.00 N ATOM 34 CA LYS A 3 6.729 12.061 6.474 1.00 0.00 C ATOM 35 C LYS A 3 5.318 11.721 5.977 1.00 0.00 C ATOM 36 O LYS A 3 4.346 12.360 6.331 1.00 0.00 O ATOM 37 CB LYS A 3 7.092 11.220 7.687 1.00 0.00 C ATOM 38 CG LYS A 3 8.017 10.046 7.322 1.00 0.00 C ATOM 39 CD LYS A 3 9.377 10.445 6.704 1.00 0.00 C ATOM 40 CE LYS A 3 10.000 11.567 7.543 1.00 0.00 C ATOM 41 NZ LYS A 3 10.069 12.818 6.761 1.00 0.00 N ATOM 0 H LYS A 3 7.300 13.713 7.655 1.00 0.00 H new ATOM 0 HA LYS A 3 7.405 11.807 5.657 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.582 11.849 8.430 1.00 0.00 H new ATOM 0 HB3 LYS A 3 6.182 10.834 8.146 1.00 0.00 H new ATOM 0 HG2 LYS A 3 8.203 9.458 8.221 1.00 0.00 H new ATOM 0 HG3 LYS A 3 7.494 9.397 6.620 1.00 0.00 H new ATOM 0 HD2 LYS A 3 10.044 9.583 6.674 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.239 10.777 5.675 1.00 0.00 H new ATOM 0 HE2 LYS A 3 9.409 11.727 8.445 1.00 0.00 H new ATOM 0 HE3 LYS A 3 11.000 11.276 7.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 9.993 13.633 7.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 10.975 12.860 6.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 9.287 12.843 6.076 1.00 0.00 H new ATOM 55 N LYS A 4 5.267 10.708 5.056 1.00 0.00 N ATOM 56 CA LYS A 4 4.029 10.086 4.587 1.00 0.00 C ATOM 57 C LYS A 4 3.829 8.641 5.089 1.00 0.00 C ATOM 58 O LYS A 4 4.693 8.075 5.748 1.00 0.00 O ATOM 59 CB LYS A 4 3.873 10.164 3.074 1.00 0.00 C ATOM 60 CG LYS A 4 3.004 11.411 2.718 1.00 0.00 C ATOM 61 CD LYS A 4 3.730 12.745 3.003 1.00 0.00 C ATOM 62 CE LYS A 4 3.692 13.635 1.763 1.00 0.00 C ATOM 63 NZ LYS A 4 4.960 13.531 0.996 1.00 0.00 N ATOM 0 H LYS A 4 6.103 10.312 4.627 1.00 0.00 H new ATOM 0 HA LYS A 4 3.234 10.681 5.036 1.00 0.00 H new ATOM 0 HB2 LYS A 4 4.851 10.238 2.598 1.00 0.00 H new ATOM 0 HB3 LYS A 4 3.402 9.256 2.696 1.00 0.00 H new ATOM 0 HG2 LYS A 4 2.730 11.369 1.664 1.00 0.00 H new ATOM 0 HG3 LYS A 4 2.076 11.378 3.290 1.00 0.00 H new ATOM 0 HD2 LYS A 4 3.256 13.255 3.841 1.00 0.00 H new ATOM 0 HD3 LYS A 4 4.763 12.552 3.291 1.00 0.00 H new ATOM 0 HE2 LYS A 4 2.854 13.346 1.129 1.00 0.00 H new ATOM 0 HE3 LYS A 4 3.525 14.671 2.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 4.910 14.145 0.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 5.755 13.829 1.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 5.104 12.546 0.695 1.00 0.00 H new ATOM 77 N HIS A 5 2.629 8.072 4.767 1.00 0.00 N ATOM 78 CA HIS A 5 2.252 6.689 5.027 1.00 0.00 C ATOM 79 C HIS A 5 1.806 5.918 3.766 1.00 0.00 C ATOM 80 O HIS A 5 0.894 6.352 3.042 1.00 0.00 O ATOM 81 CB HIS A 5 1.187 6.611 6.134 1.00 0.00 C ATOM 82 CG HIS A 5 1.635 7.260 7.461 1.00 0.00 C ATOM 83 ND1 HIS A 5 2.921 7.506 7.801 1.00 0.00 N flip ATOM 84 CD2 HIS A 5 0.846 7.779 8.424 1.00 0.00 C flip ATOM 85 CE1 HIS A 5 2.879 8.346 8.868 1.00 0.00 C flip ATOM 86 NE2 HIS A 5 1.623 8.482 9.272 1.00 0.00 N flip ATOM 0 H HIS A 5 1.888 8.599 4.305 1.00 0.00 H new ATOM 0 HA HIS A 5 3.157 6.189 5.372 1.00 0.00 H new ATOM 0 HB2 HIS A 5 0.277 7.100 5.788 1.00 0.00 H new ATOM 0 HB3 HIS A 5 0.938 5.566 6.315 1.00 0.00 H new ATOM 0 HD1 HIS A 5 3.756 7.135 7.347 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -0.224 7.653 8.502 1.00 0.00 H new ATOM 0 HE1 HIS A 5 3.735 8.828 9.317 1.00 0.00 H new ATOM 94 N ILE A 6 2.429 4.760 3.561 1.00 0.00 N ATOM 95 CA ILE A 6 2.093 3.721 2.539 1.00 0.00 C ATOM 96 C ILE A 6 1.472 2.492 3.229 1.00 0.00 C ATOM 97 O ILE A 6 2.151 1.596 3.671 1.00 0.00 O ATOM 98 CB ILE A 6 3.273 3.406 1.607 1.00 0.00 C ATOM 99 CG1 ILE A 6 3.466 4.390 0.472 1.00 0.00 C ATOM 100 CG2 ILE A 6 3.354 1.929 1.181 1.00 0.00 C ATOM 101 CD1 ILE A 6 4.911 4.724 0.066 1.00 0.00 C ATOM 0 H ILE A 6 3.232 4.487 4.127 1.00 0.00 H new ATOM 0 HA ILE A 6 1.335 4.118 1.864 1.00 0.00 H new ATOM 0 HB ILE A 6 4.151 3.562 2.233 1.00 0.00 H new ATOM 0 HG12 ILE A 6 2.951 3.998 -0.405 1.00 0.00 H new ATOM 0 HG13 ILE A 6 2.968 5.321 0.744 1.00 0.00 H new ATOM 0 HG21 ILE A 6 4.212 1.786 0.525 1.00 0.00 H new ATOM 0 HG22 ILE A 6 3.465 1.301 2.065 1.00 0.00 H new ATOM 0 HG23 ILE A 6 2.442 1.653 0.651 1.00 0.00 H new ATOM 0 HD11 ILE A 6 4.902 5.439 -0.757 1.00 0.00 H new ATOM 0 HD12 ILE A 6 5.437 5.157 0.917 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.420 3.813 -0.251 1.00 0.00 H new ATOM 113 N TYR A 7 0.105 2.494 3.312 1.00 0.00 N ATOM 114 CA TYR A 7 -0.745 1.453 3.864 1.00 0.00 C ATOM 115 C TYR A 7 -1.208 0.452 2.831 1.00 0.00 C ATOM 116 O TYR A 7 -1.694 0.788 1.729 1.00 0.00 O ATOM 117 CB TYR A 7 -1.905 2.000 4.715 1.00 0.00 C ATOM 118 CG TYR A 7 -1.493 2.793 5.964 1.00 0.00 C ATOM 119 CD1 TYR A 7 -0.211 2.720 6.503 1.00 0.00 C ATOM 120 CD2 TYR A 7 -2.490 3.611 6.543 1.00 0.00 C ATOM 121 CE1 TYR A 7 0.147 3.579 7.543 1.00 0.00 C ATOM 122 CE2 TYR A 7 -2.187 4.287 7.720 1.00 0.00 C ATOM 123 CZ TYR A 7 -0.866 4.287 8.204 1.00 0.00 C ATOM 124 OH TYR A 7 -0.568 4.972 9.312 1.00 0.00 O ATOM 0 H TYR A 7 -0.441 3.283 2.967 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.105 0.901 4.552 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.523 2.641 4.086 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -2.530 1.163 5.027 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.501 2.004 6.119 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -3.462 3.708 6.083 1.00 0.00 H new ATOM 0 HE1 TYR A 7 1.181 3.696 7.832 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -2.962 4.810 8.260 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.986 5.857 9.272 1.00 0.00 H new ATOM 134 N LEU A 8 -1.026 -0.862 3.166 1.00 0.00 N ATOM 135 CA LEU A 8 -1.252 -2.020 2.276 1.00 0.00 C ATOM 136 C LEU A 8 -2.368 -2.895 2.889 1.00 0.00 C ATOM 137 O LEU A 8 -2.354 -3.150 4.085 1.00 0.00 O ATOM 138 CB LEU A 8 0.066 -2.832 2.298 1.00 0.00 C ATOM 139 CG LEU A 8 1.138 -2.530 1.209 1.00 0.00 C ATOM 140 CD1 LEU A 8 2.015 -1.295 1.548 1.00 0.00 C ATOM 141 CD2 LEU A 8 1.980 -3.760 0.851 1.00 0.00 C ATOM 0 H LEU A 8 -0.708 -1.141 4.094 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.532 -1.714 1.268 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.531 -2.684 3.273 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -0.193 -3.888 2.226 1.00 0.00 H new ATOM 0 HG LEU A 8 0.579 -2.267 0.311 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.742 -1.136 0.752 1.00 0.00 H new ATOM 0 HD12 LEU A 8 1.381 -0.413 1.642 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.538 -1.467 2.489 1.00 0.00 H new ATOM 0 HD21 LEU A 8 2.710 -3.491 0.088 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.499 -4.117 1.740 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.330 -4.548 0.470 1.00 0.00 H new ATOM 153 N PHE A 9 -3.385 -3.298 2.076 1.00 0.00 N ATOM 154 CA PHE A 9 -4.711 -3.781 2.491 1.00 0.00 C ATOM 155 C PHE A 9 -4.976 -5.197 2.022 1.00 0.00 C ATOM 156 O PHE A 9 -5.267 -5.412 0.850 1.00 0.00 O ATOM 157 CB PHE A 9 -5.773 -2.732 2.161 1.00 0.00 C ATOM 158 CG PHE A 9 -5.512 -1.342 2.845 1.00 0.00 C ATOM 159 CD1 PHE A 9 -4.740 -1.348 3.990 1.00 0.00 C ATOM 160 CD2 PHE A 9 -6.045 -0.159 2.329 1.00 0.00 C ATOM 161 CE1 PHE A 9 -4.842 -0.246 4.891 1.00 0.00 C ATOM 162 CE2 PHE A 9 -6.010 1.005 3.133 1.00 0.00 C ATOM 163 CZ PHE A 9 -5.266 0.984 4.342 1.00 0.00 C ATOM 0 H PHE A 9 -3.285 -3.290 1.061 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.754 -3.888 3.575 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.814 -2.595 1.080 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.749 -3.104 2.472 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -4.072 -2.171 4.199 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -6.474 -0.133 1.338 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -4.607 -0.348 5.940 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -6.541 1.896 2.832 1.00 0.00 H new ATOM 0 HZ PHE A 9 -5.024 1.910 4.842 1.00 0.00 H new ATOM 173 N SER A 10 -4.734 -6.231 2.863 1.00 0.00 N ATOM 174 CA SER A 10 -4.417 -7.609 2.521 1.00 0.00 C ATOM 175 C SER A 10 -4.853 -8.039 1.135 1.00 0.00 C ATOM 176 O SER A 10 -4.351 -7.503 0.098 1.00 0.00 O ATOM 177 CB SER A 10 -4.891 -8.572 3.606 1.00 0.00 C ATOM 178 OG SER A 10 -4.862 -9.960 3.133 1.00 0.00 O ATOM 0 H SER A 10 -4.761 -6.096 3.874 1.00 0.00 H new ATOM 0 HA SER A 10 -3.329 -7.652 2.479 1.00 0.00 H new ATOM 0 HB2 SER A 10 -4.257 -8.472 4.487 1.00 0.00 H new ATOM 0 HB3 SER A 10 -5.904 -8.310 3.911 1.00 0.00 H new ATOM 0 HG SER A 10 -5.092 -10.562 3.871 1.00 0.00 H new ATOM 184 N SER A 11 -5.759 -9.030 1.031 1.00 0.00 N ATOM 185 CA SER A 11 -6.059 -9.845 -0.116 1.00 0.00 C ATOM 186 C SER A 11 -6.154 -11.338 0.201 1.00 0.00 C ATOM 187 O SER A 11 -7.249 -11.939 0.194 1.00 0.00 O ATOM 188 CB SER A 11 -5.141 -9.566 -1.276 1.00 0.00 C ATOM 189 OG SER A 11 -5.829 -9.998 -2.526 1.00 0.00 O ATOM 0 H SER A 11 -6.340 -9.287 1.829 1.00 0.00 H new ATOM 0 HA SER A 11 -7.061 -9.548 -0.426 1.00 0.00 H new ATOM 0 HB2 SER A 11 -4.898 -8.504 -1.323 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.200 -10.103 -1.154 1.00 0.00 H new ATOM 0 HG SER A 11 -6.736 -10.302 -2.312 1.00 0.00 H new ATOM 195 N ALA A 12 -4.981 -11.937 0.582 1.00 0.00 N ATOM 196 CA ALA A 12 -4.899 -13.347 0.976 1.00 0.00 C ATOM 197 C ALA A 12 -4.128 -13.532 2.317 1.00 0.00 C ATOM 198 O ALA A 12 -3.949 -14.620 2.826 1.00 0.00 O ATOM 199 CB ALA A 12 -4.222 -14.228 -0.111 1.00 0.00 C ATOM 0 H ALA A 12 -4.087 -11.447 0.618 1.00 0.00 H new ATOM 0 HA ALA A 12 -5.931 -13.673 1.103 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -4.186 -15.263 0.230 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.796 -14.170 -1.036 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -3.208 -13.870 -0.290 1.00 0.00 H new ATOM 205 N GLY A 13 -3.647 -12.381 2.836 1.00 0.00 N ATOM 206 CA GLY A 13 -2.536 -12.324 3.836 1.00 0.00 C ATOM 207 C GLY A 13 -1.330 -13.194 3.401 1.00 0.00 C ATOM 208 O GLY A 13 -1.458 -14.004 2.468 1.00 0.00 O ATOM 0 H GLY A 13 -4.011 -11.463 2.580 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -2.213 -11.291 3.963 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -2.900 -12.665 4.805 1.00 0.00 H new ATOM 212 N MET A 14 -0.171 -12.945 4.025 1.00 0.00 N ATOM 213 CA MET A 14 1.131 -13.580 3.746 1.00 0.00 C ATOM 214 C MET A 14 1.824 -13.003 2.480 1.00 0.00 C ATOM 215 O MET A 14 3.008 -13.241 2.224 1.00 0.00 O ATOM 216 CB MET A 14 1.027 -15.074 3.719 1.00 0.00 C ATOM 217 CG MET A 14 2.253 -15.847 4.227 1.00 0.00 C ATOM 218 SD MET A 14 1.965 -16.680 5.873 1.00 0.00 S ATOM 219 CE MET A 14 2.500 -15.383 6.949 1.00 0.00 C ATOM 0 H MET A 14 -0.109 -12.260 4.778 1.00 0.00 H new ATOM 0 HA MET A 14 1.786 -13.326 4.579 1.00 0.00 H new ATOM 0 HB2 MET A 14 0.164 -15.368 4.317 1.00 0.00 H new ATOM 0 HB3 MET A 14 0.826 -15.385 2.694 1.00 0.00 H new ATOM 0 HG2 MET A 14 2.531 -16.600 3.490 1.00 0.00 H new ATOM 0 HG3 MET A 14 3.096 -15.161 4.316 1.00 0.00 H new ATOM 0 HE1 MET A 14 2.398 -15.705 7.985 1.00 0.00 H new ATOM 0 HE2 MET A 14 3.544 -15.147 6.743 1.00 0.00 H new ATOM 0 HE3 MET A 14 1.888 -14.497 6.783 1.00 0.00 H new ATOM 229 N SER A 15 1.020 -12.245 1.677 1.00 0.00 N ATOM 230 CA SER A 15 1.569 -11.102 0.892 1.00 0.00 C ATOM 231 C SER A 15 1.194 -9.779 1.510 1.00 0.00 C ATOM 232 O SER A 15 0.132 -9.600 2.132 1.00 0.00 O ATOM 233 CB SER A 15 1.061 -11.248 -0.528 1.00 0.00 C ATOM 234 OG SER A 15 1.830 -12.256 -1.261 1.00 0.00 O ATOM 0 H SER A 15 0.019 -12.400 1.559 1.00 0.00 H new ATOM 0 HA SER A 15 2.659 -11.119 0.893 1.00 0.00 H new ATOM 0 HB2 SER A 15 0.008 -11.529 -0.514 1.00 0.00 H new ATOM 0 HB3 SER A 15 1.129 -10.289 -1.042 1.00 0.00 H new ATOM 0 HG SER A 15 1.312 -12.565 -2.033 1.00 0.00 H new ATOM 240 N THR A 16 2.094 -8.733 1.328 1.00 0.00 N ATOM 241 CA THR A 16 2.248 -7.510 1.943 1.00 0.00 C ATOM 242 C THR A 16 3.271 -7.417 3.099 1.00 0.00 C ATOM 243 O THR A 16 4.090 -6.486 3.185 1.00 0.00 O ATOM 244 CB THR A 16 1.076 -6.588 2.293 1.00 0.00 C ATOM 245 OG1 THR A 16 1.639 -5.357 2.876 1.00 0.00 O ATOM 246 CG2 THR A 16 -0.002 -7.223 3.167 1.00 0.00 C ATOM 0 H THR A 16 2.808 -8.834 0.607 1.00 0.00 H new ATOM 0 HA THR A 16 2.630 -7.110 1.004 1.00 0.00 H new ATOM 0 HB THR A 16 0.530 -6.362 1.377 1.00 0.00 H new ATOM 0 HG1 THR A 16 2.612 -5.445 2.949 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.789 -6.494 3.361 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.425 -8.086 2.653 1.00 0.00 H new ATOM 0 HG23 THR A 16 0.437 -7.543 4.112 1.00 0.00 H new ATOM 254 N SER A 17 3.187 -8.370 4.030 1.00 0.00 N ATOM 255 CA SER A 17 3.878 -8.333 5.346 1.00 0.00 C ATOM 256 C SER A 17 5.383 -8.020 5.170 1.00 0.00 C ATOM 257 O SER A 17 5.946 -7.143 5.810 1.00 0.00 O ATOM 258 CB SER A 17 3.625 -9.582 6.120 1.00 0.00 C ATOM 259 OG SER A 17 2.787 -9.361 7.271 1.00 0.00 O ATOM 0 H SER A 17 2.627 -9.213 3.899 1.00 0.00 H new ATOM 0 HA SER A 17 3.461 -7.518 5.938 1.00 0.00 H new ATOM 0 HB2 SER A 17 3.155 -10.319 5.469 1.00 0.00 H new ATOM 0 HB3 SER A 17 4.577 -10.003 6.444 1.00 0.00 H new ATOM 0 HG SER A 17 2.650 -10.209 7.743 1.00 0.00 H new ATOM 265 N LEU A 18 5.983 -8.753 4.175 1.00 0.00 N ATOM 266 CA LEU A 18 7.420 -8.733 3.852 1.00 0.00 C ATOM 267 C LEU A 18 7.657 -7.873 2.591 1.00 0.00 C ATOM 268 O LEU A 18 8.783 -7.718 2.181 1.00 0.00 O ATOM 269 CB LEU A 18 7.802 -10.185 3.593 1.00 0.00 C ATOM 270 CG LEU A 18 9.047 -10.786 4.302 1.00 0.00 C ATOM 271 CD1 LEU A 18 9.376 -12.221 3.844 1.00 0.00 C ATOM 272 CD2 LEU A 18 10.241 -9.841 4.305 1.00 0.00 C ATOM 0 H LEU A 18 5.453 -9.383 3.572 1.00 0.00 H new ATOM 0 HA LEU A 18 8.019 -8.304 4.655 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.944 -10.801 3.861 1.00 0.00 H new ATOM 0 HB3 LEU A 18 7.952 -10.297 2.519 1.00 0.00 H new ATOM 0 HG LEU A 18 8.773 -10.893 5.352 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.256 -12.581 4.378 1.00 0.00 H new ATOM 0 HD12 LEU A 18 8.530 -12.874 4.057 1.00 0.00 H new ATOM 0 HD13 LEU A 18 9.575 -12.224 2.772 1.00 0.00 H new ATOM 0 HD21 LEU A 18 11.080 -10.316 4.814 1.00 0.00 H new ATOM 0 HD22 LEU A 18 10.524 -9.609 3.278 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.975 -8.921 4.825 1.00 0.00 H new ATOM 284 N LEU A 19 6.565 -7.308 2.006 1.00 0.00 N ATOM 285 CA LEU A 19 6.599 -6.089 1.144 1.00 0.00 C ATOM 286 C LEU A 19 6.936 -4.881 2.094 1.00 0.00 C ATOM 287 O LEU A 19 7.898 -4.205 1.890 1.00 0.00 O ATOM 288 CB LEU A 19 5.144 -5.893 0.658 1.00 0.00 C ATOM 289 CG LEU A 19 4.625 -6.640 -0.562 1.00 0.00 C ATOM 290 CD1 LEU A 19 3.683 -5.866 -1.484 1.00 0.00 C ATOM 291 CD2 LEU A 19 5.811 -7.301 -1.371 1.00 0.00 C ATOM 0 H LEU A 19 5.626 -7.689 2.120 1.00 0.00 H new ATOM 0 HA LEU A 19 7.310 -6.163 0.321 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.490 -6.148 1.492 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.012 -4.829 0.463 1.00 0.00 H new ATOM 0 HG LEU A 19 3.987 -7.417 -0.141 1.00 0.00 H new ATOM 0 HD11 LEU A 19 3.382 -6.504 -2.315 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.799 -5.557 -0.925 1.00 0.00 H new ATOM 0 HD13 LEU A 19 4.195 -4.984 -1.870 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.411 -7.828 -2.237 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.501 -6.526 -1.704 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.340 -8.006 -0.730 1.00 0.00 H new ATOM 303 N VAL A 20 6.030 -4.646 3.075 1.00 0.00 N ATOM 304 CA VAL A 20 6.019 -3.513 3.982 1.00 0.00 C ATOM 305 C VAL A 20 7.319 -3.437 4.792 1.00 0.00 C ATOM 306 O VAL A 20 7.846 -2.371 5.125 1.00 0.00 O ATOM 307 CB VAL A 20 4.715 -3.480 4.796 1.00 0.00 C ATOM 308 CG1 VAL A 20 4.747 -2.551 6.045 1.00 0.00 C ATOM 309 CG2 VAL A 20 3.491 -3.124 3.902 1.00 0.00 C ATOM 0 H VAL A 20 5.255 -5.285 3.249 1.00 0.00 H new ATOM 0 HA VAL A 20 6.010 -2.582 3.415 1.00 0.00 H new ATOM 0 HB VAL A 20 4.611 -4.496 5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 20 3.784 -2.593 6.555 1.00 0.00 H new ATOM 0 HG12 VAL A 20 5.532 -2.882 6.725 1.00 0.00 H new ATOM 0 HG13 VAL A 20 4.947 -1.526 5.731 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.587 -3.110 4.511 1.00 0.00 H new ATOM 0 HG22 VAL A 20 3.641 -2.142 3.453 1.00 0.00 H new ATOM 0 HG23 VAL A 20 3.386 -3.870 3.115 1.00 0.00 H new ATOM 319 N SER A 21 7.871 -4.643 5.172 1.00 0.00 N ATOM 320 CA SER A 21 9.059 -4.817 5.990 1.00 0.00 C ATOM 321 C SER A 21 10.367 -4.915 5.175 1.00 0.00 C ATOM 322 O SER A 21 11.447 -4.463 5.626 1.00 0.00 O ATOM 323 CB SER A 21 8.908 -6.035 6.907 1.00 0.00 C ATOM 324 OG SER A 21 8.080 -5.802 8.038 1.00 0.00 O ATOM 0 H SER A 21 7.461 -5.533 4.890 1.00 0.00 H new ATOM 0 HA SER A 21 9.144 -3.913 6.593 1.00 0.00 H new ATOM 0 HB2 SER A 21 8.495 -6.863 6.331 1.00 0.00 H new ATOM 0 HB3 SER A 21 9.895 -6.345 7.249 1.00 0.00 H new ATOM 0 HG SER A 21 8.026 -6.618 8.578 1.00 0.00 H new ATOM 330 N LYS A 22 10.222 -5.471 3.979 1.00 0.00 N ATOM 331 CA LYS A 22 11.348 -5.383 2.922 1.00 0.00 C ATOM 332 C LYS A 22 11.391 -3.923 2.429 1.00 0.00 C ATOM 333 O LYS A 22 12.452 -3.352 2.100 1.00 0.00 O ATOM 334 CB LYS A 22 10.976 -6.328 1.792 1.00 0.00 C ATOM 335 CG LYS A 22 12.234 -6.767 0.981 1.00 0.00 C ATOM 336 CD LYS A 22 11.870 -7.472 -0.339 1.00 0.00 C ATOM 337 CE LYS A 22 11.803 -9.000 -0.136 1.00 0.00 C ATOM 338 NZ LYS A 22 13.125 -9.575 0.069 1.00 0.00 N ATOM 0 H LYS A 22 9.390 -5.979 3.677 1.00 0.00 H new ATOM 0 HA LYS A 22 12.326 -5.661 3.316 1.00 0.00 H new ATOM 0 HB2 LYS A 22 10.479 -7.208 2.200 1.00 0.00 H new ATOM 0 HB3 LYS A 22 10.264 -5.840 1.126 1.00 0.00 H new ATOM 0 HG2 LYS A 22 12.846 -5.891 0.764 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.840 -7.437 1.591 1.00 0.00 H new ATOM 0 HD2 LYS A 22 10.910 -7.105 -0.701 1.00 0.00 H new ATOM 0 HD3 LYS A 22 12.611 -7.233 -1.102 1.00 0.00 H new ATOM 0 HE2 LYS A 22 11.171 -9.226 0.723 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.336 -9.462 -1.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 13.108 -10.584 -0.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.816 -9.080 -0.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 13.397 -9.472 1.067 1.00 0.00 H new ATOM 352 N MET A 23 10.187 -3.326 2.305 1.00 0.00 N ATOM 353 CA MET A 23 9.923 -1.933 1.968 1.00 0.00 C ATOM 354 C MET A 23 10.570 -0.902 2.910 1.00 0.00 C ATOM 355 O MET A 23 11.476 -0.173 2.529 1.00 0.00 O ATOM 356 CB MET A 23 8.412 -1.675 1.819 1.00 0.00 C ATOM 357 CG MET A 23 7.971 -1.768 0.344 1.00 0.00 C ATOM 358 SD MET A 23 7.170 -0.245 -0.289 1.00 0.00 S ATOM 359 CE MET A 23 5.454 -0.653 -0.023 1.00 0.00 C ATOM 0 H MET A 23 9.323 -3.849 2.450 1.00 0.00 H new ATOM 0 HA MET A 23 10.412 -1.780 1.006 1.00 0.00 H new ATOM 0 HB2 MET A 23 7.857 -2.400 2.413 1.00 0.00 H new ATOM 0 HB3 MET A 23 8.169 -0.688 2.212 1.00 0.00 H new ATOM 0 HG2 MET A 23 8.842 -1.992 -0.272 1.00 0.00 H new ATOM 0 HG3 MET A 23 7.279 -2.603 0.234 1.00 0.00 H new ATOM 0 HE1 MET A 23 4.887 -0.452 -0.932 1.00 0.00 H new ATOM 0 HE2 MET A 23 5.367 -1.709 0.234 1.00 0.00 H new ATOM 0 HE3 MET A 23 5.058 -0.048 0.792 1.00 0.00 H new ATOM 369 N ARG A 24 10.028 -0.826 4.142 1.00 0.00 N ATOM 370 CA ARG A 24 10.701 -0.242 5.330 1.00 0.00 C ATOM 371 C ARG A 24 12.219 -0.378 5.232 1.00 0.00 C ATOM 372 O ARG A 24 12.959 0.535 5.654 1.00 0.00 O ATOM 373 CB ARG A 24 10.174 -0.884 6.619 1.00 0.00 C ATOM 374 CG ARG A 24 8.815 -0.270 7.068 1.00 0.00 C ATOM 375 CD ARG A 24 8.012 -1.277 7.914 1.00 0.00 C ATOM 376 NE ARG A 24 7.078 -0.517 8.788 1.00 0.00 N ATOM 377 CZ ARG A 24 7.199 -0.381 10.125 1.00 0.00 C ATOM 378 NH1 ARG A 24 8.275 -0.794 10.826 1.00 0.00 N ATOM 379 NH2 ARG A 24 6.219 0.245 10.828 1.00 0.00 N ATOM 0 H ARG A 24 9.092 -1.175 4.348 1.00 0.00 H new ATOM 0 HA ARG A 24 10.468 0.822 5.358 1.00 0.00 H new ATOM 0 HB2 ARG A 24 10.053 -1.956 6.466 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.909 -0.756 7.414 1.00 0.00 H new ATOM 0 HG2 ARG A 24 8.994 0.636 7.646 1.00 0.00 H new ATOM 0 HG3 ARG A 24 8.235 0.020 6.192 1.00 0.00 H new ATOM 0 HD2 ARG A 24 7.458 -1.958 7.268 1.00 0.00 H new ATOM 0 HD3 ARG A 24 8.685 -1.887 8.517 1.00 0.00 H new ATOM 0 HE ARG A 24 6.282 -0.062 8.340 1.00 0.00 H new ATOM 0 HH11 ARG A 24 9.057 -1.238 10.345 1.00 0.00 H new ATOM 0 HH12 ARG A 24 8.306 -0.662 11.837 1.00 0.00 H new ATOM 0 HH21 ARG A 24 5.398 0.609 10.345 1.00 0.00 H new ATOM 0 HH22 ARG A 24 6.305 0.351 11.839 1.00 0.00 H new ATOM 393 N ALA A 25 12.688 -1.557 4.783 1.00 0.00 N ATOM 394 CA ALA A 25 14.066 -1.875 4.468 1.00 0.00 C ATOM 395 C ALA A 25 14.686 -0.950 3.402 1.00 0.00 C ATOM 396 O ALA A 25 15.804 -0.461 3.556 1.00 0.00 O ATOM 397 CB ALA A 25 14.222 -3.351 4.025 1.00 0.00 C ATOM 0 H ALA A 25 12.067 -2.351 4.626 1.00 0.00 H new ATOM 0 HA ALA A 25 14.613 -1.712 5.396 1.00 0.00 H new ATOM 0 HB1 ALA A 25 15.268 -3.554 3.797 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.892 -4.009 4.829 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.616 -3.530 3.137 1.00 0.00 H new ATOM 403 N GLN A 26 13.955 -0.758 2.281 1.00 0.00 N ATOM 404 CA GLN A 26 14.253 0.197 1.214 1.00 0.00 C ATOM 405 C GLN A 26 13.663 1.584 1.520 1.00 0.00 C ATOM 406 O GLN A 26 13.478 2.424 0.671 1.00 0.00 O ATOM 407 CB GLN A 26 13.743 -0.344 -0.117 1.00 0.00 C ATOM 408 CG GLN A 26 12.303 -0.767 -0.216 1.00 0.00 C ATOM 409 CD GLN A 26 12.104 -2.260 -0.547 1.00 0.00 C ATOM 410 OE1 GLN A 26 11.278 -2.980 0.021 1.00 0.00 O ATOM 411 NE2 GLN A 26 12.895 -2.777 -1.535 1.00 0.00 N ATOM 0 H GLN A 26 13.106 -1.293 2.097 1.00 0.00 H new ATOM 0 HA GLN A 26 15.334 0.321 1.149 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.916 0.421 -0.874 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.360 -1.202 -0.384 1.00 0.00 H new ATOM 0 HG2 GLN A 26 11.805 -0.546 0.728 1.00 0.00 H new ATOM 0 HG3 GLN A 26 11.812 -0.168 -0.983 1.00 0.00 H new ATOM 0 HE21 GLN A 26 13.578 -2.183 -2.005 1.00 0.00 H new ATOM 0 HE22 GLN A 26 12.802 -3.757 -1.802 1.00 0.00 H new ATOM 420 N ALA A 27 13.259 1.778 2.810 1.00 0.00 N ATOM 421 CA ALA A 27 13.136 3.087 3.445 1.00 0.00 C ATOM 422 C ALA A 27 14.274 3.320 4.456 1.00 0.00 C ATOM 423 O ALA A 27 14.691 4.439 4.698 1.00 0.00 O ATOM 424 CB ALA A 27 11.777 3.205 4.155 1.00 0.00 C ATOM 0 H ALA A 27 13.011 1.007 3.430 1.00 0.00 H new ATOM 0 HA ALA A 27 13.205 3.848 2.667 1.00 0.00 H new ATOM 0 HB1 ALA A 27 11.696 4.185 4.625 1.00 0.00 H new ATOM 0 HB2 ALA A 27 10.975 3.084 3.427 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.696 2.429 4.917 1.00 0.00 H new ATOM 430 N GLU A 28 14.765 2.202 5.033 1.00 0.00 N ATOM 431 CA GLU A 28 15.993 2.132 5.877 1.00 0.00 C ATOM 432 C GLU A 28 17.255 2.269 5.011 1.00 0.00 C ATOM 433 O GLU A 28 18.120 3.127 5.286 1.00 0.00 O ATOM 434 CB GLU A 28 15.988 0.749 6.601 1.00 0.00 C ATOM 435 CG GLU A 28 14.975 0.677 7.737 1.00 0.00 C ATOM 436 CD GLU A 28 14.097 -0.602 7.773 1.00 0.00 C ATOM 437 OE1 GLU A 28 14.514 -1.547 7.031 1.00 0.00 O ATOM 438 OE2 GLU A 28 13.077 -0.604 8.471 1.00 0.00 O ATOM 0 H GLU A 28 14.311 1.295 4.926 1.00 0.00 H new ATOM 0 HA GLU A 28 15.999 2.947 6.601 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.769 -0.034 5.875 1.00 0.00 H new ATOM 0 HB3 GLU A 28 16.984 0.548 6.996 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.511 0.755 8.683 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.319 1.545 7.670 1.00 0.00 H new ATOM 445 N LYS A 29 17.398 1.408 4.007 1.00 0.00 N ATOM 446 CA LYS A 29 18.260 1.615 2.835 1.00 0.00 C ATOM 447 C LYS A 29 18.313 3.114 2.419 1.00 0.00 C ATOM 448 O LYS A 29 19.316 3.778 2.557 1.00 0.00 O ATOM 449 CB LYS A 29 17.627 0.806 1.653 1.00 0.00 C ATOM 450 CG LYS A 29 18.735 0.094 0.820 1.00 0.00 C ATOM 451 CD LYS A 29 19.024 -1.346 1.302 1.00 0.00 C ATOM 452 CE LYS A 29 17.661 -2.121 1.114 1.00 0.00 C ATOM 453 NZ LYS A 29 17.317 -2.809 2.352 1.00 0.00 N ATOM 0 H LYS A 29 16.903 0.516 3.981 1.00 0.00 H new ATOM 0 HA LYS A 29 19.273 1.291 3.073 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.928 0.067 2.044 1.00 0.00 H new ATOM 0 HB3 LYS A 29 17.056 1.477 1.011 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.433 0.067 -0.227 1.00 0.00 H new ATOM 0 HG3 LYS A 29 19.653 0.679 0.872 1.00 0.00 H new ATOM 0 HD2 LYS A 29 19.823 -1.805 0.719 1.00 0.00 H new ATOM 0 HD3 LYS A 29 19.344 -1.357 2.344 1.00 0.00 H new ATOM 0 HE2 LYS A 29 16.869 -1.424 0.841 1.00 0.00 H new ATOM 0 HE3 LYS A 29 17.748 -2.839 0.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 16.624 -3.558 2.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 18.174 -3.231 2.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 16.908 -2.130 3.025 1.00 0.00 H new ATOM 467 N TYR A 30 17.153 3.560 1.843 1.00 0.00 N ATOM 468 CA TYR A 30 17.019 4.766 1.003 1.00 0.00 C ATOM 469 C TYR A 30 16.555 5.964 1.778 1.00 0.00 C ATOM 470 O TYR A 30 16.811 7.146 1.411 1.00 0.00 O ATOM 471 CB TYR A 30 15.980 4.396 -0.153 1.00 0.00 C ATOM 472 CG TYR A 30 16.527 3.384 -1.170 1.00 0.00 C ATOM 473 CD1 TYR A 30 17.751 3.717 -1.802 1.00 0.00 C ATOM 474 CD2 TYR A 30 15.841 2.224 -1.474 1.00 0.00 C ATOM 475 CE1 TYR A 30 18.202 2.902 -2.830 1.00 0.00 C ATOM 476 CE2 TYR A 30 16.382 1.313 -2.416 1.00 0.00 C ATOM 477 CZ TYR A 30 17.505 1.714 -3.141 1.00 0.00 C ATOM 478 OH TYR A 30 17.930 0.950 -4.173 1.00 0.00 O ATOM 0 H TYR A 30 16.268 3.067 1.962 1.00 0.00 H new ATOM 0 HA TYR A 30 17.991 5.046 0.598 1.00 0.00 H new ATOM 0 HB2 TYR A 30 15.075 3.991 0.299 1.00 0.00 H new ATOM 0 HB3 TYR A 30 15.693 5.307 -0.678 1.00 0.00 H new ATOM 0 HD1 TYR A 30 18.318 4.582 -1.492 1.00 0.00 H new ATOM 0 HD2 TYR A 30 14.896 2.012 -0.996 1.00 0.00 H new ATOM 0 HE1 TYR A 30 19.084 3.175 -3.391 1.00 0.00 H new ATOM 0 HE2 TYR A 30 15.939 0.340 -2.568 1.00 0.00 H new ATOM 0 HH TYR A 30 17.349 0.166 -4.261 1.00 0.00 H new ATOM 488 N GLU A 31 15.808 5.729 2.878 1.00 0.00 N ATOM 489 CA GLU A 31 15.258 6.779 3.743 1.00 0.00 C ATOM 490 C GLU A 31 13.938 7.353 3.178 1.00 0.00 C ATOM 491 O GLU A 31 13.518 8.469 3.525 1.00 0.00 O ATOM 492 CB GLU A 31 16.285 7.917 3.889 1.00 0.00 C ATOM 493 CG GLU A 31 16.138 8.784 5.105 1.00 0.00 C ATOM 494 CD GLU A 31 14.943 8.497 5.997 1.00 0.00 C ATOM 495 OE1 GLU A 31 14.942 7.476 6.730 1.00 0.00 O ATOM 496 OE2 GLU A 31 13.977 9.327 5.900 1.00 0.00 O ATOM 0 H GLU A 31 15.570 4.787 3.189 1.00 0.00 H new ATOM 0 HA GLU A 31 15.045 6.333 4.715 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.283 7.480 3.898 1.00 0.00 H new ATOM 0 HB3 GLU A 31 16.223 8.552 3.005 1.00 0.00 H new ATOM 0 HG2 GLU A 31 17.043 8.688 5.705 1.00 0.00 H new ATOM 0 HG3 GLU A 31 16.080 9.823 4.779 1.00 0.00 H new ATOM 503 N VAL A 32 13.359 6.610 2.193 1.00 0.00 N ATOM 504 CA VAL A 32 12.128 6.956 1.465 1.00 0.00 C ATOM 505 C VAL A 32 11.065 7.557 2.405 1.00 0.00 C ATOM 506 O VAL A 32 10.411 6.843 3.181 1.00 0.00 O ATOM 507 CB VAL A 32 11.634 5.735 0.665 1.00 0.00 C ATOM 508 CG1 VAL A 32 10.162 5.768 0.231 1.00 0.00 C ATOM 509 CG2 VAL A 32 12.555 5.385 -0.541 1.00 0.00 C ATOM 0 H VAL A 32 13.759 5.725 1.882 1.00 0.00 H new ATOM 0 HA VAL A 32 12.343 7.743 0.742 1.00 0.00 H new ATOM 0 HB VAL A 32 11.698 4.932 1.399 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.926 4.860 -0.324 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.524 5.831 1.113 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.989 6.637 -0.404 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.155 4.517 -1.065 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.598 6.233 -1.224 1.00 0.00 H new ATOM 0 HG23 VAL A 32 13.558 5.160 -0.179 1.00 0.00 H new ATOM 519 N PRO A 33 10.932 8.889 2.363 1.00 0.00 N ATOM 520 CA PRO A 33 10.046 9.697 3.227 1.00 0.00 C ATOM 521 C PRO A 33 8.527 9.299 3.317 1.00 0.00 C ATOM 522 O PRO A 33 7.647 10.050 2.961 1.00 0.00 O ATOM 523 CB PRO A 33 10.251 11.126 2.819 1.00 0.00 C ATOM 524 CG PRO A 33 11.708 11.149 2.354 1.00 0.00 C ATOM 525 CD PRO A 33 11.883 9.806 1.639 1.00 0.00 C ATOM 0 HA PRO A 33 10.342 9.500 4.257 1.00 0.00 H new ATOM 0 HB2 PRO A 33 9.569 11.419 2.021 1.00 0.00 H new ATOM 0 HB3 PRO A 33 10.082 11.811 3.650 1.00 0.00 H new ATOM 0 HG2 PRO A 33 11.901 11.987 1.684 1.00 0.00 H new ATOM 0 HG3 PRO A 33 12.395 11.248 3.195 1.00 0.00 H new ATOM 0 HD2 PRO A 33 11.638 9.882 0.580 1.00 0.00 H new ATOM 0 HD3 PRO A 33 12.911 9.449 1.704 1.00 0.00 H new ATOM 533 N VAL A 34 8.358 8.152 4.027 1.00 0.00 N ATOM 534 CA VAL A 34 7.061 7.621 4.455 1.00 0.00 C ATOM 535 C VAL A 34 7.248 6.398 5.369 1.00 0.00 C ATOM 536 O VAL A 34 8.279 5.727 5.356 1.00 0.00 O ATOM 537 CB VAL A 34 6.123 7.427 3.283 1.00 0.00 C ATOM 538 CG1 VAL A 34 6.776 7.636 1.885 1.00 0.00 C ATOM 539 CG2 VAL A 34 5.339 6.093 3.307 1.00 0.00 C ATOM 0 H VAL A 34 9.143 7.568 4.317 1.00 0.00 H new ATOM 0 HA VAL A 34 6.552 8.358 5.076 1.00 0.00 H new ATOM 0 HB VAL A 34 5.406 8.235 3.429 1.00 0.00 H new ATOM 0 HG11 VAL A 34 6.029 7.476 1.107 1.00 0.00 H new ATOM 0 HG12 VAL A 34 7.164 8.652 1.813 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.593 6.926 1.755 1.00 0.00 H new ATOM 0 HG21 VAL A 34 4.691 6.036 2.432 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.040 5.259 3.295 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.732 6.044 4.211 1.00 0.00 H new ATOM 549 N ILE A 35 6.216 6.148 6.220 1.00 0.00 N ATOM 550 CA ILE A 35 5.997 4.876 6.958 1.00 0.00 C ATOM 551 C ILE A 35 5.034 3.958 6.183 1.00 0.00 C ATOM 552 O ILE A 35 3.846 4.304 5.976 1.00 0.00 O ATOM 553 CB ILE A 35 5.555 5.164 8.421 1.00 0.00 C ATOM 554 CG1 ILE A 35 6.504 6.157 9.109 1.00 0.00 C ATOM 555 CG2 ILE A 35 5.253 3.898 9.208 1.00 0.00 C ATOM 556 CD1 ILE A 35 7.906 6.345 8.478 1.00 0.00 C ATOM 0 H ILE A 35 5.496 6.844 6.416 1.00 0.00 H new ATOM 0 HA ILE A 35 6.937 4.328 7.031 1.00 0.00 H new ATOM 0 HB ILE A 35 4.591 5.672 8.387 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.013 7.130 9.138 1.00 0.00 H new ATOM 0 HG13 ILE A 35 6.638 5.837 10.142 1.00 0.00 H new ATOM 0 HG21 ILE A 35 4.950 4.163 10.221 1.00 0.00 H new ATOM 0 HG22 ILE A 35 4.447 3.350 8.720 1.00 0.00 H new ATOM 0 HG23 ILE A 35 6.145 3.273 9.248 1.00 0.00 H new ATOM 0 HD11 ILE A 35 8.473 7.071 9.061 1.00 0.00 H new ATOM 0 HD12 ILE A 35 8.434 5.391 8.474 1.00 0.00 H new ATOM 0 HD13 ILE A 35 7.799 6.705 7.455 1.00 0.00 H new ATOM 568 N ILE A 36 5.527 2.793 5.798 1.00 0.00 N ATOM 569 CA ILE A 36 4.777 1.652 5.168 1.00 0.00 C ATOM 570 C ILE A 36 4.195 0.779 6.312 1.00 0.00 C ATOM 571 O ILE A 36 4.922 0.262 7.163 1.00 0.00 O ATOM 572 CB ILE A 36 5.717 0.839 4.228 1.00 0.00 C ATOM 573 CG1 ILE A 36 6.663 1.702 3.393 1.00 0.00 C ATOM 574 CG2 ILE A 36 4.985 -0.262 3.465 1.00 0.00 C ATOM 575 CD1 ILE A 36 8.146 1.705 3.798 1.00 0.00 C ATOM 0 H ILE A 36 6.518 2.577 5.911 1.00 0.00 H new ATOM 0 HA ILE A 36 3.960 2.018 4.547 1.00 0.00 H new ATOM 0 HB ILE A 36 6.402 0.300 4.882 1.00 0.00 H new ATOM 0 HG12 ILE A 36 6.596 1.372 2.356 1.00 0.00 H new ATOM 0 HG13 ILE A 36 6.301 2.730 3.425 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.691 -0.794 2.827 1.00 0.00 H new ATOM 0 HG22 ILE A 36 4.539 -0.960 4.173 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.202 0.181 2.849 1.00 0.00 H new ATOM 0 HD11 ILE A 36 8.705 2.356 3.126 1.00 0.00 H new ATOM 0 HD12 ILE A 36 8.243 2.070 4.821 1.00 0.00 H new ATOM 0 HD13 ILE A 36 8.542 0.692 3.735 1.00 0.00 H new ATOM 587 N GLU A 37 2.859 0.660 6.322 1.00 0.00 N ATOM 588 CA GLU A 37 2.079 -0.265 7.195 1.00 0.00 C ATOM 589 C GLU A 37 0.988 -1.008 6.454 1.00 0.00 C ATOM 590 O GLU A 37 0.138 -0.409 5.794 1.00 0.00 O ATOM 591 CB GLU A 37 1.534 0.521 8.405 1.00 0.00 C ATOM 592 CG GLU A 37 2.590 1.389 9.068 1.00 0.00 C ATOM 593 CD GLU A 37 1.996 2.602 9.845 1.00 0.00 C ATOM 594 OE1 GLU A 37 0.842 2.432 10.276 1.00 0.00 O ATOM 595 OE2 GLU A 37 2.712 3.634 9.982 1.00 0.00 O ATOM 0 H GLU A 37 2.263 1.216 5.709 1.00 0.00 H new ATOM 0 HA GLU A 37 2.753 -1.045 7.549 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.705 1.150 8.080 1.00 0.00 H new ATOM 0 HB3 GLU A 37 1.134 -0.180 9.138 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.173 0.777 9.756 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.278 1.756 8.307 1.00 0.00 H new ATOM 602 N ALA A 38 1.085 -2.370 6.446 1.00 0.00 N ATOM 603 CA ALA A 38 0.081 -3.289 5.975 1.00 0.00 C ATOM 604 C ALA A 38 -1.074 -3.516 7.009 1.00 0.00 C ATOM 605 O ALA A 38 -0.976 -3.255 8.173 1.00 0.00 O ATOM 606 CB ALA A 38 0.701 -4.674 5.692 1.00 0.00 C ATOM 0 H ALA A 38 1.917 -2.849 6.790 1.00 0.00 H new ATOM 0 HA ALA A 38 -0.326 -2.835 5.071 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -0.074 -5.354 5.337 1.00 0.00 H new ATOM 0 HB2 ALA A 38 1.475 -4.577 4.931 1.00 0.00 H new ATOM 0 HB3 ALA A 38 1.140 -5.070 6.608 1.00 0.00 H new ATOM 612 N PHE A 39 -2.214 -3.964 6.424 1.00 0.00 N ATOM 613 CA PHE A 39 -3.576 -4.057 7.010 1.00 0.00 C ATOM 614 C PHE A 39 -4.456 -4.848 6.069 1.00 0.00 C ATOM 615 O PHE A 39 -4.054 -5.061 4.930 1.00 0.00 O ATOM 616 CB PHE A 39 -4.068 -2.467 6.904 1.00 0.00 C ATOM 617 CG PHE A 39 -3.249 -1.637 7.910 1.00 0.00 C ATOM 618 CD1 PHE A 39 -3.106 -2.096 9.226 1.00 0.00 C ATOM 619 CD2 PHE A 39 -2.536 -0.515 7.458 1.00 0.00 C ATOM 620 CE1 PHE A 39 -2.410 -1.313 10.151 1.00 0.00 C ATOM 621 CE2 PHE A 39 -1.858 0.289 8.384 1.00 0.00 C ATOM 622 CZ PHE A 39 -1.751 -0.147 9.716 1.00 0.00 C ATOM 0 H PHE A 39 -2.205 -4.294 5.459 1.00 0.00 H new ATOM 0 HA PHE A 39 -3.612 -4.509 8.001 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -3.919 -2.091 5.892 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -5.133 -2.384 7.122 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -3.529 -3.045 9.522 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -2.510 -0.274 6.406 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -2.378 -1.600 11.192 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.424 1.230 8.079 1.00 0.00 H new ATOM 0 HZ PHE A 39 -1.155 0.420 10.416 1.00 0.00 H new ATOM 632 N PRO A 40 -5.598 -5.383 6.566 1.00 0.00 N ATOM 633 CA PRO A 40 -6.763 -5.727 5.710 1.00 0.00 C ATOM 634 C PRO A 40 -7.743 -4.502 5.407 1.00 0.00 C ATOM 635 O PRO A 40 -8.124 -3.824 6.293 1.00 0.00 O ATOM 636 CB PRO A 40 -7.500 -6.807 6.517 1.00 0.00 C ATOM 637 CG PRO A 40 -7.263 -6.407 7.961 1.00 0.00 C ATOM 638 CD PRO A 40 -5.826 -5.765 7.945 1.00 0.00 C ATOM 0 HA PRO A 40 -6.428 -6.047 4.723 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.563 -6.829 6.278 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -7.105 -7.801 6.308 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -8.014 -5.697 8.307 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.308 -7.269 8.627 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -5.773 -4.901 8.607 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -5.073 -6.475 8.287 1.00 0.00 H new ATOM 646 N GLU A 41 -8.112 -4.504 4.107 1.00 0.00 N ATOM 647 CA GLU A 41 -9.125 -3.632 3.538 1.00 0.00 C ATOM 648 C GLU A 41 -10.138 -3.051 4.520 1.00 0.00 C ATOM 649 O GLU A 41 -10.721 -1.976 4.281 1.00 0.00 O ATOM 650 CB GLU A 41 -9.840 -4.277 2.331 1.00 0.00 C ATOM 651 CG GLU A 41 -10.466 -5.672 2.759 1.00 0.00 C ATOM 652 CD GLU A 41 -10.554 -6.629 1.565 1.00 0.00 C ATOM 653 OE1 GLU A 41 -9.796 -6.382 0.576 1.00 0.00 O ATOM 654 OE2 GLU A 41 -11.354 -7.623 1.625 1.00 0.00 O ATOM 0 H GLU A 41 -7.695 -5.132 3.420 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.546 -2.774 3.196 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -10.623 -3.614 1.964 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -9.134 -4.420 1.513 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -9.858 -6.121 3.544 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.460 -5.515 3.177 1.00 0.00 H new ATOM 661 N THR A 42 -10.509 -3.843 5.562 1.00 0.00 N ATOM 662 CA THR A 42 -11.231 -3.438 6.773 1.00 0.00 C ATOM 663 C THR A 42 -10.657 -2.136 7.399 1.00 0.00 C ATOM 664 O THR A 42 -11.402 -1.385 8.082 1.00 0.00 O ATOM 665 CB THR A 42 -11.380 -4.462 7.857 1.00 0.00 C ATOM 666 OG1 THR A 42 -11.226 -3.901 9.213 1.00 0.00 O ATOM 667 CG2 THR A 42 -10.724 -5.805 7.642 1.00 0.00 C ATOM 0 H THR A 42 -10.293 -4.840 5.567 1.00 0.00 H new ATOM 0 HA THR A 42 -12.234 -3.278 6.377 1.00 0.00 H new ATOM 0 HB THR A 42 -12.428 -4.748 7.770 1.00 0.00 H new ATOM 0 HG1 THR A 42 -11.335 -4.614 9.876 1.00 0.00 H new ATOM 0 HG21 THR A 42 -10.913 -6.445 8.504 1.00 0.00 H new ATOM 0 HG22 THR A 42 -11.135 -6.272 6.747 1.00 0.00 H new ATOM 0 HG23 THR A 42 -9.649 -5.670 7.520 1.00 0.00 H new ATOM 675 N LEU A 43 -9.384 -1.914 7.223 1.00 0.00 N ATOM 676 CA LEU A 43 -8.490 -0.954 7.849 1.00 0.00 C ATOM 677 C LEU A 43 -7.896 -0.014 6.757 1.00 0.00 C ATOM 678 O LEU A 43 -6.772 0.391 6.838 1.00 0.00 O ATOM 679 CB LEU A 43 -7.315 -1.744 8.451 1.00 0.00 C ATOM 680 CG LEU A 43 -7.095 -1.726 9.982 1.00 0.00 C ATOM 681 CD1 LEU A 43 -8.331 -1.327 10.789 1.00 0.00 C ATOM 682 CD2 LEU A 43 -6.459 -3.053 10.476 1.00 0.00 C ATOM 0 H LEU A 43 -8.871 -2.477 6.544 1.00 0.00 H new ATOM 0 HA LEU A 43 -9.028 -0.375 8.600 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -7.431 -2.785 8.149 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.401 -1.377 7.984 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.380 -0.925 10.172 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -8.091 -1.340 11.852 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -8.646 -0.324 10.500 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -9.138 -2.032 10.591 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.317 -3.009 11.556 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -7.118 -3.886 10.230 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.495 -3.198 9.989 1.00 0.00 H new ATOM 694 N ALA A 44 -8.714 0.185 5.668 1.00 0.00 N ATOM 695 CA ALA A 44 -8.572 1.385 4.809 1.00 0.00 C ATOM 696 C ALA A 44 -9.463 2.487 5.288 1.00 0.00 C ATOM 697 O ALA A 44 -9.123 3.694 5.198 1.00 0.00 O ATOM 698 CB ALA A 44 -8.940 0.959 3.349 1.00 0.00 C ATOM 0 H ALA A 44 -9.453 -0.457 5.382 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.551 1.765 4.846 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.847 1.818 2.685 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -8.264 0.170 3.019 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -9.966 0.591 3.325 1.00 0.00 H new ATOM 704 N GLY A 45 -10.671 2.141 5.789 1.00 0.00 N ATOM 705 CA GLY A 45 -11.477 2.962 6.693 1.00 0.00 C ATOM 706 C GLY A 45 -10.653 3.769 7.726 1.00 0.00 C ATOM 707 O GLY A 45 -10.596 5.007 7.689 1.00 0.00 O ATOM 0 H GLY A 45 -11.117 1.252 5.562 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -12.074 3.655 6.100 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.175 2.316 7.227 1.00 0.00 H new ATOM 711 N GLU A 46 -9.988 3.049 8.631 1.00 0.00 N ATOM 712 CA GLU A 46 -9.224 3.571 9.778 1.00 0.00 C ATOM 713 C GLU A 46 -7.794 3.996 9.355 1.00 0.00 C ATOM 714 O GLU A 46 -7.356 5.110 9.691 1.00 0.00 O ATOM 715 CB GLU A 46 -9.152 2.533 10.902 1.00 0.00 C ATOM 716 CG GLU A 46 -8.259 2.985 12.079 1.00 0.00 C ATOM 717 CD GLU A 46 -8.744 4.319 12.696 1.00 0.00 C ATOM 718 OE1 GLU A 46 -9.477 5.014 11.937 1.00 0.00 O ATOM 719 OE2 GLU A 46 -8.402 4.567 13.861 1.00 0.00 O ATOM 0 H GLU A 46 -9.963 2.030 8.586 1.00 0.00 H new ATOM 0 HA GLU A 46 -9.748 4.452 10.147 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -10.158 2.334 11.271 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.768 1.595 10.500 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.253 2.212 12.847 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.232 3.098 11.732 1.00 0.00 H new ATOM 726 N LYS A 47 -7.081 3.102 8.669 1.00 0.00 N ATOM 727 CA LYS A 47 -5.672 3.301 8.241 1.00 0.00 C ATOM 728 C LYS A 47 -5.546 4.219 7.001 1.00 0.00 C ATOM 729 O LYS A 47 -4.712 5.064 6.906 1.00 0.00 O ATOM 730 CB LYS A 47 -5.009 1.949 7.955 1.00 0.00 C ATOM 731 CG LYS A 47 -4.391 1.336 9.201 1.00 0.00 C ATOM 732 CD LYS A 47 -5.108 1.598 10.532 1.00 0.00 C ATOM 733 CE LYS A 47 -4.630 0.585 11.599 1.00 0.00 C ATOM 734 NZ LYS A 47 -5.498 0.707 12.789 1.00 0.00 N ATOM 0 H LYS A 47 -7.462 2.200 8.384 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.161 3.799 9.065 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.750 1.263 7.544 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.238 2.078 7.195 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.331 0.258 9.055 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.368 1.703 9.288 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.907 2.615 10.869 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -6.186 1.514 10.396 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -4.672 -0.430 11.203 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.592 0.780 11.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -5.188 0.031 13.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -5.436 1.674 13.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.482 0.502 12.523 1.00 0.00 H new ATOM 748 N GLY A 48 -6.429 3.897 6.009 1.00 0.00 N ATOM 749 CA GLY A 48 -6.743 4.744 4.867 1.00 0.00 C ATOM 750 C GLY A 48 -7.243 6.144 5.212 1.00 0.00 C ATOM 751 O GLY A 48 -7.132 7.086 4.383 1.00 0.00 O ATOM 0 H GLY A 48 -6.942 3.016 6.002 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -5.851 4.837 4.248 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -7.500 4.244 4.262 1.00 0.00 H new ATOM 755 N GLN A 49 -7.845 6.314 6.405 1.00 0.00 N ATOM 756 CA GLN A 49 -7.971 7.616 7.114 1.00 0.00 C ATOM 757 C GLN A 49 -6.575 8.164 7.454 1.00 0.00 C ATOM 758 O GLN A 49 -6.294 9.368 7.245 1.00 0.00 O ATOM 759 CB GLN A 49 -8.789 7.394 8.376 1.00 0.00 C ATOM 760 CG GLN A 49 -8.852 8.682 9.282 1.00 0.00 C ATOM 761 CD GLN A 49 -10.082 8.650 10.201 1.00 0.00 C ATOM 762 OE1 GLN A 49 -11.202 9.122 9.859 1.00 0.00 O ATOM 763 NE2 GLN A 49 -9.963 8.042 11.394 1.00 0.00 N ATOM 0 H GLN A 49 -8.267 5.540 6.918 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.472 8.348 6.481 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -9.801 7.095 8.103 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.357 6.572 8.947 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -7.946 8.752 9.884 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -8.887 9.572 8.653 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.064 7.656 11.682 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -10.772 7.966 12.011 1.00 0.00 H new ATOM 772 N ASN A 50 -5.701 7.321 8.045 1.00 0.00 N ATOM 773 CA ASN A 50 -4.395 7.663 8.635 1.00 0.00 C ATOM 774 C ASN A 50 -3.221 7.324 7.718 1.00 0.00 C ATOM 775 O ASN A 50 -2.089 7.091 8.157 1.00 0.00 O ATOM 776 CB ASN A 50 -4.274 7.058 10.043 1.00 0.00 C ATOM 777 CG ASN A 50 -4.738 8.025 11.172 1.00 0.00 C ATOM 778 OD1 ASN A 50 -5.697 8.786 11.049 1.00 0.00 O ATOM 779 ND2 ASN A 50 -4.046 7.978 12.324 1.00 0.00 N ATOM 0 H ASN A 50 -5.903 6.325 8.126 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.345 8.746 8.743 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -4.867 6.145 10.090 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.237 6.774 10.221 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -4.315 8.576 13.105 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -3.252 7.344 12.417 1.00 0.00 H new ATOM 786 N ALA A 51 -3.546 7.198 6.379 1.00 0.00 N ATOM 787 CA ALA A 51 -2.524 7.120 5.328 1.00 0.00 C ATOM 788 C ALA A 51 -2.320 8.458 4.613 1.00 0.00 C ATOM 789 O ALA A 51 -2.990 9.467 4.912 1.00 0.00 O ATOM 790 CB ALA A 51 -2.972 6.035 4.278 1.00 0.00 C ATOM 0 H ALA A 51 -4.504 7.151 6.033 1.00 0.00 H new ATOM 0 HA ALA A 51 -1.576 6.853 5.795 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.224 5.962 3.488 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -3.072 5.069 4.773 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -3.930 6.322 3.845 1.00 0.00 H new ATOM 796 N ASP A 52 -1.375 8.489 3.666 1.00 0.00 N ATOM 797 CA ASP A 52 -1.187 9.436 2.566 1.00 0.00 C ATOM 798 C ASP A 52 -1.386 8.772 1.177 1.00 0.00 C ATOM 799 O ASP A 52 -1.663 9.473 0.200 1.00 0.00 O ATOM 800 CB ASP A 52 0.170 10.113 2.634 1.00 0.00 C ATOM 801 CG ASP A 52 0.206 11.520 1.998 1.00 0.00 C ATOM 802 OD1 ASP A 52 0.458 11.604 0.764 1.00 0.00 O ATOM 803 OD2 ASP A 52 -0.009 12.467 2.791 1.00 0.00 O ATOM 0 H ASP A 52 -0.647 7.774 3.652 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.958 10.197 2.685 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.474 10.190 3.678 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.905 9.481 2.134 1.00 0.00 H new ATOM 808 N VAL A 53 -1.006 7.465 1.101 1.00 0.00 N ATOM 809 CA VAL A 53 -1.098 6.637 -0.121 1.00 0.00 C ATOM 810 C VAL A 53 -1.462 5.184 0.277 1.00 0.00 C ATOM 811 O VAL A 53 -0.714 4.476 0.929 1.00 0.00 O ATOM 812 CB VAL A 53 0.145 6.765 -0.976 1.00 0.00 C ATOM 813 CG1 VAL A 53 -0.015 6.472 -2.487 1.00 0.00 C ATOM 814 CG2 VAL A 53 0.912 8.110 -0.782 1.00 0.00 C ATOM 0 H VAL A 53 -0.624 6.958 1.899 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.901 7.000 -0.763 1.00 0.00 H new ATOM 0 HB VAL A 53 0.746 5.948 -0.577 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.946 6.599 -2.986 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.363 5.448 -2.624 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.741 7.163 -2.917 1.00 0.00 H new ATOM 0 HG21 VAL A 53 1.789 8.125 -1.428 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.257 8.943 -1.039 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.226 8.203 0.258 1.00 0.00 H new ATOM 824 N VAL A 54 -2.712 4.797 -0.104 1.00 0.00 N ATOM 825 CA VAL A 54 -3.344 3.529 0.267 1.00 0.00 C ATOM 826 C VAL A 54 -3.121 2.500 -0.853 1.00 0.00 C ATOM 827 O VAL A 54 -3.325 2.800 -2.058 1.00 0.00 O ATOM 828 CB VAL A 54 -4.797 3.744 0.701 1.00 0.00 C ATOM 829 CG1 VAL A 54 -5.839 2.728 0.160 1.00 0.00 C ATOM 830 CG2 VAL A 54 -4.943 3.880 2.249 1.00 0.00 C ATOM 0 H VAL A 54 -3.309 5.381 -0.690 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.872 3.102 1.152 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.043 4.690 0.220 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.829 2.986 0.537 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.846 2.759 -0.930 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -5.575 1.724 0.492 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -5.992 4.031 2.504 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.580 2.972 2.730 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.359 4.733 2.596 1.00 0.00 H new ATOM 840 N LEU A 55 -2.610 1.292 -0.521 1.00 0.00 N ATOM 841 CA LEU A 55 -2.503 0.112 -1.366 1.00 0.00 C ATOM 842 C LEU A 55 -3.276 -1.065 -0.718 1.00 0.00 C ATOM 843 O LEU A 55 -3.374 -1.132 0.494 1.00 0.00 O ATOM 844 CB LEU A 55 -0.995 -0.229 -1.443 1.00 0.00 C ATOM 845 CG LEU A 55 -0.083 0.768 -2.223 1.00 0.00 C ATOM 846 CD1 LEU A 55 0.630 0.163 -3.431 1.00 0.00 C ATOM 847 CD2 LEU A 55 -0.917 2.024 -2.648 1.00 0.00 C ATOM 0 H LEU A 55 -2.239 1.119 0.413 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.923 0.288 -2.356 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.614 -0.312 -0.425 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.893 -1.212 -1.902 1.00 0.00 H new ATOM 0 HG LEU A 55 0.713 1.053 -1.535 1.00 0.00 H new ATOM 0 HD11 LEU A 55 1.241 0.926 -3.913 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.267 -0.659 -3.104 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -0.109 -0.211 -4.140 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.277 2.718 -3.193 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.743 1.713 -3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -1.313 2.516 -1.759 1.00 0.00 H new ATOM 859 N LEU A 56 -3.843 -1.922 -1.596 1.00 0.00 N ATOM 860 CA LEU A 56 -5.027 -2.831 -1.179 1.00 0.00 C ATOM 861 C LEU A 56 -5.045 -3.987 -2.192 1.00 0.00 C ATOM 862 O LEU A 56 -5.493 -3.788 -3.321 1.00 0.00 O ATOM 863 CB LEU A 56 -6.216 -1.917 -1.280 1.00 0.00 C ATOM 864 CG LEU A 56 -7.497 -2.272 -2.090 1.00 0.00 C ATOM 865 CD1 LEU A 56 -8.372 -3.276 -1.203 1.00 0.00 C ATOM 866 CD2 LEU A 56 -8.346 -0.963 -2.292 1.00 0.00 C ATOM 0 H LEU A 56 -3.544 -2.031 -2.565 1.00 0.00 H new ATOM 0 HA LEU A 56 -4.988 -3.274 -0.184 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.542 -1.720 -0.259 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -5.847 -0.974 -1.684 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.229 -2.711 -3.051 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.279 -3.544 -1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.794 -4.176 -0.995 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.640 -2.792 -0.264 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -9.247 -1.198 -2.859 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -8.624 -0.556 -1.320 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.756 -0.227 -2.838 1.00 0.00 H new ATOM 878 N GLY A 57 -4.508 -5.161 -1.818 1.00 0.00 N ATOM 879 CA GLY A 57 -3.945 -6.157 -2.716 1.00 0.00 C ATOM 880 C GLY A 57 -4.703 -6.348 -4.023 1.00 0.00 C ATOM 881 O GLY A 57 -5.900 -5.979 -4.168 1.00 0.00 O ATOM 0 H GLY A 57 -4.457 -5.444 -0.839 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.917 -5.876 -2.947 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -3.904 -7.113 -2.194 1.00 0.00 H new ATOM 885 N PRO A 58 -4.012 -6.921 -5.014 1.00 0.00 N ATOM 886 CA PRO A 58 -4.452 -7.078 -6.415 1.00 0.00 C ATOM 887 C PRO A 58 -5.771 -7.973 -6.576 1.00 0.00 C ATOM 888 O PRO A 58 -6.697 -7.604 -7.241 1.00 0.00 O ATOM 889 CB PRO A 58 -3.311 -7.581 -7.211 1.00 0.00 C ATOM 890 CG PRO A 58 -2.259 -8.043 -6.230 1.00 0.00 C ATOM 891 CD PRO A 58 -2.585 -7.321 -4.914 1.00 0.00 C ATOM 0 HA PRO A 58 -4.755 -6.103 -6.797 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -3.623 -8.402 -7.857 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -2.917 -6.798 -7.859 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -2.289 -9.125 -6.102 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.258 -7.791 -6.579 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.422 -7.976 -4.058 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -1.944 -6.450 -4.776 1.00 0.00 H new ATOM 899 N GLN A 59 -5.688 -9.040 -5.713 1.00 0.00 N ATOM 900 CA GLN A 59 -6.692 -10.106 -5.695 1.00 0.00 C ATOM 901 C GLN A 59 -8.018 -9.635 -5.065 1.00 0.00 C ATOM 902 O GLN A 59 -9.100 -10.095 -5.437 1.00 0.00 O ATOM 903 CB GLN A 59 -6.129 -11.330 -5.028 1.00 0.00 C ATOM 904 CG GLN A 59 -4.551 -11.456 -5.074 1.00 0.00 C ATOM 905 CD GLN A 59 -3.987 -11.557 -3.664 1.00 0.00 C ATOM 906 OE1 GLN A 59 -3.485 -10.577 -3.047 1.00 0.00 O ATOM 907 NE2 GLN A 59 -4.063 -12.765 -3.030 1.00 0.00 N ATOM 0 H GLN A 59 -4.935 -9.163 -5.036 1.00 0.00 H new ATOM 0 HA GLN A 59 -6.937 -10.374 -6.723 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -6.448 -11.336 -3.986 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -6.562 -12.213 -5.499 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -4.266 -12.336 -5.651 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -4.125 -10.591 -5.582 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -4.465 -13.569 -3.511 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -3.717 -12.863 -2.075 1.00 0.00 H new ATOM 916 N ILE A 60 -7.915 -8.739 -4.057 1.00 0.00 N ATOM 917 CA ILE A 60 -9.019 -7.916 -3.524 1.00 0.00 C ATOM 918 C ILE A 60 -9.841 -7.342 -4.719 1.00 0.00 C ATOM 919 O ILE A 60 -11.000 -7.704 -4.926 1.00 0.00 O ATOM 920 CB ILE A 60 -8.668 -7.012 -2.400 1.00 0.00 C ATOM 921 CG1 ILE A 60 -9.498 -5.701 -2.423 1.00 0.00 C ATOM 922 CG2 ILE A 60 -7.211 -6.833 -2.005 1.00 0.00 C ATOM 923 CD1 ILE A 60 -9.047 -4.697 -3.497 1.00 0.00 C ATOM 0 H ILE A 60 -7.031 -8.565 -3.578 1.00 0.00 H new ATOM 0 HA ILE A 60 -9.709 -8.549 -2.966 1.00 0.00 H new ATOM 0 HB ILE A 60 -8.982 -7.605 -1.541 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -10.546 -5.949 -2.589 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -9.434 -5.225 -1.445 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -7.144 -6.139 -1.167 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.792 -7.796 -1.713 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -6.651 -6.435 -2.851 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -9.675 -3.807 -3.450 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -8.008 -4.418 -3.321 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -9.138 -5.153 -4.483 1.00 0.00 H new ATOM 935 N ALA A 61 -9.165 -6.541 -5.569 1.00 0.00 N ATOM 936 CA ALA A 61 -9.669 -5.888 -6.761 1.00 0.00 C ATOM 937 C ALA A 61 -10.979 -5.120 -6.587 1.00 0.00 C ATOM 938 O ALA A 61 -11.089 -3.902 -6.820 1.00 0.00 O ATOM 939 CB ALA A 61 -9.838 -6.903 -7.921 1.00 0.00 C ATOM 0 H ALA A 61 -8.180 -6.328 -5.414 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.906 -5.145 -6.993 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.217 -6.387 -8.803 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -8.874 -7.356 -8.152 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.542 -7.681 -7.624 1.00 0.00 H new ATOM 945 N TYR A 62 -12.045 -5.839 -6.164 1.00 0.00 N ATOM 946 CA TYR A 62 -13.451 -5.492 -6.138 1.00 0.00 C ATOM 947 C TYR A 62 -13.781 -4.360 -5.131 1.00 0.00 C ATOM 948 O TYR A 62 -14.832 -3.681 -5.269 1.00 0.00 O ATOM 949 CB TYR A 62 -14.310 -6.752 -5.827 1.00 0.00 C ATOM 950 CG TYR A 62 -14.246 -7.282 -4.395 1.00 0.00 C ATOM 951 CD1 TYR A 62 -13.137 -7.037 -3.576 1.00 0.00 C ATOM 952 CD2 TYR A 62 -15.325 -8.078 -3.955 1.00 0.00 C ATOM 953 CE1 TYR A 62 -13.112 -7.564 -2.285 1.00 0.00 C ATOM 954 CE2 TYR A 62 -15.364 -8.481 -2.608 1.00 0.00 C ATOM 955 CZ TYR A 62 -14.245 -8.218 -1.790 1.00 0.00 C ATOM 956 OH TYR A 62 -14.294 -8.615 -0.501 1.00 0.00 O ATOM 0 H TYR A 62 -11.904 -6.779 -5.795 1.00 0.00 H new ATOM 0 HA TYR A 62 -13.697 -5.111 -7.129 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.350 -6.523 -6.060 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -14.001 -7.551 -6.501 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -12.310 -6.446 -3.940 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -16.106 -8.372 -4.640 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -12.227 -7.468 -1.674 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -16.233 -8.982 -2.208 1.00 0.00 H new ATOM 0 HH TYR A 62 -15.154 -9.052 -0.326 1.00 0.00 H new ATOM 966 N MET A 63 -12.919 -4.197 -4.123 1.00 0.00 N ATOM 967 CA MET A 63 -13.166 -3.409 -2.901 1.00 0.00 C ATOM 968 C MET A 63 -12.769 -1.924 -3.131 1.00 0.00 C ATOM 969 O MET A 63 -13.087 -1.041 -2.341 1.00 0.00 O ATOM 970 CB MET A 63 -12.401 -3.979 -1.708 1.00 0.00 C ATOM 971 CG MET A 63 -13.279 -5.012 -0.929 1.00 0.00 C ATOM 972 SD MET A 63 -14.127 -4.221 0.520 1.00 0.00 S ATOM 973 CE MET A 63 -15.838 -4.426 0.050 1.00 0.00 C ATOM 0 H MET A 63 -11.993 -4.625 -4.131 1.00 0.00 H new ATOM 0 HA MET A 63 -14.231 -3.464 -2.676 1.00 0.00 H new ATOM 0 HB2 MET A 63 -11.486 -4.460 -2.053 1.00 0.00 H new ATOM 0 HB3 MET A 63 -12.104 -3.170 -1.040 1.00 0.00 H new ATOM 0 HG2 MET A 63 -14.024 -5.438 -1.601 1.00 0.00 H new ATOM 0 HG3 MET A 63 -12.654 -5.835 -0.582 1.00 0.00 H new ATOM 0 HE1 MET A 63 -16.451 -4.534 0.945 1.00 0.00 H new ATOM 0 HE2 MET A 63 -16.168 -3.552 -0.512 1.00 0.00 H new ATOM 0 HE3 MET A 63 -15.941 -5.317 -0.570 1.00 0.00 H new ATOM 983 N LEU A 64 -12.015 -1.696 -4.220 1.00 0.00 N ATOM 984 CA LEU A 64 -11.421 -0.438 -4.692 1.00 0.00 C ATOM 985 C LEU A 64 -12.469 0.666 -4.741 1.00 0.00 C ATOM 986 O LEU A 64 -12.162 1.832 -4.404 1.00 0.00 O ATOM 987 CB LEU A 64 -10.822 -0.699 -6.082 1.00 0.00 C ATOM 988 CG LEU A 64 -9.739 0.240 -6.646 1.00 0.00 C ATOM 989 CD1 LEU A 64 -10.267 1.658 -6.958 1.00 0.00 C ATOM 990 CD2 LEU A 64 -8.497 0.266 -5.719 1.00 0.00 C ATOM 0 H LEU A 64 -11.785 -2.464 -4.851 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.641 -0.103 -4.008 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -10.403 -1.705 -6.070 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -11.647 -0.705 -6.794 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.432 -0.170 -7.608 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.456 2.270 -7.352 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -11.065 1.594 -7.697 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -10.653 2.111 -6.045 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.745 0.935 -6.137 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.788 0.620 -4.730 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -8.083 -0.739 -5.637 1.00 0.00 H new ATOM 1002 N PRO A 65 -13.704 0.356 -5.154 1.00 0.00 N ATOM 1003 CA PRO A 65 -14.896 1.248 -5.134 1.00 0.00 C ATOM 1004 C PRO A 65 -15.610 1.437 -3.761 1.00 0.00 C ATOM 1005 O PRO A 65 -16.150 2.466 -3.450 1.00 0.00 O ATOM 1006 CB PRO A 65 -15.828 0.704 -6.209 1.00 0.00 C ATOM 1007 CG PRO A 65 -15.598 -0.789 -6.141 1.00 0.00 C ATOM 1008 CD PRO A 65 -14.079 -0.901 -5.839 1.00 0.00 C ATOM 0 HA PRO A 65 -14.567 2.268 -5.331 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -16.868 0.961 -6.008 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -15.585 1.105 -7.193 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -16.199 -1.254 -5.360 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -15.859 -1.280 -7.079 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -13.869 -1.766 -5.209 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -13.507 -1.030 -6.758 1.00 0.00 H new ATOM 1016 N GLU A 66 -15.338 0.391 -2.940 1.00 0.00 N ATOM 1017 CA GLU A 66 -15.542 0.419 -1.468 1.00 0.00 C ATOM 1018 C GLU A 66 -14.617 1.427 -0.790 1.00 0.00 C ATOM 1019 O GLU A 66 -15.075 2.352 -0.106 1.00 0.00 O ATOM 1020 CB GLU A 66 -15.358 -0.992 -0.887 1.00 0.00 C ATOM 1021 CG GLU A 66 -15.686 -1.001 0.629 1.00 0.00 C ATOM 1022 CD GLU A 66 -16.914 -1.901 0.960 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -17.957 -1.719 0.339 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -16.689 -2.727 1.897 1.00 0.00 O ATOM 0 H GLU A 66 -14.970 -0.497 -3.280 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.562 0.746 -1.269 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -16.007 -1.695 -1.410 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -14.333 -1.326 -1.045 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -14.818 -1.355 1.185 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.884 0.018 0.962 1.00 0.00 H new ATOM 1031 N ILE A 67 -13.285 1.181 -0.896 1.00 0.00 N ATOM 1032 CA ILE A 67 -12.244 2.118 -0.463 1.00 0.00 C ATOM 1033 C ILE A 67 -12.632 3.582 -0.857 1.00 0.00 C ATOM 1034 O ILE A 67 -12.883 4.418 -0.003 1.00 0.00 O ATOM 1035 CB ILE A 67 -10.826 1.700 -0.855 1.00 0.00 C ATOM 1036 CG1 ILE A 67 -10.397 0.357 -0.266 1.00 0.00 C ATOM 1037 CG2 ILE A 67 -9.810 2.832 -0.449 1.00 0.00 C ATOM 1038 CD1 ILE A 67 -11.303 -0.149 0.914 1.00 0.00 C ATOM 0 H ILE A 67 -12.913 0.317 -1.289 1.00 0.00 H new ATOM 0 HA ILE A 67 -12.202 2.087 0.626 1.00 0.00 H new ATOM 0 HB ILE A 67 -10.825 1.564 -1.936 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -10.400 -0.392 -1.058 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -9.370 0.441 0.090 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -8.800 2.532 -0.729 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -10.070 3.756 -0.965 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -9.855 2.992 0.628 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.930 -1.108 1.274 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -11.281 0.577 1.727 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -12.327 -0.268 0.561 1.00 0.00 H new ATOM 1050 N GLN A 68 -12.616 3.806 -2.176 1.00 0.00 N ATOM 1051 CA GLN A 68 -12.947 5.035 -2.869 1.00 0.00 C ATOM 1052 C GLN A 68 -14.106 5.822 -2.250 1.00 0.00 C ATOM 1053 O GLN A 68 -14.103 7.072 -2.227 1.00 0.00 O ATOM 1054 CB GLN A 68 -13.328 4.617 -4.332 1.00 0.00 C ATOM 1055 CG GLN A 68 -12.126 4.646 -5.274 1.00 0.00 C ATOM 1056 CD GLN A 68 -10.788 4.487 -4.556 1.00 0.00 C ATOM 1057 OE1 GLN A 68 -10.262 3.408 -4.214 1.00 0.00 O ATOM 1058 NE2 GLN A 68 -10.100 5.638 -4.265 1.00 0.00 N ATOM 0 H GLN A 68 -12.349 3.069 -2.828 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.088 5.704 -2.813 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.755 3.614 -4.322 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -14.100 5.288 -4.710 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -12.232 3.849 -6.010 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -12.126 5.588 -5.822 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.489 6.544 -4.525 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.199 5.587 -3.789 1.00 0.00 H new ATOM 1067 N ARG A 69 -15.185 5.105 -1.852 1.00 0.00 N ATOM 1068 CA ARG A 69 -16.377 5.724 -1.200 1.00 0.00 C ATOM 1069 C ARG A 69 -16.064 6.007 0.289 1.00 0.00 C ATOM 1070 O ARG A 69 -16.641 6.907 0.897 1.00 0.00 O ATOM 1071 CB ARG A 69 -17.602 4.829 -1.323 1.00 0.00 C ATOM 1072 CG ARG A 69 -17.865 4.266 -2.715 1.00 0.00 C ATOM 1073 CD ARG A 69 -19.376 4.195 -3.031 1.00 0.00 C ATOM 1074 NE ARG A 69 -19.697 2.809 -3.480 1.00 0.00 N ATOM 1075 CZ ARG A 69 -20.897 2.436 -3.985 1.00 0.00 C ATOM 1076 NH1 ARG A 69 -21.928 3.297 -4.158 1.00 0.00 N ATOM 1077 NH2 ARG A 69 -21.072 1.157 -4.403 1.00 0.00 N ATOM 0 H ARG A 69 -15.259 4.094 -1.969 1.00 0.00 H new ATOM 0 HA ARG A 69 -16.601 6.662 -1.709 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -17.494 3.997 -0.628 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -18.478 5.396 -1.008 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -17.367 4.889 -3.459 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -17.431 3.269 -2.792 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -19.961 4.453 -2.148 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -19.636 4.915 -3.807 1.00 0.00 H new ATOM 0 HE ARG A 69 -18.969 2.099 -3.402 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -21.821 4.279 -3.903 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -22.812 2.964 -4.543 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -20.304 0.489 -4.335 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -21.971 0.864 -4.785 1.00 0.00 H new ATOM 1091 N LEU A 70 -15.182 5.113 0.835 1.00 0.00 N ATOM 1092 CA LEU A 70 -14.715 5.158 2.229 1.00 0.00 C ATOM 1093 C LEU A 70 -13.659 6.228 2.447 1.00 0.00 C ATOM 1094 O LEU A 70 -13.519 6.740 3.591 1.00 0.00 O ATOM 1095 CB LEU A 70 -14.099 3.747 2.477 1.00 0.00 C ATOM 1096 CG LEU A 70 -14.623 2.984 3.740 1.00 0.00 C ATOM 1097 CD1 LEU A 70 -14.131 1.553 3.866 1.00 0.00 C ATOM 1098 CD2 LEU A 70 -14.393 3.834 5.022 1.00 0.00 C ATOM 0 H LEU A 70 -14.782 4.341 0.302 1.00 0.00 H new ATOM 0 HA LEU A 70 -15.530 5.402 2.910 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -14.289 3.130 1.599 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -13.018 3.854 2.564 1.00 0.00 H new ATOM 0 HG LEU A 70 -15.698 2.862 3.606 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -14.545 1.104 4.769 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -14.452 0.980 2.996 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -13.043 1.546 3.923 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -14.763 3.289 5.891 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -13.327 4.029 5.143 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -14.927 4.780 4.932 1.00 0.00 H new ATOM 1110 N LEU A 71 -12.851 6.603 1.424 1.00 0.00 N ATOM 1111 CA LEU A 71 -11.915 7.740 1.401 1.00 0.00 C ATOM 1112 C LEU A 71 -11.703 8.215 -0.034 1.00 0.00 C ATOM 1113 O LEU A 71 -10.614 8.014 -0.597 1.00 0.00 O ATOM 1114 CB LEU A 71 -10.592 7.189 1.977 1.00 0.00 C ATOM 1115 CG LEU A 71 -10.538 5.754 2.524 1.00 0.00 C ATOM 1116 CD1 LEU A 71 -9.236 4.979 2.086 1.00 0.00 C ATOM 1117 CD2 LEU A 71 -10.699 5.733 4.078 1.00 0.00 C ATOM 0 H LEU A 71 -12.840 6.086 0.545 1.00 0.00 H new ATOM 0 HA LEU A 71 -12.289 8.589 1.974 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.838 7.267 1.193 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -10.285 7.856 2.782 1.00 0.00 H new ATOM 0 HG LEU A 71 -11.383 5.227 2.080 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -9.255 3.972 2.502 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -9.196 4.921 0.998 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -8.357 5.508 2.454 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -10.657 4.704 4.434 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -9.894 6.309 4.535 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -11.659 6.172 4.350 1.00 0.00 H new ATOM 1129 N PRO A 72 -12.724 8.829 -0.657 1.00 0.00 N ATOM 1130 CA PRO A 72 -12.727 9.409 -2.003 1.00 0.00 C ATOM 1131 C PRO A 72 -11.524 10.252 -2.486 1.00 0.00 C ATOM 1132 O PRO A 72 -11.175 10.303 -3.657 1.00 0.00 O ATOM 1133 CB PRO A 72 -14.034 10.236 -2.068 1.00 0.00 C ATOM 1134 CG PRO A 72 -14.999 9.388 -1.279 1.00 0.00 C ATOM 1135 CD PRO A 72 -14.143 8.738 -0.168 1.00 0.00 C ATOM 0 HA PRO A 72 -12.648 8.570 -2.695 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.910 11.225 -1.628 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -14.370 10.384 -3.094 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -15.802 9.993 -0.856 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.467 8.632 -1.910 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -14.267 9.261 0.780 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -14.436 7.701 -0.001 1.00 0.00 H new ATOM 1143 N ASN A 73 -10.812 10.782 -1.434 1.00 0.00 N ATOM 1144 CA ASN A 73 -9.782 11.819 -1.574 1.00 0.00 C ATOM 1145 C ASN A 73 -8.442 11.411 -0.922 1.00 0.00 C ATOM 1146 O ASN A 73 -7.912 12.068 -0.034 1.00 0.00 O ATOM 1147 CB ASN A 73 -10.292 13.162 -1.039 1.00 0.00 C ATOM 1148 CG ASN A 73 -9.197 14.260 -0.965 1.00 0.00 C ATOM 1149 OD1 ASN A 73 -9.152 15.092 -0.047 1.00 0.00 O ATOM 1150 ND2 ASN A 73 -8.311 14.296 -1.966 1.00 0.00 N ATOM 0 H ASN A 73 -10.954 10.485 -0.469 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.577 11.935 -2.638 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -11.103 13.513 -1.677 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -10.711 13.011 -0.044 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.587 15.014 -1.980 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -8.359 13.605 -2.715 1.00 0.00 H new ATOM 1157 N LYS A 74 -7.913 10.234 -1.377 1.00 0.00 N ATOM 1158 CA LYS A 74 -6.509 9.844 -1.167 1.00 0.00 C ATOM 1159 C LYS A 74 -5.908 9.111 -2.374 1.00 0.00 C ATOM 1160 O LYS A 74 -6.612 8.564 -3.233 1.00 0.00 O ATOM 1161 CB LYS A 74 -6.358 8.995 0.106 1.00 0.00 C ATOM 1162 CG LYS A 74 -6.849 9.710 1.345 1.00 0.00 C ATOM 1163 CD LYS A 74 -5.763 10.303 2.278 1.00 0.00 C ATOM 1164 CE LYS A 74 -6.211 10.035 3.735 1.00 0.00 C ATOM 1165 NZ LYS A 74 -5.366 10.814 4.664 1.00 0.00 N ATOM 0 H LYS A 74 -8.456 9.543 -1.895 1.00 0.00 H new ATOM 0 HA LYS A 74 -5.947 10.770 -1.044 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -6.912 8.064 -0.015 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -5.310 8.727 0.237 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -7.509 10.519 1.033 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -7.453 9.012 1.925 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -4.795 9.842 2.083 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -5.648 11.373 2.102 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -7.258 10.311 3.861 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -6.132 8.972 3.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -5.657 10.620 5.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -4.370 10.542 4.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -5.476 11.829 4.465 1.00 0.00 H new ATOM 1179 N PRO A 75 -4.556 9.147 -2.447 1.00 0.00 N ATOM 1180 CA PRO A 75 -3.750 8.418 -3.460 1.00 0.00 C ATOM 1181 C PRO A 75 -3.588 6.889 -3.309 1.00 0.00 C ATOM 1182 O PRO A 75 -2.582 6.317 -2.947 1.00 0.00 O ATOM 1183 CB PRO A 75 -2.487 9.188 -3.625 1.00 0.00 C ATOM 1184 CG PRO A 75 -2.290 9.960 -2.318 1.00 0.00 C ATOM 1185 CD PRO A 75 -3.699 10.101 -1.718 1.00 0.00 C ATOM 0 HA PRO A 75 -4.320 8.393 -4.388 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.646 8.522 -3.815 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -2.553 9.868 -4.474 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.625 9.424 -1.640 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.840 10.936 -2.501 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.691 9.880 -0.651 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.069 11.120 -1.830 1.00 0.00 H new ATOM 1193 N VAL A 76 -4.647 6.213 -3.826 1.00 0.00 N ATOM 1194 CA VAL A 76 -4.972 4.808 -3.628 1.00 0.00 C ATOM 1195 C VAL A 76 -4.535 3.945 -4.821 1.00 0.00 C ATOM 1196 O VAL A 76 -4.301 4.382 -5.932 1.00 0.00 O ATOM 1197 CB VAL A 76 -6.516 4.689 -3.309 1.00 0.00 C ATOM 1198 CG1 VAL A 76 -6.991 3.267 -3.081 1.00 0.00 C ATOM 1199 CG2 VAL A 76 -6.909 5.650 -2.183 1.00 0.00 C ATOM 0 H VAL A 76 -5.328 6.679 -4.426 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.412 4.416 -2.779 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.050 4.998 -4.207 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.060 3.270 -2.868 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.801 2.672 -3.974 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -6.454 2.835 -2.236 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -7.975 5.554 -1.978 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.343 5.408 -1.284 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -6.689 6.674 -2.485 1.00 0.00 H new ATOM 1209 N GLU A 77 -4.405 2.637 -4.547 1.00 0.00 N ATOM 1210 CA GLU A 77 -4.360 1.529 -5.489 1.00 0.00 C ATOM 1211 C GLU A 77 -4.019 0.191 -4.808 1.00 0.00 C ATOM 1212 O GLU A 77 -3.266 0.144 -3.826 1.00 0.00 O ATOM 1213 CB GLU A 77 -3.414 1.832 -6.648 1.00 0.00 C ATOM 1214 CG GLU A 77 -2.636 0.641 -7.184 1.00 0.00 C ATOM 1215 CD GLU A 77 -2.427 0.655 -8.708 1.00 0.00 C ATOM 1216 OE1 GLU A 77 -2.551 1.829 -9.237 1.00 0.00 O ATOM 1217 OE2 GLU A 77 -2.099 -0.391 -9.302 1.00 0.00 O ATOM 0 H GLU A 77 -4.323 2.312 -3.584 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.364 1.416 -5.898 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -3.994 2.263 -7.464 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -2.703 2.593 -6.325 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -1.662 0.609 -6.696 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -3.161 -0.274 -6.909 1.00 0.00 H new ATOM 1224 N VAL A 78 -4.684 -0.894 -5.265 1.00 0.00 N ATOM 1225 CA VAL A 78 -4.319 -2.292 -5.024 1.00 0.00 C ATOM 1226 C VAL A 78 -2.807 -2.465 -4.888 1.00 0.00 C ATOM 1227 O VAL A 78 -2.045 -1.508 -5.058 1.00 0.00 O ATOM 1228 CB VAL A 78 -4.973 -3.188 -6.088 1.00 0.00 C ATOM 1229 CG1 VAL A 78 -6.482 -3.298 -6.087 1.00 0.00 C ATOM 1230 CG2 VAL A 78 -4.428 -2.791 -7.510 1.00 0.00 C ATOM 0 H VAL A 78 -5.525 -0.806 -5.836 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.714 -2.616 -4.061 1.00 0.00 H new ATOM 0 HB VAL A 78 -4.674 -4.198 -5.809 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.799 -3.962 -6.891 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -6.817 -3.700 -5.131 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.919 -2.311 -6.238 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.890 -3.425 -8.267 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -4.669 -1.748 -7.714 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.347 -2.925 -7.536 1.00 0.00 H new ATOM 1240 N ILE A 79 -2.373 -3.684 -4.530 1.00 0.00 N ATOM 1241 CA ILE A 79 -1.018 -4.210 -4.832 1.00 0.00 C ATOM 1242 C ILE A 79 -0.959 -4.814 -6.240 1.00 0.00 C ATOM 1243 O ILE A 79 -1.968 -5.193 -6.836 1.00 0.00 O ATOM 1244 CB ILE A 79 -0.406 -4.967 -3.679 1.00 0.00 C ATOM 1245 CG1 ILE A 79 -0.971 -4.553 -2.299 1.00 0.00 C ATOM 1246 CG2 ILE A 79 1.170 -4.883 -3.692 1.00 0.00 C ATOM 1247 CD1 ILE A 79 -1.102 -5.732 -1.290 1.00 0.00 C ATOM 0 H ILE A 79 -2.955 -4.346 -4.016 1.00 0.00 H new ATOM 0 HA ILE A 79 -0.306 -3.388 -4.907 1.00 0.00 H new ATOM 0 HB ILE A 79 -0.694 -6.007 -3.830 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.325 -3.789 -1.867 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.952 -4.098 -2.441 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.571 -5.441 -2.846 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.549 -5.310 -4.621 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.479 -3.840 -3.619 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.505 -5.361 -0.347 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.773 -6.488 -1.699 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -0.121 -6.173 -1.117 1.00 0.00 H new ATOM 1259 N ASP A 80 0.289 -4.891 -6.764 1.00 0.00 N ATOM 1260 CA ASP A 80 0.762 -5.746 -7.876 1.00 0.00 C ATOM 1261 C ASP A 80 0.881 -7.220 -7.333 1.00 0.00 C ATOM 1262 O ASP A 80 0.615 -7.503 -6.193 1.00 0.00 O ATOM 1263 CB ASP A 80 2.116 -5.301 -8.393 1.00 0.00 C ATOM 1264 CG ASP A 80 2.120 -4.392 -9.624 1.00 0.00 C ATOM 1265 OD1 ASP A 80 1.887 -3.146 -9.424 1.00 0.00 O ATOM 1266 OD2 ASP A 80 2.357 -4.944 -10.755 1.00 0.00 O ATOM 0 H ASP A 80 1.044 -4.315 -6.392 1.00 0.00 H new ATOM 0 HA ASP A 80 0.053 -5.675 -8.701 1.00 0.00 H new ATOM 0 HB2 ASP A 80 2.634 -4.782 -7.586 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.700 -6.191 -8.626 1.00 0.00 H new ATOM 1271 N SER A 81 1.028 -8.135 -8.318 1.00 0.00 N ATOM 1272 CA SER A 81 0.561 -9.558 -8.254 1.00 0.00 C ATOM 1273 C SER A 81 1.765 -10.516 -8.068 1.00 0.00 C ATOM 1274 O SER A 81 1.685 -11.538 -7.400 1.00 0.00 O ATOM 1275 CB SER A 81 -0.132 -9.900 -9.574 1.00 0.00 C ATOM 1276 OG SER A 81 -0.514 -11.292 -9.611 1.00 0.00 O ATOM 0 H SER A 81 1.483 -7.910 -9.203 1.00 0.00 H new ATOM 0 HA SER A 81 -0.121 -9.673 -7.411 1.00 0.00 H new ATOM 0 HB2 SER A 81 -1.015 -9.273 -9.699 1.00 0.00 H new ATOM 0 HB3 SER A 81 0.535 -9.680 -10.407 1.00 0.00 H new ATOM 0 HG SER A 81 -0.957 -11.487 -10.463 1.00 0.00 H new ATOM 1282 N LEU A 82 2.924 -10.080 -8.624 1.00 0.00 N ATOM 1283 CA LEU A 82 4.250 -10.678 -8.527 1.00 0.00 C ATOM 1284 C LEU A 82 5.155 -9.820 -7.596 1.00 0.00 C ATOM 1285 O LEU A 82 6.053 -10.341 -6.993 1.00 0.00 O ATOM 1286 CB LEU A 82 4.840 -10.557 -9.987 1.00 0.00 C ATOM 1287 CG LEU A 82 4.496 -11.673 -10.977 1.00 0.00 C ATOM 1288 CD1 LEU A 82 5.730 -12.514 -11.392 1.00 0.00 C ATOM 1289 CD2 LEU A 82 3.307 -12.552 -10.563 1.00 0.00 C ATOM 0 H LEU A 82 2.940 -9.234 -9.193 1.00 0.00 H new ATOM 0 HA LEU A 82 4.205 -11.697 -8.142 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.499 -9.613 -10.411 1.00 0.00 H new ATOM 0 HB3 LEU A 82 5.926 -10.498 -9.909 1.00 0.00 H new ATOM 0 HG LEU A 82 4.158 -11.143 -11.867 1.00 0.00 H new ATOM 0 HD11 LEU A 82 5.423 -13.289 -12.094 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.469 -11.867 -11.865 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.168 -12.978 -10.508 1.00 0.00 H new ATOM 0 HD21 LEU A 82 3.136 -13.314 -11.323 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.525 -13.033 -9.609 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.415 -11.934 -10.463 1.00 0.00 H new ATOM 1301 N LEU A 83 4.876 -8.473 -7.588 1.00 0.00 N ATOM 1302 CA LEU A 83 5.549 -7.554 -6.585 1.00 0.00 C ATOM 1303 C LEU A 83 5.063 -7.958 -5.192 1.00 0.00 C ATOM 1304 O LEU A 83 5.845 -8.157 -4.265 1.00 0.00 O ATOM 1305 CB LEU A 83 5.086 -6.169 -6.978 1.00 0.00 C ATOM 1306 CG LEU A 83 5.759 -5.452 -8.183 1.00 0.00 C ATOM 1307 CD1 LEU A 83 7.212 -5.038 -7.959 1.00 0.00 C ATOM 1308 CD2 LEU A 83 5.529 -6.214 -9.499 1.00 0.00 C ATOM 0 H LEU A 83 4.226 -8.013 -8.226 1.00 0.00 H new ATOM 0 HA LEU A 83 6.638 -7.601 -6.575 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.018 -6.228 -7.188 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.204 -5.525 -6.107 1.00 0.00 H new ATOM 0 HG LEU A 83 5.244 -4.496 -8.275 1.00 0.00 H new ATOM 0 HD11 LEU A 83 7.593 -4.547 -8.854 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.268 -4.350 -7.116 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.814 -5.922 -7.747 1.00 0.00 H new ATOM 0 HD21 LEU A 83 6.014 -5.682 -10.317 1.00 0.00 H new ATOM 0 HD22 LEU A 83 5.950 -7.216 -9.418 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.459 -6.285 -9.696 1.00 0.00 H new ATOM 1320 N TYR A 84 3.719 -8.119 -5.066 1.00 0.00 N ATOM 1321 CA TYR A 84 3.013 -8.751 -3.891 1.00 0.00 C ATOM 1322 C TYR A 84 3.638 -10.142 -3.634 1.00 0.00 C ATOM 1323 O TYR A 84 4.469 -10.335 -2.724 1.00 0.00 O ATOM 1324 CB TYR A 84 1.526 -8.837 -4.175 1.00 0.00 C ATOM 1325 CG TYR A 84 0.567 -8.936 -2.983 1.00 0.00 C ATOM 1326 CD1 TYR A 84 0.603 -7.954 -1.984 1.00 0.00 C ATOM 1327 CD2 TYR A 84 -0.329 -10.016 -2.916 1.00 0.00 C ATOM 1328 CE1 TYR A 84 -0.013 -8.273 -0.747 1.00 0.00 C ATOM 1329 CE2 TYR A 84 -1.222 -10.102 -1.843 1.00 0.00 C ATOM 1330 CZ TYR A 84 -1.003 -9.268 -0.737 1.00 0.00 C ATOM 1331 OH TYR A 84 -1.780 -9.407 0.350 1.00 0.00 O ATOM 0 H TYR A 84 3.070 -7.809 -5.790 1.00 0.00 H new ATOM 0 HA TYR A 84 3.135 -8.147 -2.992 1.00 0.00 H new ATOM 0 HB2 TYR A 84 1.246 -7.958 -4.756 1.00 0.00 H new ATOM 0 HB3 TYR A 84 1.358 -9.706 -4.811 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.078 -6.998 -2.148 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.328 -10.773 -3.686 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.272 -7.764 0.162 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -2.055 -10.790 -1.865 1.00 0.00 H new ATOM 0 HH TYR A 84 -1.222 -9.385 1.156 1.00 0.00 H new ATOM 1341 N GLY A 85 3.215 -11.110 -4.464 1.00 0.00 N ATOM 1342 CA GLY A 85 3.336 -12.550 -4.226 1.00 0.00 C ATOM 1343 C GLY A 85 4.658 -13.157 -4.649 1.00 0.00 C ATOM 1344 O GLY A 85 4.937 -14.342 -4.477 1.00 0.00 O ATOM 0 H GLY A 85 2.762 -10.898 -5.353 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.188 -12.742 -3.163 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.532 -13.060 -4.757 1.00 0.00 H new ATOM 1348 N LYS A 86 5.498 -12.296 -5.339 1.00 0.00 N ATOM 1349 CA LYS A 86 6.946 -12.520 -5.393 1.00 0.00 C ATOM 1350 C LYS A 86 7.746 -11.479 -4.557 1.00 0.00 C ATOM 1351 O LYS A 86 8.937 -11.319 -4.699 1.00 0.00 O ATOM 1352 CB LYS A 86 7.467 -12.526 -6.834 1.00 0.00 C ATOM 1353 CG LYS A 86 6.641 -13.412 -7.754 1.00 0.00 C ATOM 1354 CD LYS A 86 7.425 -14.635 -8.298 1.00 0.00 C ATOM 1355 CE LYS A 86 6.361 -15.743 -8.607 1.00 0.00 C ATOM 1356 NZ LYS A 86 7.077 -16.970 -9.038 1.00 0.00 N ATOM 0 H LYS A 86 5.179 -11.469 -5.844 1.00 0.00 H new ATOM 0 HA LYS A 86 7.107 -13.504 -4.952 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.466 -11.507 -7.221 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.502 -12.868 -6.840 1.00 0.00 H new ATOM 0 HG2 LYS A 86 5.762 -13.764 -7.214 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.282 -12.817 -8.594 1.00 0.00 H new ATOM 0 HD2 LYS A 86 7.982 -14.370 -9.197 1.00 0.00 H new ATOM 0 HD3 LYS A 86 8.151 -14.988 -7.565 1.00 0.00 H new ATOM 0 HE2 LYS A 86 5.757 -15.947 -7.723 1.00 0.00 H new ATOM 0 HE3 LYS A 86 5.679 -15.407 -9.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 6.387 -17.719 -9.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.635 -16.765 -9.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 7.711 -17.287 -8.277 1.00 0.00 H new ATOM 1370 N VAL A 87 6.963 -10.772 -3.665 1.00 0.00 N ATOM 1371 CA VAL A 87 7.517 -10.181 -2.452 1.00 0.00 C ATOM 1372 C VAL A 87 8.785 -9.366 -2.791 1.00 0.00 C ATOM 1373 O VAL A 87 9.911 -9.712 -2.457 1.00 0.00 O ATOM 1374 CB VAL A 87 7.687 -11.220 -1.342 1.00 0.00 C ATOM 1375 CG1 VAL A 87 8.459 -10.544 -0.097 1.00 0.00 C ATOM 1376 CG2 VAL A 87 6.302 -11.694 -0.793 1.00 0.00 C ATOM 0 H VAL A 87 5.963 -10.616 -3.788 1.00 0.00 H new ATOM 0 HA VAL A 87 6.808 -9.466 -2.034 1.00 0.00 H new ATOM 0 HB VAL A 87 8.236 -12.062 -1.763 1.00 0.00 H new ATOM 0 HG11 VAL A 87 8.583 -11.280 0.697 1.00 0.00 H new ATOM 0 HG12 VAL A 87 9.438 -10.194 -0.423 1.00 0.00 H new ATOM 0 HG13 VAL A 87 7.878 -9.701 0.277 1.00 0.00 H new ATOM 0 HG21 VAL A 87 6.456 -12.432 -0.006 1.00 0.00 H new ATOM 0 HG22 VAL A 87 5.759 -10.840 -0.389 1.00 0.00 H new ATOM 0 HG23 VAL A 87 5.724 -12.141 -1.602 1.00 0.00 H new ATOM 1386 N ASP A 88 8.564 -8.246 -3.559 1.00 0.00 N ATOM 1387 CA ASP A 88 9.453 -7.091 -3.676 1.00 0.00 C ATOM 1388 C ASP A 88 8.850 -5.833 -3.019 1.00 0.00 C ATOM 1389 O ASP A 88 7.645 -5.550 -3.176 1.00 0.00 O ATOM 1390 CB ASP A 88 9.715 -6.811 -5.179 1.00 0.00 C ATOM 1391 CG ASP A 88 11.221 -6.764 -5.527 1.00 0.00 C ATOM 1392 OD1 ASP A 88 12.016 -6.300 -4.713 1.00 0.00 O ATOM 1393 OD2 ASP A 88 11.487 -7.225 -6.693 1.00 0.00 O ATOM 0 H ASP A 88 7.722 -8.144 -4.126 1.00 0.00 H new ATOM 0 HA ASP A 88 10.383 -7.322 -3.157 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.233 -7.584 -5.777 1.00 0.00 H new ATOM 0 HB3 ASP A 88 9.254 -5.862 -5.453 1.00 0.00 H new ATOM 1398 N GLY A 89 9.647 -5.187 -2.152 1.00 0.00 N ATOM 1399 CA GLY A 89 9.380 -3.859 -1.569 1.00 0.00 C ATOM 1400 C GLY A 89 9.627 -2.706 -2.570 1.00 0.00 C ATOM 1401 O GLY A 89 8.796 -1.790 -2.709 1.00 0.00 O ATOM 0 H GLY A 89 10.526 -5.588 -1.825 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.347 -3.820 -1.224 1.00 0.00 H new ATOM 0 HA3 GLY A 89 10.014 -3.717 -0.694 1.00 0.00 H new ATOM 1405 N LEU A 90 10.792 -2.776 -3.253 1.00 0.00 N ATOM 1406 CA LEU A 90 11.470 -1.670 -3.950 1.00 0.00 C ATOM 1407 C LEU A 90 10.601 -1.177 -5.126 1.00 0.00 C ATOM 1408 O LEU A 90 10.463 0.030 -5.322 1.00 0.00 O ATOM 1409 CB LEU A 90 12.770 -2.323 -4.521 1.00 0.00 C ATOM 1410 CG LEU A 90 13.483 -1.472 -5.628 1.00 0.00 C ATOM 1411 CD1 LEU A 90 13.782 -0.024 -5.202 1.00 0.00 C ATOM 1412 CD2 LEU A 90 14.680 -2.182 -6.255 1.00 0.00 C ATOM 0 H LEU A 90 11.308 -3.652 -3.334 1.00 0.00 H new ATOM 0 HA LEU A 90 11.662 -0.820 -3.295 1.00 0.00 H new ATOM 0 HB2 LEU A 90 13.469 -2.492 -3.702 1.00 0.00 H new ATOM 0 HB3 LEU A 90 12.521 -3.301 -4.934 1.00 0.00 H new ATOM 0 HG LEU A 90 12.750 -1.378 -6.429 1.00 0.00 H new ATOM 0 HD11 LEU A 90 14.275 0.501 -6.020 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.849 0.483 -4.956 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.434 -0.029 -4.328 1.00 0.00 H new ATOM 0 HD21 LEU A 90 15.128 -1.539 -7.013 1.00 0.00 H new ATOM 0 HD22 LEU A 90 15.418 -2.402 -5.483 1.00 0.00 H new ATOM 0 HD23 LEU A 90 14.350 -3.112 -6.717 1.00 0.00 H new ATOM 1424 N GLY A 91 10.078 -2.134 -5.940 1.00 0.00 N ATOM 1425 CA GLY A 91 8.933 -1.878 -6.844 1.00 0.00 C ATOM 1426 C GLY A 91 7.784 -1.148 -6.152 1.00 0.00 C ATOM 1427 O GLY A 91 7.321 -0.092 -6.618 1.00 0.00 O ATOM 0 H GLY A 91 10.435 -3.089 -5.985 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.273 -1.287 -7.695 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.569 -2.826 -7.239 1.00 0.00 H new ATOM 1431 N VAL A 92 7.292 -1.711 -5.018 1.00 0.00 N ATOM 1432 CA VAL A 92 6.114 -1.317 -4.270 1.00 0.00 C ATOM 1433 C VAL A 92 6.233 -0.080 -3.488 1.00 0.00 C ATOM 1434 O VAL A 92 5.225 0.651 -3.172 1.00 0.00 O ATOM 1435 CB VAL A 92 5.522 -2.586 -3.574 1.00 0.00 C ATOM 1436 CG1 VAL A 92 5.639 -3.869 -4.489 1.00 0.00 C ATOM 1437 CG2 VAL A 92 6.150 -2.887 -2.195 1.00 0.00 C ATOM 0 H VAL A 92 7.758 -2.510 -4.588 1.00 0.00 H new ATOM 0 HA VAL A 92 5.348 -0.959 -4.957 1.00 0.00 H new ATOM 0 HB VAL A 92 4.471 -2.347 -3.413 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.216 -4.728 -3.967 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.094 -3.704 -5.418 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.688 -4.061 -4.713 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.690 -3.781 -1.773 1.00 0.00 H new ATOM 0 HG22 VAL A 92 7.221 -3.051 -2.311 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.982 -2.042 -1.527 1.00 0.00 H new ATOM 1447 N LEU A 93 7.457 0.302 -3.031 1.00 0.00 N ATOM 1448 CA LEU A 93 7.818 1.608 -2.524 1.00 0.00 C ATOM 1449 C LEU A 93 7.854 2.652 -3.650 1.00 0.00 C ATOM 1450 O LEU A 93 7.240 3.714 -3.482 1.00 0.00 O ATOM 1451 CB LEU A 93 9.203 1.458 -1.850 1.00 0.00 C ATOM 1452 CG LEU A 93 9.517 2.330 -0.627 1.00 0.00 C ATOM 1453 CD1 LEU A 93 8.409 2.342 0.443 1.00 0.00 C ATOM 1454 CD2 LEU A 93 10.919 2.001 -0.051 1.00 0.00 C ATOM 0 H LEU A 93 8.245 -0.346 -3.016 1.00 0.00 H new ATOM 0 HA LEU A 93 7.078 1.962 -1.807 1.00 0.00 H new ATOM 0 HB2 LEU A 93 9.316 0.416 -1.553 1.00 0.00 H new ATOM 0 HB3 LEU A 93 9.963 1.659 -2.605 1.00 0.00 H new ATOM 0 HG LEU A 93 9.544 3.359 -0.985 1.00 0.00 H new ATOM 0 HD11 LEU A 93 8.711 2.982 1.272 1.00 0.00 H new ATOM 0 HD12 LEU A 93 7.486 2.725 0.007 1.00 0.00 H new ATOM 0 HD13 LEU A 93 8.245 1.328 0.808 1.00 0.00 H new ATOM 0 HD21 LEU A 93 11.114 2.634 0.815 1.00 0.00 H new ATOM 0 HD22 LEU A 93 10.952 0.954 0.250 1.00 0.00 H new ATOM 0 HD23 LEU A 93 11.677 2.184 -0.813 1.00 0.00 H new ATOM 1466 N LYS A 94 8.592 2.374 -4.755 1.00 0.00 N ATOM 1467 CA LYS A 94 8.730 3.332 -5.879 1.00 0.00 C ATOM 1468 C LYS A 94 7.545 3.269 -6.859 1.00 0.00 C ATOM 1469 O LYS A 94 7.486 4.060 -7.816 1.00 0.00 O ATOM 1470 CB LYS A 94 10.073 3.209 -6.587 1.00 0.00 C ATOM 1471 CG LYS A 94 11.214 3.839 -5.767 1.00 0.00 C ATOM 1472 CD LYS A 94 12.240 4.652 -6.594 1.00 0.00 C ATOM 1473 CE LYS A 94 12.502 3.920 -7.913 1.00 0.00 C ATOM 1474 NZ LYS A 94 13.918 4.038 -8.322 1.00 0.00 N ATOM 0 H LYS A 94 9.098 1.499 -4.890 1.00 0.00 H new ATOM 0 HA LYS A 94 8.706 4.327 -5.434 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.293 2.157 -6.767 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.016 3.694 -7.561 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.780 4.492 -5.010 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.742 3.046 -5.238 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.859 5.654 -6.788 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.169 4.767 -6.035 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.239 2.868 -7.806 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.861 4.331 -8.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 14.064 3.532 -9.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.161 5.041 -8.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.527 3.624 -7.588 1.00 0.00 H new ATOM 1488 N ALA A 95 6.622 2.311 -6.623 1.00 0.00 N ATOM 1489 CA ALA A 95 5.357 2.153 -7.348 1.00 0.00 C ATOM 1490 C ALA A 95 4.228 2.992 -6.740 1.00 0.00 C ATOM 1491 O ALA A 95 3.460 3.638 -7.460 1.00 0.00 O ATOM 1492 CB ALA A 95 4.947 0.678 -7.464 1.00 0.00 C ATOM 0 H ALA A 95 6.748 1.606 -5.897 1.00 0.00 H new ATOM 0 HA ALA A 95 5.531 2.530 -8.356 1.00 0.00 H new ATOM 0 HB1 ALA A 95 4.005 0.604 -8.007 1.00 0.00 H new ATOM 0 HB2 ALA A 95 5.720 0.127 -8.000 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.825 0.255 -6.467 1.00 0.00 H new ATOM 1498 N ALA A 96 4.138 2.924 -5.388 1.00 0.00 N ATOM 1499 CA ALA A 96 3.229 3.786 -4.568 1.00 0.00 C ATOM 1500 C ALA A 96 3.578 5.261 -4.748 1.00 0.00 C ATOM 1501 O ALA A 96 2.730 6.107 -5.043 1.00 0.00 O ATOM 1502 CB ALA A 96 3.306 3.375 -3.099 1.00 0.00 C ATOM 0 H ALA A 96 4.690 2.273 -4.830 1.00 0.00 H new ATOM 0 HA ALA A 96 2.204 3.645 -4.911 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.642 4.007 -2.509 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.002 2.333 -2.996 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.329 3.491 -2.742 1.00 0.00 H new ATOM 1508 N VAL A 97 4.883 5.590 -4.545 1.00 0.00 N ATOM 1509 CA VAL A 97 5.431 6.933 -4.776 1.00 0.00 C ATOM 1510 C VAL A 97 4.991 7.442 -6.177 1.00 0.00 C ATOM 1511 O VAL A 97 4.543 8.602 -6.313 1.00 0.00 O ATOM 1512 CB VAL A 97 6.936 6.961 -4.559 1.00 0.00 C ATOM 1513 CG1 VAL A 97 7.735 7.851 -5.559 1.00 0.00 C ATOM 1514 CG2 VAL A 97 7.319 7.328 -3.112 1.00 0.00 C ATOM 0 H VAL A 97 5.578 4.920 -4.215 1.00 0.00 H new ATOM 0 HA VAL A 97 5.024 7.627 -4.041 1.00 0.00 H new ATOM 0 HB VAL A 97 7.234 5.932 -4.760 1.00 0.00 H new ATOM 0 HG11 VAL A 97 8.797 7.803 -5.320 1.00 0.00 H new ATOM 0 HG12 VAL A 97 7.575 7.490 -6.575 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.392 8.883 -5.482 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.404 7.333 -3.013 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.928 8.317 -2.872 1.00 0.00 H new ATOM 0 HG23 VAL A 97 6.896 6.594 -2.426 1.00 0.00 H new ATOM 1524 N ALA A 98 5.211 6.639 -7.212 1.00 0.00 N ATOM 1525 CA ALA A 98 4.784 6.865 -8.604 1.00 0.00 C ATOM 1526 C ALA A 98 3.302 7.350 -8.649 1.00 0.00 C ATOM 1527 O ALA A 98 2.943 8.227 -9.395 1.00 0.00 O ATOM 1528 CB ALA A 98 4.926 5.597 -9.440 1.00 0.00 C ATOM 0 H ALA A 98 5.720 5.762 -7.105 1.00 0.00 H new ATOM 0 HA ALA A 98 5.432 7.634 -9.024 1.00 0.00 H new ATOM 0 HB1 ALA A 98 4.603 5.797 -10.462 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.969 5.279 -9.445 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.308 4.808 -9.012 1.00 0.00 H new ATOM 1534 N ALA A 99 2.482 6.670 -7.806 1.00 0.00 N ATOM 1535 CA ALA A 99 1.029 6.870 -7.744 1.00 0.00 C ATOM 1536 C ALA A 99 0.659 8.296 -7.333 1.00 0.00 C ATOM 1537 O ALA A 99 -0.207 8.957 -7.885 1.00 0.00 O ATOM 1538 CB ALA A 99 0.407 5.881 -6.713 1.00 0.00 C ATOM 0 H ALA A 99 2.822 5.966 -7.151 1.00 0.00 H new ATOM 0 HA ALA A 99 0.636 6.688 -8.744 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.672 6.032 -6.669 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.618 4.856 -7.019 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.839 6.062 -5.729 1.00 0.00 H new ATOM 1544 N ILE A 100 1.323 8.782 -6.241 1.00 0.00 N ATOM 1545 CA ILE A 100 1.173 10.091 -5.603 1.00 0.00 C ATOM 1546 C ILE A 100 1.949 11.169 -6.362 1.00 0.00 C ATOM 1547 O ILE A 100 2.000 12.336 -5.944 1.00 0.00 O ATOM 1548 CB ILE A 100 1.442 10.040 -4.071 1.00 0.00 C ATOM 1549 CG1 ILE A 100 2.209 11.314 -3.581 1.00 0.00 C ATOM 1550 CG2 ILE A 100 2.171 8.756 -3.619 1.00 0.00 C ATOM 1551 CD1 ILE A 100 2.374 11.484 -2.085 1.00 0.00 C ATOM 0 H ILE A 100 2.023 8.214 -5.763 1.00 0.00 H new ATOM 0 HA ILE A 100 0.127 10.388 -5.673 1.00 0.00 H new ATOM 0 HB ILE A 100 0.459 10.021 -3.599 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.201 11.307 -4.033 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.690 12.191 -3.966 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.326 8.786 -2.541 1.00 0.00 H new ATOM 0 HG22 ILE A 100 1.567 7.885 -3.874 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.135 8.689 -4.123 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.922 12.404 -1.882 1.00 0.00 H new ATOM 0 HD12 ILE A 100 1.392 11.534 -1.614 1.00 0.00 H new ATOM 0 HD13 ILE A 100 2.927 10.636 -1.681 1.00 0.00 H new ATOM 1563 N LYS A 101 2.599 10.748 -7.456 1.00 0.00 N ATOM 1564 CA LYS A 101 3.092 11.688 -8.514 1.00 0.00 C ATOM 1565 C LYS A 101 1.947 12.161 -9.418 1.00 0.00 C ATOM 1566 O LYS A 101 1.777 13.378 -9.628 1.00 0.00 O ATOM 1567 CB LYS A 101 4.214 11.068 -9.329 1.00 0.00 C ATOM 1568 CG LYS A 101 5.025 12.138 -10.089 1.00 0.00 C ATOM 1569 CD LYS A 101 4.368 12.645 -11.395 1.00 0.00 C ATOM 1570 CE LYS A 101 4.525 11.579 -12.482 1.00 0.00 C ATOM 1571 NZ LYS A 101 3.596 11.819 -13.604 1.00 0.00 N ATOM 0 H LYS A 101 2.803 9.767 -7.646 1.00 0.00 H new ATOM 0 HA LYS A 101 3.498 12.564 -8.008 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.877 10.509 -8.669 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.796 10.355 -10.040 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.188 12.988 -9.427 1.00 0.00 H new ATOM 0 HG3 LYS A 101 6.006 11.728 -10.328 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.312 12.858 -11.227 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.834 13.578 -11.713 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.551 11.579 -12.850 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.339 10.593 -12.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 3.725 11.081 -14.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 2.617 11.795 -13.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 3.791 12.751 -14.023 1.00 0.00 H new ATOM 1585 N LYS A 102 1.239 11.178 -10.015 1.00 0.00 N ATOM 1586 CA LYS A 102 -0.005 11.462 -10.810 1.00 0.00 C ATOM 1587 C LYS A 102 -0.958 12.377 -10.035 1.00 0.00 C ATOM 1588 O LYS A 102 -1.691 13.190 -10.624 1.00 0.00 O ATOM 1589 CB LYS A 102 -0.669 10.166 -11.236 1.00 0.00 C ATOM 1590 CG LYS A 102 -1.708 9.686 -10.215 1.00 0.00 C ATOM 1591 CD LYS A 102 -3.174 10.007 -10.609 1.00 0.00 C ATOM 1592 CE LYS A 102 -3.864 10.652 -9.409 1.00 0.00 C ATOM 1593 NZ LYS A 102 -5.336 10.552 -9.534 1.00 0.00 N ATOM 0 H LYS A 102 1.491 10.191 -9.971 1.00 0.00 H new ATOM 0 HA LYS A 102 0.275 11.998 -11.717 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.151 10.307 -12.203 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.091 9.396 -11.368 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.605 8.609 -10.086 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.493 10.145 -9.250 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -3.198 10.679 -11.467 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -3.696 9.096 -10.903 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -3.538 10.164 -8.491 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -3.571 11.699 -9.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -5.786 10.996 -8.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -5.645 11.038 -10.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -5.613 9.551 -9.582 1.00 0.00 H new ATOM 1607 N ALA A 103 -0.955 12.215 -8.690 1.00 0.00 N ATOM 1608 CA ALA A 103 -1.649 13.051 -7.722 1.00 0.00 C ATOM 1609 C ALA A 103 -1.553 14.549 -8.045 1.00 0.00 C ATOM 1610 O ALA A 103 -2.471 15.134 -8.613 1.00 0.00 O ATOM 1611 CB ALA A 103 -1.199 12.769 -6.285 1.00 0.00 C ATOM 0 H ALA A 103 -0.439 11.456 -8.245 1.00 0.00 H new ATOM 0 HA ALA A 103 -2.701 12.777 -7.801 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.745 13.417 -5.599 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.401 11.727 -6.038 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -0.130 12.962 -6.194 1.00 0.00 H new ATOM 1617 N ALA A 104 -0.442 15.173 -7.612 1.00 0.00 N ATOM 1618 CA ALA A 104 -0.223 16.612 -7.531 1.00 0.00 C ATOM 1619 C ALA A 104 0.447 17.196 -8.785 1.00 0.00 C ATOM 1620 O ALA A 104 1.456 16.655 -9.260 1.00 0.00 O ATOM 1621 CB ALA A 104 0.579 16.980 -6.274 1.00 0.00 C ATOM 0 H ALA A 104 0.370 14.646 -7.292 1.00 0.00 H new ATOM 0 HA ALA A 104 -1.213 17.063 -7.466 1.00 0.00 H new ATOM 0 HB1 ALA A 104 0.727 18.059 -6.240 1.00 0.00 H new ATOM 0 HB2 ALA A 104 0.032 16.661 -5.387 1.00 0.00 H new ATOM 0 HB3 ALA A 104 1.548 16.481 -6.302 1.00 0.00 H new ATOM 1627 N ALA A 105 -0.112 18.292 -9.322 1.00 0.00 N ATOM 1628 CA ALA A 105 0.552 19.232 -10.240 1.00 0.00 C ATOM 1629 C ALA A 105 1.097 18.485 -11.488 1.00 0.00 C ATOM 1630 O ALA A 105 0.497 18.529 -12.562 1.00 0.00 O ATOM 1631 CB ALA A 105 1.707 19.961 -9.556 1.00 0.00 C ATOM 0 H ALA A 105 -1.076 18.558 -9.121 1.00 0.00 H new ATOM 0 HA ALA A 105 -0.196 19.964 -10.545 1.00 0.00 H new ATOM 0 HB1 ALA A 105 2.174 20.647 -10.263 1.00 0.00 H new ATOM 0 HB2 ALA A 105 1.328 20.523 -8.702 1.00 0.00 H new ATOM 0 HB3 ALA A 105 2.444 19.235 -9.214 1.00 0.00 H new ATOM 1637 N ASN A 106 2.269 17.847 -11.307 1.00 0.00 N ATOM 1638 CA ASN A 106 3.134 17.315 -12.380 1.00 0.00 C ATOM 1639 C ASN A 106 2.299 16.441 -13.354 1.00 0.00 C ATOM 1640 O ASN A 106 1.192 15.994 -12.964 1.00 0.00 O ATOM 1641 CB ASN A 106 4.293 16.496 -11.760 1.00 0.00 C ATOM 1642 CG ASN A 106 5.640 17.261 -11.763 1.00 0.00 C ATOM 1643 OD1 ASN A 106 6.275 17.529 -10.739 1.00 0.00 O ATOM 1644 ND2 ASN A 106 6.082 17.675 -12.966 1.00 0.00 N ATOM 0 H ASN A 106 2.654 17.681 -10.377 1.00 0.00 H new ATOM 0 HA ASN A 106 3.559 18.144 -12.946 1.00 0.00 H new ATOM 0 HB2 ASN A 106 4.035 16.229 -10.735 1.00 0.00 H new ATOM 0 HB3 ASN A 106 4.409 15.564 -12.313 1.00 0.00 H new ATOM 0 HD21 ASN A 106 6.946 18.213 -13.034 1.00 0.00 H new ATOM 0 HD22 ASN A 106 5.553 17.450 -13.809 1.00 0.00 H new TER 1651 ASN A 106