USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 734 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 25 TYR OH : rot -63:sc= 1.17 USER MOD Set 1.2: A 69 LYS NZ :NH3+ -167:sc= 0.873 (180deg=-0.175) USER MOD Single : A 1 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 1 GLN N :NH3+ -171:sc= 0.167 (180deg=-0.113) USER MOD Single : A 3 HIS : no HD1:sc= -0.0557 X(o=-0.056,f=-0.075) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 CYS SG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 174:sc= 0 (180deg=-0.0783) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ -140:sc= -0.0113 (180deg=-0.243) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 37:sc= 0.248 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -168:sc= -0.0127 (180deg=-0.184) USER MOD Single : A 35 THR OG1 : rot 180:sc=-0.00695 USER MOD Single : A 42 LYS NZ :NH3+ 164:sc= -0.149 (180deg=-0.556) USER MOD Single : A 43 LYS NZ :NH3+ -170:sc=-0.00959 (180deg=-0.128) USER MOD Single : A 44 SER OG : rot -179:sc= 0.32 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -179:sc=-0.00326 (180deg=-0.0043) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 165:sc= -1.35 (180deg=-1.58) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 143:sc= 1.12 (180deg=-0.801) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 10.369 -7.947 0.323 1.00 0.00 N ATOM 2 CA GLN A 1 9.861 -7.408 1.593 1.00 0.00 C ATOM 3 C GLN A 1 10.177 -5.911 1.654 1.00 0.00 C ATOM 4 O GLN A 1 11.351 -5.525 1.648 1.00 0.00 O ATOM 5 CB GLN A 1 10.496 -8.152 2.789 1.00 0.00 C ATOM 6 CG GLN A 1 10.268 -9.680 2.798 1.00 0.00 C ATOM 7 CD GLN A 1 10.877 -10.383 4.013 1.00 0.00 C ATOM 8 OE1 GLN A 1 10.975 -9.815 5.101 1.00 0.00 O ATOM 9 NE2 GLN A 1 11.302 -11.624 3.833 1.00 0.00 N ATOM 0 H1 GLN A 1 10.030 -8.922 0.199 1.00 0.00 H new ATOM 0 H2 GLN A 1 10.028 -7.359 -0.465 1.00 0.00 H new ATOM 0 H3 GLN A 1 11.409 -7.941 0.335 1.00 0.00 H new ATOM 0 HA GLN A 1 8.782 -7.553 1.649 1.00 0.00 H new ATOM 0 HB2 GLN A 1 11.569 -7.959 2.790 1.00 0.00 H new ATOM 0 HB3 GLN A 1 10.096 -7.734 3.713 1.00 0.00 H new ATOM 0 HG2 GLN A 1 9.197 -9.879 2.773 1.00 0.00 H new ATOM 0 HG3 GLN A 1 10.693 -10.108 1.890 1.00 0.00 H new ATOM 0 HE21 GLN A 1 11.207 -12.068 2.920 1.00 0.00 H new ATOM 0 HE22 GLN A 1 11.724 -12.136 4.608 1.00 0.00 H new ATOM 20 N GLY A 2 9.119 -5.081 1.707 1.00 0.00 N ATOM 21 CA GLY A 2 9.256 -3.625 1.657 1.00 0.00 C ATOM 22 C GLY A 2 9.410 -3.140 0.223 1.00 0.00 C ATOM 23 O GLY A 2 8.477 -3.291 -0.569 1.00 0.00 O ATOM 0 H GLY A 2 8.155 -5.404 1.785 1.00 0.00 H new ATOM 0 HA2 GLY A 2 8.382 -3.158 2.110 1.00 0.00 H new ATOM 0 HA3 GLY A 2 10.122 -3.317 2.244 1.00 0.00 H new ATOM 27 N HIS A 3 10.597 -2.595 -0.120 1.00 0.00 N ATOM 28 CA HIS A 3 10.901 -2.113 -1.484 1.00 0.00 C ATOM 29 C HIS A 3 12.437 -2.031 -1.714 1.00 0.00 C ATOM 30 O HIS A 3 12.894 -1.670 -2.807 1.00 0.00 O ATOM 31 CB HIS A 3 10.202 -0.738 -1.730 1.00 0.00 C ATOM 32 CG HIS A 3 10.275 -0.233 -3.156 1.00 0.00 C ATOM 33 ND1 HIS A 3 9.925 -1.005 -4.247 1.00 0.00 N ATOM 34 CD2 HIS A 3 10.688 0.954 -3.666 1.00 0.00 C ATOM 35 CE1 HIS A 3 10.120 -0.322 -5.352 1.00 0.00 C ATOM 36 NE2 HIS A 3 10.579 0.870 -5.031 1.00 0.00 N ATOM 0 H HIS A 3 11.368 -2.477 0.538 1.00 0.00 H new ATOM 0 HA HIS A 3 10.508 -2.826 -2.209 1.00 0.00 H new ATOM 0 HB2 HIS A 3 9.154 -0.823 -1.443 1.00 0.00 H new ATOM 0 HB3 HIS A 3 10.653 0.005 -1.073 1.00 0.00 H new ATOM 0 HD2 HIS A 3 11.038 1.806 -3.103 1.00 0.00 H new ATOM 0 HE1 HIS A 3 9.935 -0.678 -6.355 1.00 0.00 H new ATOM 0 HE2 HIS A 3 10.815 1.611 -5.691 1.00 0.00 H new ATOM 45 N MET A 4 13.235 -2.381 -0.681 1.00 0.00 N ATOM 46 CA MET A 4 14.710 -2.384 -0.769 1.00 0.00 C ATOM 47 C MET A 4 15.188 -3.750 -1.278 1.00 0.00 C ATOM 48 O MET A 4 15.758 -3.847 -2.373 1.00 0.00 O ATOM 49 CB MET A 4 15.353 -2.054 0.613 1.00 0.00 C ATOM 50 CG MET A 4 14.928 -0.700 1.204 1.00 0.00 C ATOM 51 SD MET A 4 15.664 -0.394 2.827 1.00 0.00 S ATOM 52 CE MET A 4 14.949 1.195 3.253 1.00 0.00 C ATOM 0 H MET A 4 12.877 -2.667 0.230 1.00 0.00 H new ATOM 0 HA MET A 4 15.023 -1.611 -1.470 1.00 0.00 H new ATOM 0 HB2 MET A 4 15.092 -2.843 1.319 1.00 0.00 H new ATOM 0 HB3 MET A 4 16.438 -2.066 0.508 1.00 0.00 H new ATOM 0 HG2 MET A 4 15.217 0.098 0.521 1.00 0.00 H new ATOM 0 HG3 MET A 4 13.842 -0.669 1.289 1.00 0.00 H new ATOM 0 HE1 MET A 4 15.315 1.508 4.231 1.00 0.00 H new ATOM 0 HE2 MET A 4 15.234 1.935 2.505 1.00 0.00 H new ATOM 0 HE3 MET A 4 13.863 1.109 3.283 1.00 0.00 H new ATOM 62 N ASP A 5 14.951 -4.801 -0.447 1.00 0.00 N ATOM 63 CA ASP A 5 15.308 -6.208 -0.752 1.00 0.00 C ATOM 64 C ASP A 5 16.825 -6.407 -0.987 1.00 0.00 C ATOM 65 O ASP A 5 17.244 -7.421 -1.532 1.00 0.00 O ATOM 66 CB ASP A 5 14.451 -6.759 -1.943 1.00 0.00 C ATOM 67 CG ASP A 5 12.983 -7.023 -1.544 1.00 0.00 C ATOM 68 OD1 ASP A 5 12.206 -6.055 -1.374 1.00 0.00 O ATOM 69 OD2 ASP A 5 12.605 -8.207 -1.377 1.00 0.00 O ATOM 0 H ASP A 5 14.502 -4.691 0.462 1.00 0.00 H new ATOM 0 HA ASP A 5 15.066 -6.796 0.134 1.00 0.00 H new ATOM 0 HB2 ASP A 5 14.477 -6.045 -2.766 1.00 0.00 H new ATOM 0 HB3 ASP A 5 14.896 -7.684 -2.309 1.00 0.00 H new ATOM 74 N LEU A 6 17.640 -5.439 -0.545 1.00 0.00 N ATOM 75 CA LEU A 6 19.114 -5.510 -0.640 1.00 0.00 C ATOM 76 C LEU A 6 19.698 -6.171 0.627 1.00 0.00 C ATOM 77 O LEU A 6 20.771 -6.792 0.596 1.00 0.00 O ATOM 78 CB LEU A 6 19.692 -4.077 -0.827 1.00 0.00 C ATOM 79 CG LEU A 6 19.157 -3.273 -2.067 1.00 0.00 C ATOM 80 CD1 LEU A 6 19.744 -1.841 -2.110 1.00 0.00 C ATOM 81 CD2 LEU A 6 19.419 -4.029 -3.397 1.00 0.00 C ATOM 0 H LEU A 6 17.300 -4.581 -0.110 1.00 0.00 H new ATOM 0 HA LEU A 6 19.392 -6.118 -1.501 1.00 0.00 H new ATOM 0 HB2 LEU A 6 19.479 -3.501 0.073 1.00 0.00 H new ATOM 0 HB3 LEU A 6 20.776 -4.152 -0.908 1.00 0.00 H new ATOM 0 HG LEU A 6 18.077 -3.183 -1.951 1.00 0.00 H new ATOM 0 HD11 LEU A 6 19.353 -1.313 -2.980 1.00 0.00 H new ATOM 0 HD12 LEU A 6 19.462 -1.305 -1.204 1.00 0.00 H new ATOM 0 HD13 LEU A 6 20.831 -1.895 -2.177 1.00 0.00 H new ATOM 0 HD21 LEU A 6 19.035 -3.442 -4.231 1.00 0.00 H new ATOM 0 HD22 LEU A 6 20.491 -4.182 -3.524 1.00 0.00 H new ATOM 0 HD23 LEU A 6 18.915 -4.995 -3.372 1.00 0.00 H new ATOM 93 N ILE A 7 18.966 -6.019 1.740 1.00 0.00 N ATOM 94 CA ILE A 7 19.378 -6.484 3.074 1.00 0.00 C ATOM 95 C ILE A 7 18.493 -7.650 3.557 1.00 0.00 C ATOM 96 O ILE A 7 17.558 -8.066 2.857 1.00 0.00 O ATOM 97 CB ILE A 7 19.342 -5.290 4.103 1.00 0.00 C ATOM 98 CG1 ILE A 7 17.889 -4.705 4.237 1.00 0.00 C ATOM 99 CG2 ILE A 7 20.359 -4.188 3.694 1.00 0.00 C ATOM 100 CD1 ILE A 7 17.744 -3.585 5.253 1.00 0.00 C ATOM 0 H ILE A 7 18.054 -5.561 1.739 1.00 0.00 H new ATOM 0 HA ILE A 7 20.401 -6.854 3.005 1.00 0.00 H new ATOM 0 HB ILE A 7 19.633 -5.672 5.082 1.00 0.00 H new ATOM 0 HG12 ILE A 7 17.570 -4.336 3.262 1.00 0.00 H new ATOM 0 HG13 ILE A 7 17.211 -5.514 4.509 1.00 0.00 H new ATOM 0 HG21 ILE A 7 20.321 -3.372 4.415 1.00 0.00 H new ATOM 0 HG22 ILE A 7 21.364 -4.609 3.676 1.00 0.00 H new ATOM 0 HG23 ILE A 7 20.106 -3.809 2.704 1.00 0.00 H new ATOM 0 HD11 ILE A 7 16.708 -3.246 5.275 1.00 0.00 H new ATOM 0 HD12 ILE A 7 18.027 -3.950 6.240 1.00 0.00 H new ATOM 0 HD13 ILE A 7 18.392 -2.754 4.974 1.00 0.00 H new ATOM 112 N CYS A 8 18.839 -8.179 4.754 1.00 0.00 N ATOM 113 CA CYS A 8 18.148 -9.309 5.428 1.00 0.00 C ATOM 114 C CYS A 8 18.270 -10.656 4.663 1.00 0.00 C ATOM 115 O CYS A 8 17.721 -11.675 5.110 1.00 0.00 O ATOM 116 CB CYS A 8 16.663 -8.958 5.706 1.00 0.00 C ATOM 117 SG CYS A 8 16.420 -7.422 6.640 1.00 0.00 S ATOM 0 H CYS A 8 19.628 -7.823 5.294 1.00 0.00 H new ATOM 0 HA CYS A 8 18.661 -9.457 6.378 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.137 -8.878 4.755 1.00 0.00 H new ATOM 0 HB3 CYS A 8 16.205 -9.780 6.256 1.00 0.00 H new ATOM 0 HG CYS A 8 15.148 -7.218 6.817 1.00 0.00 H new ATOM 123 N MET A 9 19.017 -10.666 3.540 1.00 0.00 N ATOM 124 CA MET A 9 19.168 -11.856 2.680 1.00 0.00 C ATOM 125 C MET A 9 20.402 -12.665 3.100 1.00 0.00 C ATOM 126 O MET A 9 21.425 -12.109 3.517 1.00 0.00 O ATOM 127 CB MET A 9 19.246 -11.459 1.179 1.00 0.00 C ATOM 128 CG MET A 9 17.932 -10.928 0.597 1.00 0.00 C ATOM 129 SD MET A 9 17.994 -10.762 -1.200 1.00 0.00 S ATOM 130 CE MET A 9 16.279 -10.412 -1.588 1.00 0.00 C ATOM 0 H MET A 9 19.531 -9.851 3.205 1.00 0.00 H new ATOM 0 HA MET A 9 18.286 -12.483 2.808 1.00 0.00 H new ATOM 0 HB2 MET A 9 20.017 -10.699 1.056 1.00 0.00 H new ATOM 0 HB3 MET A 9 19.560 -12.328 0.601 1.00 0.00 H new ATOM 0 HG2 MET A 9 17.119 -11.601 0.869 1.00 0.00 H new ATOM 0 HG3 MET A 9 17.706 -9.959 1.041 1.00 0.00 H new ATOM 0 HE1 MET A 9 16.186 -10.181 -2.649 1.00 0.00 H new ATOM 0 HE2 MET A 9 15.667 -11.283 -1.351 1.00 0.00 H new ATOM 0 HE3 MET A 9 15.940 -9.559 -1.000 1.00 0.00 H new ATOM 140 N TYR A 10 20.284 -13.991 2.964 1.00 0.00 N ATOM 141 CA TYR A 10 21.255 -14.954 3.492 1.00 0.00 C ATOM 142 C TYR A 10 22.406 -15.140 2.493 1.00 0.00 C ATOM 143 O TYR A 10 22.220 -15.705 1.410 1.00 0.00 O ATOM 144 CB TYR A 10 20.525 -16.288 3.809 1.00 0.00 C ATOM 145 CG TYR A 10 19.274 -16.069 4.681 1.00 0.00 C ATOM 146 CD1 TYR A 10 19.386 -15.536 5.969 1.00 0.00 C ATOM 147 CD2 TYR A 10 17.990 -16.331 4.197 1.00 0.00 C ATOM 148 CE1 TYR A 10 18.270 -15.287 6.739 1.00 0.00 C ATOM 149 CE2 TYR A 10 16.870 -16.070 4.965 1.00 0.00 C ATOM 150 CZ TYR A 10 17.017 -15.550 6.235 1.00 0.00 C ATOM 151 OH TYR A 10 15.907 -15.276 7.004 1.00 0.00 O ATOM 0 H TYR A 10 19.502 -14.430 2.478 1.00 0.00 H new ATOM 0 HA TYR A 10 21.694 -14.583 4.418 1.00 0.00 H new ATOM 0 HB2 TYR A 10 20.236 -16.774 2.877 1.00 0.00 H new ATOM 0 HB3 TYR A 10 21.210 -16.963 4.321 1.00 0.00 H new ATOM 0 HD1 TYR A 10 20.365 -15.315 6.368 1.00 0.00 H new ATOM 0 HD2 TYR A 10 17.870 -16.744 3.206 1.00 0.00 H new ATOM 0 HE1 TYR A 10 18.379 -14.886 7.736 1.00 0.00 H new ATOM 0 HE2 TYR A 10 15.884 -16.272 4.573 1.00 0.00 H new ATOM 0 HH TYR A 10 15.097 -15.516 6.507 1.00 0.00 H new ATOM 161 N VAL A 11 23.576 -14.611 2.864 1.00 0.00 N ATOM 162 CA VAL A 11 24.769 -14.591 2.017 1.00 0.00 C ATOM 163 C VAL A 11 25.498 -15.948 2.058 1.00 0.00 C ATOM 164 O VAL A 11 25.938 -16.398 3.121 1.00 0.00 O ATOM 165 CB VAL A 11 25.731 -13.426 2.454 1.00 0.00 C ATOM 166 CG1 VAL A 11 27.019 -13.393 1.606 1.00 0.00 C ATOM 167 CG2 VAL A 11 24.996 -12.067 2.395 1.00 0.00 C ATOM 0 H VAL A 11 23.721 -14.178 3.776 1.00 0.00 H new ATOM 0 HA VAL A 11 24.455 -14.412 0.989 1.00 0.00 H new ATOM 0 HB VAL A 11 26.031 -13.616 3.485 1.00 0.00 H new ATOM 0 HG11 VAL A 11 27.655 -12.573 1.941 1.00 0.00 H new ATOM 0 HG12 VAL A 11 27.553 -14.336 1.719 1.00 0.00 H new ATOM 0 HG13 VAL A 11 26.761 -13.246 0.557 1.00 0.00 H new ATOM 0 HG21 VAL A 11 25.676 -11.272 2.701 1.00 0.00 H new ATOM 0 HG22 VAL A 11 24.655 -11.882 1.376 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.138 -12.088 3.067 1.00 0.00 H new ATOM 177 N PHE A 12 25.581 -16.597 0.889 1.00 0.00 N ATOM 178 CA PHE A 12 26.319 -17.850 0.691 1.00 0.00 C ATOM 179 C PHE A 12 27.521 -17.598 -0.227 1.00 0.00 C ATOM 180 O PHE A 12 27.358 -17.195 -1.380 1.00 0.00 O ATOM 181 CB PHE A 12 25.389 -18.952 0.102 1.00 0.00 C ATOM 182 CG PHE A 12 24.381 -19.497 1.119 1.00 0.00 C ATOM 183 CD1 PHE A 12 23.221 -18.793 1.432 1.00 0.00 C ATOM 184 CD2 PHE A 12 24.614 -20.701 1.789 1.00 0.00 C ATOM 185 CE1 PHE A 12 22.331 -19.270 2.374 1.00 0.00 C ATOM 186 CE2 PHE A 12 23.718 -21.179 2.728 1.00 0.00 C ATOM 187 CZ PHE A 12 22.580 -20.464 3.022 1.00 0.00 C ATOM 0 H PHE A 12 25.129 -16.259 0.040 1.00 0.00 H new ATOM 0 HA PHE A 12 26.681 -18.206 1.656 1.00 0.00 H new ATOM 0 HB2 PHE A 12 24.849 -18.544 -0.753 1.00 0.00 H new ATOM 0 HB3 PHE A 12 26.001 -19.774 -0.270 1.00 0.00 H new ATOM 0 HD1 PHE A 12 23.014 -17.859 0.930 1.00 0.00 H new ATOM 0 HD2 PHE A 12 25.507 -21.267 1.570 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.438 -18.708 2.605 1.00 0.00 H new ATOM 0 HE2 PHE A 12 23.912 -22.115 3.231 1.00 0.00 H new ATOM 0 HZ PHE A 12 21.883 -20.836 3.758 1.00 0.00 H new ATOM 197 N LYS A 13 28.727 -17.818 0.304 1.00 0.00 N ATOM 198 CA LYS A 13 29.975 -17.701 -0.452 1.00 0.00 C ATOM 199 C LYS A 13 30.153 -18.956 -1.321 1.00 0.00 C ATOM 200 O LYS A 13 30.679 -19.986 -0.874 1.00 0.00 O ATOM 201 CB LYS A 13 31.152 -17.461 0.531 1.00 0.00 C ATOM 202 CG LYS A 13 32.540 -17.350 -0.126 1.00 0.00 C ATOM 203 CD LYS A 13 33.635 -16.910 0.877 1.00 0.00 C ATOM 204 CE LYS A 13 35.048 -17.089 0.310 1.00 0.00 C ATOM 205 NZ LYS A 13 35.380 -18.527 0.120 1.00 0.00 N ATOM 0 H LYS A 13 28.865 -18.084 1.279 1.00 0.00 H new ATOM 0 HA LYS A 13 29.950 -16.845 -1.126 1.00 0.00 H new ATOM 0 HB2 LYS A 13 30.957 -16.545 1.090 1.00 0.00 H new ATOM 0 HB3 LYS A 13 31.173 -18.277 1.254 1.00 0.00 H new ATOM 0 HG2 LYS A 13 32.813 -18.313 -0.558 1.00 0.00 H new ATOM 0 HG3 LYS A 13 32.494 -16.634 -0.947 1.00 0.00 H new ATOM 0 HD2 LYS A 13 33.482 -15.864 1.143 1.00 0.00 H new ATOM 0 HD3 LYS A 13 33.538 -17.490 1.795 1.00 0.00 H new ATOM 0 HE2 LYS A 13 35.128 -16.567 -0.643 1.00 0.00 H new ATOM 0 HE3 LYS A 13 35.773 -16.633 0.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 36.367 -18.695 0.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 34.749 -19.109 0.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 35.256 -18.783 -0.880 1.00 0.00 H new ATOM 219 N GLY A 14 29.638 -18.874 -2.561 1.00 0.00 N ATOM 220 CA GLY A 14 29.544 -20.030 -3.436 1.00 0.00 C ATOM 221 C GLY A 14 28.402 -20.925 -2.980 1.00 0.00 C ATOM 222 O GLY A 14 27.245 -20.724 -3.381 1.00 0.00 O ATOM 0 H GLY A 14 29.282 -18.010 -2.970 1.00 0.00 H new ATOM 0 HA2 GLY A 14 29.378 -19.708 -4.464 1.00 0.00 H new ATOM 0 HA3 GLY A 14 30.482 -20.585 -3.423 1.00 0.00 H new ATOM 226 N GLU A 15 28.737 -21.904 -2.121 1.00 0.00 N ATOM 227 CA GLU A 15 27.765 -22.837 -1.516 1.00 0.00 C ATOM 228 C GLU A 15 27.752 -22.715 0.028 1.00 0.00 C ATOM 229 O GLU A 15 26.747 -23.058 0.662 1.00 0.00 O ATOM 230 CB GLU A 15 28.104 -24.296 -1.928 1.00 0.00 C ATOM 231 CG GLU A 15 29.497 -24.771 -1.461 1.00 0.00 C ATOM 232 CD GLU A 15 29.774 -26.237 -1.795 1.00 0.00 C ATOM 233 OE1 GLU A 15 29.287 -27.119 -1.063 1.00 0.00 O ATOM 234 OE2 GLU A 15 30.472 -26.516 -2.795 1.00 0.00 O ATOM 0 H GLU A 15 29.698 -22.073 -1.824 1.00 0.00 H new ATOM 0 HA GLU A 15 26.773 -22.576 -1.884 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.347 -24.964 -1.518 1.00 0.00 H new ATOM 0 HB3 GLU A 15 28.048 -24.379 -3.013 1.00 0.00 H new ATOM 0 HG2 GLU A 15 30.261 -24.148 -1.926 1.00 0.00 H new ATOM 0 HG3 GLU A 15 29.581 -24.628 -0.384 1.00 0.00 H new ATOM 241 N GLU A 16 28.865 -22.222 0.629 1.00 0.00 N ATOM 242 CA GLU A 16 29.035 -22.205 2.105 1.00 0.00 C ATOM 243 C GLU A 16 28.247 -21.030 2.717 1.00 0.00 C ATOM 244 O GLU A 16 28.181 -19.952 2.124 1.00 0.00 O ATOM 245 CB GLU A 16 30.546 -22.114 2.508 1.00 0.00 C ATOM 246 CG GLU A 16 31.246 -20.787 2.134 1.00 0.00 C ATOM 247 CD GLU A 16 32.710 -20.677 2.600 1.00 0.00 C ATOM 248 OE1 GLU A 16 32.941 -20.353 3.788 1.00 0.00 O ATOM 249 OE2 GLU A 16 33.634 -20.893 1.780 1.00 0.00 O ATOM 0 H GLU A 16 29.656 -21.832 0.116 1.00 0.00 H new ATOM 0 HA GLU A 16 28.642 -23.143 2.498 1.00 0.00 H new ATOM 0 HB2 GLU A 16 30.628 -22.259 3.585 1.00 0.00 H new ATOM 0 HB3 GLU A 16 31.083 -22.936 2.034 1.00 0.00 H new ATOM 0 HG2 GLU A 16 31.214 -20.668 1.051 1.00 0.00 H new ATOM 0 HG3 GLU A 16 30.680 -19.960 2.562 1.00 0.00 H new ATOM 256 N SER A 17 27.641 -21.257 3.893 1.00 0.00 N ATOM 257 CA SER A 17 26.918 -20.225 4.645 1.00 0.00 C ATOM 258 C SER A 17 27.923 -19.196 5.189 1.00 0.00 C ATOM 259 O SER A 17 28.599 -19.450 6.194 1.00 0.00 O ATOM 260 CB SER A 17 26.106 -20.875 5.792 1.00 0.00 C ATOM 261 OG SER A 17 25.332 -19.919 6.507 1.00 0.00 O ATOM 0 H SER A 17 27.640 -22.169 4.350 1.00 0.00 H new ATOM 0 HA SER A 17 26.216 -19.712 3.988 1.00 0.00 H new ATOM 0 HB2 SER A 17 25.447 -21.640 5.381 1.00 0.00 H new ATOM 0 HB3 SER A 17 26.787 -21.377 6.479 1.00 0.00 H new ATOM 0 HG SER A 17 24.834 -20.369 7.221 1.00 0.00 H new ATOM 267 N PHE A 18 28.050 -18.059 4.485 1.00 0.00 N ATOM 268 CA PHE A 18 28.992 -17.002 4.862 1.00 0.00 C ATOM 269 C PHE A 18 28.396 -16.163 6.007 1.00 0.00 C ATOM 270 O PHE A 18 28.968 -16.106 7.098 1.00 0.00 O ATOM 271 CB PHE A 18 29.325 -16.128 3.625 1.00 0.00 C ATOM 272 CG PHE A 18 30.358 -15.032 3.895 1.00 0.00 C ATOM 273 CD1 PHE A 18 31.717 -15.332 3.966 1.00 0.00 C ATOM 274 CD2 PHE A 18 29.969 -13.713 4.108 1.00 0.00 C ATOM 275 CE1 PHE A 18 32.646 -14.346 4.228 1.00 0.00 C ATOM 276 CE2 PHE A 18 30.897 -12.730 4.372 1.00 0.00 C ATOM 277 CZ PHE A 18 32.234 -13.049 4.437 1.00 0.00 C ATOM 0 H PHE A 18 27.507 -17.851 3.647 1.00 0.00 H new ATOM 0 HA PHE A 18 29.923 -17.444 5.217 1.00 0.00 H new ATOM 0 HB2 PHE A 18 29.695 -16.772 2.827 1.00 0.00 H new ATOM 0 HB3 PHE A 18 28.407 -15.666 3.262 1.00 0.00 H new ATOM 0 HD1 PHE A 18 32.047 -16.349 3.814 1.00 0.00 H new ATOM 0 HD2 PHE A 18 28.921 -13.456 4.066 1.00 0.00 H new ATOM 0 HE1 PHE A 18 33.697 -14.592 4.269 1.00 0.00 H new ATOM 0 HE2 PHE A 18 30.576 -11.711 4.528 1.00 0.00 H new ATOM 0 HZ PHE A 18 32.962 -12.280 4.652 1.00 0.00 H new ATOM 287 N GLY A 19 27.204 -15.584 5.763 1.00 0.00 N ATOM 288 CA GLY A 19 26.549 -14.697 6.728 1.00 0.00 C ATOM 289 C GLY A 19 25.224 -14.149 6.215 1.00 0.00 C ATOM 290 O GLY A 19 24.434 -14.889 5.617 1.00 0.00 O ATOM 0 H GLY A 19 26.678 -15.719 4.900 1.00 0.00 H new ATOM 0 HA2 GLY A 19 26.378 -15.240 7.657 1.00 0.00 H new ATOM 0 HA3 GLY A 19 27.215 -13.867 6.963 1.00 0.00 H new ATOM 294 N GLU A 20 24.982 -12.843 6.447 1.00 0.00 N ATOM 295 CA GLU A 20 23.741 -12.149 6.044 1.00 0.00 C ATOM 296 C GLU A 20 24.033 -10.667 5.709 1.00 0.00 C ATOM 297 O GLU A 20 24.794 -10.005 6.425 1.00 0.00 O ATOM 298 CB GLU A 20 22.687 -12.258 7.177 1.00 0.00 C ATOM 299 CG GLU A 20 23.185 -11.762 8.555 1.00 0.00 C ATOM 300 CD GLU A 20 22.143 -11.928 9.664 1.00 0.00 C ATOM 301 OE1 GLU A 20 21.877 -13.082 10.067 1.00 0.00 O ATOM 302 OE2 GLU A 20 21.578 -10.923 10.131 1.00 0.00 O ATOM 0 H GLU A 20 25.648 -12.235 6.923 1.00 0.00 H new ATOM 0 HA GLU A 20 23.343 -12.625 5.148 1.00 0.00 H new ATOM 0 HB2 GLU A 20 21.805 -11.684 6.894 1.00 0.00 H new ATOM 0 HB3 GLU A 20 22.375 -13.298 7.269 1.00 0.00 H new ATOM 0 HG2 GLU A 20 24.087 -12.309 8.827 1.00 0.00 H new ATOM 0 HG3 GLU A 20 23.461 -10.710 8.478 1.00 0.00 H new ATOM 309 N SER A 21 23.438 -10.167 4.611 1.00 0.00 N ATOM 310 CA SER A 21 23.594 -8.776 4.170 1.00 0.00 C ATOM 311 C SER A 21 22.809 -7.855 5.121 1.00 0.00 C ATOM 312 O SER A 21 21.587 -7.885 5.146 1.00 0.00 O ATOM 313 CB SER A 21 23.117 -8.625 2.697 1.00 0.00 C ATOM 314 OG SER A 21 21.788 -9.102 2.514 1.00 0.00 O ATOM 0 H SER A 21 22.834 -10.722 4.005 1.00 0.00 H new ATOM 0 HA SER A 21 24.645 -8.489 4.202 1.00 0.00 H new ATOM 0 HB2 SER A 21 23.169 -7.576 2.405 1.00 0.00 H new ATOM 0 HB3 SER A 21 23.792 -9.173 2.040 1.00 0.00 H new ATOM 0 HG SER A 21 21.249 -8.879 3.302 1.00 0.00 H new ATOM 320 N ILE A 22 23.527 -7.086 5.948 1.00 0.00 N ATOM 321 CA ILE A 22 22.917 -6.203 6.967 1.00 0.00 C ATOM 322 C ILE A 22 22.833 -4.756 6.436 1.00 0.00 C ATOM 323 O ILE A 22 21.876 -4.028 6.755 1.00 0.00 O ATOM 324 CB ILE A 22 23.710 -6.305 8.341 1.00 0.00 C ATOM 325 CG1 ILE A 22 23.073 -5.444 9.507 1.00 0.00 C ATOM 326 CG2 ILE A 22 25.209 -5.991 8.154 1.00 0.00 C ATOM 327 CD1 ILE A 22 23.561 -3.992 9.643 1.00 0.00 C ATOM 0 H ILE A 22 24.546 -7.053 5.935 1.00 0.00 H new ATOM 0 HA ILE A 22 21.897 -6.532 7.167 1.00 0.00 H new ATOM 0 HB ILE A 22 23.620 -7.343 8.660 1.00 0.00 H new ATOM 0 HG12 ILE A 22 21.992 -5.427 9.366 1.00 0.00 H new ATOM 0 HG13 ILE A 22 23.263 -5.956 10.450 1.00 0.00 H new ATOM 0 HG21 ILE A 22 25.720 -6.070 9.114 1.00 0.00 H new ATOM 0 HG22 ILE A 22 25.645 -6.701 7.451 1.00 0.00 H new ATOM 0 HG23 ILE A 22 25.323 -4.979 7.765 1.00 0.00 H new ATOM 0 HD11 ILE A 22 23.049 -3.513 10.477 1.00 0.00 H new ATOM 0 HD12 ILE A 22 24.636 -3.985 9.825 1.00 0.00 H new ATOM 0 HD13 ILE A 22 23.345 -3.448 8.723 1.00 0.00 H new ATOM 339 N ASP A 23 23.813 -4.359 5.599 1.00 0.00 N ATOM 340 CA ASP A 23 23.923 -2.971 5.098 1.00 0.00 C ATOM 341 C ASP A 23 24.800 -2.925 3.819 1.00 0.00 C ATOM 342 O ASP A 23 25.277 -3.965 3.360 1.00 0.00 O ATOM 343 CB ASP A 23 24.490 -2.056 6.236 1.00 0.00 C ATOM 344 CG ASP A 23 24.287 -0.553 5.977 1.00 0.00 C ATOM 345 OD1 ASP A 23 23.175 -0.047 6.234 1.00 0.00 O ATOM 346 OD2 ASP A 23 25.216 0.115 5.493 1.00 0.00 O ATOM 0 H ASP A 23 24.543 -4.982 5.254 1.00 0.00 H new ATOM 0 HA ASP A 23 22.938 -2.596 4.820 1.00 0.00 H new ATOM 0 HB2 ASP A 23 24.010 -2.322 7.178 1.00 0.00 H new ATOM 0 HB3 ASP A 23 25.555 -2.255 6.354 1.00 0.00 H new ATOM 351 N VAL A 24 24.968 -1.724 3.224 1.00 0.00 N ATOM 352 CA VAL A 24 25.851 -1.486 2.065 1.00 0.00 C ATOM 353 C VAL A 24 26.298 -0.001 2.048 1.00 0.00 C ATOM 354 O VAL A 24 25.504 0.892 2.363 1.00 0.00 O ATOM 355 CB VAL A 24 25.138 -1.879 0.697 1.00 0.00 C ATOM 356 CG1 VAL A 24 23.789 -1.134 0.513 1.00 0.00 C ATOM 357 CG2 VAL A 24 26.079 -1.667 -0.524 1.00 0.00 C ATOM 0 H VAL A 24 24.487 -0.882 3.541 1.00 0.00 H new ATOM 0 HA VAL A 24 26.730 -2.123 2.164 1.00 0.00 H new ATOM 0 HB VAL A 24 24.912 -2.944 0.751 1.00 0.00 H new ATOM 0 HG11 VAL A 24 23.336 -1.431 -0.433 1.00 0.00 H new ATOM 0 HG12 VAL A 24 23.118 -1.389 1.333 1.00 0.00 H new ATOM 0 HG13 VAL A 24 23.965 -0.058 0.509 1.00 0.00 H new ATOM 0 HG21 VAL A 24 25.556 -1.946 -1.439 1.00 0.00 H new ATOM 0 HG22 VAL A 24 26.373 -0.619 -0.579 1.00 0.00 H new ATOM 0 HG23 VAL A 24 26.968 -2.287 -0.410 1.00 0.00 H new ATOM 367 N TYR A 25 27.581 0.256 1.718 1.00 0.00 N ATOM 368 CA TYR A 25 28.122 1.627 1.553 1.00 0.00 C ATOM 369 C TYR A 25 29.108 1.644 0.367 1.00 0.00 C ATOM 370 O TYR A 25 29.950 0.742 0.263 1.00 0.00 O ATOM 371 CB TYR A 25 28.814 2.131 2.873 1.00 0.00 C ATOM 372 CG TYR A 25 30.253 1.630 3.126 1.00 0.00 C ATOM 373 CD1 TYR A 25 30.514 0.301 3.450 1.00 0.00 C ATOM 374 CD2 TYR A 25 31.350 2.484 3.001 1.00 0.00 C ATOM 375 CE1 TYR A 25 31.808 -0.149 3.648 1.00 0.00 C ATOM 376 CE2 TYR A 25 32.640 2.037 3.189 1.00 0.00 C ATOM 377 CZ TYR A 25 32.866 0.721 3.511 1.00 0.00 C ATOM 378 OH TYR A 25 34.157 0.273 3.689 1.00 0.00 O ATOM 0 H TYR A 25 28.272 -0.477 1.558 1.00 0.00 H new ATOM 0 HA TYR A 25 27.299 2.310 1.344 1.00 0.00 H new ATOM 0 HB2 TYR A 25 28.829 3.221 2.857 1.00 0.00 H new ATOM 0 HB3 TYR A 25 28.195 1.833 3.719 1.00 0.00 H new ATOM 0 HD1 TYR A 25 29.691 -0.392 3.549 1.00 0.00 H new ATOM 0 HD2 TYR A 25 31.184 3.521 2.751 1.00 0.00 H new ATOM 0 HE1 TYR A 25 31.987 -1.181 3.910 1.00 0.00 H new ATOM 0 HE2 TYR A 25 33.471 2.719 3.083 1.00 0.00 H new ATOM 0 HH TYR A 25 34.273 -0.031 4.613 1.00 0.00 H new ATOM 388 N GLY A 26 28.965 2.638 -0.534 1.00 0.00 N ATOM 389 CA GLY A 26 29.948 2.887 -1.589 1.00 0.00 C ATOM 390 C GLY A 26 30.161 1.698 -2.528 1.00 0.00 C ATOM 391 O GLY A 26 29.315 1.398 -3.377 1.00 0.00 O ATOM 0 H GLY A 26 28.172 3.279 -0.545 1.00 0.00 H new ATOM 0 HA2 GLY A 26 29.627 3.748 -2.175 1.00 0.00 H new ATOM 0 HA3 GLY A 26 30.901 3.151 -1.130 1.00 0.00 H new ATOM 395 N ASP A 27 31.294 1.006 -2.325 1.00 0.00 N ATOM 396 CA ASP A 27 31.762 -0.105 -3.181 1.00 0.00 C ATOM 397 C ASP A 27 31.779 -1.438 -2.406 1.00 0.00 C ATOM 398 O ASP A 27 32.402 -2.407 -2.854 1.00 0.00 O ATOM 399 CB ASP A 27 33.193 0.213 -3.711 1.00 0.00 C ATOM 400 CG ASP A 27 33.269 1.519 -4.520 1.00 0.00 C ATOM 401 OD1 ASP A 27 33.501 2.594 -3.917 1.00 0.00 O ATOM 402 OD2 ASP A 27 33.100 1.474 -5.760 1.00 0.00 O ATOM 0 H ASP A 27 31.924 1.204 -1.548 1.00 0.00 H new ATOM 0 HA ASP A 27 31.071 -0.208 -4.018 1.00 0.00 H new ATOM 0 HB2 ASP A 27 33.879 0.277 -2.867 1.00 0.00 H new ATOM 0 HB3 ASP A 27 33.533 -0.613 -4.336 1.00 0.00 H new ATOM 407 N TYR A 28 31.079 -1.517 -1.248 1.00 0.00 N ATOM 408 CA TYR A 28 31.131 -2.707 -0.358 1.00 0.00 C ATOM 409 C TYR A 28 29.754 -3.028 0.257 1.00 0.00 C ATOM 410 O TYR A 28 29.129 -2.169 0.885 1.00 0.00 O ATOM 411 CB TYR A 28 32.169 -2.493 0.784 1.00 0.00 C ATOM 412 CG TYR A 28 33.589 -2.186 0.283 1.00 0.00 C ATOM 413 CD1 TYR A 28 34.417 -3.206 -0.191 1.00 0.00 C ATOM 414 CD2 TYR A 28 34.079 -0.876 0.241 1.00 0.00 C ATOM 415 CE1 TYR A 28 35.678 -2.930 -0.672 1.00 0.00 C ATOM 416 CE2 TYR A 28 35.336 -0.600 -0.246 1.00 0.00 C ATOM 417 CZ TYR A 28 36.132 -1.631 -0.703 1.00 0.00 C ATOM 418 OH TYR A 28 37.390 -1.359 -1.189 1.00 0.00 O ATOM 0 H TYR A 28 30.471 -0.772 -0.907 1.00 0.00 H new ATOM 0 HA TYR A 28 31.434 -3.552 -0.976 1.00 0.00 H new ATOM 0 HB2 TYR A 28 31.833 -1.673 1.419 1.00 0.00 H new ATOM 0 HB3 TYR A 28 32.199 -3.387 1.407 1.00 0.00 H new ATOM 0 HD1 TYR A 28 34.063 -4.226 -0.180 1.00 0.00 H new ATOM 0 HD2 TYR A 28 33.459 -0.067 0.597 1.00 0.00 H new ATOM 0 HE1 TYR A 28 36.310 -3.732 -1.024 1.00 0.00 H new ATOM 0 HE2 TYR A 28 35.698 0.417 -0.271 1.00 0.00 H new ATOM 0 HH TYR A 28 37.557 -0.394 -1.143 1.00 0.00 H new ATOM 428 N LEU A 29 29.302 -4.279 0.069 1.00 0.00 N ATOM 429 CA LEU A 29 28.116 -4.840 0.737 1.00 0.00 C ATOM 430 C LEU A 29 28.515 -5.334 2.145 1.00 0.00 C ATOM 431 O LEU A 29 29.279 -6.299 2.271 1.00 0.00 O ATOM 432 CB LEU A 29 27.528 -6.019 -0.099 1.00 0.00 C ATOM 433 CG LEU A 29 26.273 -6.737 0.509 1.00 0.00 C ATOM 434 CD1 LEU A 29 25.047 -5.795 0.582 1.00 0.00 C ATOM 435 CD2 LEU A 29 25.935 -8.030 -0.270 1.00 0.00 C ATOM 0 H LEU A 29 29.758 -4.939 -0.561 1.00 0.00 H new ATOM 0 HA LEU A 29 27.352 -4.068 0.824 1.00 0.00 H new ATOM 0 HB2 LEU A 29 27.262 -5.641 -1.086 1.00 0.00 H new ATOM 0 HB3 LEU A 29 28.312 -6.762 -0.243 1.00 0.00 H new ATOM 0 HG LEU A 29 26.528 -7.016 1.531 1.00 0.00 H new ATOM 0 HD11 LEU A 29 24.200 -6.332 1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 29 25.285 -4.936 1.209 1.00 0.00 H new ATOM 0 HD13 LEU A 29 24.791 -5.453 -0.421 1.00 0.00 H new ATOM 0 HD21 LEU A 29 25.061 -8.505 0.175 1.00 0.00 H new ATOM 0 HD22 LEU A 29 25.724 -7.783 -1.310 1.00 0.00 H new ATOM 0 HD23 LEU A 29 26.782 -8.714 -0.224 1.00 0.00 H new ATOM 447 N ILE A 30 28.015 -4.653 3.189 1.00 0.00 N ATOM 448 CA ILE A 30 28.270 -5.034 4.589 1.00 0.00 C ATOM 449 C ILE A 30 27.508 -6.331 4.922 1.00 0.00 C ATOM 450 O ILE A 30 26.265 -6.350 4.937 1.00 0.00 O ATOM 451 CB ILE A 30 27.827 -3.908 5.600 1.00 0.00 C ATOM 452 CG1 ILE A 30 28.503 -2.542 5.277 1.00 0.00 C ATOM 453 CG2 ILE A 30 28.130 -4.330 7.059 1.00 0.00 C ATOM 454 CD1 ILE A 30 29.998 -2.525 5.520 1.00 0.00 C ATOM 0 H ILE A 30 27.425 -3.827 3.088 1.00 0.00 H new ATOM 0 HA ILE A 30 29.345 -5.182 4.694 1.00 0.00 H new ATOM 0 HB ILE A 30 26.750 -3.778 5.489 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.311 -2.290 4.234 1.00 0.00 H new ATOM 0 HG13 ILE A 30 28.037 -1.765 5.883 1.00 0.00 H new ATOM 0 HG21 ILE A 30 27.816 -3.538 7.739 1.00 0.00 H new ATOM 0 HG22 ILE A 30 27.587 -5.246 7.293 1.00 0.00 H new ATOM 0 HG23 ILE A 30 29.200 -4.503 7.173 1.00 0.00 H new ATOM 0 HD11 ILE A 30 30.396 -1.541 5.272 1.00 0.00 H new ATOM 0 HD12 ILE A 30 30.199 -2.744 6.569 1.00 0.00 H new ATOM 0 HD13 ILE A 30 30.477 -3.278 4.894 1.00 0.00 H new ATOM 466 N VAL A 31 28.260 -7.412 5.165 1.00 0.00 N ATOM 467 CA VAL A 31 27.700 -8.704 5.570 1.00 0.00 C ATOM 468 C VAL A 31 28.114 -9.016 7.021 1.00 0.00 C ATOM 469 O VAL A 31 29.310 -9.123 7.328 1.00 0.00 O ATOM 470 CB VAL A 31 28.160 -9.850 4.595 1.00 0.00 C ATOM 471 CG1 VAL A 31 27.620 -11.224 5.045 1.00 0.00 C ATOM 472 CG2 VAL A 31 27.749 -9.534 3.131 1.00 0.00 C ATOM 0 H VAL A 31 29.277 -7.413 5.085 1.00 0.00 H new ATOM 0 HA VAL A 31 26.613 -8.647 5.517 1.00 0.00 H new ATOM 0 HB VAL A 31 29.248 -9.900 4.633 1.00 0.00 H new ATOM 0 HG11 VAL A 31 27.957 -11.993 4.349 1.00 0.00 H new ATOM 0 HG12 VAL A 31 27.991 -11.451 6.044 1.00 0.00 H new ATOM 0 HG13 VAL A 31 26.530 -11.200 5.059 1.00 0.00 H new ATOM 0 HG21 VAL A 31 28.079 -10.342 2.478 1.00 0.00 H new ATOM 0 HG22 VAL A 31 26.665 -9.438 3.070 1.00 0.00 H new ATOM 0 HG23 VAL A 31 28.214 -8.600 2.816 1.00 0.00 H new ATOM 482 N LYS A 32 27.108 -9.135 7.904 1.00 0.00 N ATOM 483 CA LYS A 32 27.308 -9.480 9.316 1.00 0.00 C ATOM 484 C LYS A 32 27.564 -10.992 9.452 1.00 0.00 C ATOM 485 O LYS A 32 26.781 -11.811 8.956 1.00 0.00 O ATOM 486 CB LYS A 32 26.076 -9.053 10.159 1.00 0.00 C ATOM 487 CG LYS A 32 26.182 -9.355 11.676 1.00 0.00 C ATOM 488 CD LYS A 32 27.416 -8.693 12.338 1.00 0.00 C ATOM 489 CE LYS A 32 27.452 -8.887 13.863 1.00 0.00 C ATOM 490 NZ LYS A 32 26.265 -8.287 14.531 1.00 0.00 N ATOM 0 H LYS A 32 26.129 -8.993 7.654 1.00 0.00 H new ATOM 0 HA LYS A 32 28.178 -8.942 9.693 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.918 -7.983 10.027 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.193 -9.556 9.765 1.00 0.00 H new ATOM 0 HG2 LYS A 32 25.278 -9.006 12.175 1.00 0.00 H new ATOM 0 HG3 LYS A 32 26.232 -10.434 11.824 1.00 0.00 H new ATOM 0 HD2 LYS A 32 28.324 -9.110 11.902 1.00 0.00 H new ATOM 0 HD3 LYS A 32 27.415 -7.627 12.112 1.00 0.00 H new ATOM 0 HE2 LYS A 32 27.497 -9.952 14.092 1.00 0.00 H new ATOM 0 HE3 LYS A 32 28.360 -8.436 14.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 26.423 -8.258 15.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 26.118 -7.321 14.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 25.423 -8.863 14.326 1.00 0.00 H new ATOM 504 N VAL A 33 28.685 -11.328 10.114 1.00 0.00 N ATOM 505 CA VAL A 33 29.134 -12.709 10.350 1.00 0.00 C ATOM 506 C VAL A 33 29.524 -12.891 11.848 1.00 0.00 C ATOM 507 O VAL A 33 30.706 -12.894 12.214 1.00 0.00 O ATOM 508 CB VAL A 33 30.319 -13.105 9.365 1.00 0.00 C ATOM 509 CG1 VAL A 33 29.834 -13.191 7.896 1.00 0.00 C ATOM 510 CG2 VAL A 33 31.504 -12.115 9.455 1.00 0.00 C ATOM 0 H VAL A 33 29.317 -10.631 10.508 1.00 0.00 H new ATOM 0 HA VAL A 33 28.312 -13.392 10.134 1.00 0.00 H new ATOM 0 HB VAL A 33 30.663 -14.089 9.685 1.00 0.00 H new ATOM 0 HG11 VAL A 33 30.670 -13.464 7.252 1.00 0.00 H new ATOM 0 HG12 VAL A 33 29.052 -13.946 7.815 1.00 0.00 H new ATOM 0 HG13 VAL A 33 29.438 -12.224 7.586 1.00 0.00 H new ATOM 0 HG21 VAL A 33 32.290 -12.424 8.766 1.00 0.00 H new ATOM 0 HG22 VAL A 33 31.163 -11.114 9.191 1.00 0.00 H new ATOM 0 HG23 VAL A 33 31.896 -12.108 10.472 1.00 0.00 H new ATOM 520 N GLY A 34 28.482 -12.956 12.710 1.00 0.00 N ATOM 521 CA GLY A 34 28.626 -13.268 14.146 1.00 0.00 C ATOM 522 C GLY A 34 29.475 -12.259 14.932 1.00 0.00 C ATOM 523 O GLY A 34 28.936 -11.363 15.600 1.00 0.00 O ATOM 0 H GLY A 34 27.516 -12.793 12.425 1.00 0.00 H new ATOM 0 HA2 GLY A 34 27.634 -13.318 14.596 1.00 0.00 H new ATOM 0 HA3 GLY A 34 29.073 -14.257 14.247 1.00 0.00 H new ATOM 527 N THR A 35 30.807 -12.417 14.836 1.00 0.00 N ATOM 528 CA THR A 35 31.790 -11.570 15.518 1.00 0.00 C ATOM 529 C THR A 35 31.838 -10.151 14.908 1.00 0.00 C ATOM 530 O THR A 35 31.741 -9.150 15.633 1.00 0.00 O ATOM 531 CB THR A 35 33.223 -12.214 15.421 1.00 0.00 C ATOM 532 OG1 THR A 35 33.527 -12.479 14.039 1.00 0.00 O ATOM 533 CG2 THR A 35 33.340 -13.521 16.236 1.00 0.00 C ATOM 0 H THR A 35 31.234 -13.151 14.271 1.00 0.00 H new ATOM 0 HA THR A 35 31.483 -11.492 16.561 1.00 0.00 H new ATOM 0 HB THR A 35 33.935 -11.505 15.844 1.00 0.00 H new ATOM 0 HG1 THR A 35 34.419 -12.879 13.971 1.00 0.00 H new ATOM 0 HG21 THR A 35 34.348 -13.924 16.135 1.00 0.00 H new ATOM 0 HG22 THR A 35 33.136 -13.314 17.287 1.00 0.00 H new ATOM 0 HG23 THR A 35 32.619 -14.248 15.862 1.00 0.00 H new ATOM 541 N GLU A 36 31.947 -10.066 13.566 1.00 0.00 N ATOM 542 CA GLU A 36 32.288 -8.792 12.875 1.00 0.00 C ATOM 543 C GLU A 36 31.464 -8.584 11.604 1.00 0.00 C ATOM 544 O GLU A 36 30.650 -9.426 11.219 1.00 0.00 O ATOM 545 CB GLU A 36 33.816 -8.747 12.546 1.00 0.00 C ATOM 546 CG GLU A 36 34.727 -8.601 13.780 1.00 0.00 C ATOM 547 CD GLU A 36 36.232 -8.620 13.468 1.00 0.00 C ATOM 548 OE1 GLU A 36 36.671 -7.924 12.530 1.00 0.00 O ATOM 549 OE2 GLU A 36 36.988 -9.301 14.193 1.00 0.00 O ATOM 0 H GLU A 36 31.806 -10.856 12.937 1.00 0.00 H new ATOM 0 HA GLU A 36 32.041 -7.977 13.556 1.00 0.00 H new ATOM 0 HB2 GLU A 36 34.088 -9.659 12.014 1.00 0.00 H new ATOM 0 HB3 GLU A 36 34.005 -7.914 11.869 1.00 0.00 H new ATOM 0 HG2 GLU A 36 34.486 -7.666 14.285 1.00 0.00 H new ATOM 0 HG3 GLU A 36 34.503 -9.408 14.478 1.00 0.00 H new ATOM 556 N PHE A 37 31.682 -7.411 10.980 1.00 0.00 N ATOM 557 CA PHE A 37 31.070 -7.030 9.704 1.00 0.00 C ATOM 558 C PHE A 37 32.148 -7.125 8.615 1.00 0.00 C ATOM 559 O PHE A 37 33.087 -6.316 8.590 1.00 0.00 O ATOM 560 CB PHE A 37 30.515 -5.574 9.780 1.00 0.00 C ATOM 561 CG PHE A 37 29.470 -5.340 10.882 1.00 0.00 C ATOM 562 CD1 PHE A 37 29.855 -5.171 12.216 1.00 0.00 C ATOM 563 CD2 PHE A 37 28.107 -5.279 10.587 1.00 0.00 C ATOM 564 CE1 PHE A 37 28.916 -4.948 13.207 1.00 0.00 C ATOM 565 CE2 PHE A 37 27.170 -5.052 11.577 1.00 0.00 C ATOM 566 CZ PHE A 37 27.575 -4.887 12.887 1.00 0.00 C ATOM 0 H PHE A 37 32.300 -6.693 11.359 1.00 0.00 H new ATOM 0 HA PHE A 37 30.238 -7.696 9.475 1.00 0.00 H new ATOM 0 HB2 PHE A 37 31.349 -4.890 9.938 1.00 0.00 H new ATOM 0 HB3 PHE A 37 30.071 -5.318 8.818 1.00 0.00 H new ATOM 0 HD1 PHE A 37 30.902 -5.215 12.477 1.00 0.00 H new ATOM 0 HD2 PHE A 37 27.779 -5.412 9.567 1.00 0.00 H new ATOM 0 HE1 PHE A 37 29.233 -4.822 14.232 1.00 0.00 H new ATOM 0 HE2 PHE A 37 26.121 -5.004 11.326 1.00 0.00 H new ATOM 0 HZ PHE A 37 26.843 -4.710 13.661 1.00 0.00 H new ATOM 576 N LEU A 38 32.022 -8.136 7.743 1.00 0.00 N ATOM 577 CA LEU A 38 32.905 -8.312 6.578 1.00 0.00 C ATOM 578 C LEU A 38 32.223 -7.678 5.366 1.00 0.00 C ATOM 579 O LEU A 38 31.238 -8.210 4.836 1.00 0.00 O ATOM 580 CB LEU A 38 33.241 -9.825 6.342 1.00 0.00 C ATOM 581 CG LEU A 38 34.471 -10.391 7.137 1.00 0.00 C ATOM 582 CD1 LEU A 38 34.355 -10.149 8.661 1.00 0.00 C ATOM 583 CD2 LEU A 38 34.688 -11.893 6.824 1.00 0.00 C ATOM 0 H LEU A 38 31.304 -8.856 7.825 1.00 0.00 H new ATOM 0 HA LEU A 38 33.860 -7.817 6.753 1.00 0.00 H new ATOM 0 HB2 LEU A 38 32.363 -10.416 6.602 1.00 0.00 H new ATOM 0 HB3 LEU A 38 33.422 -9.974 5.278 1.00 0.00 H new ATOM 0 HG LEU A 38 35.348 -9.839 6.799 1.00 0.00 H new ATOM 0 HD11 LEU A 38 35.231 -10.560 9.162 1.00 0.00 H new ATOM 0 HD12 LEU A 38 34.294 -9.078 8.856 1.00 0.00 H new ATOM 0 HD13 LEU A 38 33.458 -10.638 9.040 1.00 0.00 H new ATOM 0 HD21 LEU A 38 35.546 -12.262 7.387 1.00 0.00 H new ATOM 0 HD22 LEU A 38 33.799 -12.456 7.108 1.00 0.00 H new ATOM 0 HD23 LEU A 38 34.872 -12.019 5.757 1.00 0.00 H new ATOM 595 N ALA A 39 32.745 -6.511 4.976 1.00 0.00 N ATOM 596 CA ALA A 39 32.237 -5.735 3.855 1.00 0.00 C ATOM 597 C ALA A 39 32.764 -6.318 2.536 1.00 0.00 C ATOM 598 O ALA A 39 33.883 -6.012 2.101 1.00 0.00 O ATOM 599 CB ALA A 39 32.646 -4.276 4.030 1.00 0.00 C ATOM 0 H ALA A 39 33.543 -6.078 5.441 1.00 0.00 H new ATOM 0 HA ALA A 39 31.149 -5.784 3.825 1.00 0.00 H new ATOM 0 HB1 ALA A 39 32.268 -3.689 3.193 1.00 0.00 H new ATOM 0 HB2 ALA A 39 32.229 -3.890 4.961 1.00 0.00 H new ATOM 0 HB3 ALA A 39 33.733 -4.204 4.062 1.00 0.00 H new ATOM 605 N VAL A 40 31.944 -7.191 1.945 1.00 0.00 N ATOM 606 CA VAL A 40 32.262 -7.904 0.704 1.00 0.00 C ATOM 607 C VAL A 40 32.257 -6.919 -0.494 1.00 0.00 C ATOM 608 O VAL A 40 31.255 -6.220 -0.694 1.00 0.00 O ATOM 609 CB VAL A 40 31.226 -9.069 0.460 1.00 0.00 C ATOM 610 CG1 VAL A 40 31.578 -9.900 -0.800 1.00 0.00 C ATOM 611 CG2 VAL A 40 31.111 -9.974 1.714 1.00 0.00 C ATOM 0 H VAL A 40 31.026 -7.426 2.321 1.00 0.00 H new ATOM 0 HA VAL A 40 33.257 -8.339 0.796 1.00 0.00 H new ATOM 0 HB VAL A 40 30.254 -8.611 0.279 1.00 0.00 H new ATOM 0 HG11 VAL A 40 30.840 -10.691 -0.932 1.00 0.00 H new ATOM 0 HG12 VAL A 40 31.575 -9.252 -1.676 1.00 0.00 H new ATOM 0 HG13 VAL A 40 32.567 -10.342 -0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 40 30.391 -10.770 1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 40 32.084 -10.410 1.938 1.00 0.00 H new ATOM 0 HG23 VAL A 40 30.776 -9.378 2.563 1.00 0.00 H new ATOM 621 N PRO A 41 33.381 -6.829 -1.290 1.00 0.00 N ATOM 622 CA PRO A 41 33.438 -5.975 -2.511 1.00 0.00 C ATOM 623 C PRO A 41 32.314 -6.347 -3.516 1.00 0.00 C ATOM 624 O PRO A 41 31.992 -7.526 -3.660 1.00 0.00 O ATOM 625 CB PRO A 41 34.864 -6.260 -3.077 1.00 0.00 C ATOM 626 CG PRO A 41 35.281 -7.563 -2.451 1.00 0.00 C ATOM 627 CD PRO A 41 34.680 -7.535 -1.067 1.00 0.00 C ATOM 0 HA PRO A 41 33.276 -4.916 -2.308 1.00 0.00 H new ATOM 0 HB2 PRO A 41 34.849 -6.332 -4.165 1.00 0.00 H new ATOM 0 HB3 PRO A 41 35.557 -5.459 -2.820 1.00 0.00 H new ATOM 0 HG2 PRO A 41 34.913 -8.413 -3.025 1.00 0.00 H new ATOM 0 HG3 PRO A 41 36.367 -7.652 -2.409 1.00 0.00 H new ATOM 0 HD2 PRO A 41 34.533 -8.539 -0.669 1.00 0.00 H new ATOM 0 HD3 PRO A 41 35.315 -7.002 -0.360 1.00 0.00 H new ATOM 635 N LYS A 42 31.716 -5.335 -4.181 1.00 0.00 N ATOM 636 CA LYS A 42 30.521 -5.518 -5.048 1.00 0.00 C ATOM 637 C LYS A 42 30.777 -6.477 -6.232 1.00 0.00 C ATOM 638 O LYS A 42 29.875 -7.227 -6.627 1.00 0.00 O ATOM 639 CB LYS A 42 30.013 -4.144 -5.556 1.00 0.00 C ATOM 640 CG LYS A 42 29.606 -3.159 -4.434 1.00 0.00 C ATOM 641 CD LYS A 42 28.413 -3.641 -3.551 1.00 0.00 C ATOM 642 CE LYS A 42 27.033 -3.229 -4.096 1.00 0.00 C ATOM 643 NZ LYS A 42 26.733 -3.777 -5.443 1.00 0.00 N ATOM 0 H LYS A 42 32.043 -4.370 -4.135 1.00 0.00 H new ATOM 0 HA LYS A 42 29.751 -5.985 -4.434 1.00 0.00 H new ATOM 0 HB2 LYS A 42 30.793 -3.683 -6.162 1.00 0.00 H new ATOM 0 HB3 LYS A 42 29.156 -4.306 -6.209 1.00 0.00 H new ATOM 0 HG2 LYS A 42 30.469 -2.983 -3.792 1.00 0.00 H new ATOM 0 HG3 LYS A 42 29.344 -2.202 -4.885 1.00 0.00 H new ATOM 0 HD2 LYS A 42 28.451 -4.727 -3.466 1.00 0.00 H new ATOM 0 HD3 LYS A 42 28.531 -3.239 -2.545 1.00 0.00 H new ATOM 0 HE2 LYS A 42 26.264 -3.561 -3.399 1.00 0.00 H new ATOM 0 HE3 LYS A 42 26.979 -2.141 -4.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 25.714 -3.695 -5.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 27.262 -3.242 -6.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 27.013 -4.778 -5.481 1.00 0.00 H new ATOM 657 N LYS A 43 32.010 -6.461 -6.777 1.00 0.00 N ATOM 658 CA LYS A 43 32.401 -7.366 -7.887 1.00 0.00 C ATOM 659 C LYS A 43 32.472 -8.841 -7.421 1.00 0.00 C ATOM 660 O LYS A 43 32.384 -9.758 -8.245 1.00 0.00 O ATOM 661 CB LYS A 43 33.756 -6.949 -8.538 1.00 0.00 C ATOM 662 CG LYS A 43 35.017 -7.078 -7.628 1.00 0.00 C ATOM 663 CD LYS A 43 35.309 -5.835 -6.749 1.00 0.00 C ATOM 664 CE LYS A 43 35.697 -4.596 -7.578 1.00 0.00 C ATOM 665 NZ LYS A 43 36.923 -4.818 -8.401 1.00 0.00 N ATOM 0 H LYS A 43 32.754 -5.834 -6.470 1.00 0.00 H new ATOM 0 HA LYS A 43 31.621 -7.275 -8.643 1.00 0.00 H new ATOM 0 HB2 LYS A 43 33.911 -7.557 -9.429 1.00 0.00 H new ATOM 0 HB3 LYS A 43 33.675 -5.914 -8.869 1.00 0.00 H new ATOM 0 HG2 LYS A 43 34.893 -7.945 -6.979 1.00 0.00 H new ATOM 0 HG3 LYS A 43 35.885 -7.273 -8.258 1.00 0.00 H new ATOM 0 HD2 LYS A 43 34.428 -5.604 -6.150 1.00 0.00 H new ATOM 0 HD3 LYS A 43 36.115 -6.069 -6.054 1.00 0.00 H new ATOM 0 HE2 LYS A 43 34.868 -4.327 -8.233 1.00 0.00 H new ATOM 0 HE3 LYS A 43 35.861 -3.752 -6.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 37.238 -3.913 -8.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 37.677 -5.211 -7.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 36.709 -5.485 -9.170 1.00 0.00 H new ATOM 679 N SER A 44 32.628 -9.061 -6.096 1.00 0.00 N ATOM 680 CA SER A 44 32.698 -10.413 -5.516 1.00 0.00 C ATOM 681 C SER A 44 31.308 -11.070 -5.475 1.00 0.00 C ATOM 682 O SER A 44 31.218 -12.297 -5.539 1.00 0.00 O ATOM 683 CB SER A 44 33.335 -10.378 -4.107 1.00 0.00 C ATOM 684 OG SER A 44 33.490 -11.683 -3.563 1.00 0.00 O ATOM 0 H SER A 44 32.708 -8.312 -5.408 1.00 0.00 H new ATOM 0 HA SER A 44 33.336 -11.020 -6.159 1.00 0.00 H new ATOM 0 HB2 SER A 44 34.308 -9.889 -4.160 1.00 0.00 H new ATOM 0 HB3 SER A 44 32.713 -9.779 -3.442 1.00 0.00 H new ATOM 0 HG SER A 44 33.883 -11.620 -2.667 1.00 0.00 H new ATOM 690 N ILE A 45 30.218 -10.256 -5.386 1.00 0.00 N ATOM 691 CA ILE A 45 28.841 -10.792 -5.444 1.00 0.00 C ATOM 692 C ILE A 45 28.642 -11.399 -6.851 1.00 0.00 C ATOM 693 O ILE A 45 28.652 -10.678 -7.859 1.00 0.00 O ATOM 694 CB ILE A 45 27.700 -9.717 -5.144 1.00 0.00 C ATOM 695 CG1 ILE A 45 27.714 -9.194 -3.656 1.00 0.00 C ATOM 696 CG2 ILE A 45 26.291 -10.296 -5.479 1.00 0.00 C ATOM 697 CD1 ILE A 45 28.926 -8.385 -3.234 1.00 0.00 C ATOM 0 H ILE A 45 30.271 -9.243 -5.276 1.00 0.00 H new ATOM 0 HA ILE A 45 28.740 -11.536 -4.654 1.00 0.00 H new ATOM 0 HB ILE A 45 27.914 -8.865 -5.790 1.00 0.00 H new ATOM 0 HG12 ILE A 45 26.825 -8.583 -3.501 1.00 0.00 H new ATOM 0 HG13 ILE A 45 27.630 -10.054 -2.991 1.00 0.00 H new ATOM 0 HG21 ILE A 45 25.529 -9.546 -5.267 1.00 0.00 H new ATOM 0 HG22 ILE A 45 26.250 -10.566 -6.534 1.00 0.00 H new ATOM 0 HG23 ILE A 45 26.107 -11.182 -4.871 1.00 0.00 H new ATOM 0 HD11 ILE A 45 28.817 -8.084 -2.192 1.00 0.00 H new ATOM 0 HD12 ILE A 45 29.825 -8.992 -3.344 1.00 0.00 H new ATOM 0 HD13 ILE A 45 29.008 -7.498 -3.862 1.00 0.00 H new ATOM 709 N LYS A 46 28.484 -12.723 -6.888 1.00 0.00 N ATOM 710 CA LYS A 46 28.381 -13.498 -8.126 1.00 0.00 C ATOM 711 C LYS A 46 26.961 -13.398 -8.696 1.00 0.00 C ATOM 712 O LYS A 46 26.769 -13.091 -9.877 1.00 0.00 O ATOM 713 CB LYS A 46 28.758 -14.982 -7.839 1.00 0.00 C ATOM 714 CG LYS A 46 30.184 -15.183 -7.264 1.00 0.00 C ATOM 715 CD LYS A 46 31.305 -14.704 -8.217 1.00 0.00 C ATOM 716 CE LYS A 46 31.421 -15.566 -9.489 1.00 0.00 C ATOM 717 NZ LYS A 46 32.419 -15.017 -10.445 1.00 0.00 N ATOM 0 H LYS A 46 28.423 -13.296 -6.046 1.00 0.00 H new ATOM 0 HA LYS A 46 29.072 -13.095 -8.867 1.00 0.00 H new ATOM 0 HB2 LYS A 46 28.035 -15.398 -7.138 1.00 0.00 H new ATOM 0 HB3 LYS A 46 28.669 -15.552 -8.764 1.00 0.00 H new ATOM 0 HG2 LYS A 46 30.266 -14.645 -6.320 1.00 0.00 H new ATOM 0 HG3 LYS A 46 30.333 -16.240 -7.043 1.00 0.00 H new ATOM 0 HD2 LYS A 46 31.115 -13.669 -8.502 1.00 0.00 H new ATOM 0 HD3 LYS A 46 32.257 -14.719 -7.686 1.00 0.00 H new ATOM 0 HE2 LYS A 46 31.703 -16.582 -9.214 1.00 0.00 H new ATOM 0 HE3 LYS A 46 30.448 -15.627 -9.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 32.466 -15.627 -11.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 32.137 -14.057 -10.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 33.354 -14.983 -9.990 1.00 0.00 H new ATOM 731 N SER A 47 25.974 -13.652 -7.826 1.00 0.00 N ATOM 732 CA SER A 47 24.559 -13.703 -8.197 1.00 0.00 C ATOM 733 C SER A 47 23.686 -13.230 -7.027 1.00 0.00 C ATOM 734 O SER A 47 23.830 -13.722 -5.903 1.00 0.00 O ATOM 735 CB SER A 47 24.175 -15.152 -8.585 1.00 0.00 C ATOM 736 OG SER A 47 24.956 -15.638 -9.663 1.00 0.00 O ATOM 0 H SER A 47 26.140 -13.829 -6.835 1.00 0.00 H new ATOM 0 HA SER A 47 24.392 -13.043 -9.049 1.00 0.00 H new ATOM 0 HB2 SER A 47 24.303 -15.805 -7.721 1.00 0.00 H new ATOM 0 HB3 SER A 47 23.120 -15.187 -8.857 1.00 0.00 H new ATOM 0 HG SER A 47 24.684 -16.555 -9.876 1.00 0.00 H new ATOM 742 N VAL A 48 22.810 -12.255 -7.290 1.00 0.00 N ATOM 743 CA VAL A 48 21.727 -11.895 -6.366 1.00 0.00 C ATOM 744 C VAL A 48 20.515 -12.807 -6.676 1.00 0.00 C ATOM 745 O VAL A 48 19.891 -12.707 -7.735 1.00 0.00 O ATOM 746 CB VAL A 48 21.356 -10.355 -6.436 1.00 0.00 C ATOM 747 CG1 VAL A 48 21.117 -9.866 -7.890 1.00 0.00 C ATOM 748 CG2 VAL A 48 20.142 -10.028 -5.517 1.00 0.00 C ATOM 0 H VAL A 48 22.830 -11.696 -8.143 1.00 0.00 H new ATOM 0 HA VAL A 48 22.055 -12.056 -5.339 1.00 0.00 H new ATOM 0 HB VAL A 48 22.219 -9.804 -6.063 1.00 0.00 H new ATOM 0 HG11 VAL A 48 20.866 -8.805 -7.881 1.00 0.00 H new ATOM 0 HG12 VAL A 48 22.021 -10.020 -8.479 1.00 0.00 H new ATOM 0 HG13 VAL A 48 20.295 -10.429 -8.333 1.00 0.00 H new ATOM 0 HG21 VAL A 48 19.910 -8.965 -5.585 1.00 0.00 H new ATOM 0 HG22 VAL A 48 19.277 -10.609 -5.836 1.00 0.00 H new ATOM 0 HG23 VAL A 48 20.388 -10.280 -4.486 1.00 0.00 H new ATOM 758 N GLU A 49 20.237 -13.723 -5.752 1.00 0.00 N ATOM 759 CA GLU A 49 19.196 -14.764 -5.892 1.00 0.00 C ATOM 760 C GLU A 49 18.025 -14.481 -4.942 1.00 0.00 C ATOM 761 O GLU A 49 18.107 -13.580 -4.098 1.00 0.00 O ATOM 762 CB GLU A 49 19.818 -16.162 -5.594 1.00 0.00 C ATOM 763 CG GLU A 49 21.005 -16.546 -6.509 1.00 0.00 C ATOM 764 CD GLU A 49 20.612 -16.697 -7.993 1.00 0.00 C ATOM 765 OE1 GLU A 49 20.098 -17.770 -8.368 1.00 0.00 O ATOM 766 OE2 GLU A 49 20.808 -15.746 -8.785 1.00 0.00 O ATOM 0 H GLU A 49 20.734 -13.772 -4.863 1.00 0.00 H new ATOM 0 HA GLU A 49 18.813 -14.755 -6.912 1.00 0.00 H new ATOM 0 HB2 GLU A 49 20.154 -16.182 -4.557 1.00 0.00 H new ATOM 0 HB3 GLU A 49 19.041 -16.920 -5.692 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.781 -15.786 -6.422 1.00 0.00 H new ATOM 0 HG3 GLU A 49 21.436 -17.484 -6.158 1.00 0.00 H new ATOM 773 N ASP A 50 16.939 -15.270 -5.083 1.00 0.00 N ATOM 774 CA ASP A 50 15.696 -15.080 -4.312 1.00 0.00 C ATOM 775 C ASP A 50 15.942 -15.367 -2.812 1.00 0.00 C ATOM 776 O ASP A 50 15.989 -16.531 -2.391 1.00 0.00 O ATOM 777 CB ASP A 50 14.571 -15.976 -4.897 1.00 0.00 C ATOM 778 CG ASP A 50 13.219 -15.806 -4.176 1.00 0.00 C ATOM 779 OD1 ASP A 50 12.529 -14.799 -4.427 1.00 0.00 O ATOM 780 OD2 ASP A 50 12.844 -16.674 -3.350 1.00 0.00 O ATOM 0 H ASP A 50 16.901 -16.055 -5.734 1.00 0.00 H new ATOM 0 HA ASP A 50 15.373 -14.042 -4.394 1.00 0.00 H new ATOM 0 HB2 ASP A 50 14.443 -15.743 -5.954 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.879 -17.020 -4.836 1.00 0.00 H new ATOM 785 N GLY A 51 16.176 -14.281 -2.044 1.00 0.00 N ATOM 786 CA GLY A 51 16.432 -14.353 -0.596 1.00 0.00 C ATOM 787 C GLY A 51 17.848 -14.812 -0.236 1.00 0.00 C ATOM 788 O GLY A 51 18.161 -14.988 0.949 1.00 0.00 O ATOM 0 H GLY A 51 16.192 -13.331 -2.414 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.257 -13.371 -0.157 1.00 0.00 H new ATOM 0 HA3 GLY A 51 15.713 -15.037 -0.144 1.00 0.00 H new ATOM 792 N ARG A 52 18.705 -14.993 -1.260 1.00 0.00 N ATOM 793 CA ARG A 52 20.078 -15.519 -1.108 1.00 0.00 C ATOM 794 C ARG A 52 21.049 -14.612 -1.873 1.00 0.00 C ATOM 795 O ARG A 52 20.778 -14.259 -3.014 1.00 0.00 O ATOM 796 CB ARG A 52 20.172 -16.975 -1.672 1.00 0.00 C ATOM 797 CG ARG A 52 19.141 -17.981 -1.099 1.00 0.00 C ATOM 798 CD ARG A 52 19.310 -18.240 0.408 1.00 0.00 C ATOM 799 NE ARG A 52 18.201 -19.064 0.941 1.00 0.00 N ATOM 800 CZ ARG A 52 18.330 -20.206 1.637 1.00 0.00 C ATOM 801 NH1 ARG A 52 19.517 -20.750 1.837 1.00 0.00 N ATOM 802 NH2 ARG A 52 17.254 -20.821 2.104 1.00 0.00 N ATOM 0 H ARG A 52 18.462 -14.776 -2.227 1.00 0.00 H new ATOM 0 HA ARG A 52 20.337 -15.537 -0.049 1.00 0.00 H new ATOM 0 HB2 ARG A 52 20.051 -16.935 -2.755 1.00 0.00 H new ATOM 0 HB3 ARG A 52 21.174 -17.358 -1.477 1.00 0.00 H new ATOM 0 HG2 ARG A 52 18.135 -17.604 -1.284 1.00 0.00 H new ATOM 0 HG3 ARG A 52 19.231 -18.926 -1.635 1.00 0.00 H new ATOM 0 HD2 ARG A 52 20.259 -18.744 0.588 1.00 0.00 H new ATOM 0 HD3 ARG A 52 19.348 -17.290 0.940 1.00 0.00 H new ATOM 0 HE ARG A 52 17.252 -18.734 0.763 1.00 0.00 H new ATOM 0 HH11 ARG A 52 20.353 -20.303 1.461 1.00 0.00 H new ATOM 0 HH12 ARG A 52 19.598 -21.617 2.368 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.328 -20.428 1.935 1.00 0.00 H new ATOM 0 HH22 ARG A 52 17.351 -21.688 2.632 1.00 0.00 H new ATOM 816 N ILE A 53 22.174 -14.221 -1.253 1.00 0.00 N ATOM 817 CA ILE A 53 23.232 -13.454 -1.943 1.00 0.00 C ATOM 818 C ILE A 53 24.458 -14.361 -2.138 1.00 0.00 C ATOM 819 O ILE A 53 25.205 -14.616 -1.186 1.00 0.00 O ATOM 820 CB ILE A 53 23.645 -12.153 -1.146 1.00 0.00 C ATOM 821 CG1 ILE A 53 22.402 -11.253 -0.832 1.00 0.00 C ATOM 822 CG2 ILE A 53 24.737 -11.344 -1.905 1.00 0.00 C ATOM 823 CD1 ILE A 53 21.659 -10.719 -2.057 1.00 0.00 C ATOM 0 H ILE A 53 22.378 -14.422 -0.274 1.00 0.00 H new ATOM 0 HA ILE A 53 22.841 -13.128 -2.907 1.00 0.00 H new ATOM 0 HB ILE A 53 24.069 -12.479 -0.196 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.702 -11.827 -0.224 1.00 0.00 H new ATOM 0 HG13 ILE A 53 22.729 -10.407 -0.228 1.00 0.00 H new ATOM 0 HG21 ILE A 53 24.998 -10.456 -1.329 1.00 0.00 H new ATOM 0 HG22 ILE A 53 25.624 -11.964 -2.037 1.00 0.00 H new ATOM 0 HG23 ILE A 53 24.355 -11.044 -2.881 1.00 0.00 H new ATOM 0 HD11 ILE A 53 20.816 -10.108 -1.734 1.00 0.00 H new ATOM 0 HD12 ILE A 53 22.337 -10.113 -2.658 1.00 0.00 H new ATOM 0 HD13 ILE A 53 21.294 -11.555 -2.654 1.00 0.00 H new ATOM 835 N VAL A 54 24.653 -14.860 -3.368 1.00 0.00 N ATOM 836 CA VAL A 54 25.811 -15.688 -3.703 1.00 0.00 C ATOM 837 C VAL A 54 27.000 -14.765 -3.984 1.00 0.00 C ATOM 838 O VAL A 54 26.951 -13.975 -4.924 1.00 0.00 O ATOM 839 CB VAL A 54 25.530 -16.630 -4.938 1.00 0.00 C ATOM 840 CG1 VAL A 54 26.771 -17.498 -5.282 1.00 0.00 C ATOM 841 CG2 VAL A 54 24.280 -17.515 -4.679 1.00 0.00 C ATOM 0 H VAL A 54 24.016 -14.700 -4.149 1.00 0.00 H new ATOM 0 HA VAL A 54 26.032 -16.343 -2.860 1.00 0.00 H new ATOM 0 HB VAL A 54 25.325 -15.998 -5.802 1.00 0.00 H new ATOM 0 HG11 VAL A 54 26.544 -18.135 -6.137 1.00 0.00 H new ATOM 0 HG12 VAL A 54 27.612 -16.849 -5.526 1.00 0.00 H new ATOM 0 HG13 VAL A 54 27.029 -18.120 -4.425 1.00 0.00 H new ATOM 0 HG21 VAL A 54 24.103 -18.157 -5.542 1.00 0.00 H new ATOM 0 HG22 VAL A 54 24.448 -18.132 -3.796 1.00 0.00 H new ATOM 0 HG23 VAL A 54 23.411 -16.878 -4.517 1.00 0.00 H new ATOM 851 N ILE A 55 28.025 -14.832 -3.123 1.00 0.00 N ATOM 852 CA ILE A 55 29.292 -14.092 -3.302 1.00 0.00 C ATOM 853 C ILE A 55 30.409 -15.089 -3.656 1.00 0.00 C ATOM 854 O ILE A 55 30.209 -16.303 -3.581 1.00 0.00 O ATOM 855 CB ILE A 55 29.677 -13.249 -2.023 1.00 0.00 C ATOM 856 CG1 ILE A 55 29.981 -14.170 -0.803 1.00 0.00 C ATOM 857 CG2 ILE A 55 28.555 -12.233 -1.675 1.00 0.00 C ATOM 858 CD1 ILE A 55 30.432 -13.452 0.453 1.00 0.00 C ATOM 0 H ILE A 55 28.003 -15.402 -2.278 1.00 0.00 H new ATOM 0 HA ILE A 55 29.161 -13.378 -4.115 1.00 0.00 H new ATOM 0 HB ILE A 55 30.586 -12.694 -2.255 1.00 0.00 H new ATOM 0 HG12 ILE A 55 29.085 -14.746 -0.571 1.00 0.00 H new ATOM 0 HG13 ILE A 55 30.753 -14.884 -1.091 1.00 0.00 H new ATOM 0 HG21 ILE A 55 28.841 -11.663 -0.791 1.00 0.00 H new ATOM 0 HG22 ILE A 55 28.408 -11.552 -2.513 1.00 0.00 H new ATOM 0 HG23 ILE A 55 27.627 -12.769 -1.476 1.00 0.00 H new ATOM 0 HD11 ILE A 55 30.618 -14.181 1.242 1.00 0.00 H new ATOM 0 HD12 ILE A 55 31.348 -12.899 0.247 1.00 0.00 H new ATOM 0 HD13 ILE A 55 29.655 -12.759 0.775 1.00 0.00 H new ATOM 870 N GLY A 56 31.574 -14.568 -4.044 1.00 0.00 N ATOM 871 CA GLY A 56 32.670 -15.391 -4.550 1.00 0.00 C ATOM 872 C GLY A 56 33.857 -15.424 -3.619 1.00 0.00 C ATOM 873 O GLY A 56 33.726 -15.155 -2.418 1.00 0.00 O ATOM 0 H GLY A 56 31.782 -13.570 -4.016 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.311 -16.408 -4.709 1.00 0.00 H new ATOM 0 HA3 GLY A 56 32.986 -15.009 -5.521 1.00 0.00 H new ATOM 877 N GLU A 57 35.023 -15.776 -4.179 1.00 0.00 N ATOM 878 CA GLU A 57 36.290 -15.818 -3.439 1.00 0.00 C ATOM 879 C GLU A 57 36.934 -14.417 -3.438 1.00 0.00 C ATOM 880 O GLU A 57 37.197 -13.823 -4.490 1.00 0.00 O ATOM 881 CB GLU A 57 37.240 -16.894 -4.033 1.00 0.00 C ATOM 882 CG GLU A 57 37.520 -16.768 -5.546 1.00 0.00 C ATOM 883 CD GLU A 57 38.460 -17.859 -6.065 1.00 0.00 C ATOM 884 OE1 GLU A 57 39.692 -17.671 -6.017 1.00 0.00 O ATOM 885 OE2 GLU A 57 37.973 -18.926 -6.496 1.00 0.00 O ATOM 0 H GLU A 57 35.113 -16.040 -5.160 1.00 0.00 H new ATOM 0 HA GLU A 57 36.096 -16.103 -2.405 1.00 0.00 H new ATOM 0 HB2 GLU A 57 38.190 -16.850 -3.500 1.00 0.00 H new ATOM 0 HB3 GLU A 57 36.812 -17.878 -3.841 1.00 0.00 H new ATOM 0 HG2 GLU A 57 36.577 -16.817 -6.091 1.00 0.00 H new ATOM 0 HG3 GLU A 57 37.956 -15.790 -5.751 1.00 0.00 H new ATOM 892 N PHE A 58 37.124 -13.894 -2.233 1.00 0.00 N ATOM 893 CA PHE A 58 37.751 -12.591 -1.969 1.00 0.00 C ATOM 894 C PHE A 58 38.606 -12.739 -0.704 1.00 0.00 C ATOM 895 O PHE A 58 38.526 -13.768 -0.008 1.00 0.00 O ATOM 896 CB PHE A 58 36.668 -11.487 -1.785 1.00 0.00 C ATOM 897 CG PHE A 58 35.737 -11.708 -0.587 1.00 0.00 C ATOM 898 CD1 PHE A 58 34.745 -12.683 -0.630 1.00 0.00 C ATOM 899 CD2 PHE A 58 35.873 -10.961 0.587 1.00 0.00 C ATOM 900 CE1 PHE A 58 33.925 -12.906 0.446 1.00 0.00 C ATOM 901 CE2 PHE A 58 35.043 -11.187 1.662 1.00 0.00 C ATOM 902 CZ PHE A 58 34.073 -12.159 1.589 1.00 0.00 C ATOM 0 H PHE A 58 36.839 -14.376 -1.380 1.00 0.00 H new ATOM 0 HA PHE A 58 38.374 -12.289 -2.811 1.00 0.00 H new ATOM 0 HB2 PHE A 58 37.164 -10.523 -1.671 1.00 0.00 H new ATOM 0 HB3 PHE A 58 36.066 -11.430 -2.692 1.00 0.00 H new ATOM 0 HD1 PHE A 58 34.619 -13.274 -1.525 1.00 0.00 H new ATOM 0 HD2 PHE A 58 36.636 -10.200 0.651 1.00 0.00 H new ATOM 0 HE1 PHE A 58 33.163 -13.669 0.395 1.00 0.00 H new ATOM 0 HE2 PHE A 58 35.154 -10.601 2.562 1.00 0.00 H new ATOM 0 HZ PHE A 58 33.425 -12.336 2.434 1.00 0.00 H new ATOM 912 N ASP A 59 39.402 -11.717 -0.392 1.00 0.00 N ATOM 913 CA ASP A 59 40.233 -11.702 0.820 1.00 0.00 C ATOM 914 C ASP A 59 39.395 -11.143 1.988 1.00 0.00 C ATOM 915 O ASP A 59 39.028 -9.957 1.986 1.00 0.00 O ATOM 916 CB ASP A 59 41.513 -10.869 0.579 1.00 0.00 C ATOM 917 CG ASP A 59 42.505 -10.953 1.750 1.00 0.00 C ATOM 918 OD1 ASP A 59 43.345 -11.872 1.769 1.00 0.00 O ATOM 919 OD2 ASP A 59 42.442 -10.117 2.657 1.00 0.00 O ATOM 0 H ASP A 59 39.492 -10.879 -0.966 1.00 0.00 H new ATOM 0 HA ASP A 59 40.552 -12.713 1.073 1.00 0.00 H new ATOM 0 HB2 ASP A 59 42.002 -11.217 -0.331 1.00 0.00 H new ATOM 0 HB3 ASP A 59 41.238 -9.827 0.415 1.00 0.00 H new ATOM 924 N GLU A 60 39.076 -12.014 2.968 1.00 0.00 N ATOM 925 CA GLU A 60 38.208 -11.667 4.117 1.00 0.00 C ATOM 926 C GLU A 60 38.895 -10.685 5.085 1.00 0.00 C ATOM 927 O GLU A 60 38.208 -9.970 5.820 1.00 0.00 O ATOM 928 CB GLU A 60 37.758 -12.941 4.884 1.00 0.00 C ATOM 929 CG GLU A 60 38.896 -13.762 5.540 1.00 0.00 C ATOM 930 CD GLU A 60 38.381 -14.916 6.417 1.00 0.00 C ATOM 931 OE1 GLU A 60 38.100 -16.006 5.880 1.00 0.00 O ATOM 932 OE2 GLU A 60 38.257 -14.739 7.646 1.00 0.00 O ATOM 0 H GLU A 60 39.412 -12.977 2.987 1.00 0.00 H new ATOM 0 HA GLU A 60 37.328 -11.173 3.706 1.00 0.00 H new ATOM 0 HB2 GLU A 60 37.052 -12.646 5.661 1.00 0.00 H new ATOM 0 HB3 GLU A 60 37.219 -13.588 4.193 1.00 0.00 H new ATOM 0 HG2 GLU A 60 39.540 -14.167 4.759 1.00 0.00 H new ATOM 0 HG3 GLU A 60 39.511 -13.098 6.148 1.00 0.00 H new ATOM 939 N GLU A 61 40.242 -10.666 5.065 1.00 0.00 N ATOM 940 CA GLU A 61 41.050 -9.786 5.924 1.00 0.00 C ATOM 941 C GLU A 61 40.893 -8.316 5.468 1.00 0.00 C ATOM 942 O GLU A 61 40.838 -7.404 6.301 1.00 0.00 O ATOM 943 CB GLU A 61 42.537 -10.227 5.894 1.00 0.00 C ATOM 944 CG GLU A 61 43.449 -9.561 6.947 1.00 0.00 C ATOM 945 CD GLU A 61 43.130 -9.979 8.392 1.00 0.00 C ATOM 946 OE1 GLU A 61 43.284 -11.181 8.712 1.00 0.00 O ATOM 947 OE2 GLU A 61 42.732 -9.126 9.212 1.00 0.00 O ATOM 0 H GLU A 61 40.798 -11.262 4.452 1.00 0.00 H new ATOM 0 HA GLU A 61 40.697 -9.864 6.952 1.00 0.00 H new ATOM 0 HB2 GLU A 61 42.580 -11.307 6.032 1.00 0.00 H new ATOM 0 HB3 GLU A 61 42.941 -10.016 4.904 1.00 0.00 H new ATOM 0 HG2 GLU A 61 44.487 -9.811 6.726 1.00 0.00 H new ATOM 0 HG3 GLU A 61 43.357 -8.478 6.862 1.00 0.00 H new ATOM 954 N GLU A 62 40.805 -8.117 4.131 1.00 0.00 N ATOM 955 CA GLU A 62 40.449 -6.821 3.528 1.00 0.00 C ATOM 956 C GLU A 62 39.045 -6.411 4.001 1.00 0.00 C ATOM 957 O GLU A 62 38.864 -5.349 4.594 1.00 0.00 O ATOM 958 CB GLU A 62 40.459 -6.893 1.967 1.00 0.00 C ATOM 959 CG GLU A 62 41.831 -7.152 1.320 1.00 0.00 C ATOM 960 CD GLU A 62 42.851 -6.031 1.571 1.00 0.00 C ATOM 961 OE1 GLU A 62 42.679 -4.931 1.008 1.00 0.00 O ATOM 962 OE2 GLU A 62 43.829 -6.243 2.313 1.00 0.00 O ATOM 0 H GLU A 62 40.979 -8.852 3.446 1.00 0.00 H new ATOM 0 HA GLU A 62 41.190 -6.086 3.842 1.00 0.00 H new ATOM 0 HB2 GLU A 62 39.775 -7.682 1.654 1.00 0.00 H new ATOM 0 HB3 GLU A 62 40.064 -5.955 1.576 1.00 0.00 H new ATOM 0 HG2 GLU A 62 42.233 -8.090 1.703 1.00 0.00 H new ATOM 0 HG3 GLU A 62 41.699 -7.277 0.245 1.00 0.00 H new ATOM 969 N ALA A 63 38.076 -7.319 3.777 1.00 0.00 N ATOM 970 CA ALA A 63 36.646 -7.070 4.029 1.00 0.00 C ATOM 971 C ALA A 63 36.370 -6.685 5.496 1.00 0.00 C ATOM 972 O ALA A 63 35.551 -5.790 5.765 1.00 0.00 O ATOM 973 CB ALA A 63 35.829 -8.308 3.640 1.00 0.00 C ATOM 0 H ALA A 63 38.266 -8.253 3.413 1.00 0.00 H new ATOM 0 HA ALA A 63 36.344 -6.222 3.414 1.00 0.00 H new ATOM 0 HB1 ALA A 63 34.772 -8.120 3.828 1.00 0.00 H new ATOM 0 HB2 ALA A 63 35.977 -8.524 2.582 1.00 0.00 H new ATOM 0 HB3 ALA A 63 36.157 -9.161 4.233 1.00 0.00 H new ATOM 979 N ARG A 64 37.080 -7.344 6.431 1.00 0.00 N ATOM 980 CA ARG A 64 36.871 -7.133 7.867 1.00 0.00 C ATOM 981 C ARG A 64 37.455 -5.788 8.314 1.00 0.00 C ATOM 982 O ARG A 64 36.788 -5.058 9.025 1.00 0.00 O ATOM 983 CB ARG A 64 37.409 -8.333 8.721 1.00 0.00 C ATOM 984 CG ARG A 64 38.942 -8.585 8.715 1.00 0.00 C ATOM 985 CD ARG A 64 39.711 -7.847 9.827 1.00 0.00 C ATOM 986 NE ARG A 64 39.342 -8.338 11.167 1.00 0.00 N ATOM 987 CZ ARG A 64 40.203 -8.779 12.091 1.00 0.00 C ATOM 988 NH1 ARG A 64 41.499 -8.824 11.843 1.00 0.00 N ATOM 989 NH2 ARG A 64 39.752 -9.211 13.249 1.00 0.00 N ATOM 0 H ARG A 64 37.804 -8.028 6.212 1.00 0.00 H new ATOM 0 HA ARG A 64 35.796 -7.094 8.044 1.00 0.00 H new ATOM 0 HB2 ARG A 64 37.097 -8.178 9.754 1.00 0.00 H new ATOM 0 HB3 ARG A 64 36.917 -9.241 8.373 1.00 0.00 H new ATOM 0 HG2 ARG A 64 39.123 -9.655 8.814 1.00 0.00 H new ATOM 0 HG3 ARG A 64 39.344 -8.282 7.748 1.00 0.00 H new ATOM 0 HD2 ARG A 64 40.783 -7.976 9.675 1.00 0.00 H new ATOM 0 HD3 ARG A 64 39.506 -6.778 9.763 1.00 0.00 H new ATOM 0 HE ARG A 64 38.351 -8.342 11.409 1.00 0.00 H new ATOM 0 HH11 ARG A 64 41.856 -8.520 10.937 1.00 0.00 H new ATOM 0 HH12 ARG A 64 42.143 -9.163 12.557 1.00 0.00 H new ATOM 0 HH21 ARG A 64 38.750 -9.209 13.439 1.00 0.00 H new ATOM 0 HH22 ARG A 64 40.405 -9.548 13.957 1.00 0.00 H new ATOM 1003 N GLU A 65 38.690 -5.447 7.858 1.00 0.00 N ATOM 1004 CA GLU A 65 39.398 -4.227 8.322 1.00 0.00 C ATOM 1005 C GLU A 65 38.681 -2.951 7.847 1.00 0.00 C ATOM 1006 O GLU A 65 38.548 -1.985 8.605 1.00 0.00 O ATOM 1007 CB GLU A 65 40.896 -4.209 7.890 1.00 0.00 C ATOM 1008 CG GLU A 65 41.150 -4.161 6.370 1.00 0.00 C ATOM 1009 CD GLU A 65 42.638 -4.165 5.994 1.00 0.00 C ATOM 1010 OE1 GLU A 65 43.252 -5.246 5.981 1.00 0.00 O ATOM 1011 OE2 GLU A 65 43.205 -3.080 5.719 1.00 0.00 O ATOM 0 H GLU A 65 39.211 -5.996 7.175 1.00 0.00 H new ATOM 0 HA GLU A 65 39.376 -4.250 9.412 1.00 0.00 H new ATOM 0 HB2 GLU A 65 41.377 -3.345 8.348 1.00 0.00 H new ATOM 0 HB3 GLU A 65 41.383 -5.097 8.294 1.00 0.00 H new ATOM 0 HG2 GLU A 65 40.664 -5.017 5.902 1.00 0.00 H new ATOM 0 HG3 GLU A 65 40.683 -3.265 5.960 1.00 0.00 H new ATOM 1018 N LEU A 66 38.192 -2.971 6.592 1.00 0.00 N ATOM 1019 CA LEU A 66 37.452 -1.839 6.008 1.00 0.00 C ATOM 1020 C LEU A 66 35.964 -1.876 6.446 1.00 0.00 C ATOM 1021 O LEU A 66 35.246 -0.876 6.322 1.00 0.00 O ATOM 1022 CB LEU A 66 37.670 -1.790 4.460 1.00 0.00 C ATOM 1023 CG LEU A 66 37.113 -2.978 3.597 1.00 0.00 C ATOM 1024 CD1 LEU A 66 35.640 -2.787 3.228 1.00 0.00 C ATOM 1025 CD2 LEU A 66 37.958 -3.224 2.324 1.00 0.00 C ATOM 0 H LEU A 66 38.298 -3.765 5.961 1.00 0.00 H new ATOM 0 HA LEU A 66 37.845 -0.898 6.393 1.00 0.00 H new ATOM 0 HB2 LEU A 66 37.221 -0.869 4.089 1.00 0.00 H new ATOM 0 HB3 LEU A 66 38.742 -1.718 4.276 1.00 0.00 H new ATOM 0 HG LEU A 66 37.189 -3.864 4.228 1.00 0.00 H new ATOM 0 HD11 LEU A 66 35.302 -3.634 2.632 1.00 0.00 H new ATOM 0 HD12 LEU A 66 35.043 -2.722 4.137 1.00 0.00 H new ATOM 0 HD13 LEU A 66 35.525 -1.869 2.652 1.00 0.00 H new ATOM 0 HD21 LEU A 66 37.533 -4.055 1.760 1.00 0.00 H new ATOM 0 HD22 LEU A 66 37.954 -2.326 1.706 1.00 0.00 H new ATOM 0 HD23 LEU A 66 38.983 -3.464 2.608 1.00 0.00 H new ATOM 1037 N GLY A 67 35.526 -3.049 6.958 1.00 0.00 N ATOM 1038 CA GLY A 67 34.236 -3.190 7.646 1.00 0.00 C ATOM 1039 C GLY A 67 34.273 -2.572 9.053 1.00 0.00 C ATOM 1040 O GLY A 67 33.267 -2.062 9.550 1.00 0.00 O ATOM 0 H GLY A 67 36.059 -3.917 6.903 1.00 0.00 H new ATOM 0 HA2 GLY A 67 33.455 -2.709 7.057 1.00 0.00 H new ATOM 0 HA3 GLY A 67 33.976 -4.246 7.719 1.00 0.00 H new ATOM 1044 N ARG A 68 35.459 -2.644 9.695 1.00 0.00 N ATOM 1045 CA ARG A 68 35.745 -1.991 10.993 1.00 0.00 C ATOM 1046 C ARG A 68 35.975 -0.481 10.789 1.00 0.00 C ATOM 1047 O ARG A 68 35.729 0.322 11.695 1.00 0.00 O ATOM 1048 CB ARG A 68 36.974 -2.663 11.660 1.00 0.00 C ATOM 1049 CG ARG A 68 36.775 -4.167 11.974 1.00 0.00 C ATOM 1050 CD ARG A 68 38.101 -4.912 12.218 1.00 0.00 C ATOM 1051 NE ARG A 68 38.758 -4.486 13.469 1.00 0.00 N ATOM 1052 CZ ARG A 68 38.920 -5.253 14.554 1.00 0.00 C ATOM 1053 NH1 ARG A 68 38.487 -6.507 14.574 1.00 0.00 N ATOM 1054 NH2 ARG A 68 39.518 -4.757 15.620 1.00 0.00 N ATOM 0 H ARG A 68 36.255 -3.163 9.323 1.00 0.00 H new ATOM 0 HA ARG A 68 34.888 -2.112 11.656 1.00 0.00 H new ATOM 0 HB2 ARG A 68 37.838 -2.550 11.004 1.00 0.00 H new ATOM 0 HB3 ARG A 68 37.206 -2.136 12.586 1.00 0.00 H new ATOM 0 HG2 ARG A 68 36.141 -4.268 12.855 1.00 0.00 H new ATOM 0 HG3 ARG A 68 36.247 -4.639 11.145 1.00 0.00 H new ATOM 0 HD2 ARG A 68 37.911 -5.985 12.256 1.00 0.00 H new ATOM 0 HD3 ARG A 68 38.774 -4.737 11.378 1.00 0.00 H new ATOM 0 HE ARG A 68 39.117 -3.532 13.510 1.00 0.00 H new ATOM 0 HH11 ARG A 68 38.023 -6.899 13.755 1.00 0.00 H new ATOM 0 HH12 ARG A 68 38.618 -7.079 15.409 1.00 0.00 H new ATOM 0 HH21 ARG A 68 39.854 -3.794 15.614 1.00 0.00 H new ATOM 0 HH22 ARG A 68 39.644 -5.337 16.450 1.00 0.00 H new ATOM 1068 N LYS A 69 36.467 -0.114 9.587 1.00 0.00 N ATOM 1069 CA LYS A 69 36.535 1.293 9.136 1.00 0.00 C ATOM 1070 C LYS A 69 35.111 1.849 8.981 1.00 0.00 C ATOM 1071 O LYS A 69 34.870 3.023 9.235 1.00 0.00 O ATOM 1072 CB LYS A 69 37.283 1.414 7.783 1.00 0.00 C ATOM 1073 CG LYS A 69 37.329 2.844 7.185 1.00 0.00 C ATOM 1074 CD LYS A 69 37.874 2.882 5.733 1.00 0.00 C ATOM 1075 CE LYS A 69 37.025 2.053 4.746 1.00 0.00 C ATOM 1076 NZ LYS A 69 35.597 2.463 4.738 1.00 0.00 N ATOM 0 H LYS A 69 36.827 -0.781 8.904 1.00 0.00 H new ATOM 0 HA LYS A 69 37.084 1.865 9.884 1.00 0.00 H new ATOM 0 HB2 LYS A 69 38.305 1.060 7.917 1.00 0.00 H new ATOM 0 HB3 LYS A 69 36.807 0.750 7.061 1.00 0.00 H new ATOM 0 HG2 LYS A 69 36.326 3.270 7.201 1.00 0.00 H new ATOM 0 HG3 LYS A 69 37.953 3.475 7.817 1.00 0.00 H new ATOM 0 HD2 LYS A 69 37.910 3.917 5.392 1.00 0.00 H new ATOM 0 HD3 LYS A 69 38.898 2.508 5.726 1.00 0.00 H new ATOM 0 HE2 LYS A 69 37.435 2.159 3.742 1.00 0.00 H new ATOM 0 HE3 LYS A 69 37.095 0.998 5.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 35.033 1.747 4.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 35.255 2.550 5.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 35.502 3.379 4.256 1.00 0.00 H new ATOM 1090 N TRP A 70 34.180 0.975 8.545 1.00 0.00 N ATOM 1091 CA TRP A 70 32.753 1.313 8.438 1.00 0.00 C ATOM 1092 C TRP A 70 32.158 1.582 9.841 1.00 0.00 C ATOM 1093 O TRP A 70 31.344 2.495 10.014 1.00 0.00 O ATOM 1094 CB TRP A 70 31.977 0.213 7.683 1.00 0.00 C ATOM 1095 CG TRP A 70 30.492 0.473 7.561 1.00 0.00 C ATOM 1096 CD1 TRP A 70 29.874 1.413 6.786 1.00 0.00 C ATOM 1097 CD2 TRP A 70 29.443 -0.227 8.246 1.00 0.00 C ATOM 1098 NE1 TRP A 70 28.512 1.333 6.940 1.00 0.00 N ATOM 1099 CE2 TRP A 70 28.224 0.333 7.828 1.00 0.00 C ATOM 1100 CE3 TRP A 70 29.427 -1.279 9.165 1.00 0.00 C ATOM 1101 CZ2 TRP A 70 27.001 -0.123 8.306 1.00 0.00 C ATOM 1102 CZ3 TRP A 70 28.213 -1.736 9.629 1.00 0.00 C ATOM 1103 CH2 TRP A 70 27.012 -1.156 9.202 1.00 0.00 C ATOM 0 H TRP A 70 34.399 0.021 8.259 1.00 0.00 H new ATOM 0 HA TRP A 70 32.654 2.228 7.854 1.00 0.00 H new ATOM 0 HB2 TRP A 70 32.399 0.107 6.684 1.00 0.00 H new ATOM 0 HB3 TRP A 70 32.127 -0.738 8.195 1.00 0.00 H new ATOM 0 HD1 TRP A 70 30.383 2.117 6.145 1.00 0.00 H new ATOM 0 HE1 TRP A 70 27.826 1.923 6.469 1.00 0.00 H new ATOM 0 HE3 TRP A 70 30.349 -1.726 9.505 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 26.073 0.324 7.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 28.187 -2.554 10.333 1.00 0.00 H new ATOM 0 HH2 TRP A 70 26.076 -1.532 9.588 1.00 0.00 H new ATOM 1114 N LEU A 71 32.601 0.790 10.838 1.00 0.00 N ATOM 1115 CA LEU A 71 32.248 0.999 12.260 1.00 0.00 C ATOM 1116 C LEU A 71 32.870 2.306 12.813 1.00 0.00 C ATOM 1117 O LEU A 71 32.331 2.923 13.736 1.00 0.00 O ATOM 1118 CB LEU A 71 32.703 -0.225 13.105 1.00 0.00 C ATOM 1119 CG LEU A 71 32.066 -1.598 12.703 1.00 0.00 C ATOM 1120 CD1 LEU A 71 32.669 -2.765 13.519 1.00 0.00 C ATOM 1121 CD2 LEU A 71 30.522 -1.554 12.830 1.00 0.00 C ATOM 0 H LEU A 71 33.212 -0.011 10.682 1.00 0.00 H new ATOM 0 HA LEU A 71 31.165 1.097 12.330 1.00 0.00 H new ATOM 0 HB2 LEU A 71 33.787 -0.312 13.031 1.00 0.00 H new ATOM 0 HB3 LEU A 71 32.469 -0.029 14.151 1.00 0.00 H new ATOM 0 HG LEU A 71 32.307 -1.780 11.656 1.00 0.00 H new ATOM 0 HD11 LEU A 71 32.203 -3.702 13.213 1.00 0.00 H new ATOM 0 HD12 LEU A 71 33.743 -2.818 13.339 1.00 0.00 H new ATOM 0 HD13 LEU A 71 32.487 -2.599 14.581 1.00 0.00 H new ATOM 0 HD21 LEU A 71 30.106 -2.520 12.545 1.00 0.00 H new ATOM 0 HD22 LEU A 71 30.248 -1.331 13.861 1.00 0.00 H new ATOM 0 HD23 LEU A 71 30.125 -0.780 12.174 1.00 0.00 H new ATOM 1133 N GLU A 72 34.007 2.712 12.229 1.00 0.00 N ATOM 1134 CA GLU A 72 34.727 3.939 12.607 1.00 0.00 C ATOM 1135 C GLU A 72 34.054 5.200 11.996 1.00 0.00 C ATOM 1136 O GLU A 72 33.928 6.225 12.669 1.00 0.00 O ATOM 1137 CB GLU A 72 36.207 3.825 12.142 1.00 0.00 C ATOM 1138 CG GLU A 72 37.092 5.063 12.415 1.00 0.00 C ATOM 1139 CD GLU A 72 38.515 4.923 11.837 1.00 0.00 C ATOM 1140 OE1 GLU A 72 38.647 4.823 10.601 1.00 0.00 O ATOM 1141 OE2 GLU A 72 39.499 4.932 12.607 1.00 0.00 O ATOM 0 H GLU A 72 34.457 2.194 11.474 1.00 0.00 H new ATOM 0 HA GLU A 72 34.693 4.048 13.691 1.00 0.00 H new ATOM 0 HB2 GLU A 72 36.658 2.963 12.634 1.00 0.00 H new ATOM 0 HB3 GLU A 72 36.218 3.622 11.071 1.00 0.00 H new ATOM 0 HG2 GLU A 72 36.616 5.945 11.986 1.00 0.00 H new ATOM 0 HG3 GLU A 72 37.157 5.227 13.491 1.00 0.00 H new ATOM 1148 N GLU A 73 33.632 5.112 10.717 1.00 0.00 N ATOM 1149 CA GLU A 73 33.105 6.272 9.949 1.00 0.00 C ATOM 1150 C GLU A 73 31.662 6.627 10.367 1.00 0.00 C ATOM 1151 O GLU A 73 31.292 7.808 10.376 1.00 0.00 O ATOM 1152 CB GLU A 73 33.202 6.012 8.418 1.00 0.00 C ATOM 1153 CG GLU A 73 32.390 4.811 7.930 1.00 0.00 C ATOM 1154 CD GLU A 73 32.652 4.418 6.468 1.00 0.00 C ATOM 1155 OE1 GLU A 73 33.796 4.033 6.144 1.00 0.00 O ATOM 1156 OE2 GLU A 73 31.714 4.474 5.649 1.00 0.00 O ATOM 0 H GLU A 73 33.645 4.242 10.185 1.00 0.00 H new ATOM 0 HA GLU A 73 33.728 7.134 10.186 1.00 0.00 H new ATOM 0 HB2 GLU A 73 32.865 6.903 7.888 1.00 0.00 H new ATOM 0 HB3 GLU A 73 34.248 5.860 8.153 1.00 0.00 H new ATOM 0 HG2 GLU A 73 32.611 3.955 8.568 1.00 0.00 H new ATOM 0 HG3 GLU A 73 31.329 5.033 8.049 1.00 0.00 H new ATOM 1163 N LYS A 74 30.869 5.595 10.755 1.00 0.00 N ATOM 1164 CA LYS A 74 29.479 5.793 11.242 1.00 0.00 C ATOM 1165 C LYS A 74 29.480 6.476 12.624 1.00 0.00 C ATOM 1166 O LYS A 74 28.490 7.105 13.011 1.00 0.00 O ATOM 1167 CB LYS A 74 28.684 4.438 11.256 1.00 0.00 C ATOM 1168 CG LYS A 74 29.180 3.343 12.257 1.00 0.00 C ATOM 1169 CD LYS A 74 28.630 3.499 13.708 1.00 0.00 C ATOM 1170 CE LYS A 74 29.227 2.488 14.702 1.00 0.00 C ATOM 1171 NZ LYS A 74 28.908 1.092 14.337 1.00 0.00 N ATOM 0 H LYS A 74 31.168 4.620 10.740 1.00 0.00 H new ATOM 0 HA LYS A 74 28.963 6.457 10.548 1.00 0.00 H new ATOM 0 HB2 LYS A 74 27.641 4.658 11.482 1.00 0.00 H new ATOM 0 HB3 LYS A 74 28.711 4.017 10.251 1.00 0.00 H new ATOM 0 HG2 LYS A 74 28.893 2.363 11.876 1.00 0.00 H new ATOM 0 HG3 LYS A 74 30.269 3.365 12.290 1.00 0.00 H new ATOM 0 HD2 LYS A 74 28.838 4.509 14.060 1.00 0.00 H new ATOM 0 HD3 LYS A 74 27.546 3.384 13.692 1.00 0.00 H new ATOM 0 HE2 LYS A 74 30.309 2.614 14.740 1.00 0.00 H new ATOM 0 HE3 LYS A 74 28.847 2.696 15.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 29.316 0.447 15.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 27.876 0.968 14.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 29.308 0.878 13.401 1.00 0.00 H new ATOM 1185 N SER A 75 30.598 6.307 13.364 1.00 0.00 N ATOM 1186 CA SER A 75 30.801 6.918 14.691 1.00 0.00 C ATOM 1187 C SER A 75 30.793 8.462 14.589 1.00 0.00 C ATOM 1188 O SER A 75 30.380 9.158 15.528 1.00 0.00 O ATOM 1189 CB SER A 75 32.129 6.402 15.300 1.00 0.00 C ATOM 1190 OG SER A 75 32.361 6.916 16.599 1.00 0.00 O ATOM 0 H SER A 75 31.387 5.740 13.054 1.00 0.00 H new ATOM 0 HA SER A 75 29.981 6.630 15.349 1.00 0.00 H new ATOM 0 HB2 SER A 75 32.108 5.313 15.341 1.00 0.00 H new ATOM 0 HB3 SER A 75 32.957 6.681 14.648 1.00 0.00 H new ATOM 0 HG SER A 75 33.208 6.563 16.944 1.00 0.00 H new ATOM 1196 N LYS A 76 31.263 8.986 13.434 1.00 0.00 N ATOM 1197 CA LYS A 76 31.116 10.411 13.072 1.00 0.00 C ATOM 1198 C LYS A 76 29.743 10.625 12.401 1.00 0.00 C ATOM 1199 O LYS A 76 29.267 9.730 11.699 1.00 0.00 O ATOM 1200 CB LYS A 76 32.263 10.891 12.123 1.00 0.00 C ATOM 1201 CG LYS A 76 33.678 10.977 12.774 1.00 0.00 C ATOM 1202 CD LYS A 76 34.472 9.653 12.750 1.00 0.00 C ATOM 1203 CE LYS A 76 34.857 9.237 11.319 1.00 0.00 C ATOM 1204 NZ LYS A 76 35.767 8.067 11.305 1.00 0.00 N ATOM 0 H LYS A 76 31.753 8.434 12.730 1.00 0.00 H new ATOM 0 HA LYS A 76 31.181 11.005 13.984 1.00 0.00 H new ATOM 0 HB2 LYS A 76 32.314 10.213 11.271 1.00 0.00 H new ATOM 0 HB3 LYS A 76 32.001 11.874 11.733 1.00 0.00 H new ATOM 0 HG2 LYS A 76 34.256 11.743 12.257 1.00 0.00 H new ATOM 0 HG3 LYS A 76 33.570 11.303 13.808 1.00 0.00 H new ATOM 0 HD2 LYS A 76 35.375 9.761 13.351 1.00 0.00 H new ATOM 0 HD3 LYS A 76 33.876 8.864 13.209 1.00 0.00 H new ATOM 0 HE2 LYS A 76 33.955 9.001 10.755 1.00 0.00 H new ATOM 0 HE3 LYS A 76 35.337 10.076 10.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 35.800 7.664 10.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 36.722 8.367 11.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 35.419 7.348 11.971 1.00 0.00 H new ATOM 1218 N PRO A 77 29.077 11.814 12.601 1.00 0.00 N ATOM 1219 CA PRO A 77 27.804 12.148 11.904 1.00 0.00 C ATOM 1220 C PRO A 77 27.986 12.200 10.369 1.00 0.00 C ATOM 1221 O PRO A 77 29.115 12.375 9.875 1.00 0.00 O ATOM 1222 CB PRO A 77 27.437 13.546 12.480 1.00 0.00 C ATOM 1223 CG PRO A 77 28.738 14.110 12.970 1.00 0.00 C ATOM 1224 CD PRO A 77 29.501 12.925 13.509 1.00 0.00 C ATOM 0 HA PRO A 77 27.027 11.401 12.067 1.00 0.00 H new ATOM 0 HB2 PRO A 77 26.991 14.184 11.717 1.00 0.00 H new ATOM 0 HB3 PRO A 77 26.712 13.463 13.289 1.00 0.00 H new ATOM 0 HG2 PRO A 77 29.285 14.598 12.163 1.00 0.00 H new ATOM 0 HG3 PRO A 77 28.576 14.860 13.744 1.00 0.00 H new ATOM 0 HD2 PRO A 77 30.578 13.088 13.473 1.00 0.00 H new ATOM 0 HD3 PRO A 77 29.245 12.718 14.548 1.00 0.00 H new ATOM 1232 N VAL A 78 26.870 12.015 9.630 1.00 0.00 N ATOM 1233 CA VAL A 78 26.861 12.101 8.162 1.00 0.00 C ATOM 1234 C VAL A 78 27.177 13.556 7.719 1.00 0.00 C ATOM 1235 O VAL A 78 26.291 14.410 7.596 1.00 0.00 O ATOM 1236 CB VAL A 78 25.512 11.552 7.527 1.00 0.00 C ATOM 1237 CG1 VAL A 78 24.248 12.178 8.169 1.00 0.00 C ATOM 1238 CG2 VAL A 78 25.510 11.738 5.990 1.00 0.00 C ATOM 0 H VAL A 78 25.958 11.803 10.036 1.00 0.00 H new ATOM 0 HA VAL A 78 27.645 11.448 7.778 1.00 0.00 H new ATOM 0 HB VAL A 78 25.473 10.485 7.746 1.00 0.00 H new ATOM 0 HG11 VAL A 78 23.357 11.766 7.695 1.00 0.00 H new ATOM 0 HG12 VAL A 78 24.231 11.951 9.235 1.00 0.00 H new ATOM 0 HG13 VAL A 78 24.266 13.259 8.029 1.00 0.00 H new ATOM 0 HG21 VAL A 78 24.576 11.355 5.578 1.00 0.00 H new ATOM 0 HG22 VAL A 78 25.604 12.797 5.752 1.00 0.00 H new ATOM 0 HG23 VAL A 78 26.349 11.193 5.556 1.00 0.00 H new ATOM 1248 N THR A 79 28.483 13.823 7.570 1.00 0.00 N ATOM 1249 CA THR A 79 29.013 15.126 7.159 1.00 0.00 C ATOM 1250 C THR A 79 28.906 15.303 5.630 1.00 0.00 C ATOM 1251 O THR A 79 28.684 16.423 5.154 1.00 0.00 O ATOM 1252 CB THR A 79 30.490 15.308 7.665 1.00 0.00 C ATOM 1253 OG1 THR A 79 31.013 16.571 7.232 1.00 0.00 O ATOM 1254 CG2 THR A 79 31.428 14.174 7.212 1.00 0.00 C ATOM 0 H THR A 79 29.210 13.127 7.735 1.00 0.00 H new ATOM 0 HA THR A 79 28.409 15.908 7.620 1.00 0.00 H new ATOM 0 HB THR A 79 30.449 15.274 8.754 1.00 0.00 H new ATOM 0 HG1 THR A 79 31.933 16.672 7.555 1.00 0.00 H new ATOM 0 HG21 THR A 79 32.432 14.358 7.594 1.00 0.00 H new ATOM 0 HG22 THR A 79 31.062 13.223 7.598 1.00 0.00 H new ATOM 0 HG23 THR A 79 31.455 14.137 6.123 1.00 0.00 H new ATOM 1262 N LEU A 80 29.026 14.180 4.878 1.00 0.00 N ATOM 1263 CA LEU A 80 28.858 14.166 3.407 1.00 0.00 C ATOM 1264 C LEU A 80 28.869 12.695 2.905 1.00 0.00 C ATOM 1265 O LEU A 80 29.942 12.100 2.734 1.00 0.00 O ATOM 1266 CB LEU A 80 29.974 15.040 2.707 1.00 0.00 C ATOM 1267 CG LEU A 80 29.560 15.839 1.419 1.00 0.00 C ATOM 1268 CD1 LEU A 80 30.671 16.834 0.997 1.00 0.00 C ATOM 1269 CD2 LEU A 80 29.180 14.900 0.248 1.00 0.00 C ATOM 0 H LEU A 80 29.241 13.265 5.274 1.00 0.00 H new ATOM 0 HA LEU A 80 27.899 14.612 3.143 1.00 0.00 H new ATOM 0 HB2 LEU A 80 30.353 15.753 3.439 1.00 0.00 H new ATOM 0 HB3 LEU A 80 30.802 14.382 2.444 1.00 0.00 H new ATOM 0 HG LEU A 80 28.669 16.413 1.672 1.00 0.00 H new ATOM 0 HD11 LEU A 80 30.357 17.373 0.103 1.00 0.00 H new ATOM 0 HD12 LEU A 80 30.849 17.544 1.805 1.00 0.00 H new ATOM 0 HD13 LEU A 80 31.589 16.286 0.786 1.00 0.00 H new ATOM 0 HD21 LEU A 80 28.901 15.496 -0.621 1.00 0.00 H new ATOM 0 HD22 LEU A 80 30.032 14.269 -0.004 1.00 0.00 H new ATOM 0 HD23 LEU A 80 28.339 14.273 0.543 1.00 0.00 H new ATOM 1281 N GLU A 81 27.664 12.108 2.699 1.00 0.00 N ATOM 1282 CA GLU A 81 27.511 10.718 2.187 1.00 0.00 C ATOM 1283 C GLU A 81 27.303 10.697 0.659 1.00 0.00 C ATOM 1284 O GLU A 81 27.361 9.633 0.041 1.00 0.00 O ATOM 1285 CB GLU A 81 26.324 9.982 2.880 1.00 0.00 C ATOM 1286 CG GLU A 81 24.920 10.522 2.504 1.00 0.00 C ATOM 1287 CD GLU A 81 23.759 9.783 3.195 1.00 0.00 C ATOM 1288 OE1 GLU A 81 23.573 8.576 2.929 1.00 0.00 O ATOM 1289 OE2 GLU A 81 23.021 10.408 3.992 1.00 0.00 O ATOM 0 H GLU A 81 26.777 12.577 2.880 1.00 0.00 H new ATOM 0 HA GLU A 81 28.438 10.195 2.423 1.00 0.00 H new ATOM 0 HB2 GLU A 81 26.372 8.923 2.625 1.00 0.00 H new ATOM 0 HB3 GLU A 81 26.449 10.055 3.960 1.00 0.00 H new ATOM 0 HG2 GLU A 81 24.868 11.580 2.761 1.00 0.00 H new ATOM 0 HG3 GLU A 81 24.792 10.450 1.424 1.00 0.00 H new ATOM 1296 N GLU A 82 27.049 11.875 0.062 1.00 0.00 N ATOM 1297 CA GLU A 82 26.776 11.994 -1.382 1.00 0.00 C ATOM 1298 C GLU A 82 28.044 11.689 -2.211 1.00 0.00 C ATOM 1299 O GLU A 82 27.952 11.234 -3.354 1.00 0.00 O ATOM 1300 CB GLU A 82 26.214 13.404 -1.704 1.00 0.00 C ATOM 1301 CG GLU A 82 25.559 13.550 -3.094 1.00 0.00 C ATOM 1302 CD GLU A 82 24.283 12.697 -3.244 1.00 0.00 C ATOM 1303 OE1 GLU A 82 23.214 13.129 -2.761 1.00 0.00 O ATOM 1304 OE2 GLU A 82 24.351 11.580 -3.804 1.00 0.00 O ATOM 0 H GLU A 82 27.027 12.764 0.561 1.00 0.00 H new ATOM 0 HA GLU A 82 26.023 11.256 -1.658 1.00 0.00 H new ATOM 0 HB2 GLU A 82 25.478 13.666 -0.944 1.00 0.00 H new ATOM 0 HB3 GLU A 82 27.025 14.128 -1.625 1.00 0.00 H new ATOM 0 HG2 GLU A 82 25.313 14.598 -3.267 1.00 0.00 H new ATOM 0 HG3 GLU A 82 26.277 13.260 -3.861 1.00 0.00 H new ATOM 1311 N LEU A 83 29.225 11.921 -1.601 1.00 0.00 N ATOM 1312 CA LEU A 83 30.533 11.584 -2.208 1.00 0.00 C ATOM 1313 C LEU A 83 30.779 10.051 -2.159 1.00 0.00 C ATOM 1314 O LEU A 83 31.571 9.513 -2.942 1.00 0.00 O ATOM 1315 CB LEU A 83 31.678 12.361 -1.488 1.00 0.00 C ATOM 1316 CG LEU A 83 33.123 12.176 -2.073 1.00 0.00 C ATOM 1317 CD1 LEU A 83 33.206 12.616 -3.555 1.00 0.00 C ATOM 1318 CD2 LEU A 83 34.181 12.905 -1.213 1.00 0.00 C ATOM 0 H LEU A 83 29.301 12.346 -0.677 1.00 0.00 H new ATOM 0 HA LEU A 83 30.522 11.887 -3.255 1.00 0.00 H new ATOM 0 HB2 LEU A 83 31.435 13.423 -1.508 1.00 0.00 H new ATOM 0 HB3 LEU A 83 31.692 12.057 -0.441 1.00 0.00 H new ATOM 0 HG LEU A 83 33.346 11.110 -2.038 1.00 0.00 H new ATOM 0 HD11 LEU A 83 34.223 12.472 -3.921 1.00 0.00 H new ATOM 0 HD12 LEU A 83 32.517 12.018 -4.151 1.00 0.00 H new ATOM 0 HD13 LEU A 83 32.937 13.669 -3.638 1.00 0.00 H new ATOM 0 HD21 LEU A 83 35.169 12.755 -1.648 1.00 0.00 H new ATOM 0 HD22 LEU A 83 33.955 13.971 -1.184 1.00 0.00 H new ATOM 0 HD23 LEU A 83 34.166 12.504 -0.200 1.00 0.00 H new ATOM 1330 N LYS A 84 30.094 9.355 -1.230 1.00 0.00 N ATOM 1331 CA LYS A 84 30.131 7.876 -1.128 1.00 0.00 C ATOM 1332 C LYS A 84 29.231 7.248 -2.218 1.00 0.00 C ATOM 1333 O LYS A 84 29.470 6.115 -2.658 1.00 0.00 O ATOM 1334 CB LYS A 84 29.666 7.420 0.286 1.00 0.00 C ATOM 1335 CG LYS A 84 30.417 8.100 1.456 1.00 0.00 C ATOM 1336 CD LYS A 84 29.854 7.706 2.849 1.00 0.00 C ATOM 1337 CE LYS A 84 30.076 6.221 3.195 1.00 0.00 C ATOM 1338 NZ LYS A 84 31.523 5.883 3.256 1.00 0.00 N ATOM 0 H LYS A 84 29.500 9.798 -0.529 1.00 0.00 H new ATOM 0 HA LYS A 84 31.156 7.538 -1.281 1.00 0.00 H new ATOM 0 HB2 LYS A 84 28.600 7.623 0.388 1.00 0.00 H new ATOM 0 HB3 LYS A 84 29.794 6.341 0.367 1.00 0.00 H new ATOM 0 HG2 LYS A 84 31.472 7.832 1.408 1.00 0.00 H new ATOM 0 HG3 LYS A 84 30.357 9.182 1.339 1.00 0.00 H new ATOM 0 HD2 LYS A 84 30.325 8.325 3.613 1.00 0.00 H new ATOM 0 HD3 LYS A 84 28.786 7.923 2.877 1.00 0.00 H new ATOM 0 HE2 LYS A 84 29.609 5.997 4.154 1.00 0.00 H new ATOM 0 HE3 LYS A 84 29.587 5.596 2.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 31.688 5.198 4.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 31.821 5.469 2.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 32.074 6.746 3.440 1.00 0.00 H new ATOM 1352 N SER A 85 28.188 8.002 -2.625 1.00 0.00 N ATOM 1353 CA SER A 85 27.271 7.613 -3.710 1.00 0.00 C ATOM 1354 C SER A 85 28.010 7.700 -5.059 1.00 0.00 C ATOM 1355 O SER A 85 28.437 8.791 -5.465 1.00 0.00 O ATOM 1356 CB SER A 85 26.037 8.546 -3.723 1.00 0.00 C ATOM 1357 OG SER A 85 25.491 8.699 -2.424 1.00 0.00 O ATOM 0 H SER A 85 27.960 8.903 -2.205 1.00 0.00 H new ATOM 0 HA SER A 85 26.933 6.590 -3.547 1.00 0.00 H new ATOM 0 HB2 SER A 85 26.321 9.522 -4.117 1.00 0.00 H new ATOM 0 HB3 SER A 85 25.279 8.140 -4.393 1.00 0.00 H new ATOM 0 HG SER A 85 24.714 9.295 -2.464 1.00 0.00 H new ATOM 1363 N TYR A 86 28.175 6.548 -5.732 1.00 0.00 N ATOM 1364 CA TYR A 86 28.951 6.454 -6.981 1.00 0.00 C ATOM 1365 C TYR A 86 28.150 6.990 -8.190 1.00 0.00 C ATOM 1366 O TYR A 86 26.921 6.825 -8.268 1.00 0.00 O ATOM 1367 CB TYR A 86 29.422 4.988 -7.232 1.00 0.00 C ATOM 1368 CG TYR A 86 28.304 3.949 -7.480 1.00 0.00 C ATOM 1369 CD1 TYR A 86 27.623 3.341 -6.420 1.00 0.00 C ATOM 1370 CD2 TYR A 86 27.931 3.577 -8.781 1.00 0.00 C ATOM 1371 CE1 TYR A 86 26.620 2.413 -6.649 1.00 0.00 C ATOM 1372 CE2 TYR A 86 26.928 2.653 -9.008 1.00 0.00 C ATOM 1373 CZ TYR A 86 26.278 2.074 -7.942 1.00 0.00 C ATOM 1374 OH TYR A 86 25.274 1.153 -8.166 1.00 0.00 O ATOM 0 H TYR A 86 27.776 5.660 -5.427 1.00 0.00 H new ATOM 0 HA TYR A 86 29.834 7.083 -6.868 1.00 0.00 H new ATOM 0 HB2 TYR A 86 30.091 4.985 -8.093 1.00 0.00 H new ATOM 0 HB3 TYR A 86 30.008 4.663 -6.372 1.00 0.00 H new ATOM 0 HD1 TYR A 86 27.884 3.600 -5.404 1.00 0.00 H new ATOM 0 HD2 TYR A 86 28.439 4.023 -9.624 1.00 0.00 H new ATOM 0 HE1 TYR A 86 26.106 1.955 -5.816 1.00 0.00 H new ATOM 0 HE2 TYR A 86 26.655 2.386 -10.018 1.00 0.00 H new ATOM 0 HH TYR A 86 25.155 1.026 -9.131 1.00 0.00 H new ATOM 1384 N GLY A 87 28.876 7.639 -9.108 1.00 0.00 N ATOM 1385 CA GLY A 87 28.350 8.100 -10.392 1.00 0.00 C ATOM 1386 C GLY A 87 29.352 7.805 -11.486 1.00 0.00 C ATOM 1387 O GLY A 87 29.005 7.230 -12.529 1.00 0.00 O ATOM 0 H GLY A 87 29.863 7.861 -8.974 1.00 0.00 H new ATOM 0 HA2 GLY A 87 27.404 7.604 -10.608 1.00 0.00 H new ATOM 0 HA3 GLY A 87 28.147 9.170 -10.350 1.00 0.00 H new ATOM 1391 N PHE A 88 30.607 8.266 -11.240 1.00 0.00 N ATOM 1392 CA PHE A 88 31.818 7.878 -12.006 1.00 0.00 C ATOM 1393 C PHE A 88 31.775 8.412 -13.464 1.00 0.00 C ATOM 1394 O PHE A 88 32.611 8.049 -14.297 1.00 0.00 O ATOM 1395 CB PHE A 88 32.003 6.326 -11.926 1.00 0.00 C ATOM 1396 CG PHE A 88 33.356 5.776 -12.383 1.00 0.00 C ATOM 1397 CD1 PHE A 88 34.545 6.249 -11.823 1.00 0.00 C ATOM 1398 CD2 PHE A 88 33.439 4.767 -13.346 1.00 0.00 C ATOM 1399 CE1 PHE A 88 35.766 5.736 -12.218 1.00 0.00 C ATOM 1400 CE2 PHE A 88 34.663 4.259 -13.741 1.00 0.00 C ATOM 1401 CZ PHE A 88 35.826 4.741 -13.173 1.00 0.00 C ATOM 0 H PHE A 88 30.807 8.929 -10.491 1.00 0.00 H new ATOM 0 HA PHE A 88 32.694 8.345 -11.557 1.00 0.00 H new ATOM 0 HB2 PHE A 88 31.839 6.015 -10.894 1.00 0.00 H new ATOM 0 HB3 PHE A 88 31.224 5.858 -12.527 1.00 0.00 H new ATOM 0 HD1 PHE A 88 34.510 7.025 -11.072 1.00 0.00 H new ATOM 0 HD2 PHE A 88 32.534 4.378 -13.788 1.00 0.00 H new ATOM 0 HE1 PHE A 88 36.677 6.115 -11.778 1.00 0.00 H new ATOM 0 HE2 PHE A 88 34.709 3.486 -14.493 1.00 0.00 H new ATOM 0 HZ PHE A 88 36.782 4.340 -13.476 1.00 0.00 H new ATOM 1411 N GLY A 89 30.828 9.326 -13.731 1.00 0.00 N ATOM 1412 CA GLY A 89 30.603 9.869 -15.066 1.00 0.00 C ATOM 1413 C GLY A 89 29.371 10.745 -15.098 1.00 0.00 C ATOM 1414 O GLY A 89 28.330 10.351 -15.642 1.00 0.00 O ATOM 0 H GLY A 89 30.200 9.705 -13.022 1.00 0.00 H new ATOM 0 HA2 GLY A 89 31.472 10.448 -15.378 1.00 0.00 H new ATOM 0 HA3 GLY A 89 30.491 9.053 -15.780 1.00 0.00 H new ATOM 1418 N GLU A 90 29.472 11.935 -14.481 1.00 0.00 N ATOM 1419 CA GLU A 90 28.372 12.915 -14.411 1.00 0.00 C ATOM 1420 C GLU A 90 28.289 13.711 -15.735 1.00 0.00 C ATOM 1421 O GLU A 90 28.597 14.910 -15.783 1.00 0.00 O ATOM 1422 CB GLU A 90 28.524 13.871 -13.177 1.00 0.00 C ATOM 1423 CG GLU A 90 28.559 13.180 -11.782 1.00 0.00 C ATOM 1424 CD GLU A 90 29.879 12.440 -11.480 1.00 0.00 C ATOM 1425 OE1 GLU A 90 30.907 13.121 -11.290 1.00 0.00 O ATOM 1426 OE2 GLU A 90 29.909 11.190 -11.484 1.00 0.00 O ATOM 0 H GLU A 90 30.324 12.247 -14.014 1.00 0.00 H new ATOM 0 HA GLU A 90 27.438 12.371 -14.273 1.00 0.00 H new ATOM 0 HB2 GLU A 90 29.441 14.447 -13.299 1.00 0.00 H new ATOM 0 HB3 GLU A 90 27.698 14.582 -13.188 1.00 0.00 H new ATOM 0 HG2 GLU A 90 28.392 13.932 -11.011 1.00 0.00 H new ATOM 0 HG3 GLU A 90 27.734 12.470 -11.719 1.00 0.00 H new ATOM 1433 N GLU A 91 27.869 13.004 -16.793 1.00 0.00 N ATOM 1434 CA GLU A 91 27.738 13.533 -18.155 1.00 0.00 C ATOM 1435 C GLU A 91 27.023 12.479 -19.017 1.00 0.00 C ATOM 1436 O GLU A 91 27.215 11.272 -18.809 1.00 0.00 O ATOM 1437 CB GLU A 91 29.136 13.868 -18.770 1.00 0.00 C ATOM 1438 CG GLU A 91 29.128 14.426 -20.215 1.00 0.00 C ATOM 1439 CD GLU A 91 28.336 15.736 -20.365 1.00 0.00 C ATOM 1440 OE1 GLU A 91 28.886 16.811 -20.054 1.00 0.00 O ATOM 1441 OE2 GLU A 91 27.149 15.701 -20.769 1.00 0.00 O ATOM 0 H GLU A 91 27.604 12.022 -16.722 1.00 0.00 H new ATOM 0 HA GLU A 91 27.162 14.458 -18.127 1.00 0.00 H new ATOM 0 HB2 GLU A 91 29.630 14.594 -18.124 1.00 0.00 H new ATOM 0 HB3 GLU A 91 29.743 12.963 -18.755 1.00 0.00 H new ATOM 0 HG2 GLU A 91 30.156 14.594 -20.536 1.00 0.00 H new ATOM 0 HG3 GLU A 91 28.704 13.676 -20.883 1.00 0.00 H new ATOM 1448 N GLY A 92 26.222 12.939 -19.989 1.00 0.00 N ATOM 1449 CA GLY A 92 25.513 12.049 -20.902 1.00 0.00 C ATOM 1450 C GLY A 92 25.174 12.720 -22.223 1.00 0.00 C ATOM 1451 O GLY A 92 24.829 13.905 -22.255 1.00 0.00 O ATOM 0 H GLY A 92 26.052 13.930 -20.159 1.00 0.00 H new ATOM 0 HA2 GLY A 92 26.125 11.167 -21.093 1.00 0.00 H new ATOM 0 HA3 GLY A 92 24.595 11.704 -20.427 1.00 0.00 H new ATOM 1455 N GLU A 93 25.272 11.955 -23.326 1.00 0.00 N ATOM 1456 CA GLU A 93 24.907 12.424 -24.679 1.00 0.00 C ATOM 1457 C GLU A 93 23.368 12.491 -24.839 1.00 0.00 C ATOM 1458 O GLU A 93 22.847 13.303 -25.613 1.00 0.00 O ATOM 1459 CB GLU A 93 25.546 11.500 -25.753 1.00 0.00 C ATOM 1460 CG GLU A 93 25.104 10.015 -25.683 1.00 0.00 C ATOM 1461 CD GLU A 93 25.892 9.104 -26.640 1.00 0.00 C ATOM 1462 OE1 GLU A 93 25.589 9.091 -27.854 1.00 0.00 O ATOM 1463 OE2 GLU A 93 26.827 8.406 -26.189 1.00 0.00 O ATOM 0 H GLU A 93 25.607 10.992 -23.306 1.00 0.00 H new ATOM 0 HA GLU A 93 25.297 13.432 -24.820 1.00 0.00 H new ATOM 0 HB2 GLU A 93 25.300 11.891 -26.740 1.00 0.00 H new ATOM 0 HB3 GLU A 93 26.630 11.546 -25.653 1.00 0.00 H new ATOM 0 HG2 GLU A 93 25.228 9.653 -24.662 1.00 0.00 H new ATOM 0 HG3 GLU A 93 24.042 9.947 -25.919 1.00 0.00 H new ATOM 1470 N GLY A 94 22.658 11.631 -24.090 1.00 0.00 N ATOM 1471 CA GLY A 94 21.197 11.596 -24.104 1.00 0.00 C ATOM 1472 C GLY A 94 20.657 10.221 -23.739 1.00 0.00 C ATOM 1473 O GLY A 94 20.867 9.257 -24.479 1.00 0.00 O ATOM 0 H GLY A 94 23.083 10.947 -23.464 1.00 0.00 H new ATOM 0 HA2 GLY A 94 20.810 12.335 -23.403 1.00 0.00 H new ATOM 0 HA3 GLY A 94 20.837 11.876 -25.094 1.00 0.00 H new ATOM 1477 N SER A 95 19.975 10.129 -22.590 1.00 0.00 N ATOM 1478 CA SER A 95 19.343 8.892 -22.115 1.00 0.00 C ATOM 1479 C SER A 95 17.865 8.862 -22.586 1.00 0.00 C ATOM 1480 O SER A 95 17.044 9.624 -22.032 1.00 0.00 O ATOM 1481 CB SER A 95 19.457 8.813 -20.575 1.00 0.00 C ATOM 1482 OG SER A 95 20.801 8.965 -20.155 1.00 0.00 O ATOM 1483 OXT SER A 95 17.550 8.130 -23.539 1.00 0.00 O ATOM 0 H SER A 95 19.845 10.919 -21.958 1.00 0.00 H new ATOM 0 HA SER A 95 19.849 8.021 -22.531 1.00 0.00 H new ATOM 0 HB2 SER A 95 18.841 9.589 -20.121 1.00 0.00 H new ATOM 0 HB3 SER A 95 19.070 7.855 -20.227 1.00 0.00 H new ATOM 0 HG SER A 95 20.846 8.913 -19.177 1.00 0.00 H new TER 1489 SER A 95