USER MOD reduce.3.24.130724 H: found=0, std=0, add=573, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 576 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 MET CE :methyl -163:sc= -0.877 (180deg=-1.04) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -3:sc= 0.831 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 138:sc= 1.27 (180deg=0.0272) USER MOD Single : A 23 SER OG : rot 180:sc= -0.007 USER MOD Single : A 30 LYS NZ :NH3+ 147:sc= 1.11 (180deg=0.365) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 172:sc= 3.06 (180deg=2.7) USER MOD Single : A 48 ASN : amide:sc= -0.0713 K(o=-0.071,f=-1.3!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 4 14.851 19.309 5.300 1.00 0.00 N ATOM 2 CA MET A 4 13.526 18.802 4.882 1.00 0.00 C ATOM 3 C MET A 4 13.687 17.506 4.098 1.00 0.00 C ATOM 4 O MET A 4 14.393 17.463 3.092 1.00 0.00 O ATOM 5 CB MET A 4 12.806 19.840 4.014 1.00 0.00 C ATOM 6 CG MET A 4 11.475 19.353 3.458 1.00 0.00 C ATOM 7 SD MET A 4 10.703 20.548 2.348 1.00 0.00 S ATOM 8 CE MET A 4 9.188 19.686 1.929 1.00 0.00 C ATOM 0 HA MET A 4 12.931 18.613 5.775 1.00 0.00 H new ATOM 0 HB2 MET A 4 12.636 20.740 4.605 1.00 0.00 H new ATOM 0 HB3 MET A 4 13.455 20.121 3.185 1.00 0.00 H new ATOM 0 HG2 MET A 4 11.630 18.415 2.924 1.00 0.00 H new ATOM 0 HG3 MET A 4 10.797 19.141 4.284 1.00 0.00 H new ATOM 0 HE1 MET A 4 8.598 20.298 1.246 1.00 0.00 H new ATOM 0 HE2 MET A 4 9.430 18.737 1.450 1.00 0.00 H new ATOM 0 HE3 MET A 4 8.614 19.498 2.836 1.00 0.00 H new ATOM 20 N VAL A 5 13.034 16.453 4.561 1.00 0.00 N ATOM 21 CA VAL A 5 13.102 15.170 3.892 1.00 0.00 C ATOM 22 C VAL A 5 11.950 15.030 2.907 1.00 0.00 C ATOM 23 O VAL A 5 10.779 15.142 3.273 1.00 0.00 O ATOM 24 CB VAL A 5 13.099 13.997 4.903 1.00 0.00 C ATOM 25 CG1 VAL A 5 11.861 14.020 5.790 1.00 0.00 C ATOM 26 CG2 VAL A 5 13.212 12.663 4.181 1.00 0.00 C ATOM 0 H VAL A 5 12.451 16.464 5.398 1.00 0.00 H new ATOM 0 HA VAL A 5 14.044 15.128 3.345 1.00 0.00 H new ATOM 0 HB VAL A 5 13.969 14.120 5.547 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.896 13.181 6.485 1.00 0.00 H new ATOM 0 HG12 VAL A 5 11.832 14.955 6.350 1.00 0.00 H new ATOM 0 HG13 VAL A 5 10.968 13.940 5.170 1.00 0.00 H new ATOM 0 HG21 VAL A 5 13.208 11.853 4.910 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.368 12.544 3.502 1.00 0.00 H new ATOM 0 HG23 VAL A 5 14.142 12.635 3.612 1.00 0.00 H new ATOM 36 N ILE A 6 12.286 14.839 1.642 1.00 0.00 N ATOM 37 CA ILE A 6 11.279 14.609 0.624 1.00 0.00 C ATOM 38 C ILE A 6 11.190 13.124 0.315 1.00 0.00 C ATOM 39 O ILE A 6 12.187 12.484 -0.025 1.00 0.00 O ATOM 40 CB ILE A 6 11.549 15.411 -0.672 1.00 0.00 C ATOM 41 CG1 ILE A 6 12.977 15.180 -1.180 1.00 0.00 C ATOM 42 CG2 ILE A 6 11.301 16.892 -0.432 1.00 0.00 C ATOM 43 CD1 ILE A 6 13.264 15.839 -2.512 1.00 0.00 C ATOM 0 H ILE A 6 13.246 14.839 1.298 1.00 0.00 H new ATOM 0 HA ILE A 6 10.328 14.962 1.022 1.00 0.00 H new ATOM 0 HB ILE A 6 10.861 15.058 -1.441 1.00 0.00 H new ATOM 0 HG12 ILE A 6 13.682 15.557 -0.439 1.00 0.00 H new ATOM 0 HG13 ILE A 6 13.152 14.108 -1.270 1.00 0.00 H new ATOM 0 HG21 ILE A 6 11.494 17.447 -1.350 1.00 0.00 H new ATOM 0 HG22 ILE A 6 10.265 17.043 -0.128 1.00 0.00 H new ATOM 0 HG23 ILE A 6 11.966 17.249 0.354 1.00 0.00 H new ATOM 0 HD11 ILE A 6 14.293 15.632 -2.806 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.584 15.445 -3.267 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.122 16.916 -2.423 1.00 0.00 H new ATOM 55 N GLY A 7 10.000 12.575 0.472 1.00 0.00 N ATOM 56 CA GLY A 7 9.814 11.158 0.276 1.00 0.00 C ATOM 57 C GLY A 7 9.564 10.455 1.588 1.00 0.00 C ATOM 58 O GLY A 7 9.504 11.100 2.636 1.00 0.00 O ATOM 0 H GLY A 7 9.157 13.087 0.732 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.973 10.988 -0.397 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.697 10.735 -0.204 1.00 0.00 H new ATOM 62 N MET A 8 9.417 9.144 1.539 1.00 0.00 N ATOM 63 CA MET A 8 9.122 8.362 2.733 1.00 0.00 C ATOM 64 C MET A 8 9.466 6.894 2.528 1.00 0.00 C ATOM 65 O MET A 8 9.505 6.408 1.396 1.00 0.00 O ATOM 66 CB MET A 8 7.645 8.523 3.134 1.00 0.00 C ATOM 67 CG MET A 8 6.683 8.692 1.962 1.00 0.00 C ATOM 68 SD MET A 8 6.673 7.292 0.829 1.00 0.00 S ATOM 69 CE MET A 8 5.522 7.866 -0.412 1.00 0.00 C ATOM 0 H MET A 8 9.497 8.594 0.684 1.00 0.00 H new ATOM 0 HA MET A 8 9.744 8.741 3.544 1.00 0.00 H new ATOM 0 HB2 MET A 8 7.342 7.650 3.713 1.00 0.00 H new ATOM 0 HB3 MET A 8 7.553 9.388 3.790 1.00 0.00 H new ATOM 0 HG2 MET A 8 5.675 8.843 2.349 1.00 0.00 H new ATOM 0 HG3 MET A 8 6.951 9.593 1.410 1.00 0.00 H new ATOM 0 HE1 MET A 8 5.178 7.021 -1.008 1.00 0.00 H new ATOM 0 HE2 MET A 8 4.668 8.338 0.074 1.00 0.00 H new ATOM 0 HE3 MET A 8 6.017 8.589 -1.060 1.00 0.00 H new ATOM 79 N LYS A 9 9.756 6.205 3.626 1.00 0.00 N ATOM 80 CA LYS A 9 9.982 4.766 3.599 1.00 0.00 C ATOM 81 C LYS A 9 8.784 4.049 4.194 1.00 0.00 C ATOM 82 O LYS A 9 8.346 4.375 5.294 1.00 0.00 O ATOM 83 CB LYS A 9 11.229 4.391 4.398 1.00 0.00 C ATOM 84 CG LYS A 9 12.510 5.019 3.881 1.00 0.00 C ATOM 85 CD LYS A 9 13.701 4.613 4.732 1.00 0.00 C ATOM 86 CE LYS A 9 13.536 5.068 6.174 1.00 0.00 C ATOM 87 NZ LYS A 9 14.677 4.646 7.027 1.00 0.00 N ATOM 0 H LYS A 9 9.840 6.624 4.552 1.00 0.00 H new ATOM 0 HA LYS A 9 10.125 4.466 2.561 1.00 0.00 H new ATOM 0 HB2 LYS A 9 11.085 4.689 5.437 1.00 0.00 H new ATOM 0 HB3 LYS A 9 11.340 3.307 4.390 1.00 0.00 H new ATOM 0 HG2 LYS A 9 12.677 4.714 2.848 1.00 0.00 H new ATOM 0 HG3 LYS A 9 12.412 6.105 3.881 1.00 0.00 H new ATOM 0 HD2 LYS A 9 13.819 3.530 4.702 1.00 0.00 H new ATOM 0 HD3 LYS A 9 14.611 5.044 4.315 1.00 0.00 H new ATOM 0 HE2 LYS A 9 13.444 6.154 6.203 1.00 0.00 H new ATOM 0 HE3 LYS A 9 12.610 4.659 6.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 14.523 4.977 8.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 14.750 3.609 7.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.558 5.057 6.657 1.00 0.00 H new ATOM 101 N PHE A 10 8.259 3.075 3.480 1.00 0.00 N ATOM 102 CA PHE A 10 7.097 2.343 3.950 1.00 0.00 C ATOM 103 C PHE A 10 7.240 0.857 3.655 1.00 0.00 C ATOM 104 O PHE A 10 7.904 0.467 2.697 1.00 0.00 O ATOM 105 CB PHE A 10 5.816 2.905 3.321 1.00 0.00 C ATOM 106 CG PHE A 10 5.830 2.957 1.816 1.00 0.00 C ATOM 107 CD1 PHE A 10 6.524 3.951 1.146 1.00 0.00 C ATOM 108 CD2 PHE A 10 5.133 2.021 1.075 1.00 0.00 C ATOM 109 CE1 PHE A 10 6.526 4.004 -0.236 1.00 0.00 C ATOM 110 CE2 PHE A 10 5.131 2.068 -0.305 1.00 0.00 C ATOM 111 CZ PHE A 10 5.828 3.061 -0.962 1.00 0.00 C ATOM 0 H PHE A 10 8.616 2.771 2.574 1.00 0.00 H new ATOM 0 HA PHE A 10 7.028 2.466 5.031 1.00 0.00 H new ATOM 0 HB2 PHE A 10 4.971 2.296 3.643 1.00 0.00 H new ATOM 0 HB3 PHE A 10 5.649 3.911 3.705 1.00 0.00 H new ATOM 0 HD1 PHE A 10 7.070 4.693 1.709 1.00 0.00 H new ATOM 0 HD2 PHE A 10 4.583 1.242 1.582 1.00 0.00 H new ATOM 0 HE1 PHE A 10 7.073 4.783 -0.746 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.584 1.328 -0.870 1.00 0.00 H new ATOM 0 HZ PHE A 10 5.827 3.100 -2.041 1.00 0.00 H new ATOM 121 N THR A 11 6.640 0.030 4.491 1.00 0.00 N ATOM 122 CA THR A 11 6.708 -1.406 4.299 1.00 0.00 C ATOM 123 C THR A 11 5.341 -1.956 3.907 1.00 0.00 C ATOM 124 O THR A 11 4.361 -1.794 4.639 1.00 0.00 O ATOM 125 CB THR A 11 7.207 -2.127 5.565 1.00 0.00 C ATOM 126 OG1 THR A 11 8.424 -1.520 6.023 1.00 0.00 O ATOM 127 CG2 THR A 11 7.446 -3.605 5.286 1.00 0.00 C ATOM 0 H THR A 11 6.103 0.326 5.306 1.00 0.00 H new ATOM 0 HA THR A 11 7.421 -1.592 3.496 1.00 0.00 H new ATOM 0 HB THR A 11 6.442 -2.038 6.336 1.00 0.00 H new ATOM 0 HG1 THR A 11 8.736 -1.981 6.829 1.00 0.00 H new ATOM 0 HG21 THR A 11 7.798 -4.094 6.194 1.00 0.00 H new ATOM 0 HG22 THR A 11 6.515 -4.069 4.961 1.00 0.00 H new ATOM 0 HG23 THR A 11 8.197 -3.711 4.503 1.00 0.00 H new ATOM 135 N VAL A 12 5.283 -2.585 2.746 1.00 0.00 N ATOM 136 CA VAL A 12 4.054 -3.166 2.240 1.00 0.00 C ATOM 137 C VAL A 12 4.170 -4.680 2.215 1.00 0.00 C ATOM 138 O VAL A 12 5.153 -5.218 1.710 1.00 0.00 O ATOM 139 CB VAL A 12 3.748 -2.682 0.806 1.00 0.00 C ATOM 140 CG1 VAL A 12 2.366 -3.135 0.363 1.00 0.00 C ATOM 141 CG2 VAL A 12 3.882 -1.174 0.699 1.00 0.00 C ATOM 0 H VAL A 12 6.086 -2.707 2.129 1.00 0.00 H new ATOM 0 HA VAL A 12 3.248 -2.852 2.903 1.00 0.00 H new ATOM 0 HB VAL A 12 4.482 -3.133 0.138 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.175 -2.781 -0.650 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.316 -4.224 0.383 1.00 0.00 H new ATOM 0 HG13 VAL A 12 1.615 -2.725 1.038 1.00 0.00 H new ATOM 0 HG21 VAL A 12 3.661 -0.861 -0.321 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.182 -0.697 1.385 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.900 -0.880 0.957 1.00 0.00 H new ATOM 151 N ILE A 13 3.190 -5.380 2.759 1.00 0.00 N ATOM 152 CA ILE A 13 3.190 -6.823 2.642 1.00 0.00 C ATOM 153 C ILE A 13 2.498 -7.235 1.354 1.00 0.00 C ATOM 154 O ILE A 13 1.401 -6.766 1.040 1.00 0.00 O ATOM 155 CB ILE A 13 2.548 -7.556 3.844 1.00 0.00 C ATOM 156 CG1 ILE A 13 2.546 -9.068 3.583 1.00 0.00 C ATOM 157 CG2 ILE A 13 1.144 -7.044 4.116 1.00 0.00 C ATOM 158 CD1 ILE A 13 1.802 -9.884 4.614 1.00 0.00 C ATOM 0 H ILE A 13 2.404 -4.983 3.273 1.00 0.00 H new ATOM 0 HA ILE A 13 4.237 -7.126 2.630 1.00 0.00 H new ATOM 0 HB ILE A 13 3.141 -7.353 4.736 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.104 -9.254 2.604 1.00 0.00 H new ATOM 0 HG13 ILE A 13 3.578 -9.417 3.538 1.00 0.00 H new ATOM 0 HG21 ILE A 13 0.720 -7.579 4.966 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.183 -5.978 4.340 1.00 0.00 H new ATOM 0 HG23 ILE A 13 0.520 -7.207 3.237 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.853 -10.940 4.348 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.256 -9.734 5.594 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.759 -9.568 4.645 1.00 0.00 H new ATOM 170 N THR A 14 3.178 -8.083 0.605 1.00 0.00 N ATOM 171 CA THR A 14 2.673 -8.591 -0.646 1.00 0.00 C ATOM 172 C THR A 14 2.646 -10.115 -0.612 1.00 0.00 C ATOM 173 O THR A 14 2.964 -10.728 0.411 1.00 0.00 O ATOM 174 CB THR A 14 3.531 -8.103 -1.834 1.00 0.00 C ATOM 175 OG1 THR A 14 4.920 -8.371 -1.590 1.00 0.00 O ATOM 176 CG2 THR A 14 3.332 -6.610 -2.074 1.00 0.00 C ATOM 0 H THR A 14 4.101 -8.438 0.854 1.00 0.00 H new ATOM 0 HA THR A 14 1.660 -8.213 -0.784 1.00 0.00 H new ATOM 0 HB THR A 14 3.210 -8.645 -2.724 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.027 -8.756 -0.695 1.00 0.00 H new ATOM 0 HG21 THR A 14 3.947 -6.292 -2.916 1.00 0.00 H new ATOM 0 HG22 THR A 14 2.283 -6.414 -2.296 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.623 -6.056 -1.182 1.00 0.00 H new ATOM 184 N ASP A 15 2.295 -10.714 -1.735 1.00 0.00 N ATOM 185 CA ASP A 15 2.126 -12.158 -1.828 1.00 0.00 C ATOM 186 C ASP A 15 3.454 -12.896 -1.670 1.00 0.00 C ATOM 187 O ASP A 15 3.491 -14.035 -1.204 1.00 0.00 O ATOM 188 CB ASP A 15 1.483 -12.517 -3.169 1.00 0.00 C ATOM 189 CG ASP A 15 1.260 -14.004 -3.328 1.00 0.00 C ATOM 190 OD1 ASP A 15 0.611 -14.607 -2.452 1.00 0.00 O ATOM 191 OD2 ASP A 15 1.720 -14.578 -4.335 1.00 0.00 O ATOM 0 H ASP A 15 2.119 -10.217 -2.608 1.00 0.00 H new ATOM 0 HA ASP A 15 1.476 -12.473 -1.012 1.00 0.00 H new ATOM 0 HB2 ASP A 15 0.529 -11.999 -3.260 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.118 -12.160 -3.979 1.00 0.00 H new ATOM 196 N ASP A 16 4.546 -12.247 -2.051 1.00 0.00 N ATOM 197 CA ASP A 16 5.861 -12.878 -1.984 1.00 0.00 C ATOM 198 C ASP A 16 6.594 -12.511 -0.694 1.00 0.00 C ATOM 199 O ASP A 16 7.665 -13.049 -0.409 1.00 0.00 O ATOM 200 CB ASP A 16 6.713 -12.505 -3.205 1.00 0.00 C ATOM 201 CG ASP A 16 7.164 -11.056 -3.205 1.00 0.00 C ATOM 202 OD1 ASP A 16 8.196 -10.752 -2.569 1.00 0.00 O ATOM 203 OD2 ASP A 16 6.502 -10.219 -3.864 1.00 0.00 O ATOM 0 H ASP A 16 4.550 -11.291 -2.407 1.00 0.00 H new ATOM 0 HA ASP A 16 5.703 -13.956 -1.987 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.590 -13.151 -3.238 1.00 0.00 H new ATOM 0 HB3 ASP A 16 6.140 -12.700 -4.112 1.00 0.00 H new ATOM 208 N GLY A 17 6.019 -11.613 0.093 1.00 0.00 N ATOM 209 CA GLY A 17 6.645 -11.228 1.345 1.00 0.00 C ATOM 210 C GLY A 17 6.385 -9.781 1.703 1.00 0.00 C ATOM 211 O GLY A 17 5.678 -9.074 0.983 1.00 0.00 O ATOM 0 H GLY A 17 5.135 -11.145 -0.110 1.00 0.00 H new ATOM 0 HA2 GLY A 17 6.274 -11.869 2.145 1.00 0.00 H new ATOM 0 HA3 GLY A 17 7.720 -11.394 1.276 1.00 0.00 H new ATOM 215 N LYS A 18 6.967 -9.331 2.807 1.00 0.00 N ATOM 216 CA LYS A 18 6.754 -7.973 3.280 1.00 0.00 C ATOM 217 C LYS A 18 7.928 -7.090 2.863 1.00 0.00 C ATOM 218 O LYS A 18 9.037 -7.220 3.382 1.00 0.00 O ATOM 219 CB LYS A 18 6.557 -7.969 4.801 1.00 0.00 C ATOM 220 CG LYS A 18 5.763 -6.776 5.317 1.00 0.00 C ATOM 221 CD LYS A 18 5.251 -7.022 6.731 1.00 0.00 C ATOM 222 CE LYS A 18 4.340 -5.897 7.207 1.00 0.00 C ATOM 223 NZ LYS A 18 3.712 -6.204 8.524 1.00 0.00 N ATOM 0 H LYS A 18 7.590 -9.889 3.391 1.00 0.00 H new ATOM 0 HA LYS A 18 5.849 -7.567 2.828 1.00 0.00 H new ATOM 0 HB2 LYS A 18 6.047 -8.887 5.094 1.00 0.00 H new ATOM 0 HB3 LYS A 18 7.534 -7.979 5.284 1.00 0.00 H new ATOM 0 HG2 LYS A 18 6.391 -5.886 5.305 1.00 0.00 H new ATOM 0 HG3 LYS A 18 4.922 -6.581 4.652 1.00 0.00 H new ATOM 0 HD2 LYS A 18 4.708 -7.967 6.762 1.00 0.00 H new ATOM 0 HD3 LYS A 18 6.097 -7.118 7.412 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.915 -4.974 7.286 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.560 -5.724 6.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 3.101 -5.413 8.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.142 -7.070 8.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.455 -6.344 9.239 1.00 0.00 H new ATOM 237 N LYS A 19 7.668 -6.204 1.914 1.00 0.00 N ATOM 238 CA LYS A 19 8.708 -5.409 1.276 1.00 0.00 C ATOM 239 C LYS A 19 8.722 -3.978 1.796 1.00 0.00 C ATOM 240 O LYS A 19 7.706 -3.288 1.755 1.00 0.00 O ATOM 241 CB LYS A 19 8.476 -5.375 -0.236 1.00 0.00 C ATOM 242 CG LYS A 19 8.770 -6.685 -0.949 1.00 0.00 C ATOM 243 CD LYS A 19 8.202 -6.680 -2.361 1.00 0.00 C ATOM 244 CE LYS A 19 8.770 -7.810 -3.199 1.00 0.00 C ATOM 245 NZ LYS A 19 7.997 -8.013 -4.450 1.00 0.00 N ATOM 0 H LYS A 19 6.729 -6.015 1.563 1.00 0.00 H new ATOM 0 HA LYS A 19 9.666 -5.874 1.509 1.00 0.00 H new ATOM 0 HB2 LYS A 19 7.439 -5.098 -0.425 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.099 -4.593 -0.669 1.00 0.00 H new ATOM 0 HG2 LYS A 19 9.847 -6.848 -0.988 1.00 0.00 H new ATOM 0 HG3 LYS A 19 8.342 -7.514 -0.385 1.00 0.00 H new ATOM 0 HD2 LYS A 19 7.117 -6.770 -2.317 1.00 0.00 H new ATOM 0 HD3 LYS A 19 8.424 -5.726 -2.839 1.00 0.00 H new ATOM 0 HE2 LYS A 19 9.809 -7.592 -3.445 1.00 0.00 H new ATOM 0 HE3 LYS A 19 8.767 -8.731 -2.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 8.653 -8.179 -5.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 7.371 -8.836 -4.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 7.426 -7.166 -4.646 1.00 0.00 H new ATOM 259 N ILE A 20 9.869 -3.540 2.285 1.00 0.00 N ATOM 260 CA ILE A 20 10.061 -2.138 2.611 1.00 0.00 C ATOM 261 C ILE A 20 10.614 -1.417 1.379 1.00 0.00 C ATOM 262 O ILE A 20 11.612 -1.836 0.789 1.00 0.00 O ATOM 263 CB ILE A 20 10.987 -1.952 3.854 1.00 0.00 C ATOM 264 CG1 ILE A 20 10.988 -0.492 4.352 1.00 0.00 C ATOM 265 CG2 ILE A 20 12.409 -2.414 3.567 1.00 0.00 C ATOM 266 CD1 ILE A 20 11.874 0.459 3.564 1.00 0.00 C ATOM 0 H ILE A 20 10.679 -4.133 2.465 1.00 0.00 H new ATOM 0 HA ILE A 20 9.101 -1.700 2.883 1.00 0.00 H new ATOM 0 HB ILE A 20 10.578 -2.579 4.646 1.00 0.00 H new ATOM 0 HG12 ILE A 20 9.965 -0.116 4.327 1.00 0.00 H new ATOM 0 HG13 ILE A 20 11.306 -0.481 5.394 1.00 0.00 H new ATOM 0 HG21 ILE A 20 13.025 -2.269 4.455 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.401 -3.470 3.299 1.00 0.00 H new ATOM 0 HG23 ILE A 20 12.821 -1.833 2.742 1.00 0.00 H new ATOM 0 HD11 ILE A 20 11.805 1.459 3.992 1.00 0.00 H new ATOM 0 HD12 ILE A 20 12.907 0.115 3.609 1.00 0.00 H new ATOM 0 HD13 ILE A 20 11.545 0.486 2.525 1.00 0.00 H new ATOM 278 N LEU A 21 9.930 -0.362 0.965 1.00 0.00 N ATOM 279 CA LEU A 21 10.340 0.414 -0.191 1.00 0.00 C ATOM 280 C LEU A 21 10.118 1.894 0.082 1.00 0.00 C ATOM 281 O LEU A 21 9.423 2.258 1.031 1.00 0.00 O ATOM 282 CB LEU A 21 9.583 -0.020 -1.460 1.00 0.00 C ATOM 283 CG LEU A 21 8.059 0.162 -1.445 1.00 0.00 C ATOM 284 CD1 LEU A 21 7.511 0.118 -2.864 1.00 0.00 C ATOM 285 CD2 LEU A 21 7.386 -0.911 -0.604 1.00 0.00 C ATOM 0 H LEU A 21 9.081 -0.023 1.418 1.00 0.00 H new ATOM 0 HA LEU A 21 11.401 0.234 -0.366 1.00 0.00 H new ATOM 0 HB2 LEU A 21 9.985 0.539 -2.305 1.00 0.00 H new ATOM 0 HB3 LEU A 21 9.799 -1.073 -1.643 1.00 0.00 H new ATOM 0 HG LEU A 21 7.842 1.134 -1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.429 0.248 -2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.960 0.918 -3.452 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.751 -0.844 -3.317 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.307 -0.756 -0.612 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.615 -1.894 -1.017 1.00 0.00 H new ATOM 0 HD23 LEU A 21 7.753 -0.854 0.421 1.00 0.00 H new ATOM 297 N GLU A 22 10.718 2.741 -0.734 1.00 0.00 N ATOM 298 CA GLU A 22 10.634 4.175 -0.524 1.00 0.00 C ATOM 299 C GLU A 22 10.457 4.924 -1.840 1.00 0.00 C ATOM 300 O GLU A 22 10.664 4.366 -2.918 1.00 0.00 O ATOM 301 CB GLU A 22 11.870 4.669 0.247 1.00 0.00 C ATOM 302 CG GLU A 22 13.206 4.175 -0.297 1.00 0.00 C ATOM 303 CD GLU A 22 13.674 4.942 -1.517 1.00 0.00 C ATOM 304 OE1 GLU A 22 14.018 6.136 -1.376 1.00 0.00 O ATOM 305 OE2 GLU A 22 13.706 4.359 -2.619 1.00 0.00 O ATOM 0 H GLU A 22 11.268 2.462 -1.547 1.00 0.00 H new ATOM 0 HA GLU A 22 9.749 4.383 0.078 1.00 0.00 H new ATOM 0 HB2 GLU A 22 11.872 5.759 0.241 1.00 0.00 H new ATOM 0 HB3 GLU A 22 11.780 4.357 1.287 1.00 0.00 H new ATOM 0 HG2 GLU A 22 13.961 4.254 0.485 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.119 3.119 -0.551 1.00 0.00 H new ATOM 312 N SER A 23 10.037 6.175 -1.738 1.00 0.00 N ATOM 313 CA SER A 23 9.889 7.043 -2.895 1.00 0.00 C ATOM 314 C SER A 23 10.484 8.407 -2.583 1.00 0.00 C ATOM 315 O SER A 23 10.626 8.774 -1.414 1.00 0.00 O ATOM 316 CB SER A 23 8.408 7.177 -3.283 1.00 0.00 C ATOM 317 OG SER A 23 8.242 8.043 -4.400 1.00 0.00 O ATOM 0 H SER A 23 9.790 6.617 -0.852 1.00 0.00 H new ATOM 0 HA SER A 23 10.420 6.606 -3.740 1.00 0.00 H new ATOM 0 HB2 SER A 23 8.001 6.194 -3.519 1.00 0.00 H new ATOM 0 HB3 SER A 23 7.841 7.561 -2.435 1.00 0.00 H new ATOM 0 HG SER A 23 7.290 8.108 -4.625 1.00 0.00 H new ATOM 323 N GLY A 24 10.835 9.152 -3.623 1.00 0.00 N ATOM 324 CA GLY A 24 11.434 10.458 -3.438 1.00 0.00 C ATOM 325 C GLY A 24 10.397 11.545 -3.248 1.00 0.00 C ATOM 326 O GLY A 24 10.738 12.702 -2.990 1.00 0.00 O ATOM 0 H GLY A 24 10.714 8.872 -4.596 1.00 0.00 H new ATOM 0 HA2 GLY A 24 12.094 10.433 -2.571 1.00 0.00 H new ATOM 0 HA3 GLY A 24 12.053 10.697 -4.303 1.00 0.00 H new ATOM 330 N ALA A 25 9.131 11.178 -3.377 1.00 0.00 N ATOM 331 CA ALA A 25 8.042 12.121 -3.194 1.00 0.00 C ATOM 332 C ALA A 25 6.903 11.480 -2.412 1.00 0.00 C ATOM 333 O ALA A 25 6.614 10.298 -2.592 1.00 0.00 O ATOM 334 CB ALA A 25 7.546 12.621 -4.544 1.00 0.00 C ATOM 0 H ALA A 25 8.833 10.230 -3.609 1.00 0.00 H new ATOM 0 HA ALA A 25 8.413 12.971 -2.622 1.00 0.00 H new ATOM 0 HB1 ALA A 25 6.730 13.327 -4.393 1.00 0.00 H new ATOM 0 HB2 ALA A 25 8.362 13.117 -5.071 1.00 0.00 H new ATOM 0 HB3 ALA A 25 7.191 11.778 -5.136 1.00 0.00 H new ATOM 340 N PRO A 26 6.262 12.240 -1.511 1.00 0.00 N ATOM 341 CA PRO A 26 5.087 11.770 -0.769 1.00 0.00 C ATOM 342 C PRO A 26 3.927 11.442 -1.707 1.00 0.00 C ATOM 343 O PRO A 26 3.591 12.225 -2.595 1.00 0.00 O ATOM 344 CB PRO A 26 4.733 12.952 0.140 1.00 0.00 C ATOM 345 CG PRO A 26 5.973 13.774 0.202 1.00 0.00 C ATOM 346 CD PRO A 26 6.634 13.611 -1.133 1.00 0.00 C ATOM 0 HA PRO A 26 5.286 10.851 -0.217 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.899 13.525 -0.265 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.435 12.612 1.132 1.00 0.00 H new ATOM 0 HG2 PRO A 26 5.740 14.820 0.398 1.00 0.00 H new ATOM 0 HG3 PRO A 26 6.627 13.437 1.006 1.00 0.00 H new ATOM 0 HD2 PRO A 26 6.273 14.343 -1.856 1.00 0.00 H new ATOM 0 HD3 PRO A 26 7.715 13.734 -1.068 1.00 0.00 H new ATOM 354 N ARG A 27 3.323 10.278 -1.513 1.00 0.00 N ATOM 355 CA ARG A 27 2.291 9.799 -2.422 1.00 0.00 C ATOM 356 C ARG A 27 1.079 9.290 -1.659 1.00 0.00 C ATOM 357 O ARG A 27 1.115 9.140 -0.437 1.00 0.00 O ATOM 358 CB ARG A 27 2.828 8.654 -3.290 1.00 0.00 C ATOM 359 CG ARG A 27 3.994 9.029 -4.190 1.00 0.00 C ATOM 360 CD ARG A 27 3.603 10.099 -5.188 1.00 0.00 C ATOM 361 NE ARG A 27 4.657 10.339 -6.166 1.00 0.00 N ATOM 362 CZ ARG A 27 4.731 11.430 -6.915 1.00 0.00 C ATOM 363 NH1 ARG A 27 3.837 12.401 -6.774 1.00 0.00 N ATOM 364 NH2 ARG A 27 5.700 11.553 -7.809 1.00 0.00 N ATOM 0 H ARG A 27 3.529 9.649 -0.737 1.00 0.00 H new ATOM 0 HA ARG A 27 1.998 10.641 -3.049 1.00 0.00 H new ATOM 0 HB2 ARG A 27 3.139 7.838 -2.638 1.00 0.00 H new ATOM 0 HB3 ARG A 27 2.016 8.275 -3.910 1.00 0.00 H new ATOM 0 HG2 ARG A 27 4.825 9.384 -3.581 1.00 0.00 H new ATOM 0 HG3 ARG A 27 4.344 8.144 -4.722 1.00 0.00 H new ATOM 0 HD2 ARG A 27 2.691 9.799 -5.703 1.00 0.00 H new ATOM 0 HD3 ARG A 27 3.380 11.026 -4.659 1.00 0.00 H new ATOM 0 HE ARG A 27 5.378 9.627 -6.280 1.00 0.00 H new ATOM 0 HH11 ARG A 27 3.089 12.310 -6.087 1.00 0.00 H new ATOM 0 HH12 ARG A 27 3.898 13.239 -7.353 1.00 0.00 H new ATOM 0 HH21 ARG A 27 6.388 10.809 -7.921 1.00 0.00 H new ATOM 0 HH22 ARG A 27 5.758 12.392 -8.386 1.00 0.00 H new ATOM 378 N ARG A 28 0.008 9.037 -2.395 1.00 0.00 N ATOM 379 CA ARG A 28 -1.131 8.300 -1.872 1.00 0.00 C ATOM 380 C ARG A 28 -1.089 6.881 -2.413 1.00 0.00 C ATOM 381 O ARG A 28 -0.344 6.597 -3.353 1.00 0.00 O ATOM 382 CB ARG A 28 -2.459 8.965 -2.254 1.00 0.00 C ATOM 383 CG ARG A 28 -2.779 10.196 -1.429 1.00 0.00 C ATOM 384 CD ARG A 28 -4.154 10.762 -1.756 1.00 0.00 C ATOM 385 NE ARG A 28 -4.403 12.004 -1.029 1.00 0.00 N ATOM 386 CZ ARG A 28 -5.444 12.808 -1.246 1.00 0.00 C ATOM 387 NH1 ARG A 28 -6.369 12.484 -2.141 1.00 0.00 N ATOM 388 NH2 ARG A 28 -5.563 13.939 -0.562 1.00 0.00 N ATOM 0 H ARG A 28 -0.096 9.335 -3.365 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.069 8.293 -0.784 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -2.428 9.242 -3.308 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -3.265 8.241 -2.139 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -2.734 9.944 -0.370 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.021 10.959 -1.608 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -4.229 10.944 -2.828 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -4.921 10.030 -1.503 1.00 0.00 H new ATOM 0 HE ARG A 28 -3.736 12.274 -0.307 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -6.286 11.615 -2.668 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -7.163 13.104 -2.302 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -4.858 14.193 0.130 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -6.360 14.554 -0.728 1.00 0.00 H new ATOM 402 N ILE A 29 -1.882 6.001 -1.822 1.00 0.00 N ATOM 403 CA ILE A 29 -1.958 4.614 -2.260 1.00 0.00 C ATOM 404 C ILE A 29 -2.318 4.543 -3.743 1.00 0.00 C ATOM 405 O ILE A 29 -1.746 3.757 -4.496 1.00 0.00 O ATOM 406 CB ILE A 29 -3.002 3.831 -1.431 1.00 0.00 C ATOM 407 CG1 ILE A 29 -2.632 3.853 0.057 1.00 0.00 C ATOM 408 CG2 ILE A 29 -3.130 2.397 -1.927 1.00 0.00 C ATOM 409 CD1 ILE A 29 -1.282 3.237 0.366 1.00 0.00 C ATOM 0 H ILE A 29 -2.487 6.224 -1.032 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.979 4.159 -2.108 1.00 0.00 H new ATOM 0 HB ILE A 29 -3.968 4.320 -1.557 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -2.637 4.885 0.407 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.400 3.322 0.620 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -3.871 1.869 -1.326 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -3.444 2.400 -2.971 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -2.167 1.894 -1.839 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.094 3.291 1.438 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.277 2.194 0.049 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.503 3.782 -0.167 1.00 0.00 H new ATOM 421 N LYS A 30 -3.251 5.400 -4.139 1.00 0.00 N ATOM 422 CA LYS A 30 -3.734 5.494 -5.515 1.00 0.00 C ATOM 423 C LYS A 30 -2.589 5.628 -6.512 1.00 0.00 C ATOM 424 O LYS A 30 -2.587 4.973 -7.551 1.00 0.00 O ATOM 425 CB LYS A 30 -4.660 6.706 -5.632 1.00 0.00 C ATOM 426 CG LYS A 30 -5.332 6.864 -6.985 1.00 0.00 C ATOM 427 CD LYS A 30 -6.325 5.747 -7.238 1.00 0.00 C ATOM 428 CE LYS A 30 -7.319 6.124 -8.321 1.00 0.00 C ATOM 429 NZ LYS A 30 -8.414 5.128 -8.436 1.00 0.00 N ATOM 0 H LYS A 30 -3.701 6.060 -3.505 1.00 0.00 H new ATOM 0 HA LYS A 30 -4.270 4.575 -5.753 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -5.431 6.632 -4.865 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -4.085 7.607 -5.420 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.843 7.826 -7.030 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.577 6.868 -7.771 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -5.791 4.843 -7.531 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -6.859 5.517 -6.316 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -7.741 7.105 -8.101 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -6.801 6.207 -9.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -9.294 5.609 -8.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -8.166 4.421 -9.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -8.550 4.655 -7.520 1.00 0.00 H new ATOM 443 N ASP A 31 -1.615 6.462 -6.176 1.00 0.00 N ATOM 444 CA ASP A 31 -0.520 6.770 -7.090 1.00 0.00 C ATOM 445 C ASP A 31 0.343 5.537 -7.338 1.00 0.00 C ATOM 446 O ASP A 31 0.594 5.159 -8.483 1.00 0.00 O ATOM 447 CB ASP A 31 0.336 7.906 -6.521 1.00 0.00 C ATOM 448 CG ASP A 31 1.324 8.455 -7.531 1.00 0.00 C ATOM 449 OD1 ASP A 31 0.921 9.304 -8.353 1.00 0.00 O ATOM 450 OD2 ASP A 31 2.499 8.051 -7.506 1.00 0.00 O ATOM 0 H ASP A 31 -1.559 6.939 -5.276 1.00 0.00 H new ATOM 0 HA ASP A 31 -0.946 7.087 -8.042 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -0.315 8.711 -6.181 1.00 0.00 H new ATOM 0 HB3 ASP A 31 0.878 7.544 -5.647 1.00 0.00 H new ATOM 455 N VAL A 32 0.764 4.897 -6.256 1.00 0.00 N ATOM 456 CA VAL A 32 1.617 3.717 -6.342 1.00 0.00 C ATOM 457 C VAL A 32 0.844 2.521 -6.898 1.00 0.00 C ATOM 458 O VAL A 32 1.296 1.854 -7.832 1.00 0.00 O ATOM 459 CB VAL A 32 2.201 3.354 -4.959 1.00 0.00 C ATOM 460 CG1 VAL A 32 3.125 2.150 -5.054 1.00 0.00 C ATOM 461 CG2 VAL A 32 2.933 4.544 -4.360 1.00 0.00 C ATOM 0 H VAL A 32 0.528 5.176 -5.304 1.00 0.00 H new ATOM 0 HA VAL A 32 2.436 3.956 -7.021 1.00 0.00 H new ATOM 0 HB VAL A 32 1.372 3.090 -4.302 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.522 1.917 -4.066 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.568 1.293 -5.433 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.948 2.376 -5.731 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.338 4.270 -3.386 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.748 4.840 -5.021 1.00 0.00 H new ATOM 0 HG23 VAL A 32 2.239 5.377 -4.243 1.00 0.00 H new ATOM 471 N LEU A 33 -0.329 2.271 -6.330 1.00 0.00 N ATOM 472 CA LEU A 33 -1.159 1.135 -6.720 1.00 0.00 C ATOM 473 C LEU A 33 -1.579 1.250 -8.181 1.00 0.00 C ATOM 474 O LEU A 33 -1.579 0.262 -8.921 1.00 0.00 O ATOM 475 CB LEU A 33 -2.401 1.074 -5.829 1.00 0.00 C ATOM 476 CG LEU A 33 -3.267 -0.175 -5.980 1.00 0.00 C ATOM 477 CD1 LEU A 33 -2.536 -1.394 -5.443 1.00 0.00 C ATOM 478 CD2 LEU A 33 -4.599 0.014 -5.268 1.00 0.00 C ATOM 0 H LEU A 33 -0.731 2.846 -5.590 1.00 0.00 H new ATOM 0 HA LEU A 33 -0.577 0.222 -6.598 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.083 1.149 -4.789 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.018 1.948 -6.038 1.00 0.00 H new ATOM 0 HG LEU A 33 -3.466 -0.336 -7.039 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -3.166 -2.276 -5.558 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.609 -1.536 -5.998 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -2.308 -1.246 -4.387 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.205 -0.885 -5.385 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.422 0.197 -4.208 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.125 0.865 -5.700 1.00 0.00 H new ATOM 490 N GLY A 34 -1.918 2.468 -8.589 1.00 0.00 N ATOM 491 CA GLY A 34 -2.381 2.708 -9.940 1.00 0.00 C ATOM 492 C GLY A 34 -1.311 2.430 -10.977 1.00 0.00 C ATOM 493 O GLY A 34 -1.579 1.785 -11.991 1.00 0.00 O ATOM 0 H GLY A 34 -1.879 3.300 -8.000 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.249 2.080 -10.140 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -2.709 3.743 -10.030 1.00 0.00 H new ATOM 497 N GLU A 35 -0.093 2.896 -10.714 1.00 0.00 N ATOM 498 CA GLU A 35 1.015 2.706 -11.644 1.00 0.00 C ATOM 499 C GLU A 35 1.492 1.255 -11.662 1.00 0.00 C ATOM 500 O GLU A 35 1.976 0.768 -12.680 1.00 0.00 O ATOM 501 CB GLU A 35 2.179 3.635 -11.302 1.00 0.00 C ATOM 502 CG GLU A 35 1.891 5.098 -11.591 1.00 0.00 C ATOM 503 CD GLU A 35 3.109 5.985 -11.408 1.00 0.00 C ATOM 504 OE1 GLU A 35 4.245 5.471 -11.488 1.00 0.00 O ATOM 505 OE2 GLU A 35 2.935 7.205 -11.221 1.00 0.00 O ATOM 0 H GLU A 35 0.151 3.407 -9.866 1.00 0.00 H new ATOM 0 HA GLU A 35 0.646 2.954 -12.639 1.00 0.00 H new ATOM 0 HB2 GLU A 35 2.425 3.523 -10.246 1.00 0.00 H new ATOM 0 HB3 GLU A 35 3.058 3.327 -11.868 1.00 0.00 H new ATOM 0 HG2 GLU A 35 1.526 5.197 -12.613 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.094 5.443 -10.933 1.00 0.00 H new ATOM 512 N LEU A 36 1.352 0.562 -10.537 1.00 0.00 N ATOM 513 CA LEU A 36 1.752 -0.839 -10.461 1.00 0.00 C ATOM 514 C LEU A 36 0.707 -1.742 -11.109 1.00 0.00 C ATOM 515 O LEU A 36 0.931 -2.944 -11.272 1.00 0.00 O ATOM 516 CB LEU A 36 1.992 -1.265 -9.011 1.00 0.00 C ATOM 517 CG LEU A 36 3.209 -0.622 -8.340 1.00 0.00 C ATOM 518 CD1 LEU A 36 3.356 -1.124 -6.911 1.00 0.00 C ATOM 519 CD2 LEU A 36 4.477 -0.905 -9.136 1.00 0.00 C ATOM 0 H LEU A 36 0.968 0.943 -9.672 1.00 0.00 H new ATOM 0 HA LEU A 36 2.688 -0.944 -11.010 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.104 -1.025 -8.426 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.110 -2.348 -8.981 1.00 0.00 H new ATOM 0 HG LEU A 36 3.054 0.457 -8.315 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.226 -0.657 -6.449 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.462 -0.869 -6.342 1.00 0.00 H new ATOM 0 HD13 LEU A 36 3.486 -2.206 -6.917 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.329 -0.439 -8.641 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.637 -1.982 -9.196 1.00 0.00 H new ATOM 0 HD23 LEU A 36 4.374 -0.497 -10.142 1.00 0.00 H new ATOM 531 N GLU A 37 -0.437 -1.149 -11.464 1.00 0.00 N ATOM 532 CA GLU A 37 -1.499 -1.846 -12.187 1.00 0.00 C ATOM 533 C GLU A 37 -2.088 -2.981 -11.341 1.00 0.00 C ATOM 534 O GLU A 37 -2.637 -3.951 -11.866 1.00 0.00 O ATOM 535 CB GLU A 37 -0.951 -2.381 -13.519 1.00 0.00 C ATOM 536 CG GLU A 37 -2.022 -2.790 -14.519 1.00 0.00 C ATOM 537 CD GLU A 37 -1.444 -3.476 -15.737 1.00 0.00 C ATOM 538 OE1 GLU A 37 -1.307 -4.717 -15.715 1.00 0.00 O ATOM 539 OE2 GLU A 37 -1.136 -2.782 -16.730 1.00 0.00 O ATOM 0 H GLU A 37 -0.650 -0.173 -11.257 1.00 0.00 H new ATOM 0 HA GLU A 37 -2.304 -1.141 -12.394 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -0.321 -1.616 -13.972 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -0.313 -3.241 -13.316 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -2.733 -3.458 -14.033 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.578 -1.907 -14.833 1.00 0.00 H new ATOM 546 N ILE A 38 -1.994 -2.844 -10.026 1.00 0.00 N ATOM 547 CA ILE A 38 -2.515 -3.860 -9.122 1.00 0.00 C ATOM 548 C ILE A 38 -4.012 -3.659 -8.913 1.00 0.00 C ATOM 549 O ILE A 38 -4.451 -2.571 -8.540 1.00 0.00 O ATOM 550 CB ILE A 38 -1.795 -3.833 -7.756 1.00 0.00 C ATOM 551 CG1 ILE A 38 -0.289 -4.023 -7.952 1.00 0.00 C ATOM 552 CG2 ILE A 38 -2.355 -4.908 -6.832 1.00 0.00 C ATOM 553 CD1 ILE A 38 0.506 -3.956 -6.666 1.00 0.00 C ATOM 0 H ILE A 38 -1.564 -2.043 -9.563 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.334 -4.832 -9.582 1.00 0.00 H new ATOM 0 HB ILE A 38 -1.967 -2.863 -7.290 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -0.113 -4.988 -8.428 1.00 0.00 H new ATOM 0 HG13 ILE A 38 0.079 -3.258 -8.636 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -1.835 -4.872 -5.875 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -3.419 -4.733 -6.673 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.212 -5.889 -7.286 1.00 0.00 H new ATOM 0 HD11 ILE A 38 1.564 -4.099 -6.885 1.00 0.00 H new ATOM 0 HD12 ILE A 38 0.361 -2.982 -6.199 1.00 0.00 H new ATOM 0 HD13 ILE A 38 0.167 -4.738 -5.987 1.00 0.00 H new ATOM 565 N PRO A 39 -4.817 -4.702 -9.175 1.00 0.00 N ATOM 566 CA PRO A 39 -6.270 -4.632 -9.027 1.00 0.00 C ATOM 567 C PRO A 39 -6.722 -4.589 -7.563 1.00 0.00 C ATOM 568 O PRO A 39 -6.641 -5.585 -6.841 1.00 0.00 O ATOM 569 CB PRO A 39 -6.763 -5.908 -9.714 1.00 0.00 C ATOM 570 CG PRO A 39 -5.617 -6.859 -9.637 1.00 0.00 C ATOM 571 CD PRO A 39 -4.365 -6.025 -9.649 1.00 0.00 C ATOM 0 HA PRO A 39 -6.674 -3.717 -9.461 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -7.643 -6.310 -9.213 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -7.046 -5.714 -10.749 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -5.673 -7.461 -8.730 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -5.630 -7.551 -10.479 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -3.599 -6.444 -8.996 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -3.934 -5.966 -10.648 1.00 0.00 H new ATOM 579 N ILE A 40 -7.209 -3.425 -7.143 1.00 0.00 N ATOM 580 CA ILE A 40 -7.715 -3.227 -5.785 1.00 0.00 C ATOM 581 C ILE A 40 -9.068 -3.929 -5.614 1.00 0.00 C ATOM 582 O ILE A 40 -9.590 -4.068 -4.508 1.00 0.00 O ATOM 583 CB ILE A 40 -7.866 -1.713 -5.481 1.00 0.00 C ATOM 584 CG1 ILE A 40 -8.160 -1.473 -3.996 1.00 0.00 C ATOM 585 CG2 ILE A 40 -8.958 -1.103 -6.351 1.00 0.00 C ATOM 586 CD1 ILE A 40 -8.352 -0.014 -3.641 1.00 0.00 C ATOM 0 H ILE A 40 -7.265 -2.594 -7.731 1.00 0.00 H new ATOM 0 HA ILE A 40 -7.000 -3.659 -5.084 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.920 -1.225 -5.716 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.057 -2.026 -3.718 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -7.340 -1.877 -3.403 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -9.052 -0.041 -6.126 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -8.699 -1.230 -7.402 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -9.906 -1.602 -6.148 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -8.556 0.077 -2.574 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.447 0.542 -3.886 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -9.191 0.391 -4.207 1.00 0.00 H new ATOM 598 N GLU A 41 -9.611 -4.389 -6.732 1.00 0.00 N ATOM 599 CA GLU A 41 -10.926 -5.008 -6.776 1.00 0.00 C ATOM 600 C GLU A 41 -10.936 -6.368 -6.075 1.00 0.00 C ATOM 601 O GLU A 41 -11.859 -6.683 -5.323 1.00 0.00 O ATOM 602 CB GLU A 41 -11.337 -5.181 -8.237 1.00 0.00 C ATOM 603 CG GLU A 41 -12.697 -5.822 -8.433 1.00 0.00 C ATOM 604 CD GLU A 41 -12.935 -6.212 -9.875 1.00 0.00 C ATOM 605 OE1 GLU A 41 -13.403 -5.367 -10.659 1.00 0.00 O ATOM 606 OE2 GLU A 41 -12.637 -7.371 -10.233 1.00 0.00 O ATOM 0 H GLU A 41 -9.148 -4.342 -7.640 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.630 -4.362 -6.252 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -11.336 -4.204 -8.720 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -10.586 -5.788 -8.744 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -12.776 -6.706 -7.800 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.475 -5.129 -8.111 1.00 0.00 H new ATOM 613 N THR A 42 -9.904 -7.163 -6.313 1.00 0.00 N ATOM 614 CA THR A 42 -9.906 -8.552 -5.876 1.00 0.00 C ATOM 615 C THR A 42 -9.405 -8.727 -4.436 1.00 0.00 C ATOM 616 O THR A 42 -10.051 -9.404 -3.636 1.00 0.00 O ATOM 617 CB THR A 42 -9.085 -9.444 -6.838 1.00 0.00 C ATOM 618 OG1 THR A 42 -8.959 -10.765 -6.308 1.00 0.00 O ATOM 619 CG2 THR A 42 -7.706 -8.862 -7.101 1.00 0.00 C ATOM 0 H THR A 42 -9.058 -6.873 -6.804 1.00 0.00 H new ATOM 0 HA THR A 42 -10.948 -8.872 -5.896 1.00 0.00 H new ATOM 0 HB THR A 42 -9.623 -9.484 -7.785 1.00 0.00 H new ATOM 0 HG1 THR A 42 -8.439 -11.318 -6.928 1.00 0.00 H new ATOM 0 HG21 THR A 42 -7.159 -9.515 -7.780 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.808 -7.874 -7.551 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.161 -8.778 -6.161 1.00 0.00 H new ATOM 627 N VAL A 43 -8.277 -8.108 -4.092 1.00 0.00 N ATOM 628 CA VAL A 43 -7.659 -8.345 -2.788 1.00 0.00 C ATOM 629 C VAL A 43 -7.940 -7.204 -1.811 1.00 0.00 C ATOM 630 O VAL A 43 -8.607 -6.226 -2.156 1.00 0.00 O ATOM 631 CB VAL A 43 -6.137 -8.582 -2.911 1.00 0.00 C ATOM 632 CG1 VAL A 43 -5.858 -9.748 -3.846 1.00 0.00 C ATOM 633 CG2 VAL A 43 -5.411 -7.336 -3.388 1.00 0.00 C ATOM 0 H VAL A 43 -7.778 -7.448 -4.688 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.113 -9.252 -2.389 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.759 -8.824 -1.918 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.782 -9.903 -3.923 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.328 -10.650 -3.453 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.264 -9.528 -4.833 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -4.343 -7.543 -3.462 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -5.793 -7.045 -4.367 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.575 -6.525 -2.678 1.00 0.00 H new ATOM 643 N VAL A 44 -7.434 -7.339 -0.590 1.00 0.00 N ATOM 644 CA VAL A 44 -7.750 -6.403 0.483 1.00 0.00 C ATOM 645 C VAL A 44 -6.594 -5.444 0.749 1.00 0.00 C ATOM 646 O VAL A 44 -5.432 -5.843 0.737 1.00 0.00 O ATOM 647 CB VAL A 44 -8.080 -7.158 1.790 1.00 0.00 C ATOM 648 CG1 VAL A 44 -8.557 -6.197 2.869 1.00 0.00 C ATOM 649 CG2 VAL A 44 -9.115 -8.242 1.545 1.00 0.00 C ATOM 0 H VAL A 44 -6.801 -8.091 -0.318 1.00 0.00 H new ATOM 0 HA VAL A 44 -8.619 -5.830 0.158 1.00 0.00 H new ATOM 0 HB VAL A 44 -7.164 -7.634 2.139 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.783 -6.754 3.778 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.776 -5.465 3.076 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.455 -5.682 2.527 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -9.330 -8.758 2.481 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -10.030 -7.791 1.161 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.729 -8.956 0.817 1.00 0.00 H new ATOM 659 N VAL A 45 -6.922 -4.178 0.989 1.00 0.00 N ATOM 660 CA VAL A 45 -5.920 -3.177 1.324 1.00 0.00 C ATOM 661 C VAL A 45 -6.153 -2.648 2.740 1.00 0.00 C ATOM 662 O VAL A 45 -7.252 -2.200 3.079 1.00 0.00 O ATOM 663 CB VAL A 45 -5.947 -1.996 0.324 1.00 0.00 C ATOM 664 CG1 VAL A 45 -4.868 -0.977 0.660 1.00 0.00 C ATOM 665 CG2 VAL A 45 -5.787 -2.500 -1.103 1.00 0.00 C ATOM 0 H VAL A 45 -7.877 -3.822 0.957 1.00 0.00 H new ATOM 0 HA VAL A 45 -4.943 -3.657 1.268 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.915 -1.502 0.406 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -4.907 -0.156 -0.056 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.034 -0.589 1.665 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.889 -1.454 0.612 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.808 -1.655 -1.792 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.836 -3.023 -1.200 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.602 -3.183 -1.341 1.00 0.00 H new ATOM 675 N LYS A 46 -5.118 -2.713 3.561 1.00 0.00 N ATOM 676 CA LYS A 46 -5.188 -2.235 4.933 1.00 0.00 C ATOM 677 C LYS A 46 -4.021 -1.303 5.237 1.00 0.00 C ATOM 678 O LYS A 46 -2.953 -1.418 4.641 1.00 0.00 O ATOM 679 CB LYS A 46 -5.143 -3.407 5.920 1.00 0.00 C ATOM 680 CG LYS A 46 -6.393 -4.266 5.924 1.00 0.00 C ATOM 681 CD LYS A 46 -6.250 -5.453 6.864 1.00 0.00 C ATOM 682 CE LYS A 46 -7.468 -6.358 6.801 1.00 0.00 C ATOM 683 NZ LYS A 46 -7.429 -7.430 7.831 1.00 0.00 N ATOM 0 H LYS A 46 -4.210 -3.096 3.298 1.00 0.00 H new ATOM 0 HA LYS A 46 -6.129 -1.697 5.045 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -4.285 -4.035 5.681 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -4.982 -3.015 6.924 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -7.249 -3.663 6.225 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -6.594 -4.623 4.914 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -5.358 -6.022 6.602 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -6.112 -5.096 7.885 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -8.369 -5.760 6.936 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -7.531 -6.810 5.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -8.280 -8.022 7.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -6.583 -8.018 7.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -7.396 -7.001 8.778 1.00 0.00 H new ATOM 697 N LYS A 47 -4.231 -0.383 6.161 1.00 0.00 N ATOM 698 CA LYS A 47 -3.150 0.414 6.703 1.00 0.00 C ATOM 699 C LYS A 47 -2.828 -0.056 8.103 1.00 0.00 C ATOM 700 O LYS A 47 -3.545 0.268 9.055 1.00 0.00 O ATOM 701 CB LYS A 47 -3.518 1.897 6.736 1.00 0.00 C ATOM 702 CG LYS A 47 -3.335 2.599 5.408 1.00 0.00 C ATOM 703 CD LYS A 47 -1.928 2.404 4.874 1.00 0.00 C ATOM 704 CE LYS A 47 -1.519 3.544 3.970 1.00 0.00 C ATOM 705 NZ LYS A 47 -1.384 4.811 4.727 1.00 0.00 N ATOM 0 H LYS A 47 -5.148 -0.170 6.553 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.280 0.291 6.058 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.557 1.998 7.050 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.908 2.397 7.488 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.057 2.214 4.688 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.538 3.663 5.525 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.228 2.329 5.706 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -1.873 1.464 4.325 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -0.572 3.305 3.486 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.259 3.667 3.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -0.974 5.541 4.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.321 5.121 5.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.763 4.661 5.547 1.00 0.00 H new ATOM 719 N ASN A 48 -1.764 -0.842 8.216 1.00 0.00 N ATOM 720 CA ASN A 48 -1.284 -1.341 9.502 1.00 0.00 C ATOM 721 C ASN A 48 -2.397 -2.077 10.261 1.00 0.00 C ATOM 722 O ASN A 48 -2.363 -2.189 11.487 1.00 0.00 O ATOM 723 CB ASN A 48 -0.737 -0.173 10.326 1.00 0.00 C ATOM 724 CG ASN A 48 0.264 -0.596 11.381 1.00 0.00 C ATOM 725 OD1 ASN A 48 0.958 -1.606 11.240 1.00 0.00 O ATOM 726 ND2 ASN A 48 0.354 0.187 12.442 1.00 0.00 N ATOM 0 H ASN A 48 -1.208 -1.152 7.419 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.484 -2.060 9.327 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -0.265 0.545 9.655 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -1.568 0.341 10.810 1.00 0.00 H new ATOM 0 HD21 ASN A 48 1.017 -0.035 13.185 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -0.240 1.013 12.518 1.00 0.00 H new ATOM 733 N GLY A 49 -3.375 -2.592 9.516 1.00 0.00 N ATOM 734 CA GLY A 49 -4.464 -3.333 10.123 1.00 0.00 C ATOM 735 C GLY A 49 -5.838 -2.776 9.780 1.00 0.00 C ATOM 736 O GLY A 49 -6.823 -3.514 9.768 1.00 0.00 O ATOM 0 H GLY A 49 -3.430 -2.507 8.501 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.411 -4.373 9.800 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -4.338 -3.328 11.206 1.00 0.00 H new ATOM 740 N GLN A 50 -5.908 -1.483 9.501 1.00 0.00 N ATOM 741 CA GLN A 50 -7.189 -0.819 9.265 1.00 0.00 C ATOM 742 C GLN A 50 -7.585 -0.868 7.794 1.00 0.00 C ATOM 743 O GLN A 50 -6.772 -0.597 6.921 1.00 0.00 O ATOM 744 CB GLN A 50 -7.117 0.640 9.718 1.00 0.00 C ATOM 745 CG GLN A 50 -6.752 0.820 11.185 1.00 0.00 C ATOM 746 CD GLN A 50 -6.535 2.279 11.547 1.00 0.00 C ATOM 747 OE1 GLN A 50 -5.422 2.794 11.454 1.00 0.00 O ATOM 748 NE2 GLN A 50 -7.595 2.950 11.966 1.00 0.00 N ATOM 0 H GLN A 50 -5.096 -0.870 9.432 1.00 0.00 H new ATOM 0 HA GLN A 50 -7.944 -1.351 9.843 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -6.383 1.163 9.106 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -8.081 1.114 9.534 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -7.545 0.407 11.808 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.846 0.254 11.404 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -8.501 2.485 12.029 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -7.507 3.932 12.226 1.00 0.00 H new ATOM 757 N ILE A 51 -8.836 -1.212 7.526 1.00 0.00 N ATOM 758 CA ILE A 51 -9.353 -1.214 6.162 1.00 0.00 C ATOM 759 C ILE A 51 -9.385 0.207 5.603 1.00 0.00 C ATOM 760 O ILE A 51 -9.986 1.103 6.202 1.00 0.00 O ATOM 761 CB ILE A 51 -10.771 -1.822 6.103 1.00 0.00 C ATOM 762 CG1 ILE A 51 -10.728 -3.298 6.507 1.00 0.00 C ATOM 763 CG2 ILE A 51 -11.377 -1.656 4.713 1.00 0.00 C ATOM 764 CD1 ILE A 51 -9.917 -4.158 5.568 1.00 0.00 C ATOM 0 H ILE A 51 -9.514 -1.494 8.234 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.686 -1.828 5.557 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.407 -1.287 6.808 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -10.312 -3.379 7.511 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -11.746 -3.684 6.551 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -12.376 -2.092 4.697 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -11.440 -0.596 4.468 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -10.749 -2.161 3.979 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -9.931 -5.191 5.917 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -10.345 -4.107 4.567 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.889 -3.798 5.542 1.00 0.00 H new ATOM 776 N VAL A 52 -8.734 0.412 4.468 1.00 0.00 N ATOM 777 CA VAL A 52 -8.650 1.735 3.867 1.00 0.00 C ATOM 778 C VAL A 52 -8.958 1.684 2.377 1.00 0.00 C ATOM 779 O VAL A 52 -9.209 0.613 1.816 1.00 0.00 O ATOM 780 CB VAL A 52 -7.255 2.368 4.072 1.00 0.00 C ATOM 781 CG1 VAL A 52 -7.011 2.680 5.540 1.00 0.00 C ATOM 782 CG2 VAL A 52 -6.164 1.453 3.530 1.00 0.00 C ATOM 0 H VAL A 52 -8.256 -0.321 3.944 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.395 2.353 4.369 1.00 0.00 H new ATOM 0 HB VAL A 52 -7.225 3.305 3.516 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -6.023 3.125 5.658 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -7.768 3.379 5.894 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -7.067 1.760 6.122 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -5.190 1.917 3.684 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -6.197 0.497 4.053 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.323 1.289 2.464 1.00 0.00 H new ATOM 792 N ILE A 53 -8.947 2.848 1.749 1.00 0.00 N ATOM 793 CA ILE A 53 -9.164 2.957 0.317 1.00 0.00 C ATOM 794 C ILE A 53 -7.868 3.344 -0.387 1.00 0.00 C ATOM 795 O ILE A 53 -6.809 3.400 0.239 1.00 0.00 O ATOM 796 CB ILE A 53 -10.257 3.997 -0.015 1.00 0.00 C ATOM 797 CG1 ILE A 53 -9.929 5.351 0.626 1.00 0.00 C ATOM 798 CG2 ILE A 53 -11.619 3.493 0.440 1.00 0.00 C ATOM 799 CD1 ILE A 53 -10.932 6.437 0.300 1.00 0.00 C ATOM 0 H ILE A 53 -8.788 3.741 2.216 1.00 0.00 H new ATOM 0 HA ILE A 53 -9.498 1.982 -0.037 1.00 0.00 H new ATOM 0 HB ILE A 53 -10.288 4.138 -1.095 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -9.878 5.228 1.708 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -8.941 5.670 0.295 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -12.380 4.235 0.200 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -11.850 2.558 -0.070 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -11.603 3.324 1.517 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -10.635 7.365 0.788 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -10.966 6.589 -0.779 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -11.918 6.140 0.656 1.00 0.00 H new ATOM 811 N ASP A 54 -7.956 3.616 -1.676 1.00 0.00 N ATOM 812 CA ASP A 54 -6.789 3.983 -2.465 1.00 0.00 C ATOM 813 C ASP A 54 -6.463 5.466 -2.301 1.00 0.00 C ATOM 814 O ASP A 54 -5.338 5.894 -2.539 1.00 0.00 O ATOM 815 CB ASP A 54 -6.997 3.616 -3.945 1.00 0.00 C ATOM 816 CG ASP A 54 -8.272 4.187 -4.556 1.00 0.00 C ATOM 817 OD1 ASP A 54 -9.134 4.692 -3.810 1.00 0.00 O ATOM 818 OD2 ASP A 54 -8.429 4.096 -5.797 1.00 0.00 O ATOM 0 H ASP A 54 -8.828 3.590 -2.204 1.00 0.00 H new ATOM 0 HA ASP A 54 -5.935 3.416 -2.096 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -6.141 3.971 -4.520 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -7.016 2.530 -4.039 1.00 0.00 H new ATOM 823 N GLU A 55 -7.439 6.238 -1.851 1.00 0.00 N ATOM 824 CA GLU A 55 -7.244 7.666 -1.601 1.00 0.00 C ATOM 825 C GLU A 55 -6.597 7.923 -0.236 1.00 0.00 C ATOM 826 O GLU A 55 -6.768 8.989 0.354 1.00 0.00 O ATOM 827 CB GLU A 55 -8.587 8.391 -1.695 1.00 0.00 C ATOM 828 CG GLU A 55 -8.882 8.940 -3.078 1.00 0.00 C ATOM 829 CD GLU A 55 -8.137 10.232 -3.350 1.00 0.00 C ATOM 830 OE1 GLU A 55 -6.907 10.192 -3.557 1.00 0.00 O ATOM 831 OE2 GLU A 55 -8.782 11.305 -3.330 1.00 0.00 O ATOM 0 H GLU A 55 -8.381 5.902 -1.649 1.00 0.00 H new ATOM 0 HA GLU A 55 -6.564 8.052 -2.361 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.383 7.704 -1.408 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.600 9.211 -0.977 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -8.607 8.199 -3.828 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -9.954 9.112 -3.178 1.00 0.00 H new ATOM 838 N GLU A 56 -5.834 6.951 0.247 1.00 0.00 N ATOM 839 CA GLU A 56 -5.148 7.080 1.526 1.00 0.00 C ATOM 840 C GLU A 56 -3.708 7.535 1.304 1.00 0.00 C ATOM 841 O GLU A 56 -3.103 7.219 0.280 1.00 0.00 O ATOM 842 CB GLU A 56 -5.177 5.743 2.274 1.00 0.00 C ATOM 843 CG GLU A 56 -5.561 5.857 3.745 1.00 0.00 C ATOM 844 CD GLU A 56 -4.540 6.610 4.575 1.00 0.00 C ATOM 845 OE1 GLU A 56 -4.605 7.857 4.620 1.00 0.00 O ATOM 846 OE2 GLU A 56 -3.674 5.956 5.190 1.00 0.00 O ATOM 0 H GLU A 56 -5.674 6.063 -0.229 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.660 7.829 2.130 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.882 5.077 1.777 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.194 5.278 2.202 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.525 6.360 3.824 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -5.689 4.857 4.159 1.00 0.00 H new ATOM 853 N GLU A 57 -3.165 8.264 2.271 1.00 0.00 N ATOM 854 CA GLU A 57 -1.816 8.812 2.174 1.00 0.00 C ATOM 855 C GLU A 57 -0.769 7.741 2.462 1.00 0.00 C ATOM 856 O GLU A 57 -1.100 6.638 2.888 1.00 0.00 O ATOM 857 CB GLU A 57 -1.644 9.955 3.180 1.00 0.00 C ATOM 858 CG GLU A 57 -2.494 11.183 2.896 1.00 0.00 C ATOM 859 CD GLU A 57 -1.871 12.090 1.858 1.00 0.00 C ATOM 860 OE1 GLU A 57 -0.755 12.592 2.098 1.00 0.00 O ATOM 861 OE2 GLU A 57 -2.497 12.329 0.808 1.00 0.00 O ATOM 0 H GLU A 57 -3.644 8.492 3.142 1.00 0.00 H new ATOM 0 HA GLU A 57 -1.676 9.182 1.158 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -1.887 9.584 4.176 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -0.595 10.252 3.197 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -3.480 10.868 2.554 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -2.641 11.741 3.821 1.00 0.00 H new ATOM 868 N ILE A 58 0.492 8.067 2.217 1.00 0.00 N ATOM 869 CA ILE A 58 1.598 7.200 2.600 1.00 0.00 C ATOM 870 C ILE A 58 2.629 8.009 3.385 1.00 0.00 C ATOM 871 O ILE A 58 3.160 9.002 2.882 1.00 0.00 O ATOM 872 CB ILE A 58 2.285 6.552 1.376 1.00 0.00 C ATOM 873 CG1 ILE A 58 1.258 5.852 0.480 1.00 0.00 C ATOM 874 CG2 ILE A 58 3.339 5.555 1.838 1.00 0.00 C ATOM 875 CD1 ILE A 58 1.854 5.263 -0.780 1.00 0.00 C ATOM 0 H ILE A 58 0.776 8.930 1.753 1.00 0.00 H new ATOM 0 HA ILE A 58 1.189 6.398 3.215 1.00 0.00 H new ATOM 0 HB ILE A 58 2.765 7.340 0.796 1.00 0.00 H new ATOM 0 HG12 ILE A 58 0.774 5.058 1.048 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.482 6.566 0.205 1.00 0.00 H new ATOM 0 HG21 ILE A 58 3.818 5.103 0.969 1.00 0.00 H new ATOM 0 HG22 ILE A 58 4.089 6.070 2.439 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.866 4.777 2.437 1.00 0.00 H new ATOM 0 HD11 ILE A 58 1.069 4.784 -1.365 1.00 0.00 H new ATOM 0 HD12 ILE A 58 2.313 6.056 -1.370 1.00 0.00 H new ATOM 0 HD13 ILE A 58 2.610 4.524 -0.514 1.00 0.00 H new ATOM 887 N PHE A 59 2.891 7.597 4.618 1.00 0.00 N ATOM 888 CA PHE A 59 3.828 8.310 5.477 1.00 0.00 C ATOM 889 C PHE A 59 5.074 7.470 5.730 1.00 0.00 C ATOM 890 O PHE A 59 5.068 6.256 5.520 1.00 0.00 O ATOM 891 CB PHE A 59 3.169 8.663 6.815 1.00 0.00 C ATOM 892 CG PHE A 59 1.937 9.516 6.691 1.00 0.00 C ATOM 893 CD1 PHE A 59 2.040 10.882 6.488 1.00 0.00 C ATOM 894 CD2 PHE A 59 0.673 8.950 6.781 1.00 0.00 C ATOM 895 CE1 PHE A 59 0.909 11.668 6.377 1.00 0.00 C ATOM 896 CE2 PHE A 59 -0.461 9.731 6.671 1.00 0.00 C ATOM 897 CZ PHE A 59 -0.343 11.092 6.468 1.00 0.00 C ATOM 0 H PHE A 59 2.468 6.773 5.046 1.00 0.00 H new ATOM 0 HA PHE A 59 4.117 9.229 4.967 1.00 0.00 H new ATOM 0 HB2 PHE A 59 2.907 7.740 7.333 1.00 0.00 H new ATOM 0 HB3 PHE A 59 3.896 9.183 7.439 1.00 0.00 H new ATOM 0 HD1 PHE A 59 3.016 11.338 6.416 1.00 0.00 H new ATOM 0 HD2 PHE A 59 0.575 7.886 6.939 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.004 12.732 6.219 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.439 9.278 6.744 1.00 0.00 H new ATOM 0 HZ PHE A 59 -1.228 11.705 6.381 1.00 0.00 H new ATOM 907 N ASP A 60 6.138 8.121 6.176 1.00 0.00 N ATOM 908 CA ASP A 60 7.376 7.426 6.510 1.00 0.00 C ATOM 909 C ASP A 60 7.202 6.612 7.783 1.00 0.00 C ATOM 910 O ASP A 60 6.782 7.135 8.814 1.00 0.00 O ATOM 911 CB ASP A 60 8.527 8.416 6.681 1.00 0.00 C ATOM 912 CG ASP A 60 9.822 7.729 7.064 1.00 0.00 C ATOM 913 OD1 ASP A 60 10.485 7.161 6.177 1.00 0.00 O ATOM 914 OD2 ASP A 60 10.185 7.754 8.260 1.00 0.00 O ATOM 0 H ASP A 60 6.171 9.131 6.316 1.00 0.00 H new ATOM 0 HA ASP A 60 7.616 6.752 5.687 1.00 0.00 H new ATOM 0 HB2 ASP A 60 8.671 8.967 5.751 1.00 0.00 H new ATOM 0 HB3 ASP A 60 8.265 9.146 7.447 1.00 0.00 H new ATOM 919 N GLY A 61 7.515 5.332 7.699 1.00 0.00 N ATOM 920 CA GLY A 61 7.375 4.456 8.840 1.00 0.00 C ATOM 921 C GLY A 61 5.998 3.835 8.905 1.00 0.00 C ATOM 922 O GLY A 61 5.653 3.158 9.874 1.00 0.00 O ATOM 0 H GLY A 61 7.866 4.880 6.855 1.00 0.00 H new ATOM 0 HA2 GLY A 61 8.127 3.669 8.788 1.00 0.00 H new ATOM 0 HA3 GLY A 61 7.564 5.018 9.755 1.00 0.00 H new ATOM 926 N ASP A 62 5.204 4.071 7.869 1.00 0.00 N ATOM 927 CA ASP A 62 3.850 3.541 7.811 1.00 0.00 C ATOM 928 C ASP A 62 3.853 2.154 7.178 1.00 0.00 C ATOM 929 O ASP A 62 4.764 1.810 6.417 1.00 0.00 O ATOM 930 CB ASP A 62 2.944 4.488 7.020 1.00 0.00 C ATOM 931 CG ASP A 62 1.479 4.129 7.140 1.00 0.00 C ATOM 932 OD1 ASP A 62 1.059 3.734 8.248 1.00 0.00 O ATOM 933 OD2 ASP A 62 0.749 4.241 6.132 1.00 0.00 O ATOM 0 H ASP A 62 5.475 4.626 7.058 1.00 0.00 H new ATOM 0 HA ASP A 62 3.462 3.458 8.826 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.094 5.508 7.374 1.00 0.00 H new ATOM 0 HB3 ASP A 62 3.234 4.469 5.969 1.00 0.00 H new ATOM 938 N ILE A 63 2.843 1.362 7.491 1.00 0.00 N ATOM 939 CA ILE A 63 2.787 -0.017 7.039 1.00 0.00 C ATOM 940 C ILE A 63 1.535 -0.255 6.204 1.00 0.00 C ATOM 941 O ILE A 63 0.414 -0.129 6.695 1.00 0.00 O ATOM 942 CB ILE A 63 2.798 -1.006 8.226 1.00 0.00 C ATOM 943 CG1 ILE A 63 4.021 -0.770 9.123 1.00 0.00 C ATOM 944 CG2 ILE A 63 2.777 -2.445 7.725 1.00 0.00 C ATOM 945 CD1 ILE A 63 5.352 -0.973 8.427 1.00 0.00 C ATOM 0 H ILE A 63 2.047 1.652 8.059 1.00 0.00 H new ATOM 0 HA ILE A 63 3.675 -0.192 6.431 1.00 0.00 H new ATOM 0 HB ILE A 63 1.900 -0.832 8.819 1.00 0.00 H new ATOM 0 HG12 ILE A 63 3.980 0.247 9.514 1.00 0.00 H new ATOM 0 HG13 ILE A 63 3.965 -1.443 9.979 1.00 0.00 H new ATOM 0 HG21 ILE A 63 2.785 -3.127 8.576 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.876 -2.612 7.135 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.655 -2.627 7.106 1.00 0.00 H new ATOM 0 HD11 ILE A 63 6.163 -0.786 9.131 1.00 0.00 H new ATOM 0 HD12 ILE A 63 5.418 -1.997 8.060 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.433 -0.281 7.588 1.00 0.00 H new ATOM 957 N ILE A 64 1.728 -0.598 4.947 1.00 0.00 N ATOM 958 CA ILE A 64 0.614 -0.895 4.067 1.00 0.00 C ATOM 959 C ILE A 64 0.484 -2.404 3.929 1.00 0.00 C ATOM 960 O ILE A 64 1.461 -3.095 3.644 1.00 0.00 O ATOM 961 CB ILE A 64 0.774 -0.260 2.660 1.00 0.00 C ATOM 962 CG1 ILE A 64 0.874 1.270 2.738 1.00 0.00 C ATOM 963 CG2 ILE A 64 -0.391 -0.650 1.761 1.00 0.00 C ATOM 964 CD1 ILE A 64 2.214 1.792 3.210 1.00 0.00 C ATOM 0 H ILE A 64 2.646 -0.678 4.510 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.282 -0.463 4.513 1.00 0.00 H new ATOM 0 HB ILE A 64 1.702 -0.643 2.236 1.00 0.00 H new ATOM 0 HG12 ILE A 64 0.664 1.685 1.752 1.00 0.00 H new ATOM 0 HG13 ILE A 64 0.099 1.638 3.410 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -0.261 -0.195 0.779 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.423 -1.735 1.657 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.324 -0.300 2.202 1.00 0.00 H new ATOM 0 HD11 ILE A 64 2.192 2.882 3.234 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.421 1.411 4.210 1.00 0.00 H new ATOM 0 HD13 ILE A 64 2.995 1.460 2.526 1.00 0.00 H new ATOM 976 N GLU A 65 -0.704 -2.920 4.158 1.00 0.00 N ATOM 977 CA GLU A 65 -0.918 -4.349 4.080 1.00 0.00 C ATOM 978 C GLU A 65 -1.869 -4.696 2.947 1.00 0.00 C ATOM 979 O GLU A 65 -3.068 -4.435 3.029 1.00 0.00 O ATOM 980 CB GLU A 65 -1.453 -4.895 5.408 1.00 0.00 C ATOM 981 CG GLU A 65 -0.513 -4.665 6.581 1.00 0.00 C ATOM 982 CD GLU A 65 -0.922 -5.435 7.817 1.00 0.00 C ATOM 983 OE1 GLU A 65 -1.760 -4.929 8.592 1.00 0.00 O ATOM 984 OE2 GLU A 65 -0.397 -6.548 8.027 1.00 0.00 O ATOM 0 H GLU A 65 -1.532 -2.375 4.398 1.00 0.00 H new ATOM 0 HA GLU A 65 0.045 -4.818 3.876 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -2.413 -4.426 5.624 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -1.637 -5.964 5.304 1.00 0.00 H new ATOM 0 HG2 GLU A 65 0.497 -4.957 6.294 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -0.483 -3.601 6.814 1.00 0.00 H new ATOM 991 N VAL A 66 -1.329 -5.265 1.880 1.00 0.00 N ATOM 992 CA VAL A 66 -2.155 -5.749 0.792 1.00 0.00 C ATOM 993 C VAL A 66 -2.323 -7.253 0.928 1.00 0.00 C ATOM 994 O VAL A 66 -1.434 -8.036 0.590 1.00 0.00 O ATOM 995 CB VAL A 66 -1.568 -5.400 -0.591 1.00 0.00 C ATOM 996 CG1 VAL A 66 -2.387 -6.043 -1.708 1.00 0.00 C ATOM 997 CG2 VAL A 66 -1.519 -3.889 -0.773 1.00 0.00 C ATOM 0 H VAL A 66 -0.327 -5.401 1.747 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.124 -5.254 0.857 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.554 -5.796 -0.643 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.953 -5.782 -2.673 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.379 -7.126 -1.587 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.414 -5.680 -1.662 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.103 -3.654 -1.753 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -2.527 -3.481 -0.699 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.892 -3.449 0.003 1.00 0.00 H new ATOM 1007 N ILE A 67 -3.466 -7.644 1.452 1.00 0.00 N ATOM 1008 CA ILE A 67 -3.741 -9.038 1.722 1.00 0.00 C ATOM 1009 C ILE A 67 -4.456 -9.662 0.543 1.00 0.00 C ATOM 1010 O ILE A 67 -5.609 -9.327 0.258 1.00 0.00 O ATOM 1011 CB ILE A 67 -4.602 -9.211 2.990 1.00 0.00 C ATOM 1012 CG1 ILE A 67 -3.972 -8.467 4.168 1.00 0.00 C ATOM 1013 CG2 ILE A 67 -4.772 -10.691 3.318 1.00 0.00 C ATOM 1014 CD1 ILE A 67 -4.792 -8.539 5.435 1.00 0.00 C ATOM 0 H ILE A 67 -4.225 -7.009 1.701 1.00 0.00 H new ATOM 0 HA ILE A 67 -2.786 -9.537 1.885 1.00 0.00 H new ATOM 0 HB ILE A 67 -5.588 -8.785 2.803 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.982 -8.881 4.361 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -3.832 -7.421 3.894 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.382 -10.797 4.215 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.262 -11.194 2.485 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -3.794 -11.140 3.489 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -4.285 -7.990 6.228 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -5.773 -8.099 5.259 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.910 -9.581 5.733 1.00 0.00 H new ATOM 1026 N ARG A 68 -3.762 -10.533 -0.169 1.00 0.00 N ATOM 1027 CA ARG A 68 -4.382 -11.282 -1.240 1.00 0.00 C ATOM 1028 C ARG A 68 -5.452 -12.189 -0.647 1.00 0.00 C ATOM 1029 O ARG A 68 -5.268 -12.757 0.431 1.00 0.00 O ATOM 1030 CB ARG A 68 -3.350 -12.110 -2.018 1.00 0.00 C ATOM 1031 CG ARG A 68 -2.808 -13.293 -1.235 1.00 0.00 C ATOM 1032 CD ARG A 68 -2.960 -14.592 -2.014 1.00 0.00 C ATOM 1033 NE ARG A 68 -1.930 -14.743 -3.038 1.00 0.00 N ATOM 1034 CZ ARG A 68 -2.171 -14.931 -4.334 1.00 0.00 C ATOM 1035 NH1 ARG A 68 -3.420 -14.949 -4.791 1.00 0.00 N ATOM 1036 NH2 ARG A 68 -1.151 -15.091 -5.173 1.00 0.00 N ATOM 0 H ARG A 68 -2.773 -10.736 -0.023 1.00 0.00 H new ATOM 0 HA ARG A 68 -4.833 -10.583 -1.945 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.807 -12.472 -2.939 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.520 -11.464 -2.306 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.756 -13.127 -1.004 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -3.334 -13.374 -0.284 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -2.912 -15.435 -1.325 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -3.944 -14.620 -2.483 1.00 0.00 H new ATOM 0 HE ARG A 68 -0.956 -14.701 -2.739 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -4.200 -14.818 -4.147 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -3.597 -15.093 -5.785 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -0.194 -15.069 -4.822 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -1.326 -15.236 -6.167 1.00 0.00 H new ATOM 1050 N VAL A 69 -6.569 -12.319 -1.331 1.00 0.00 N ATOM 1051 CA VAL A 69 -7.659 -13.125 -0.820 1.00 0.00 C ATOM 1052 C VAL A 69 -7.431 -14.593 -1.136 1.00 0.00 C ATOM 1053 O VAL A 69 -7.001 -14.947 -2.238 1.00 0.00 O ATOM 1054 CB VAL A 69 -9.023 -12.668 -1.386 1.00 0.00 C ATOM 1055 CG1 VAL A 69 -9.377 -11.283 -0.863 1.00 0.00 C ATOM 1056 CG2 VAL A 69 -9.015 -12.678 -2.909 1.00 0.00 C ATOM 0 H VAL A 69 -6.746 -11.881 -2.235 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.682 -12.991 0.262 1.00 0.00 H new ATOM 0 HB VAL A 69 -9.783 -13.373 -1.049 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -10.340 -10.975 -1.271 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -9.435 -11.309 0.225 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -8.610 -10.572 -1.169 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -9.987 -12.352 -3.280 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -8.242 -12.001 -3.273 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -8.810 -13.688 -3.265 1.00 0.00 H new ATOM 1066 N ILE A 70 -7.678 -15.442 -0.155 1.00 0.00 N ATOM 1067 CA ILE A 70 -7.567 -16.871 -0.357 1.00 0.00 C ATOM 1068 C ILE A 70 -8.862 -17.383 -0.968 1.00 0.00 C ATOM 1069 O ILE A 70 -9.957 -17.081 -0.488 1.00 0.00 O ATOM 1070 CB ILE A 70 -7.235 -17.636 0.954 1.00 0.00 C ATOM 1071 CG1 ILE A 70 -7.093 -19.138 0.678 1.00 0.00 C ATOM 1072 CG2 ILE A 70 -8.289 -17.391 2.027 1.00 0.00 C ATOM 1073 CD1 ILE A 70 -5.960 -19.478 -0.269 1.00 0.00 C ATOM 0 H ILE A 70 -7.956 -15.166 0.787 1.00 0.00 H new ATOM 0 HA ILE A 70 -6.734 -17.055 -1.035 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.285 -17.255 1.328 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -6.934 -19.659 1.622 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -8.028 -19.512 0.261 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -8.024 -17.942 2.930 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -8.338 -16.326 2.253 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -9.260 -17.730 1.667 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -5.921 -20.557 -0.417 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.127 -18.986 -1.227 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -5.016 -19.135 0.155 1.00 0.00 H new ATOM 1085 N TYR A 71 -8.734 -18.117 -2.056 1.00 0.00 N ATOM 1086 CA TYR A 71 -9.889 -18.580 -2.797 1.00 0.00 C ATOM 1087 C TYR A 71 -10.521 -19.778 -2.105 1.00 0.00 C ATOM 1088 O TYR A 71 -10.079 -20.914 -2.274 1.00 0.00 O ATOM 1089 CB TYR A 71 -9.489 -18.936 -4.229 1.00 0.00 C ATOM 1090 CG TYR A 71 -8.694 -17.846 -4.915 1.00 0.00 C ATOM 1091 CD1 TYR A 71 -9.326 -16.843 -5.642 1.00 0.00 C ATOM 1092 CD2 TYR A 71 -7.308 -17.819 -4.828 1.00 0.00 C ATOM 1093 CE1 TYR A 71 -8.596 -15.845 -6.260 1.00 0.00 C ATOM 1094 CE2 TYR A 71 -6.572 -16.827 -5.443 1.00 0.00 C ATOM 1095 CZ TYR A 71 -7.218 -15.843 -6.157 1.00 0.00 C ATOM 1096 OH TYR A 71 -6.484 -14.850 -6.767 1.00 0.00 O ATOM 0 H TYR A 71 -7.837 -18.406 -2.447 1.00 0.00 H new ATOM 0 HA TYR A 71 -10.626 -17.778 -2.831 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -8.900 -19.853 -4.217 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -10.388 -19.141 -4.810 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -10.403 -16.844 -5.725 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -6.797 -18.589 -4.269 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -9.100 -15.071 -6.820 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -5.495 -16.823 -5.365 1.00 0.00 H new ATOM 0 HH TYR A 71 -5.530 -14.996 -6.596 1.00 0.00 H new ATOM 1106 N GLY A 72 -11.538 -19.509 -1.301 1.00 0.00 N ATOM 1107 CA GLY A 72 -12.252 -20.569 -0.619 1.00 0.00 C ATOM 1108 C GLY A 72 -13.401 -21.095 -1.449 1.00 0.00 C ATOM 1109 O GLY A 72 -14.503 -21.301 -0.942 1.00 0.00 O ATOM 0 H GLY A 72 -11.884 -18.569 -1.107 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.564 -21.384 -0.393 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -12.631 -20.198 0.333 1.00 0.00 H new ATOM 1113 N GLY A 73 -13.143 -21.306 -2.727 1.00 0.00 N ATOM 1114 CA GLY A 73 -14.165 -21.789 -3.622 1.00 0.00 C ATOM 1115 C GLY A 73 -13.620 -22.844 -4.550 1.00 0.00 C ATOM 1116 O GLY A 73 -12.420 -22.771 -4.886 1.00 0.00 O ATOM 1117 OXT GLY A 73 -14.371 -23.764 -4.920 1.00 0.00 O ATOM 0 H GLY A 73 -12.234 -21.149 -3.163 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -14.993 -22.201 -3.045 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -14.564 -20.959 -4.205 1.00 0.00 H new TER 1121 GLY A 73