USER MOD reduce.3.24.130724 H: found=0, std=0, add=848, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 844 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 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 67:sc= 0.325 USER MOD Single : A 37 HIS : no HD1:sc= -1.05 K(o=-1,f=-2.4) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 31 SER OG : rot 66:sc= 0.329 USER MOD Single : B 37 HIS : no HD1:sc= -1.02 K(o=-1,f=-2.4) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 180:sc= 0 USER MOD Single : C 31 SER OG : rot 67:sc= 0.327 USER MOD Single : C 37 HIS : no HD1:sc= -1.01 K(o=-1,f=-2.4) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 180:sc= 0 USER MOD Single : D 31 SER OG : rot 67:sc= 0.323 USER MOD Single : D 37 HIS : no HD1:sc= -1.04 K(o=-1,f=-2.4) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 22 0.606 10.412 18.987 1.00 99.99 N ATOM 2 CA SER A 22 1.253 10.116 17.676 1.00 99.99 C ATOM 3 C SER A 22 1.594 8.656 17.532 1.00 99.99 C ATOM 4 O SER A 22 1.457 7.871 18.471 1.00 99.99 O ATOM 5 CB SER A 22 2.513 11.011 17.450 1.00 99.99 C ATOM 6 OG SER A 22 3.544 10.783 18.408 1.00 99.99 O ATOM 0 HA SER A 22 0.525 10.356 16.901 1.00 99.99 H new ATOM 0 HB2 SER A 22 2.907 10.826 16.451 1.00 99.99 H new ATOM 0 HB3 SER A 22 2.217 12.059 17.487 1.00 99.99 H new ATOM 0 HG SER A 22 4.305 11.369 18.215 1.00 99.99 H new ATOM 11 N SER A 23 2.058 8.271 16.319 1.00 99.99 N ATOM 12 CA SER A 23 2.534 6.940 16.024 1.00 99.99 C ATOM 13 C SER A 23 3.961 7.110 15.569 1.00 99.99 C ATOM 14 O SER A 23 4.557 8.169 15.765 1.00 99.99 O ATOM 15 CB SER A 23 1.685 6.227 14.944 1.00 99.99 C ATOM 16 OG SER A 23 0.352 6.050 15.404 1.00 99.99 O ATOM 0 H SER A 23 2.104 8.903 15.520 1.00 99.99 H new ATOM 0 HA SER A 23 2.458 6.304 16.906 1.00 99.99 H new ATOM 0 HB2 SER A 23 1.685 6.814 14.025 1.00 99.99 H new ATOM 0 HB3 SER A 23 2.126 5.259 14.705 1.00 99.99 H new ATOM 0 HG SER A 23 -0.176 5.600 14.712 1.00 99.99 H new ATOM 22 N ASP A 24 4.560 6.047 14.971 1.00 99.99 N ATOM 23 CA ASP A 24 5.966 6.007 14.611 1.00 99.99 C ATOM 24 C ASP A 24 6.121 6.563 13.212 1.00 99.99 C ATOM 25 O ASP A 24 5.187 6.427 12.429 1.00 99.99 O ATOM 26 CB ASP A 24 6.533 4.560 14.628 1.00 99.99 C ATOM 27 CG ASP A 24 6.462 3.944 16.029 1.00 99.99 C ATOM 28 OD1 ASP A 24 6.373 4.705 17.031 1.00 99.99 O ATOM 29 OD2 ASP A 24 6.509 2.687 16.112 1.00 99.99 O ATOM 0 H ASP A 24 4.057 5.193 14.731 1.00 99.99 H new ATOM 0 HA ASP A 24 6.517 6.597 15.343 1.00 99.99 H new ATOM 0 HB2 ASP A 24 5.972 3.940 13.928 1.00 99.99 H new ATOM 0 HB3 ASP A 24 7.568 4.570 14.286 1.00 99.99 H new ATOM 34 N PRO A 25 7.225 7.208 12.828 1.00 99.99 N ATOM 35 CA PRO A 25 7.272 8.048 11.641 1.00 99.99 C ATOM 36 C PRO A 25 7.309 7.252 10.356 1.00 99.99 C ATOM 37 O PRO A 25 6.927 7.813 9.341 1.00 99.99 O ATOM 38 CB PRO A 25 8.553 8.883 11.804 1.00 99.99 C ATOM 39 CG PRO A 25 9.429 8.053 12.745 1.00 99.99 C ATOM 40 CD PRO A 25 8.401 7.409 13.672 1.00 99.99 C ATOM 0 HA PRO A 25 6.373 8.659 11.563 1.00 99.99 H new ATOM 0 HB2 PRO A 25 9.045 9.048 10.845 1.00 99.99 H new ATOM 0 HB3 PRO A 25 8.337 9.865 12.225 1.00 99.99 H new ATOM 0 HG2 PRO A 25 10.011 7.307 12.204 1.00 99.99 H new ATOM 0 HG3 PRO A 25 10.137 8.674 13.294 1.00 99.99 H new ATOM 0 HD2 PRO A 25 8.766 6.465 14.075 1.00 99.99 H new ATOM 0 HD3 PRO A 25 8.175 8.052 14.522 1.00 99.99 H new ATOM 48 N LEU A 26 7.768 5.980 10.380 1.00 99.99 N ATOM 49 CA LEU A 26 7.772 5.015 9.288 1.00 99.99 C ATOM 50 C LEU A 26 6.346 4.571 9.001 1.00 99.99 C ATOM 51 O LEU A 26 5.981 4.479 7.856 1.00 99.99 O ATOM 52 CB LEU A 26 8.563 3.741 9.617 1.00 99.99 C ATOM 53 CG LEU A 26 8.438 2.577 8.608 1.00 99.99 C ATOM 54 CD1 LEU A 26 9.009 2.924 7.231 1.00 99.99 C ATOM 55 CD2 LEU A 26 9.108 1.314 9.169 1.00 99.99 C ATOM 0 H LEU A 26 8.171 5.586 11.230 1.00 99.99 H new ATOM 0 HA LEU A 26 8.237 5.518 8.440 1.00 99.99 H new ATOM 0 HB2 LEU A 26 9.617 4.006 9.705 1.00 99.99 H new ATOM 0 HB3 LEU A 26 8.242 3.382 10.595 1.00 99.99 H new ATOM 0 HG LEU A 26 7.374 2.389 8.466 1.00 99.99 H new ATOM 0 HD11 LEU A 26 8.894 2.070 6.564 1.00 99.99 H new ATOM 0 HD12 LEU A 26 8.474 3.780 6.820 1.00 99.99 H new ATOM 0 HD13 LEU A 26 10.067 3.170 7.327 1.00 99.99 H new ATOM 0 HD21 LEU A 26 9.013 0.501 8.449 1.00 99.99 H new ATOM 0 HD22 LEU A 26 10.164 1.514 9.354 1.00 99.99 H new ATOM 0 HD23 LEU A 26 8.624 1.029 10.103 1.00 99.99 H new ATOM 67 N VAL A 27 5.623 4.316 10.004 1.00 99.99 N ATOM 68 CA VAL A 27 4.244 3.857 9.876 1.00 99.99 C ATOM 69 C VAL A 27 3.381 4.997 9.357 1.00 99.99 C ATOM 70 O VAL A 27 2.598 4.779 8.466 1.00 99.99 O ATOM 71 CB VAL A 27 3.632 3.425 11.215 1.00 99.99 C ATOM 72 CG1 VAL A 27 2.143 3.067 11.044 1.00 99.99 C ATOM 73 CG2 VAL A 27 4.396 2.198 11.760 1.00 99.99 C ATOM 0 H VAL A 27 5.942 4.410 10.968 1.00 99.99 H new ATOM 0 HA VAL A 27 4.267 3.002 9.200 1.00 99.99 H new ATOM 0 HB VAL A 27 3.713 4.255 11.917 1.00 99.99 H new ATOM 0 HG11 VAL A 27 1.729 2.763 12.006 1.00 99.99 H new ATOM 0 HG12 VAL A 27 1.600 3.936 10.673 1.00 99.99 H new ATOM 0 HG13 VAL A 27 2.045 2.248 10.332 1.00 99.99 H new ATOM 0 HG21 VAL A 27 3.961 1.892 12.711 1.00 99.99 H new ATOM 0 HG22 VAL A 27 4.323 1.377 11.046 1.00 99.99 H new ATOM 0 HG23 VAL A 27 5.444 2.458 11.908 1.00 99.99 H new ATOM 83 N VAL A 28 3.537 6.121 9.908 1.00 99.99 N ATOM 84 CA VAL A 28 2.758 7.294 9.528 1.00 99.99 C ATOM 85 C VAL A 28 3.176 7.746 8.137 1.00 99.99 C ATOM 86 O VAL A 28 2.325 8.045 7.338 1.00 99.99 O ATOM 87 CB VAL A 28 2.986 8.490 10.461 1.00 99.99 C ATOM 88 CG1 VAL A 28 2.287 9.757 9.928 1.00 99.99 C ATOM 89 CG2 VAL A 28 2.470 8.154 11.874 1.00 99.99 C ATOM 0 H VAL A 28 4.212 6.294 10.653 1.00 99.99 H new ATOM 0 HA VAL A 28 1.711 6.996 9.578 1.00 99.99 H new ATOM 0 HB VAL A 28 4.056 8.691 10.503 1.00 99.99 H new ATOM 0 HG11 VAL A 28 2.467 10.587 10.611 1.00 99.99 H new ATOM 0 HG12 VAL A 28 2.684 10.005 8.944 1.00 99.99 H new ATOM 0 HG13 VAL A 28 1.215 9.576 9.852 1.00 99.99 H new ATOM 0 HG21 VAL A 28 2.634 9.006 12.533 1.00 99.99 H new ATOM 0 HG22 VAL A 28 1.404 7.930 11.828 1.00 99.99 H new ATOM 0 HG23 VAL A 28 3.006 7.288 12.261 1.00 99.99 H new ATOM 99 N ALA A 29 4.415 7.788 7.906 1.00 99.99 N ATOM 100 CA ALA A 29 4.957 8.229 6.625 1.00 99.99 C ATOM 101 C ALA A 29 4.465 7.300 5.525 1.00 99.99 C ATOM 102 O ALA A 29 4.129 7.774 4.468 1.00 99.99 O ATOM 103 CB ALA A 29 6.489 8.181 6.576 1.00 99.99 C ATOM 0 H ALA A 29 5.125 7.520 8.588 1.00 99.99 H new ATOM 0 HA ALA A 29 4.625 9.259 6.491 1.00 99.99 H new ATOM 0 HB1 ALA A 29 6.833 8.520 5.599 1.00 99.99 H new ATOM 0 HB2 ALA A 29 6.898 8.830 7.350 1.00 99.99 H new ATOM 0 HB3 ALA A 29 6.827 7.158 6.744 1.00 99.99 H new ATOM 109 N ALA A 30 4.445 6.067 5.792 1.00 99.99 N ATOM 110 CA ALA A 30 4.020 5.065 4.823 1.00 99.99 C ATOM 111 C ALA A 30 2.551 5.275 4.490 1.00 99.99 C ATOM 112 O ALA A 30 2.173 5.079 3.361 1.00 99.99 O ATOM 113 CB ALA A 30 4.140 3.631 5.356 1.00 99.99 C ATOM 0 H ALA A 30 4.721 5.681 6.695 1.00 99.99 H new ATOM 0 HA ALA A 30 4.671 5.184 3.957 1.00 99.99 H new ATOM 0 HB1 ALA A 30 3.809 2.929 4.590 1.00 99.99 H new ATOM 0 HB2 ALA A 30 5.179 3.424 5.613 1.00 99.99 H new ATOM 0 HB3 ALA A 30 3.517 3.519 6.244 1.00 99.99 H new ATOM 119 N SER A 31 1.806 5.648 5.436 1.00 99.99 N ATOM 120 CA SER A 31 0.374 5.863 5.265 1.00 99.99 C ATOM 121 C SER A 31 0.150 6.960 4.234 1.00 99.99 C ATOM 122 O SER A 31 -0.666 6.789 3.364 1.00 99.99 O ATOM 123 CB SER A 31 -0.319 6.329 6.551 1.00 99.99 C ATOM 124 OG SER A 31 -0.281 5.307 7.546 1.00 99.99 O ATOM 0 H SER A 31 2.143 5.826 6.382 1.00 99.99 H new ATOM 0 HA SER A 31 -0.045 4.904 4.960 1.00 99.99 H new ATOM 0 HB2 SER A 31 0.170 7.228 6.928 1.00 99.99 H new ATOM 0 HB3 SER A 31 -1.354 6.595 6.336 1.00 99.99 H new ATOM 0 HG SER A 31 0.645 5.166 7.835 1.00 99.99 H new ATOM 130 N ILE A 32 0.844 8.007 4.365 1.00 99.99 N ATOM 131 CA ILE A 32 0.714 9.146 3.465 1.00 99.99 C ATOM 132 C ILE A 32 1.139 8.735 2.063 1.00 99.99 C ATOM 133 O ILE A 32 0.536 9.169 1.117 1.00 99.99 O ATOM 134 CB ILE A 32 1.612 10.325 3.862 1.00 99.99 C ATOM 135 CG1 ILE A 32 1.160 10.907 5.220 1.00 99.99 C ATOM 136 CG2 ILE A 32 1.586 11.426 2.781 1.00 99.99 C ATOM 137 CD1 ILE A 32 2.203 11.838 5.851 1.00 99.99 C ATOM 0 H ILE A 32 1.539 8.135 5.100 1.00 99.99 H new ATOM 0 HA ILE A 32 -0.330 9.456 3.514 1.00 99.99 H new ATOM 0 HB ILE A 32 2.634 9.957 3.954 1.00 99.99 H new ATOM 0 HG12 ILE A 32 0.228 11.455 5.082 1.00 99.99 H new ATOM 0 HG13 ILE A 32 0.949 10.088 5.908 1.00 99.99 H new ATOM 0 HG21 ILE A 32 2.230 12.251 3.086 1.00 99.99 H new ATOM 0 HG22 ILE A 32 1.943 11.017 1.836 1.00 99.99 H new ATOM 0 HG23 ILE A 32 0.566 11.790 2.656 1.00 99.99 H new ATOM 0 HD11 ILE A 32 1.827 12.214 6.802 1.00 99.99 H new ATOM 0 HD12 ILE A 32 3.128 11.287 6.019 1.00 99.99 H new ATOM 0 HD13 ILE A 32 2.396 12.675 5.181 1.00 99.99 H new ATOM 149 N ILE A 33 2.123 7.950 1.982 1.00 99.99 N ATOM 150 CA ILE A 33 2.656 7.495 0.703 1.00 99.99 C ATOM 151 C ILE A 33 1.579 6.721 -0.045 1.00 99.99 C ATOM 152 O ILE A 33 1.395 6.953 -1.212 1.00 99.99 O ATOM 153 CB ILE A 33 3.846 6.537 0.856 1.00 99.99 C ATOM 154 CG1 ILE A 33 5.129 7.377 1.074 1.00 99.99 C ATOM 155 CG2 ILE A 33 4.000 5.602 -0.357 1.00 99.99 C ATOM 156 CD1 ILE A 33 6.328 6.588 1.613 1.00 99.99 C ATOM 0 H ILE A 33 2.616 7.578 2.794 1.00 99.99 H new ATOM 0 HA ILE A 33 2.981 8.390 0.173 1.00 99.99 H new ATOM 0 HB ILE A 33 3.669 5.893 1.717 1.00 99.99 H new ATOM 0 HG12 ILE A 33 5.411 7.837 0.127 1.00 99.99 H new ATOM 0 HG13 ILE A 33 4.903 8.187 1.768 1.00 99.99 H new ATOM 0 HG21 ILE A 33 4.855 4.943 -0.203 1.00 99.99 H new ATOM 0 HG22 ILE A 33 3.096 5.003 -0.472 1.00 99.99 H new ATOM 0 HG23 ILE A 33 4.158 6.196 -1.257 1.00 99.99 H new ATOM 0 HD11 ILE A 33 7.180 7.258 1.734 1.00 99.99 H new ATOM 0 HD12 ILE A 33 6.071 6.150 2.577 1.00 99.99 H new ATOM 0 HD13 ILE A 33 6.587 5.795 0.911 1.00 99.99 H new ATOM 168 N GLY A 34 0.934 5.866 0.623 1.00 99.99 N ATOM 169 CA GLY A 34 -0.110 5.038 0.027 1.00 99.99 C ATOM 170 C GLY A 34 -1.268 5.921 -0.407 1.00 99.99 C ATOM 171 O GLY A 34 -1.855 5.657 -1.426 1.00 99.99 O ATOM 0 H GLY A 34 1.090 5.690 1.616 1.00 99.99 H new ATOM 0 HA2 GLY A 34 0.287 4.493 -0.829 1.00 99.99 H new ATOM 0 HA3 GLY A 34 -0.455 4.295 0.746 1.00 99.99 H new ATOM 175 N ILE A 35 -1.233 7.188 -0.027 1.00 99.99 N ATOM 176 CA ILE A 35 -2.268 8.067 -0.562 1.00 99.99 C ATOM 177 C ILE A 35 -1.735 8.785 -1.792 1.00 99.99 C ATOM 178 O ILE A 35 -2.430 8.859 -2.772 1.00 99.99 O ATOM 179 CB ILE A 35 -2.693 9.160 0.427 1.00 99.99 C ATOM 180 CG1 ILE A 35 -3.244 8.524 1.728 1.00 99.99 C ATOM 181 CG2 ILE A 35 -3.759 10.068 -0.222 1.00 99.99 C ATOM 182 CD1 ILE A 35 -3.406 9.496 2.901 1.00 99.99 C ATOM 0 H ILE A 35 -0.553 7.612 0.604 1.00 99.99 H new ATOM 0 HA ILE A 35 -3.124 7.430 -0.783 1.00 99.99 H new ATOM 0 HB ILE A 35 -1.823 9.765 0.682 1.00 99.99 H new ATOM 0 HG12 ILE A 35 -4.212 8.072 1.513 1.00 99.99 H new ATOM 0 HG13 ILE A 35 -2.577 7.718 2.032 1.00 99.99 H new ATOM 0 HG21 ILE A 35 -4.057 10.842 0.485 1.00 99.99 H new ATOM 0 HG22 ILE A 35 -3.345 10.533 -1.116 1.00 99.99 H new ATOM 0 HG23 ILE A 35 -4.629 9.471 -0.494 1.00 99.99 H new ATOM 0 HD11 ILE A 35 -3.797 8.960 3.766 1.00 99.99 H new ATOM 0 HD12 ILE A 35 -2.438 9.930 3.150 1.00 99.99 H new ATOM 0 HD13 ILE A 35 -4.099 10.290 2.623 1.00 99.99 H new ATOM 194 N LEU A 36 -0.573 9.269 -1.703 1.00 99.99 N ATOM 195 CA LEU A 36 0.051 10.007 -2.795 1.00 99.99 C ATOM 196 C LEU A 36 0.155 9.104 -4.015 1.00 99.99 C ATOM 197 O LEU A 36 -0.135 9.546 -5.097 1.00 99.99 O ATOM 198 CB LEU A 36 1.480 10.461 -2.469 1.00 99.99 C ATOM 199 CG LEU A 36 2.244 11.131 -3.631 1.00 99.99 C ATOM 200 CD1 LEU A 36 1.559 12.434 -4.067 1.00 99.99 C ATOM 201 CD2 LEU A 36 3.709 11.385 -3.252 1.00 99.99 C ATOM 0 H LEU A 36 0.012 9.183 -0.872 1.00 99.99 H new ATOM 0 HA LEU A 36 -0.573 10.884 -2.969 1.00 99.99 H new ATOM 0 HB2 LEU A 36 1.439 11.159 -1.633 1.00 99.99 H new ATOM 0 HB3 LEU A 36 2.050 9.595 -2.133 1.00 99.99 H new ATOM 0 HG LEU A 36 2.228 10.445 -4.478 1.00 99.99 H new ATOM 0 HD11 LEU A 36 2.120 12.883 -4.887 1.00 99.99 H new ATOM 0 HD12 LEU A 36 0.543 12.218 -4.398 1.00 99.99 H new ATOM 0 HD13 LEU A 36 1.527 13.127 -3.226 1.00 99.99 H new ATOM 0 HD21 LEU A 36 4.224 11.858 -4.088 1.00 99.99 H new ATOM 0 HD22 LEU A 36 3.751 12.041 -2.382 1.00 99.99 H new ATOM 0 HD23 LEU A 36 4.193 10.437 -3.016 1.00 99.99 H new ATOM 213 N HIS A 37 0.592 7.836 -3.838 1.00 99.99 N ATOM 214 CA HIS A 37 0.792 6.876 -4.896 1.00 99.99 C ATOM 215 C HIS A 37 -0.515 6.579 -5.581 1.00 99.99 C ATOM 216 O HIS A 37 -0.543 6.239 -6.762 1.00 99.99 O ATOM 217 CB HIS A 37 1.387 5.554 -4.352 1.00 99.99 C ATOM 218 CG HIS A 37 1.799 4.575 -5.421 1.00 99.99 C ATOM 219 ND1 HIS A 37 2.029 3.252 -5.157 1.00 99.99 N ATOM 220 CD2 HIS A 37 2.064 4.771 -6.735 1.00 99.99 C ATOM 221 CE1 HIS A 37 2.412 2.662 -6.281 1.00 99.99 C ATOM 222 NE2 HIS A 37 2.441 3.562 -7.254 1.00 99.99 N ATOM 0 H HIS A 37 0.817 7.462 -2.916 1.00 99.99 H new ATOM 0 HA HIS A 37 1.495 7.311 -5.607 1.00 99.99 H new ATOM 0 HB2 HIS A 37 2.254 5.786 -3.734 1.00 99.99 H new ATOM 0 HB3 HIS A 37 0.652 5.078 -3.703 1.00 99.99 H new ATOM 0 HD2 HIS A 37 1.991 5.705 -7.272 1.00 99.99 H new ATOM 0 HE1 HIS A 37 2.660 1.616 -6.387 1.00 99.99 H new ATOM 0 HE2 HIS A 37 2.700 3.384 -8.224 1.00 99.99 H new ATOM 230 N LEU A 38 -1.637 6.748 -4.840 1.00 99.99 N ATOM 231 CA LEU A 38 -2.980 6.516 -5.359 1.00 99.99 C ATOM 232 C LEU A 38 -3.346 7.632 -6.327 1.00 99.99 C ATOM 233 O LEU A 38 -3.886 7.353 -7.366 1.00 99.99 O ATOM 234 CB LEU A 38 -4.055 6.524 -4.263 1.00 99.99 C ATOM 235 CG LEU A 38 -5.489 6.305 -4.804 1.00 99.99 C ATOM 236 CD1 LEU A 38 -5.620 4.965 -5.542 1.00 99.99 C ATOM 237 CD2 LEU A 38 -6.543 6.412 -3.702 1.00 99.99 C ATOM 0 H LEU A 38 -1.621 7.050 -3.866 1.00 99.99 H new ATOM 0 HA LEU A 38 -2.958 5.535 -5.833 1.00 99.99 H new ATOM 0 HB2 LEU A 38 -3.827 5.745 -3.535 1.00 99.99 H new ATOM 0 HB3 LEU A 38 -4.016 7.476 -3.734 1.00 99.99 H new ATOM 0 HG LEU A 38 -5.673 7.107 -5.519 1.00 99.99 H new ATOM 0 HD11 LEU A 38 -6.641 4.849 -5.906 1.00 99.99 H new ATOM 0 HD12 LEU A 38 -4.929 4.945 -6.385 1.00 99.99 H new ATOM 0 HD13 LEU A 38 -5.383 4.149 -4.859 1.00 99.99 H new ATOM 0 HD21 LEU A 38 -7.533 6.251 -4.129 1.00 99.99 H new ATOM 0 HD22 LEU A 38 -6.350 5.658 -2.939 1.00 99.99 H new ATOM 0 HD23 LEU A 38 -6.499 7.403 -3.251 1.00 99.99 H new ATOM 249 N ILE A 39 -3.057 8.805 -5.969 1.00 99.99 N ATOM 250 CA ILE A 39 -3.374 9.973 -6.785 1.00 99.99 C ATOM 251 C ILE A 39 -2.597 9.896 -8.090 1.00 99.99 C ATOM 252 O ILE A 39 -3.160 10.159 -9.124 1.00 99.99 O ATOM 253 CB ILE A 39 -2.972 11.296 -6.118 1.00 99.99 C ATOM 254 CG1 ILE A 39 -3.850 11.542 -4.871 1.00 99.99 C ATOM 255 CG2 ILE A 39 -3.113 12.462 -7.118 1.00 99.99 C ATOM 256 CD1 ILE A 39 -3.406 12.748 -4.031 1.00 99.99 C ATOM 0 H ILE A 39 -2.585 9.026 -5.092 1.00 99.99 H new ATOM 0 HA ILE A 39 -4.454 9.961 -6.933 1.00 99.99 H new ATOM 0 HB ILE A 39 -1.929 11.236 -5.806 1.00 99.99 H new ATOM 0 HG12 ILE A 39 -4.882 11.692 -5.188 1.00 99.99 H new ATOM 0 HG13 ILE A 39 -3.835 10.650 -4.245 1.00 99.99 H new ATOM 0 HG21 ILE A 39 -2.825 13.394 -6.633 1.00 99.99 H new ATOM 0 HG22 ILE A 39 -2.466 12.285 -7.977 1.00 99.99 H new ATOM 0 HG23 ILE A 39 -4.148 12.532 -7.452 1.00 99.99 H new ATOM 0 HD11 ILE A 39 -4.069 12.858 -3.173 1.00 99.99 H new ATOM 0 HD12 ILE A 39 -2.385 12.593 -3.683 1.00 99.99 H new ATOM 0 HD13 ILE A 39 -3.448 13.651 -4.640 1.00 99.99 H new ATOM 268 N LEU A 40 -1.384 9.566 -8.008 1.00 99.99 N ATOM 269 CA LEU A 40 -0.515 9.478 -9.175 1.00 99.99 C ATOM 270 C LEU A 40 -1.048 8.414 -10.123 1.00 99.99 C ATOM 271 O LEU A 40 -1.084 8.647 -11.305 1.00 99.99 O ATOM 272 CB LEU A 40 0.920 9.063 -8.824 1.00 99.99 C ATOM 273 CG LEU A 40 1.756 10.125 -8.075 1.00 99.99 C ATOM 274 CD1 LEU A 40 3.124 9.529 -7.690 1.00 99.99 C ATOM 275 CD2 LEU A 40 1.955 11.402 -8.903 1.00 99.99 C ATOM 0 H LEU A 40 -0.921 9.337 -7.128 1.00 99.99 H new ATOM 0 HA LEU A 40 -0.503 10.473 -9.620 1.00 99.99 H new ATOM 0 HB2 LEU A 40 0.880 8.161 -8.213 1.00 99.99 H new ATOM 0 HB3 LEU A 40 1.439 8.801 -9.746 1.00 99.99 H new ATOM 0 HG LEU A 40 1.204 10.405 -7.178 1.00 99.99 H new ATOM 0 HD11 LEU A 40 3.712 10.279 -7.162 1.00 99.99 H new ATOM 0 HD12 LEU A 40 2.975 8.664 -7.044 1.00 99.99 H new ATOM 0 HD13 LEU A 40 3.654 9.221 -8.592 1.00 99.99 H new ATOM 0 HD21 LEU A 40 2.548 12.117 -8.333 1.00 99.99 H new ATOM 0 HD22 LEU A 40 2.474 11.157 -9.830 1.00 99.99 H new ATOM 0 HD23 LEU A 40 0.984 11.840 -9.135 1.00 99.99 H new ATOM 287 N TRP A 41 -1.425 7.329 -9.599 1.00 99.99 N ATOM 288 CA TRP A 41 -1.932 6.215 -10.390 1.00 99.99 C ATOM 289 C TRP A 41 -3.260 6.610 -11.018 1.00 99.99 C ATOM 290 O TRP A 41 -3.478 6.311 -12.166 1.00 99.99 O ATOM 291 CB TRP A 41 -2.204 4.960 -9.549 1.00 99.99 C ATOM 292 CG TRP A 41 -2.632 3.752 -10.362 1.00 99.99 C ATOM 293 CD1 TRP A 41 -1.833 2.934 -11.100 1.00 99.99 C ATOM 294 CD2 TRP A 41 -3.985 3.320 -10.589 1.00 99.99 C ATOM 295 NE1 TRP A 41 -2.580 1.965 -11.708 1.00 99.99 N ATOM 296 CE2 TRP A 41 -3.907 2.205 -11.444 1.00 99.99 C ATOM 297 CE3 TRP A 41 -5.211 3.798 -10.116 1.00 99.99 C ATOM 298 CZ2 TRP A 41 -5.054 1.530 -11.835 1.00 99.99 C ATOM 299 CZ3 TRP A 41 -6.363 3.122 -10.524 1.00 99.99 C ATOM 300 CH2 TRP A 41 -6.294 2.002 -11.371 1.00 99.99 C ATOM 0 H TRP A 41 -1.404 7.150 -8.595 1.00 99.99 H new ATOM 0 HA TRP A 41 -1.165 5.989 -11.131 1.00 99.99 H new ATOM 0 HB2 TRP A 41 -1.303 4.708 -8.990 1.00 99.99 H new ATOM 0 HB3 TRP A 41 -2.980 5.186 -8.818 1.00 99.99 H new ATOM 0 HD1 TRP A 41 -0.762 3.036 -11.192 1.00 99.99 H new ATOM 0 HE1 TRP A 41 -2.214 1.193 -12.265 1.00 99.99 H new ATOM 0 HE3 TRP A 41 -5.265 4.655 -9.462 1.00 99.99 H new ATOM 0 HZ2 TRP A 41 -4.996 0.665 -12.479 1.00 99.99 H new ATOM 0 HZ3 TRP A 41 -7.327 3.467 -10.182 1.00 99.99 H new ATOM 0 HH2 TRP A 41 -7.203 1.499 -11.668 1.00 99.99 H new ATOM 311 N ILE A 42 -4.072 7.229 -10.276 1.00 99.99 N ATOM 312 CA ILE A 42 -5.393 7.644 -10.739 1.00 99.99 C ATOM 313 C ILE A 42 -5.236 8.719 -11.805 1.00 99.99 C ATOM 314 O ILE A 42 -5.922 8.666 -12.795 1.00 99.99 O ATOM 315 CB ILE A 42 -6.249 8.260 -9.627 1.00 99.99 C ATOM 316 CG1 ILE A 42 -6.693 7.165 -8.629 1.00 99.99 C ATOM 317 CG2 ILE A 42 -7.483 8.978 -10.216 1.00 99.99 C ATOM 318 CD1 ILE A 42 -7.477 7.710 -7.425 1.00 99.99 C ATOM 0 H ILE A 42 -3.871 7.484 -9.309 1.00 99.99 H new ATOM 0 HA ILE A 42 -5.883 6.745 -11.112 1.00 99.99 H new ATOM 0 HB ILE A 42 -5.645 8.998 -9.099 1.00 99.99 H new ATOM 0 HG12 ILE A 42 -7.310 6.436 -9.154 1.00 99.99 H new ATOM 0 HG13 ILE A 42 -5.811 6.635 -8.268 1.00 99.99 H new ATOM 0 HG21 ILE A 42 -8.075 9.407 -9.407 1.00 99.99 H new ATOM 0 HG22 ILE A 42 -7.156 9.772 -10.887 1.00 99.99 H new ATOM 0 HG23 ILE A 42 -8.090 8.262 -10.770 1.00 99.99 H new ATOM 0 HD11 ILE A 42 -7.755 6.885 -6.769 1.00 99.99 H new ATOM 0 HD12 ILE A 42 -6.855 8.417 -6.876 1.00 99.99 H new ATOM 0 HD13 ILE A 42 -8.377 8.215 -7.775 1.00 99.99 H new ATOM 330 N LEU A 43 -4.386 9.622 -11.576 1.00 99.99 N ATOM 331 CA LEU A 43 -4.153 10.726 -12.499 1.00 99.99 C ATOM 332 C LEU A 43 -3.603 10.180 -13.809 1.00 99.99 C ATOM 333 O LEU A 43 -3.938 10.696 -14.845 1.00 99.99 O ATOM 334 CB LEU A 43 -3.116 11.730 -11.979 1.00 99.99 C ATOM 335 CG LEU A 43 -3.589 12.567 -10.767 1.00 99.99 C ATOM 336 CD1 LEU A 43 -2.404 13.338 -10.157 1.00 99.99 C ATOM 337 CD2 LEU A 43 -4.713 13.544 -11.146 1.00 99.99 C ATOM 0 H LEU A 43 -3.804 9.650 -10.739 1.00 99.99 H new ATOM 0 HA LEU A 43 -5.112 11.230 -12.621 1.00 99.99 H new ATOM 0 HB2 LEU A 43 -2.212 11.189 -11.701 1.00 99.99 H new ATOM 0 HB3 LEU A 43 -2.845 12.407 -12.789 1.00 99.99 H new ATOM 0 HG LEU A 43 -3.990 11.873 -10.028 1.00 99.99 H new ATOM 0 HD11 LEU A 43 -2.750 13.923 -9.305 1.00 99.99 H new ATOM 0 HD12 LEU A 43 -1.642 12.632 -9.827 1.00 99.99 H new ATOM 0 HD13 LEU A 43 -1.980 14.006 -10.907 1.00 99.99 H new ATOM 0 HD21 LEU A 43 -5.015 14.111 -10.265 1.00 99.99 H new ATOM 0 HD22 LEU A 43 -4.355 14.230 -11.914 1.00 99.99 H new ATOM 0 HD23 LEU A 43 -5.567 12.985 -11.528 1.00 99.99 H new ATOM 349 N ASP A 44 -2.804 9.208 -13.724 1.00 99.99 N ATOM 350 CA ASP A 44 -2.182 8.604 -14.894 1.00 99.99 C ATOM 351 C ASP A 44 -3.252 7.931 -15.743 1.00 99.99 C ATOM 352 O ASP A 44 -3.191 8.023 -16.944 1.00 99.99 O ATOM 353 CB ASP A 44 -1.164 7.512 -14.536 1.00 99.99 C ATOM 354 CG ASP A 44 -0.448 6.944 -15.777 1.00 99.99 C ATOM 355 OD1 ASP A 44 0.321 7.699 -16.418 1.00 99.99 O ATOM 356 OD2 ASP A 44 -0.616 5.726 -16.084 1.00 99.99 O ATOM 0 H ASP A 44 -2.535 8.775 -12.840 1.00 99.99 H new ATOM 0 HA ASP A 44 -1.671 9.412 -15.418 1.00 99.99 H new ATOM 0 HB2 ASP A 44 -0.424 7.921 -13.849 1.00 99.99 H new ATOM 0 HB3 ASP A 44 -1.673 6.703 -14.012 1.00 99.99 H new ATOM 361 N ARG A 45 -4.151 7.301 -15.123 1.00 99.99 N ATOM 362 CA ARG A 45 -5.223 6.590 -15.810 1.00 99.99 C ATOM 363 C ARG A 45 -6.088 7.588 -16.566 1.00 99.99 C ATOM 364 O ARG A 45 -6.459 7.315 -17.679 1.00 99.99 O ATOM 365 CB ARG A 45 -6.161 5.850 -14.847 1.00 99.99 C ATOM 366 CG ARG A 45 -5.478 4.702 -14.075 1.00 99.99 C ATOM 367 CD ARG A 45 -5.242 3.453 -14.936 1.00 99.99 C ATOM 368 NE ARG A 45 -3.855 3.528 -15.520 1.00 99.99 N ATOM 369 CZ ARG A 45 -3.525 2.834 -16.626 1.00 99.99 C ATOM 370 NH1 ARG A 45 -4.407 2.027 -17.241 1.00 99.99 N ATOM 371 NH2 ARG A 45 -2.269 2.938 -17.092 1.00 99.99 N ATOM 0 H ARG A 45 -4.198 7.241 -14.106 1.00 99.99 H new ATOM 0 HA ARG A 45 -4.738 5.868 -16.467 1.00 99.99 H new ATOM 0 HB2 ARG A 45 -6.570 6.564 -14.132 1.00 99.99 H new ATOM 0 HB3 ARG A 45 -7.002 5.447 -15.411 1.00 99.99 H new ATOM 0 HG2 ARG A 45 -4.523 5.053 -13.685 1.00 99.99 H new ATOM 0 HG3 ARG A 45 -6.093 4.433 -13.217 1.00 99.99 H new ATOM 0 HD2 ARG A 45 -5.350 2.552 -14.333 1.00 99.99 H new ATOM 0 HD3 ARG A 45 -5.985 3.396 -15.731 1.00 99.99 H new ATOM 0 HE ARG A 45 -3.153 4.115 -15.069 1.00 99.99 H new ATOM 0 HH11 ARG A 45 -5.353 1.929 -16.871 1.00 99.99 H new ATOM 0 HH12 ARG A 45 -4.131 1.513 -18.077 1.00 99.99 H new ATOM 0 HH21 ARG A 45 -1.594 3.531 -16.610 1.00 99.99 H new ATOM 0 HH22 ARG A 45 -1.991 2.424 -17.928 1.00 99.99 H new ATOM 385 N LEU A 46 -6.370 8.660 -15.963 1.00 99.99 N ATOM 386 CA LEU A 46 -7.209 9.693 -16.559 1.00 99.99 C ATOM 387 C LEU A 46 -6.482 10.312 -17.743 1.00 99.99 C ATOM 388 O LEU A 46 -5.463 10.981 -17.581 1.00 99.99 O ATOM 389 CB LEU A 46 -7.519 10.843 -15.592 1.00 99.99 C ATOM 390 CG LEU A 46 -8.257 10.489 -14.278 1.00 99.99 C ATOM 391 CD1 LEU A 46 -8.245 11.729 -13.364 1.00 99.99 C ATOM 392 CD2 LEU A 46 -9.695 10.008 -14.499 1.00 99.99 C ATOM 0 H LEU A 46 -6.038 8.884 -15.025 1.00 99.99 H new ATOM 0 HA LEU A 46 -8.140 9.203 -16.844 1.00 99.99 H new ATOM 0 HB2 LEU A 46 -6.578 11.326 -15.330 1.00 99.99 H new ATOM 0 HB3 LEU A 46 -8.118 11.581 -16.127 1.00 99.99 H new ATOM 0 HG LEU A 46 -7.731 9.655 -13.815 1.00 99.99 H new ATOM 0 HD11 LEU A 46 -8.761 11.499 -12.432 1.00 99.99 H new ATOM 0 HD12 LEU A 46 -7.215 12.012 -13.148 1.00 99.99 H new ATOM 0 HD13 LEU A 46 -8.751 12.555 -13.864 1.00 99.99 H new ATOM 0 HD21 LEU A 46 -10.153 9.777 -13.537 1.00 99.99 H new ATOM 0 HD22 LEU A 46 -10.268 10.791 -14.996 1.00 99.99 H new ATOM 0 HD23 LEU A 46 -9.688 9.113 -15.121 1.00 99.99 H new ATOM 405 N SER B 22 -10.412 0.606 18.987 1.00 99.99 N ATOM 406 CA SER B 22 -10.116 1.253 17.676 1.00 99.99 C ATOM 407 C SER B 22 -8.656 1.594 17.532 1.00 99.99 C ATOM 408 O SER B 22 -7.871 1.457 18.471 1.00 99.99 O ATOM 409 CB SER B 22 -11.011 2.513 17.450 1.00 99.99 C ATOM 410 OG SER B 22 -10.783 3.544 18.408 1.00 99.99 O ATOM 0 HA SER B 22 -10.356 0.525 16.901 1.00 99.99 H new ATOM 0 HB2 SER B 22 -10.826 2.907 16.451 1.00 99.99 H new ATOM 0 HB3 SER B 22 -12.059 2.217 17.487 1.00 99.99 H new ATOM 0 HG SER B 22 -11.369 4.305 18.215 1.00 99.99 H new ATOM 415 N SER B 23 -8.271 2.058 16.319 1.00 99.99 N ATOM 416 CA SER B 23 -6.940 2.534 16.024 1.00 99.99 C ATOM 417 C SER B 23 -7.110 3.961 15.569 1.00 99.99 C ATOM 418 O SER B 23 -8.169 4.557 15.765 1.00 99.99 O ATOM 419 CB SER B 23 -6.227 1.685 14.944 1.00 99.99 C ATOM 420 OG SER B 23 -6.050 0.352 15.404 1.00 99.99 O ATOM 0 H SER B 23 -8.903 2.104 15.520 1.00 99.99 H new ATOM 0 HA SER B 23 -6.304 2.458 16.906 1.00 99.99 H new ATOM 0 HB2 SER B 23 -6.814 1.685 14.025 1.00 99.99 H new ATOM 0 HB3 SER B 23 -5.259 2.126 14.705 1.00 99.99 H new ATOM 0 HG SER B 23 -5.600 -0.176 14.712 1.00 99.99 H new ATOM 426 N ASP B 24 -6.047 4.560 14.971 1.00 99.99 N ATOM 427 CA ASP B 24 -6.007 5.966 14.611 1.00 99.99 C ATOM 428 C ASP B 24 -6.563 6.121 13.212 1.00 99.99 C ATOM 429 O ASP B 24 -6.427 5.187 12.429 1.00 99.99 O ATOM 430 CB ASP B 24 -4.560 6.533 14.628 1.00 99.99 C ATOM 431 CG ASP B 24 -3.944 6.462 16.029 1.00 99.99 C ATOM 432 OD1 ASP B 24 -4.705 6.373 17.031 1.00 99.99 O ATOM 433 OD2 ASP B 24 -2.687 6.509 16.112 1.00 99.99 O ATOM 0 H ASP B 24 -5.193 4.057 14.731 1.00 99.99 H new ATOM 0 HA ASP B 24 -6.597 6.517 15.343 1.00 99.99 H new ATOM 0 HB2 ASP B 24 -3.940 5.972 13.928 1.00 99.99 H new ATOM 0 HB3 ASP B 24 -4.570 7.568 14.286 1.00 99.99 H new ATOM 438 N PRO B 25 -7.208 7.225 12.828 1.00 99.99 N ATOM 439 CA PRO B 25 -8.048 7.272 11.641 1.00 99.99 C ATOM 440 C PRO B 25 -7.252 7.309 10.356 1.00 99.99 C ATOM 441 O PRO B 25 -7.813 6.927 9.341 1.00 99.99 O ATOM 442 CB PRO B 25 -8.883 8.553 11.804 1.00 99.99 C ATOM 443 CG PRO B 25 -8.053 9.429 12.745 1.00 99.99 C ATOM 444 CD PRO B 25 -7.409 8.401 13.672 1.00 99.99 C ATOM 0 HA PRO B 25 -8.659 6.373 11.563 1.00 99.99 H new ATOM 0 HB2 PRO B 25 -9.048 9.045 10.845 1.00 99.99 H new ATOM 0 HB3 PRO B 25 -9.865 8.337 12.225 1.00 99.99 H new ATOM 0 HG2 PRO B 25 -7.307 10.011 12.204 1.00 99.99 H new ATOM 0 HG3 PRO B 25 -8.674 10.137 13.294 1.00 99.99 H new ATOM 0 HD2 PRO B 25 -6.465 8.766 14.075 1.00 99.99 H new ATOM 0 HD3 PRO B 25 -8.052 8.175 14.522 1.00 99.99 H new ATOM 452 N LEU B 26 -5.980 7.768 10.380 1.00 99.99 N ATOM 453 CA LEU B 26 -5.015 7.772 9.288 1.00 99.99 C ATOM 454 C LEU B 26 -4.571 6.346 9.001 1.00 99.99 C ATOM 455 O LEU B 26 -4.479 5.981 7.856 1.00 99.99 O ATOM 456 CB LEU B 26 -3.741 8.563 9.617 1.00 99.99 C ATOM 457 CG LEU B 26 -2.577 8.438 8.608 1.00 99.99 C ATOM 458 CD1 LEU B 26 -2.924 9.009 7.231 1.00 99.99 C ATOM 459 CD2 LEU B 26 -1.314 9.108 9.169 1.00 99.99 C ATOM 0 H LEU B 26 -5.586 8.171 11.230 1.00 99.99 H new ATOM 0 HA LEU B 26 -5.518 8.237 8.440 1.00 99.99 H new ATOM 0 HB2 LEU B 26 -4.006 9.617 9.705 1.00 99.99 H new ATOM 0 HB3 LEU B 26 -3.382 8.242 10.595 1.00 99.99 H new ATOM 0 HG LEU B 26 -2.389 7.374 8.466 1.00 99.99 H new ATOM 0 HD11 LEU B 26 -2.070 8.894 6.564 1.00 99.99 H new ATOM 0 HD12 LEU B 26 -3.780 8.474 6.820 1.00 99.99 H new ATOM 0 HD13 LEU B 26 -3.170 10.067 7.327 1.00 99.99 H new ATOM 0 HD21 LEU B 26 -0.501 9.013 8.449 1.00 99.99 H new ATOM 0 HD22 LEU B 26 -1.514 10.164 9.354 1.00 99.99 H new ATOM 0 HD23 LEU B 26 -1.029 8.624 10.103 1.00 99.99 H new ATOM 471 N VAL B 27 -4.316 5.623 10.004 1.00 99.99 N ATOM 472 CA VAL B 27 -3.857 4.244 9.876 1.00 99.99 C ATOM 473 C VAL B 27 -4.997 3.381 9.357 1.00 99.99 C ATOM 474 O VAL B 27 -4.779 2.598 8.466 1.00 99.99 O ATOM 475 CB VAL B 27 -3.425 3.632 11.215 1.00 99.99 C ATOM 476 CG1 VAL B 27 -3.067 2.143 11.044 1.00 99.99 C ATOM 477 CG2 VAL B 27 -2.198 4.396 11.760 1.00 99.99 C ATOM 0 H VAL B 27 -4.410 5.942 10.968 1.00 99.99 H new ATOM 0 HA VAL B 27 -3.002 4.267 9.200 1.00 99.99 H new ATOM 0 HB VAL B 27 -4.255 3.713 11.917 1.00 99.99 H new ATOM 0 HG11 VAL B 27 -2.763 1.729 12.006 1.00 99.99 H new ATOM 0 HG12 VAL B 27 -3.936 1.600 10.673 1.00 99.99 H new ATOM 0 HG13 VAL B 27 -2.248 2.045 10.332 1.00 99.99 H new ATOM 0 HG21 VAL B 27 -1.892 3.961 12.711 1.00 99.99 H new ATOM 0 HG22 VAL B 27 -1.377 4.323 11.046 1.00 99.99 H new ATOM 0 HG23 VAL B 27 -2.458 5.444 11.908 1.00 99.99 H new ATOM 487 N VAL B 28 -6.121 3.537 9.908 1.00 99.99 N ATOM 488 CA VAL B 28 -7.294 2.758 9.528 1.00 99.99 C ATOM 489 C VAL B 28 -7.746 3.176 8.137 1.00 99.99 C ATOM 490 O VAL B 28 -8.045 2.325 7.338 1.00 99.99 O ATOM 491 CB VAL B 28 -8.490 2.986 10.461 1.00 99.99 C ATOM 492 CG1 VAL B 28 -9.757 2.287 9.928 1.00 99.99 C ATOM 493 CG2 VAL B 28 -8.154 2.470 11.874 1.00 99.99 C ATOM 0 H VAL B 28 -6.294 4.212 10.653 1.00 99.99 H new ATOM 0 HA VAL B 28 -6.996 1.711 9.578 1.00 99.99 H new ATOM 0 HB VAL B 28 -8.691 4.056 10.503 1.00 99.99 H new ATOM 0 HG11 VAL B 28 -10.587 2.467 10.611 1.00 99.99 H new ATOM 0 HG12 VAL B 28 -10.005 2.684 8.944 1.00 99.99 H new ATOM 0 HG13 VAL B 28 -9.576 1.215 9.852 1.00 99.99 H new ATOM 0 HG21 VAL B 28 -9.006 2.634 12.533 1.00 99.99 H new ATOM 0 HG22 VAL B 28 -7.930 1.404 11.828 1.00 99.99 H new ATOM 0 HG23 VAL B 28 -7.288 3.006 12.261 1.00 99.99 H new ATOM 503 N ALA B 29 -7.788 4.415 7.906 1.00 99.99 N ATOM 504 CA ALA B 29 -8.229 4.957 6.625 1.00 99.99 C ATOM 505 C ALA B 29 -7.300 4.465 5.525 1.00 99.99 C ATOM 506 O ALA B 29 -7.774 4.129 4.468 1.00 99.99 O ATOM 507 CB ALA B 29 -8.181 6.489 6.576 1.00 99.99 C ATOM 0 H ALA B 29 -7.520 5.125 8.588 1.00 99.99 H new ATOM 0 HA ALA B 29 -9.259 4.625 6.491 1.00 99.99 H new ATOM 0 HB1 ALA B 29 -8.520 6.833 5.599 1.00 99.99 H new ATOM 0 HB2 ALA B 29 -8.830 6.898 7.350 1.00 99.99 H new ATOM 0 HB3 ALA B 29 -7.158 6.827 6.744 1.00 99.99 H new ATOM 513 N ALA B 30 -6.067 4.445 5.792 1.00 99.99 N ATOM 514 CA ALA B 30 -5.065 4.020 4.823 1.00 99.99 C ATOM 515 C ALA B 30 -5.275 2.551 4.490 1.00 99.99 C ATOM 516 O ALA B 30 -5.079 2.173 3.361 1.00 99.99 O ATOM 517 CB ALA B 30 -3.631 4.140 5.356 1.00 99.99 C ATOM 0 H ALA B 30 -5.681 4.721 6.695 1.00 99.99 H new ATOM 0 HA ALA B 30 -5.184 4.671 3.957 1.00 99.99 H new ATOM 0 HB1 ALA B 30 -2.929 3.809 4.590 1.00 99.99 H new ATOM 0 HB2 ALA B 30 -3.424 5.179 5.613 1.00 99.99 H new ATOM 0 HB3 ALA B 30 -3.519 3.517 6.244 1.00 99.99 H new ATOM 523 N SER B 31 -5.648 1.806 5.436 1.00 99.99 N ATOM 524 CA SER B 31 -5.863 0.374 5.265 1.00 99.99 C ATOM 525 C SER B 31 -6.960 0.150 4.234 1.00 99.99 C ATOM 526 O SER B 31 -6.789 -0.666 3.364 1.00 99.99 O ATOM 527 CB SER B 31 -6.329 -0.319 6.551 1.00 99.99 C ATOM 528 OG SER B 31 -5.307 -0.281 7.546 1.00 99.99 O ATOM 0 H SER B 31 -5.826 2.143 6.382 1.00 99.99 H new ATOM 0 HA SER B 31 -4.904 -0.045 4.960 1.00 99.99 H new ATOM 0 HB2 SER B 31 -7.228 0.170 6.928 1.00 99.99 H new ATOM 0 HB3 SER B 31 -6.595 -1.354 6.336 1.00 99.99 H new ATOM 0 HG SER B 31 -5.154 0.647 7.823 1.00 99.99 H new ATOM 534 N ILE B 32 -8.007 0.844 4.365 1.00 99.99 N ATOM 535 CA ILE B 32 -9.146 0.714 3.465 1.00 99.99 C ATOM 536 C ILE B 32 -8.735 1.139 2.063 1.00 99.99 C ATOM 537 O ILE B 32 -9.169 0.536 1.117 1.00 99.99 O ATOM 538 CB ILE B 32 -10.325 1.612 3.862 1.00 99.99 C ATOM 539 CG1 ILE B 32 -10.907 1.160 5.220 1.00 99.99 C ATOM 540 CG2 ILE B 32 -11.426 1.586 2.781 1.00 99.99 C ATOM 541 CD1 ILE B 32 -11.838 2.203 5.851 1.00 99.99 C ATOM 0 H ILE B 32 -8.135 1.539 5.100 1.00 99.99 H new ATOM 0 HA ILE B 32 -9.456 -0.330 3.514 1.00 99.99 H new ATOM 0 HB ILE B 32 -9.957 2.634 3.954 1.00 99.99 H new ATOM 0 HG12 ILE B 32 -11.455 0.228 5.082 1.00 99.99 H new ATOM 0 HG13 ILE B 32 -10.088 0.949 5.908 1.00 99.99 H new ATOM 0 HG21 ILE B 32 -12.251 2.230 3.086 1.00 99.99 H new ATOM 0 HG22 ILE B 32 -11.017 1.943 1.836 1.00 99.99 H new ATOM 0 HG23 ILE B 32 -11.790 0.566 2.656 1.00 99.99 H new ATOM 0 HD11 ILE B 32 -12.214 1.827 6.802 1.00 99.99 H new ATOM 0 HD12 ILE B 32 -11.287 3.128 6.019 1.00 99.99 H new ATOM 0 HD13 ILE B 32 -12.675 2.396 5.181 1.00 99.99 H new ATOM 553 N ILE B 33 -7.950 2.123 1.982 1.00 99.99 N ATOM 554 CA ILE B 33 -7.495 2.656 0.703 1.00 99.99 C ATOM 555 C ILE B 33 -6.721 1.579 -0.045 1.00 99.99 C ATOM 556 O ILE B 33 -6.953 1.395 -1.212 1.00 99.99 O ATOM 557 CB ILE B 33 -6.537 3.846 0.856 1.00 99.99 C ATOM 558 CG1 ILE B 33 -7.377 5.129 1.074 1.00 99.99 C ATOM 559 CG2 ILE B 33 -5.602 4.000 -0.357 1.00 99.99 C ATOM 560 CD1 ILE B 33 -6.588 6.328 1.613 1.00 99.99 C ATOM 0 H ILE B 33 -7.578 2.616 2.794 1.00 99.99 H new ATOM 0 HA ILE B 33 -8.390 2.981 0.173 1.00 99.99 H new ATOM 0 HB ILE B 33 -5.893 3.669 1.717 1.00 99.99 H new ATOM 0 HG12 ILE B 33 -7.837 5.411 0.127 1.00 99.99 H new ATOM 0 HG13 ILE B 33 -8.187 4.903 1.768 1.00 99.99 H new ATOM 0 HG21 ILE B 33 -4.943 4.855 -0.203 1.00 99.99 H new ATOM 0 HG22 ILE B 33 -5.003 3.096 -0.472 1.00 99.99 H new ATOM 0 HG23 ILE B 33 -6.196 4.158 -1.257 1.00 99.99 H new ATOM 0 HD11 ILE B 33 -7.258 7.180 1.734 1.00 99.99 H new ATOM 0 HD12 ILE B 33 -6.150 6.071 2.577 1.00 99.99 H new ATOM 0 HD13 ILE B 33 -5.795 6.587 0.911 1.00 99.99 H new ATOM 572 N GLY B 34 -5.866 0.934 0.623 1.00 99.99 N ATOM 573 CA GLY B 34 -5.038 -0.110 0.027 1.00 99.99 C ATOM 574 C GLY B 34 -5.921 -1.268 -0.407 1.00 99.99 C ATOM 575 O GLY B 34 -5.657 -1.855 -1.426 1.00 99.99 O ATOM 0 H GLY B 34 -5.690 1.090 1.616 1.00 99.99 H new ATOM 0 HA2 GLY B 34 -4.493 0.287 -0.829 1.00 99.99 H new ATOM 0 HA3 GLY B 34 -4.295 -0.455 0.746 1.00 99.99 H new ATOM 579 N ILE B 35 -7.188 -1.233 -0.027 1.00 99.99 N ATOM 580 CA ILE B 35 -8.067 -2.268 -0.562 1.00 99.99 C ATOM 581 C ILE B 35 -8.785 -1.735 -1.792 1.00 99.99 C ATOM 582 O ILE B 35 -8.859 -2.430 -2.772 1.00 99.99 O ATOM 583 CB ILE B 35 -9.160 -2.693 0.427 1.00 99.99 C ATOM 584 CG1 ILE B 35 -8.524 -3.244 1.728 1.00 99.99 C ATOM 585 CG2 ILE B 35 -10.068 -3.759 -0.222 1.00 99.99 C ATOM 586 CD1 ILE B 35 -9.496 -3.406 2.901 1.00 99.99 C ATOM 0 H ILE B 35 -7.612 -0.553 0.604 1.00 99.99 H new ATOM 0 HA ILE B 35 -7.430 -3.124 -0.783 1.00 99.99 H new ATOM 0 HB ILE B 35 -9.765 -1.823 0.682 1.00 99.99 H new ATOM 0 HG12 ILE B 35 -8.072 -4.212 1.513 1.00 99.99 H new ATOM 0 HG13 ILE B 35 -7.718 -2.577 2.032 1.00 99.99 H new ATOM 0 HG21 ILE B 35 -10.842 -4.057 0.485 1.00 99.99 H new ATOM 0 HG22 ILE B 35 -10.533 -3.345 -1.116 1.00 99.99 H new ATOM 0 HG23 ILE B 35 -9.471 -4.629 -0.494 1.00 99.99 H new ATOM 0 HD11 ILE B 35 -8.960 -3.797 3.766 1.00 99.99 H new ATOM 0 HD12 ILE B 35 -9.930 -2.438 3.150 1.00 99.99 H new ATOM 0 HD13 ILE B 35 -10.290 -4.099 2.623 1.00 99.99 H new ATOM 598 N LEU B 36 -9.269 -0.573 -1.703 1.00 99.99 N ATOM 599 CA LEU B 36 -10.007 0.051 -2.795 1.00 99.99 C ATOM 600 C LEU B 36 -9.104 0.155 -4.015 1.00 99.99 C ATOM 601 O LEU B 36 -9.546 -0.135 -5.097 1.00 99.99 O ATOM 602 CB LEU B 36 -10.461 1.480 -2.469 1.00 99.99 C ATOM 603 CG LEU B 36 -11.131 2.244 -3.631 1.00 99.99 C ATOM 604 CD1 LEU B 36 -12.434 1.559 -4.067 1.00 99.99 C ATOM 605 CD2 LEU B 36 -11.385 3.709 -3.252 1.00 99.99 C ATOM 0 H LEU B 36 -9.183 0.012 -0.872 1.00 99.99 H new ATOM 0 HA LEU B 36 -10.884 -0.573 -2.969 1.00 99.99 H new ATOM 0 HB2 LEU B 36 -11.159 1.439 -1.633 1.00 99.99 H new ATOM 0 HB3 LEU B 36 -9.595 2.050 -2.133 1.00 99.99 H new ATOM 0 HG LEU B 36 -10.445 2.228 -4.478 1.00 99.99 H new ATOM 0 HD11 LEU B 36 -12.883 2.120 -4.887 1.00 99.99 H new ATOM 0 HD12 LEU B 36 -12.218 0.543 -4.398 1.00 99.99 H new ATOM 0 HD13 LEU B 36 -13.127 1.527 -3.226 1.00 99.99 H new ATOM 0 HD21 LEU B 36 -11.858 4.224 -4.088 1.00 99.99 H new ATOM 0 HD22 LEU B 36 -12.041 3.751 -2.382 1.00 99.99 H new ATOM 0 HD23 LEU B 36 -10.437 4.193 -3.016 1.00 99.99 H new ATOM 617 N HIS B 37 -7.836 0.592 -3.838 1.00 99.99 N ATOM 618 CA HIS B 37 -6.876 0.792 -4.896 1.00 99.99 C ATOM 619 C HIS B 37 -6.579 -0.515 -5.581 1.00 99.99 C ATOM 620 O HIS B 37 -6.239 -0.543 -6.762 1.00 99.99 O ATOM 621 CB HIS B 37 -5.554 1.387 -4.352 1.00 99.99 C ATOM 622 CG HIS B 37 -4.575 1.799 -5.421 1.00 99.99 C ATOM 623 ND1 HIS B 37 -3.252 2.029 -5.157 1.00 99.99 N ATOM 624 CD2 HIS B 37 -4.771 2.064 -6.735 1.00 99.99 C ATOM 625 CE1 HIS B 37 -2.662 2.412 -6.281 1.00 99.99 C ATOM 626 NE2 HIS B 37 -3.562 2.441 -7.254 1.00 99.99 N ATOM 0 H HIS B 37 -7.462 0.817 -2.916 1.00 99.99 H new ATOM 0 HA HIS B 37 -7.311 1.495 -5.607 1.00 99.99 H new ATOM 0 HB2 HIS B 37 -5.786 2.254 -3.734 1.00 99.99 H new ATOM 0 HB3 HIS B 37 -5.078 0.652 -3.703 1.00 99.99 H new ATOM 0 HD2 HIS B 37 -5.705 1.991 -7.272 1.00 99.99 H new ATOM 0 HE1 HIS B 37 -1.616 2.660 -6.387 1.00 99.99 H new ATOM 0 HE2 HIS B 37 -3.384 2.700 -8.224 1.00 99.99 H new ATOM 634 N LEU B 38 -6.748 -1.637 -4.840 1.00 99.99 N ATOM 635 CA LEU B 38 -6.516 -2.980 -5.359 1.00 99.99 C ATOM 636 C LEU B 38 -7.632 -3.346 -6.327 1.00 99.99 C ATOM 637 O LEU B 38 -7.353 -3.886 -7.366 1.00 99.99 O ATOM 638 CB LEU B 38 -6.524 -4.055 -4.263 1.00 99.99 C ATOM 639 CG LEU B 38 -6.305 -5.489 -4.804 1.00 99.99 C ATOM 640 CD1 LEU B 38 -4.965 -5.620 -5.542 1.00 99.99 C ATOM 641 CD2 LEU B 38 -6.412 -6.543 -3.702 1.00 99.99 C ATOM 0 H LEU B 38 -7.050 -1.621 -3.866 1.00 99.99 H new ATOM 0 HA LEU B 38 -5.535 -2.958 -5.833 1.00 99.99 H new ATOM 0 HB2 LEU B 38 -5.745 -3.827 -3.535 1.00 99.99 H new ATOM 0 HB3 LEU B 38 -7.476 -4.016 -3.734 1.00 99.99 H new ATOM 0 HG LEU B 38 -7.107 -5.673 -5.519 1.00 99.99 H new ATOM 0 HD11 LEU B 38 -4.849 -6.641 -5.906 1.00 99.99 H new ATOM 0 HD12 LEU B 38 -4.945 -4.929 -6.385 1.00 99.99 H new ATOM 0 HD13 LEU B 38 -4.149 -5.383 -4.859 1.00 99.99 H new ATOM 0 HD21 LEU B 38 -6.251 -7.533 -4.129 1.00 99.99 H new ATOM 0 HD22 LEU B 38 -5.658 -6.350 -2.939 1.00 99.99 H new ATOM 0 HD23 LEU B 38 -7.403 -6.499 -3.251 1.00 99.99 H new ATOM 653 N ILE B 39 -8.805 -3.057 -5.969 1.00 99.99 N ATOM 654 CA ILE B 39 -9.973 -3.374 -6.785 1.00 99.99 C ATOM 655 C ILE B 39 -9.896 -2.597 -8.090 1.00 99.99 C ATOM 656 O ILE B 39 -10.159 -3.160 -9.124 1.00 99.99 O ATOM 657 CB ILE B 39 -11.296 -2.972 -6.118 1.00 99.99 C ATOM 658 CG1 ILE B 39 -11.542 -3.850 -4.871 1.00 99.99 C ATOM 659 CG2 ILE B 39 -12.462 -3.113 -7.118 1.00 99.99 C ATOM 660 CD1 ILE B 39 -12.748 -3.406 -4.031 1.00 99.99 C ATOM 0 H ILE B 39 -9.026 -2.585 -5.092 1.00 99.99 H new ATOM 0 HA ILE B 39 -9.961 -4.454 -6.933 1.00 99.99 H new ATOM 0 HB ILE B 39 -11.236 -1.929 -5.806 1.00 99.99 H new ATOM 0 HG12 ILE B 39 -11.692 -4.882 -5.188 1.00 99.99 H new ATOM 0 HG13 ILE B 39 -10.650 -3.835 -4.245 1.00 99.99 H new ATOM 0 HG21 ILE B 39 -13.394 -2.825 -6.633 1.00 99.99 H new ATOM 0 HG22 ILE B 39 -12.285 -2.466 -7.977 1.00 99.99 H new ATOM 0 HG23 ILE B 39 -12.532 -4.148 -7.452 1.00 99.99 H new ATOM 0 HD11 ILE B 39 -12.858 -4.069 -3.173 1.00 99.99 H new ATOM 0 HD12 ILE B 39 -12.593 -2.385 -3.683 1.00 99.99 H new ATOM 0 HD13 ILE B 39 -13.651 -3.448 -4.640 1.00 99.99 H new ATOM 672 N LEU B 40 -9.566 -1.384 -8.008 1.00 99.99 N ATOM 673 CA LEU B 40 -9.478 -0.515 -9.175 1.00 99.99 C ATOM 674 C LEU B 40 -8.414 -1.048 -10.123 1.00 99.99 C ATOM 675 O LEU B 40 -8.647 -1.084 -11.305 1.00 99.99 O ATOM 676 CB LEU B 40 -9.063 0.920 -8.824 1.00 99.99 C ATOM 677 CG LEU B 40 -10.125 1.756 -8.075 1.00 99.99 C ATOM 678 CD1 LEU B 40 -9.529 3.124 -7.690 1.00 99.99 C ATOM 679 CD2 LEU B 40 -11.402 1.955 -8.903 1.00 99.99 C ATOM 0 H LEU B 40 -9.337 -0.921 -7.128 1.00 99.99 H new ATOM 0 HA LEU B 40 -10.473 -0.503 -9.620 1.00 99.99 H new ATOM 0 HB2 LEU B 40 -8.161 0.880 -8.213 1.00 99.99 H new ATOM 0 HB3 LEU B 40 -8.801 1.439 -9.746 1.00 99.99 H new ATOM 0 HG LEU B 40 -10.405 1.204 -7.178 1.00 99.99 H new ATOM 0 HD11 LEU B 40 -10.279 3.712 -7.162 1.00 99.99 H new ATOM 0 HD12 LEU B 40 -8.664 2.975 -7.044 1.00 99.99 H new ATOM 0 HD13 LEU B 40 -9.221 3.654 -8.592 1.00 99.99 H new ATOM 0 HD21 LEU B 40 -12.117 2.548 -8.333 1.00 99.99 H new ATOM 0 HD22 LEU B 40 -11.157 2.474 -9.830 1.00 99.99 H new ATOM 0 HD23 LEU B 40 -11.840 0.984 -9.135 1.00 99.99 H new ATOM 691 N TRP B 41 -7.329 -1.425 -9.599 1.00 99.99 N ATOM 692 CA TRP B 41 -6.215 -1.932 -10.390 1.00 99.99 C ATOM 693 C TRP B 41 -6.610 -3.260 -11.018 1.00 99.99 C ATOM 694 O TRP B 41 -6.311 -3.478 -12.166 1.00 99.99 O ATOM 695 CB TRP B 41 -4.960 -2.204 -9.549 1.00 99.99 C ATOM 696 CG TRP B 41 -3.752 -2.632 -10.362 1.00 99.99 C ATOM 697 CD1 TRP B 41 -2.934 -1.833 -11.100 1.00 99.99 C ATOM 698 CD2 TRP B 41 -3.320 -3.985 -10.589 1.00 99.99 C ATOM 699 NE1 TRP B 41 -1.965 -2.580 -11.708 1.00 99.99 N ATOM 700 CE2 TRP B 41 -2.205 -3.907 -11.444 1.00 99.99 C ATOM 701 CE3 TRP B 41 -3.798 -5.211 -10.116 1.00 99.99 C ATOM 702 CZ2 TRP B 41 -1.530 -5.054 -11.835 1.00 99.99 C ATOM 703 CZ3 TRP B 41 -3.122 -6.363 -10.524 1.00 99.99 C ATOM 704 CH2 TRP B 41 -2.002 -6.294 -11.371 1.00 99.99 C ATOM 0 H TRP B 41 -7.150 -1.404 -8.595 1.00 99.99 H new ATOM 0 HA TRP B 41 -5.989 -1.165 -11.131 1.00 99.99 H new ATOM 0 HB2 TRP B 41 -4.708 -1.303 -8.990 1.00 99.99 H new ATOM 0 HB3 TRP B 41 -5.186 -2.980 -8.818 1.00 99.99 H new ATOM 0 HD1 TRP B 41 -3.036 -0.762 -11.192 1.00 99.99 H new ATOM 0 HE1 TRP B 41 -1.193 -2.214 -12.265 1.00 99.99 H new ATOM 0 HE3 TRP B 41 -4.655 -5.265 -9.462 1.00 99.99 H new ATOM 0 HZ2 TRP B 41 -0.665 -4.996 -12.479 1.00 99.99 H new ATOM 0 HZ3 TRP B 41 -3.467 -7.327 -10.182 1.00 99.99 H new ATOM 0 HH2 TRP B 41 -1.499 -7.203 -11.668 1.00 99.99 H new ATOM 715 N ILE B 42 -7.229 -4.072 -10.276 1.00 99.99 N ATOM 716 CA ILE B 42 -7.644 -5.393 -10.739 1.00 99.99 C ATOM 717 C ILE B 42 -8.719 -5.236 -11.805 1.00 99.99 C ATOM 718 O ILE B 42 -8.666 -5.922 -12.795 1.00 99.99 O ATOM 719 CB ILE B 42 -8.260 -6.249 -9.627 1.00 99.99 C ATOM 720 CG1 ILE B 42 -7.165 -6.693 -8.629 1.00 99.99 C ATOM 721 CG2 ILE B 42 -8.978 -7.483 -10.216 1.00 99.99 C ATOM 722 CD1 ILE B 42 -7.710 -7.477 -7.425 1.00 99.99 C ATOM 0 H ILE B 42 -7.484 -3.871 -9.309 1.00 99.99 H new ATOM 0 HA ILE B 42 -6.745 -5.883 -11.112 1.00 99.99 H new ATOM 0 HB ILE B 42 -8.998 -5.645 -9.099 1.00 99.99 H new ATOM 0 HG12 ILE B 42 -6.436 -7.310 -9.154 1.00 99.99 H new ATOM 0 HG13 ILE B 42 -6.635 -5.811 -8.268 1.00 99.99 H new ATOM 0 HG21 ILE B 42 -9.407 -8.075 -9.407 1.00 99.99 H new ATOM 0 HG22 ILE B 42 -9.772 -7.156 -10.887 1.00 99.99 H new ATOM 0 HG23 ILE B 42 -8.262 -8.090 -10.770 1.00 99.99 H new ATOM 0 HD11 ILE B 42 -6.885 -7.755 -6.769 1.00 99.99 H new ATOM 0 HD12 ILE B 42 -8.417 -6.855 -6.876 1.00 99.99 H new ATOM 0 HD13 ILE B 42 -8.215 -8.377 -7.775 1.00 99.99 H new ATOM 734 N LEU B 43 -9.622 -4.386 -11.576 1.00 99.99 N ATOM 735 CA LEU B 43 -10.726 -4.153 -12.499 1.00 99.99 C ATOM 736 C LEU B 43 -10.180 -3.603 -13.809 1.00 99.99 C ATOM 737 O LEU B 43 -10.696 -3.938 -14.845 1.00 99.99 O ATOM 738 CB LEU B 43 -11.730 -3.116 -11.979 1.00 99.99 C ATOM 739 CG LEU B 43 -12.567 -3.589 -10.767 1.00 99.99 C ATOM 740 CD1 LEU B 43 -13.338 -2.404 -10.157 1.00 99.99 C ATOM 741 CD2 LEU B 43 -13.544 -4.713 -11.146 1.00 99.99 C ATOM 0 H LEU B 43 -9.650 -3.804 -10.739 1.00 99.99 H new ATOM 0 HA LEU B 43 -11.230 -5.112 -12.621 1.00 99.99 H new ATOM 0 HB2 LEU B 43 -11.189 -2.212 -11.701 1.00 99.99 H new ATOM 0 HB3 LEU B 43 -12.407 -2.845 -12.789 1.00 99.99 H new ATOM 0 HG LEU B 43 -11.873 -3.990 -10.028 1.00 99.99 H new ATOM 0 HD11 LEU B 43 -13.923 -2.750 -9.305 1.00 99.99 H new ATOM 0 HD12 LEU B 43 -12.632 -1.642 -9.827 1.00 99.99 H new ATOM 0 HD13 LEU B 43 -14.006 -1.980 -10.907 1.00 99.99 H new ATOM 0 HD21 LEU B 43 -14.111 -5.015 -10.265 1.00 99.99 H new ATOM 0 HD22 LEU B 43 -14.230 -4.355 -11.914 1.00 99.99 H new ATOM 0 HD23 LEU B 43 -12.985 -5.567 -11.528 1.00 99.99 H new ATOM 753 N ASP B 44 -9.208 -2.804 -13.724 1.00 99.99 N ATOM 754 CA ASP B 44 -8.604 -2.182 -14.894 1.00 99.99 C ATOM 755 C ASP B 44 -7.931 -3.252 -15.743 1.00 99.99 C ATOM 756 O ASP B 44 -8.023 -3.191 -16.944 1.00 99.99 O ATOM 757 CB ASP B 44 -7.512 -1.164 -14.536 1.00 99.99 C ATOM 758 CG ASP B 44 -6.944 -0.448 -15.777 1.00 99.99 C ATOM 759 OD1 ASP B 44 -7.699 0.321 -16.418 1.00 99.99 O ATOM 760 OD2 ASP B 44 -5.726 -0.616 -16.084 1.00 99.99 O ATOM 0 H ASP B 44 -8.775 -2.535 -12.840 1.00 99.99 H new ATOM 0 HA ASP B 44 -9.412 -1.671 -15.418 1.00 99.99 H new ATOM 0 HB2 ASP B 44 -7.921 -0.424 -13.849 1.00 99.99 H new ATOM 0 HB3 ASP B 44 -6.703 -1.673 -14.012 1.00 99.99 H new ATOM 765 N ARG B 45 -7.301 -4.151 -15.123 1.00 99.99 N ATOM 766 CA ARG B 45 -6.590 -5.223 -15.810 1.00 99.99 C ATOM 767 C ARG B 45 -7.588 -6.088 -16.566 1.00 99.99 C ATOM 768 O ARG B 45 -7.315 -6.459 -17.679 1.00 99.99 O ATOM 769 CB ARG B 45 -5.850 -6.161 -14.847 1.00 99.99 C ATOM 770 CG ARG B 45 -4.702 -5.478 -14.075 1.00 99.99 C ATOM 771 CD ARG B 45 -3.453 -5.242 -14.936 1.00 99.99 C ATOM 772 NE ARG B 45 -3.528 -3.855 -15.520 1.00 99.99 N ATOM 773 CZ ARG B 45 -2.834 -3.525 -16.626 1.00 99.99 C ATOM 774 NH1 ARG B 45 -2.027 -4.407 -17.241 1.00 99.99 N ATOM 775 NH2 ARG B 45 -2.938 -2.269 -17.092 1.00 99.99 N ATOM 0 H ARG B 45 -7.241 -4.198 -14.106 1.00 99.99 H new ATOM 0 HA ARG B 45 -5.868 -4.738 -16.467 1.00 99.99 H new ATOM 0 HB2 ARG B 45 -6.564 -6.570 -14.132 1.00 99.99 H new ATOM 0 HB3 ARG B 45 -5.447 -7.002 -15.411 1.00 99.99 H new ATOM 0 HG2 ARG B 45 -5.053 -4.523 -13.685 1.00 99.99 H new ATOM 0 HG3 ARG B 45 -4.433 -6.093 -13.217 1.00 99.99 H new ATOM 0 HD2 ARG B 45 -2.552 -5.350 -14.333 1.00 99.99 H new ATOM 0 HD3 ARG B 45 -3.396 -5.985 -15.731 1.00 99.99 H new ATOM 0 HE ARG B 45 -4.115 -3.153 -15.069 1.00 99.99 H new ATOM 0 HH11 ARG B 45 -1.929 -5.353 -16.871 1.00 99.99 H new ATOM 0 HH12 ARG B 45 -1.513 -4.131 -18.077 1.00 99.99 H new ATOM 0 HH21 ARG B 45 -3.531 -1.594 -16.610 1.00 99.99 H new ATOM 0 HH22 ARG B 45 -2.424 -1.991 -17.928 1.00 99.99 H new ATOM 789 N LEU B 46 -8.660 -6.370 -15.963 1.00 99.99 N ATOM 790 CA LEU B 46 -9.693 -7.209 -16.559 1.00 99.99 C ATOM 791 C LEU B 46 -10.312 -6.482 -17.743 1.00 99.99 C ATOM 792 O LEU B 46 -10.981 -5.463 -17.581 1.00 99.99 O ATOM 793 CB LEU B 46 -10.843 -7.519 -15.592 1.00 99.99 C ATOM 794 CG LEU B 46 -10.489 -8.257 -14.278 1.00 99.99 C ATOM 795 CD1 LEU B 46 -11.729 -8.245 -13.364 1.00 99.99 C ATOM 796 CD2 LEU B 46 -10.008 -9.695 -14.499 1.00 99.99 C ATOM 0 H LEU B 46 -8.884 -6.038 -15.025 1.00 99.99 H new ATOM 0 HA LEU B 46 -9.203 -8.140 -16.844 1.00 99.99 H new ATOM 0 HB2 LEU B 46 -11.326 -6.578 -15.330 1.00 99.99 H new ATOM 0 HB3 LEU B 46 -11.581 -8.118 -16.127 1.00 99.99 H new ATOM 0 HG LEU B 46 -9.655 -7.731 -13.815 1.00 99.99 H new ATOM 0 HD11 LEU B 46 -11.499 -8.761 -12.432 1.00 99.99 H new ATOM 0 HD12 LEU B 46 -12.012 -7.215 -13.148 1.00 99.99 H new ATOM 0 HD13 LEU B 46 -12.555 -8.751 -13.864 1.00 99.99 H new ATOM 0 HD21 LEU B 46 -9.777 -10.153 -13.537 1.00 99.99 H new ATOM 0 HD22 LEU B 46 -10.791 -10.268 -14.996 1.00 99.99 H new ATOM 0 HD23 LEU B 46 -9.113 -9.688 -15.121 1.00 99.99 H new ATOM 809 N SER C 22 -0.606 -10.412 18.987 1.00 99.99 N ATOM 810 CA SER C 22 -1.253 -10.116 17.676 1.00 99.99 C ATOM 811 C SER C 22 -1.594 -8.656 17.532 1.00 99.99 C ATOM 812 O SER C 22 -1.457 -7.871 18.471 1.00 99.99 O ATOM 813 CB SER C 22 -2.513 -11.011 17.450 1.00 99.99 C ATOM 814 OG SER C 22 -3.544 -10.783 18.408 1.00 99.99 O ATOM 0 HA SER C 22 -0.525 -10.356 16.901 1.00 99.99 H new ATOM 0 HB2 SER C 22 -2.907 -10.826 16.451 1.00 99.99 H new ATOM 0 HB3 SER C 22 -2.217 -12.059 17.487 1.00 99.99 H new ATOM 0 HG SER C 22 -4.305 -11.369 18.215 1.00 99.99 H new ATOM 819 N SER C 23 -2.058 -8.271 16.319 1.00 99.99 N ATOM 820 CA SER C 23 -2.534 -6.940 16.024 1.00 99.99 C ATOM 821 C SER C 23 -3.961 -7.110 15.569 1.00 99.99 C ATOM 822 O SER C 23 -4.557 -8.169 15.765 1.00 99.99 O ATOM 823 CB SER C 23 -1.685 -6.227 14.944 1.00 99.99 C ATOM 824 OG SER C 23 -0.352 -6.050 15.404 1.00 99.99 O ATOM 0 H SER C 23 -2.104 -8.903 15.520 1.00 99.99 H new ATOM 0 HA SER C 23 -2.458 -6.304 16.906 1.00 99.99 H new ATOM 0 HB2 SER C 23 -1.685 -6.814 14.025 1.00 99.99 H new ATOM 0 HB3 SER C 23 -2.126 -5.259 14.705 1.00 99.99 H new ATOM 0 HG SER C 23 0.176 -5.600 14.712 1.00 99.99 H new ATOM 830 N ASP C 24 -4.560 -6.047 14.971 1.00 99.99 N ATOM 831 CA ASP C 24 -5.966 -6.007 14.611 1.00 99.99 C ATOM 832 C ASP C 24 -6.121 -6.563 13.212 1.00 99.99 C ATOM 833 O ASP C 24 -5.187 -6.427 12.429 1.00 99.99 O ATOM 834 CB ASP C 24 -6.533 -4.560 14.628 1.00 99.99 C ATOM 835 CG ASP C 24 -6.462 -3.944 16.029 1.00 99.99 C ATOM 836 OD1 ASP C 24 -6.373 -4.705 17.031 1.00 99.99 O ATOM 837 OD2 ASP C 24 -6.509 -2.687 16.112 1.00 99.99 O ATOM 0 H ASP C 24 -4.057 -5.193 14.731 1.00 99.99 H new ATOM 0 HA ASP C 24 -6.517 -6.597 15.343 1.00 99.99 H new ATOM 0 HB2 ASP C 24 -5.972 -3.940 13.928 1.00 99.99 H new ATOM 0 HB3 ASP C 24 -7.568 -4.570 14.286 1.00 99.99 H new ATOM 842 N PRO C 25 -7.225 -7.208 12.828 1.00 99.99 N ATOM 843 CA PRO C 25 -7.272 -8.048 11.641 1.00 99.99 C ATOM 844 C PRO C 25 -7.309 -7.252 10.356 1.00 99.99 C ATOM 845 O PRO C 25 -6.927 -7.813 9.341 1.00 99.99 O ATOM 846 CB PRO C 25 -8.553 -8.883 11.804 1.00 99.99 C ATOM 847 CG PRO C 25 -9.429 -8.053 12.745 1.00 99.99 C ATOM 848 CD PRO C 25 -8.401 -7.409 13.672 1.00 99.99 C ATOM 0 HA PRO C 25 -6.373 -8.659 11.563 1.00 99.99 H new ATOM 0 HB2 PRO C 25 -9.045 -9.048 10.845 1.00 99.99 H new ATOM 0 HB3 PRO C 25 -8.337 -9.865 12.225 1.00 99.99 H new ATOM 0 HG2 PRO C 25 -10.011 -7.307 12.204 1.00 99.99 H new ATOM 0 HG3 PRO C 25 -10.137 -8.674 13.294 1.00 99.99 H new ATOM 0 HD2 PRO C 25 -8.766 -6.465 14.075 1.00 99.99 H new ATOM 0 HD3 PRO C 25 -8.175 -8.052 14.522 1.00 99.99 H new ATOM 856 N LEU C 26 -7.768 -5.980 10.380 1.00 99.99 N ATOM 857 CA LEU C 26 -7.772 -5.015 9.288 1.00 99.99 C ATOM 858 C LEU C 26 -6.346 -4.571 9.001 1.00 99.99 C ATOM 859 O LEU C 26 -5.981 -4.479 7.856 1.00 99.99 O ATOM 860 CB LEU C 26 -8.563 -3.741 9.617 1.00 99.99 C ATOM 861 CG LEU C 26 -8.438 -2.577 8.608 1.00 99.99 C ATOM 862 CD1 LEU C 26 -9.009 -2.924 7.231 1.00 99.99 C ATOM 863 CD2 LEU C 26 -9.108 -1.314 9.169 1.00 99.99 C ATOM 0 H LEU C 26 -8.171 -5.586 11.230 1.00 99.99 H new ATOM 0 HA LEU C 26 -8.237 -5.518 8.440 1.00 99.99 H new ATOM 0 HB2 LEU C 26 -9.617 -4.006 9.705 1.00 99.99 H new ATOM 0 HB3 LEU C 26 -8.242 -3.382 10.595 1.00 99.99 H new ATOM 0 HG LEU C 26 -7.374 -2.389 8.466 1.00 99.99 H new ATOM 0 HD11 LEU C 26 -8.894 -2.070 6.564 1.00 99.99 H new ATOM 0 HD12 LEU C 26 -8.474 -3.780 6.820 1.00 99.99 H new ATOM 0 HD13 LEU C 26 -10.067 -3.170 7.327 1.00 99.99 H new ATOM 0 HD21 LEU C 26 -9.013 -0.501 8.449 1.00 99.99 H new ATOM 0 HD22 LEU C 26 -10.164 -1.514 9.354 1.00 99.99 H new ATOM 0 HD23 LEU C 26 -8.624 -1.029 10.103 1.00 99.99 H new ATOM 875 N VAL C 27 -5.623 -4.316 10.004 1.00 99.99 N ATOM 876 CA VAL C 27 -4.244 -3.857 9.876 1.00 99.99 C ATOM 877 C VAL C 27 -3.381 -4.997 9.357 1.00 99.99 C ATOM 878 O VAL C 27 -2.598 -4.779 8.466 1.00 99.99 O ATOM 879 CB VAL C 27 -3.632 -3.425 11.215 1.00 99.99 C ATOM 880 CG1 VAL C 27 -2.143 -3.067 11.044 1.00 99.99 C ATOM 881 CG2 VAL C 27 -4.396 -2.198 11.760 1.00 99.99 C ATOM 0 H VAL C 27 -5.942 -4.410 10.968 1.00 99.99 H new ATOM 0 HA VAL C 27 -4.267 -3.002 9.200 1.00 99.99 H new ATOM 0 HB VAL C 27 -3.713 -4.255 11.917 1.00 99.99 H new ATOM 0 HG11 VAL C 27 -1.729 -2.763 12.006 1.00 99.99 H new ATOM 0 HG12 VAL C 27 -1.600 -3.936 10.673 1.00 99.99 H new ATOM 0 HG13 VAL C 27 -2.045 -2.248 10.332 1.00 99.99 H new ATOM 0 HG21 VAL C 27 -3.961 -1.892 12.711 1.00 99.99 H new ATOM 0 HG22 VAL C 27 -4.323 -1.377 11.046 1.00 99.99 H new ATOM 0 HG23 VAL C 27 -5.444 -2.458 11.908 1.00 99.99 H new ATOM 891 N VAL C 28 -3.537 -6.121 9.908 1.00 99.99 N ATOM 892 CA VAL C 28 -2.758 -7.294 9.528 1.00 99.99 C ATOM 893 C VAL C 28 -3.176 -7.746 8.137 1.00 99.99 C ATOM 894 O VAL C 28 -2.325 -8.045 7.338 1.00 99.99 O ATOM 895 CB VAL C 28 -2.986 -8.490 10.461 1.00 99.99 C ATOM 896 CG1 VAL C 28 -2.287 -9.757 9.928 1.00 99.99 C ATOM 897 CG2 VAL C 28 -2.470 -8.154 11.874 1.00 99.99 C ATOM 0 H VAL C 28 -4.212 -6.294 10.653 1.00 99.99 H new ATOM 0 HA VAL C 28 -1.711 -6.996 9.578 1.00 99.99 H new ATOM 0 HB VAL C 28 -4.056 -8.691 10.503 1.00 99.99 H new ATOM 0 HG11 VAL C 28 -2.467 -10.587 10.611 1.00 99.99 H new ATOM 0 HG12 VAL C 28 -2.684 -10.005 8.944 1.00 99.99 H new ATOM 0 HG13 VAL C 28 -1.215 -9.576 9.852 1.00 99.99 H new ATOM 0 HG21 VAL C 28 -2.634 -9.006 12.533 1.00 99.99 H new ATOM 0 HG22 VAL C 28 -1.404 -7.930 11.828 1.00 99.99 H new ATOM 0 HG23 VAL C 28 -3.006 -7.288 12.261 1.00 99.99 H new ATOM 907 N ALA C 29 -4.415 -7.788 7.906 1.00 99.99 N ATOM 908 CA ALA C 29 -4.957 -8.229 6.625 1.00 99.99 C ATOM 909 C ALA C 29 -4.465 -7.300 5.525 1.00 99.99 C ATOM 910 O ALA C 29 -4.129 -7.774 4.468 1.00 99.99 O ATOM 911 CB ALA C 29 -6.489 -8.181 6.576 1.00 99.99 C ATOM 0 H ALA C 29 -5.125 -7.520 8.588 1.00 99.99 H new ATOM 0 HA ALA C 29 -4.625 -9.259 6.491 1.00 99.99 H new ATOM 0 HB1 ALA C 29 -6.833 -8.520 5.599 1.00 99.99 H new ATOM 0 HB2 ALA C 29 -6.898 -8.830 7.350 1.00 99.99 H new ATOM 0 HB3 ALA C 29 -6.827 -7.158 6.744 1.00 99.99 H new ATOM 917 N ALA C 30 -4.445 -6.067 5.792 1.00 99.99 N ATOM 918 CA ALA C 30 -4.020 -5.065 4.823 1.00 99.99 C ATOM 919 C ALA C 30 -2.551 -5.275 4.490 1.00 99.99 C ATOM 920 O ALA C 30 -2.173 -5.079 3.361 1.00 99.99 O ATOM 921 CB ALA C 30 -4.140 -3.631 5.356 1.00 99.99 C ATOM 0 H ALA C 30 -4.721 -5.681 6.695 1.00 99.99 H new ATOM 0 HA ALA C 30 -4.671 -5.184 3.957 1.00 99.99 H new ATOM 0 HB1 ALA C 30 -3.809 -2.929 4.590 1.00 99.99 H new ATOM 0 HB2 ALA C 30 -5.179 -3.424 5.613 1.00 99.99 H new ATOM 0 HB3 ALA C 30 -3.517 -3.519 6.244 1.00 99.99 H new ATOM 927 N SER C 31 -1.806 -5.648 5.436 1.00 99.99 N ATOM 928 CA SER C 31 -0.374 -5.863 5.265 1.00 99.99 C ATOM 929 C SER C 31 -0.150 -6.960 4.234 1.00 99.99 C ATOM 930 O SER C 31 0.666 -6.789 3.364 1.00 99.99 O ATOM 931 CB SER C 31 0.319 -6.329 6.551 1.00 99.99 C ATOM 932 OG SER C 31 0.281 -5.307 7.546 1.00 99.99 O ATOM 0 H SER C 31 -2.143 -5.826 6.382 1.00 99.99 H new ATOM 0 HA SER C 31 0.045 -4.904 4.960 1.00 99.99 H new ATOM 0 HB2 SER C 31 -0.170 -7.228 6.928 1.00 99.99 H new ATOM 0 HB3 SER C 31 1.354 -6.595 6.336 1.00 99.99 H new ATOM 0 HG SER C 31 -0.645 -5.166 7.835 1.00 99.99 H new ATOM 938 N ILE C 32 -0.844 -8.007 4.365 1.00 99.99 N ATOM 939 CA ILE C 32 -0.714 -9.146 3.465 1.00 99.99 C ATOM 940 C ILE C 32 -1.139 -8.735 2.063 1.00 99.99 C ATOM 941 O ILE C 32 -0.536 -9.169 1.117 1.00 99.99 O ATOM 942 CB ILE C 32 -1.612 -10.325 3.862 1.00 99.99 C ATOM 943 CG1 ILE C 32 -1.160 -10.907 5.220 1.00 99.99 C ATOM 944 CG2 ILE C 32 -1.586 -11.426 2.781 1.00 99.99 C ATOM 945 CD1 ILE C 32 -2.203 -11.838 5.851 1.00 99.99 C ATOM 0 H ILE C 32 -1.539 -8.135 5.100 1.00 99.99 H new ATOM 0 HA ILE C 32 0.330 -9.456 3.514 1.00 99.99 H new ATOM 0 HB ILE C 32 -2.634 -9.957 3.954 1.00 99.99 H new ATOM 0 HG12 ILE C 32 -0.228 -11.455 5.082 1.00 99.99 H new ATOM 0 HG13 ILE C 32 -0.949 -10.088 5.908 1.00 99.99 H new ATOM 0 HG21 ILE C 32 -2.230 -12.251 3.086 1.00 99.99 H new ATOM 0 HG22 ILE C 32 -1.943 -11.017 1.836 1.00 99.99 H new ATOM 0 HG23 ILE C 32 -0.566 -11.790 2.656 1.00 99.99 H new ATOM 0 HD11 ILE C 32 -1.827 -12.214 6.802 1.00 99.99 H new ATOM 0 HD12 ILE C 32 -3.128 -11.287 6.019 1.00 99.99 H new ATOM 0 HD13 ILE C 32 -2.396 -12.675 5.181 1.00 99.99 H new ATOM 957 N ILE C 33 -2.123 -7.950 1.982 1.00 99.99 N ATOM 958 CA ILE C 33 -2.656 -7.495 0.703 1.00 99.99 C ATOM 959 C ILE C 33 -1.579 -6.721 -0.045 1.00 99.99 C ATOM 960 O ILE C 33 -1.395 -6.953 -1.212 1.00 99.99 O ATOM 961 CB ILE C 33 -3.846 -6.537 0.856 1.00 99.99 C ATOM 962 CG1 ILE C 33 -5.129 -7.377 1.074 1.00 99.99 C ATOM 963 CG2 ILE C 33 -4.000 -5.602 -0.357 1.00 99.99 C ATOM 964 CD1 ILE C 33 -6.328 -6.588 1.613 1.00 99.99 C ATOM 0 H ILE C 33 -2.616 -7.578 2.794 1.00 99.99 H new ATOM 0 HA ILE C 33 -2.981 -8.390 0.173 1.00 99.99 H new ATOM 0 HB ILE C 33 -3.669 -5.893 1.717 1.00 99.99 H new ATOM 0 HG12 ILE C 33 -5.411 -7.837 0.127 1.00 99.99 H new ATOM 0 HG13 ILE C 33 -4.903 -8.187 1.768 1.00 99.99 H new ATOM 0 HG21 ILE C 33 -4.855 -4.943 -0.203 1.00 99.99 H new ATOM 0 HG22 ILE C 33 -3.096 -5.003 -0.472 1.00 99.99 H new ATOM 0 HG23 ILE C 33 -4.158 -6.196 -1.257 1.00 99.99 H new ATOM 0 HD11 ILE C 33 -7.180 -7.258 1.734 1.00 99.99 H new ATOM 0 HD12 ILE C 33 -6.071 -6.150 2.577 1.00 99.99 H new ATOM 0 HD13 ILE C 33 -6.587 -5.795 0.911 1.00 99.99 H new ATOM 976 N GLY C 34 -0.934 -5.866 0.623 1.00 99.99 N ATOM 977 CA GLY C 34 0.110 -5.038 0.027 1.00 99.99 C ATOM 978 C GLY C 34 1.268 -5.921 -0.407 1.00 99.99 C ATOM 979 O GLY C 34 1.855 -5.657 -1.426 1.00 99.99 O ATOM 0 H GLY C 34 -1.090 -5.690 1.616 1.00 99.99 H new ATOM 0 HA2 GLY C 34 -0.287 -4.493 -0.829 1.00 99.99 H new ATOM 0 HA3 GLY C 34 0.455 -4.295 0.746 1.00 99.99 H new ATOM 983 N ILE C 35 1.233 -7.188 -0.027 1.00 99.99 N ATOM 984 CA ILE C 35 2.268 -8.067 -0.562 1.00 99.99 C ATOM 985 C ILE C 35 1.735 -8.785 -1.792 1.00 99.99 C ATOM 986 O ILE C 35 2.430 -8.859 -2.772 1.00 99.99 O ATOM 987 CB ILE C 35 2.693 -9.160 0.427 1.00 99.99 C ATOM 988 CG1 ILE C 35 3.244 -8.524 1.728 1.00 99.99 C ATOM 989 CG2 ILE C 35 3.759 -10.068 -0.222 1.00 99.99 C ATOM 990 CD1 ILE C 35 3.406 -9.496 2.901 1.00 99.99 C ATOM 0 H ILE C 35 0.553 -7.612 0.604 1.00 99.99 H new ATOM 0 HA ILE C 35 3.124 -7.430 -0.783 1.00 99.99 H new ATOM 0 HB ILE C 35 1.823 -9.765 0.682 1.00 99.99 H new ATOM 0 HG12 ILE C 35 4.212 -8.072 1.513 1.00 99.99 H new ATOM 0 HG13 ILE C 35 2.577 -7.718 2.032 1.00 99.99 H new ATOM 0 HG21 ILE C 35 4.057 -10.842 0.485 1.00 99.99 H new ATOM 0 HG22 ILE C 35 3.345 -10.533 -1.116 1.00 99.99 H new ATOM 0 HG23 ILE C 35 4.629 -9.471 -0.494 1.00 99.99 H new ATOM 0 HD11 ILE C 35 3.797 -8.960 3.766 1.00 99.99 H new ATOM 0 HD12 ILE C 35 2.438 -9.930 3.150 1.00 99.99 H new ATOM 0 HD13 ILE C 35 4.099 -10.290 2.623 1.00 99.99 H new ATOM 1002 N LEU C 36 0.573 -9.269 -1.703 1.00 99.99 N ATOM 1003 CA LEU C 36 -0.051 -10.007 -2.795 1.00 99.99 C ATOM 1004 C LEU C 36 -0.155 -9.104 -4.015 1.00 99.99 C ATOM 1005 O LEU C 36 0.135 -9.546 -5.097 1.00 99.99 O ATOM 1006 CB LEU C 36 -1.480 -10.461 -2.469 1.00 99.99 C ATOM 1007 CG LEU C 36 -2.244 -11.131 -3.631 1.00 99.99 C ATOM 1008 CD1 LEU C 36 -1.559 -12.434 -4.067 1.00 99.99 C ATOM 1009 CD2 LEU C 36 -3.709 -11.385 -3.252 1.00 99.99 C ATOM 0 H LEU C 36 -0.012 -9.183 -0.872 1.00 99.99 H new ATOM 0 HA LEU C 36 0.573 -10.884 -2.969 1.00 99.99 H new ATOM 0 HB2 LEU C 36 -1.439 -11.159 -1.633 1.00 99.99 H new ATOM 0 HB3 LEU C 36 -2.050 -9.595 -2.133 1.00 99.99 H new ATOM 0 HG LEU C 36 -2.228 -10.445 -4.478 1.00 99.99 H new ATOM 0 HD11 LEU C 36 -2.120 -12.883 -4.887 1.00 99.99 H new ATOM 0 HD12 LEU C 36 -0.543 -12.218 -4.398 1.00 99.99 H new ATOM 0 HD13 LEU C 36 -1.527 -13.127 -3.226 1.00 99.99 H new ATOM 0 HD21 LEU C 36 -4.224 -11.858 -4.088 1.00 99.99 H new ATOM 0 HD22 LEU C 36 -3.751 -12.041 -2.382 1.00 99.99 H new ATOM 0 HD23 LEU C 36 -4.193 -10.437 -3.016 1.00 99.99 H new ATOM 1021 N HIS C 37 -0.592 -7.836 -3.838 1.00 99.99 N ATOM 1022 CA HIS C 37 -0.792 -6.876 -4.896 1.00 99.99 C ATOM 1023 C HIS C 37 0.515 -6.579 -5.581 1.00 99.99 C ATOM 1024 O HIS C 37 0.543 -6.239 -6.762 1.00 99.99 O ATOM 1025 CB HIS C 37 -1.387 -5.554 -4.352 1.00 99.99 C ATOM 1026 CG HIS C 37 -1.799 -4.575 -5.421 1.00 99.99 C ATOM 1027 ND1 HIS C 37 -2.029 -3.252 -5.157 1.00 99.99 N ATOM 1028 CD2 HIS C 37 -2.064 -4.771 -6.735 1.00 99.99 C ATOM 1029 CE1 HIS C 37 -2.412 -2.662 -6.281 1.00 99.99 C ATOM 1030 NE2 HIS C 37 -2.441 -3.562 -7.254 1.00 99.99 N ATOM 0 H HIS C 37 -0.817 -7.462 -2.916 1.00 99.99 H new ATOM 0 HA HIS C 37 -1.495 -7.311 -5.607 1.00 99.99 H new ATOM 0 HB2 HIS C 37 -2.254 -5.786 -3.734 1.00 99.99 H new ATOM 0 HB3 HIS C 37 -0.652 -5.078 -3.703 1.00 99.99 H new ATOM 0 HD2 HIS C 37 -1.991 -5.705 -7.272 1.00 99.99 H new ATOM 0 HE1 HIS C 37 -2.660 -1.616 -6.387 1.00 99.99 H new ATOM 0 HE2 HIS C 37 -2.700 -3.384 -8.224 1.00 99.99 H new ATOM 1038 N LEU C 38 1.637 -6.748 -4.840 1.00 99.99 N ATOM 1039 CA LEU C 38 2.980 -6.516 -5.359 1.00 99.99 C ATOM 1040 C LEU C 38 3.346 -7.632 -6.327 1.00 99.99 C ATOM 1041 O LEU C 38 3.886 -7.353 -7.366 1.00 99.99 O ATOM 1042 CB LEU C 38 4.055 -6.524 -4.263 1.00 99.99 C ATOM 1043 CG LEU C 38 5.489 -6.305 -4.804 1.00 99.99 C ATOM 1044 CD1 LEU C 38 5.620 -4.965 -5.542 1.00 99.99 C ATOM 1045 CD2 LEU C 38 6.543 -6.412 -3.702 1.00 99.99 C ATOM 0 H LEU C 38 1.621 -7.050 -3.866 1.00 99.99 H new ATOM 0 HA LEU C 38 2.958 -5.535 -5.833 1.00 99.99 H new ATOM 0 HB2 LEU C 38 3.827 -5.745 -3.535 1.00 99.99 H new ATOM 0 HB3 LEU C 38 4.016 -7.476 -3.734 1.00 99.99 H new ATOM 0 HG LEU C 38 5.673 -7.107 -5.519 1.00 99.99 H new ATOM 0 HD11 LEU C 38 6.641 -4.849 -5.906 1.00 99.99 H new ATOM 0 HD12 LEU C 38 4.929 -4.945 -6.385 1.00 99.99 H new ATOM 0 HD13 LEU C 38 5.383 -4.149 -4.859 1.00 99.99 H new ATOM 0 HD21 LEU C 38 7.533 -6.251 -4.129 1.00 99.99 H new ATOM 0 HD22 LEU C 38 6.350 -5.658 -2.939 1.00 99.99 H new ATOM 0 HD23 LEU C 38 6.499 -7.403 -3.251 1.00 99.99 H new ATOM 1057 N ILE C 39 3.057 -8.805 -5.969 1.00 99.99 N ATOM 1058 CA ILE C 39 3.374 -9.973 -6.785 1.00 99.99 C ATOM 1059 C ILE C 39 2.597 -9.896 -8.090 1.00 99.99 C ATOM 1060 O ILE C 39 3.160 -10.159 -9.124 1.00 99.99 O ATOM 1061 CB ILE C 39 2.972 -11.296 -6.118 1.00 99.99 C ATOM 1062 CG1 ILE C 39 3.850 -11.542 -4.871 1.00 99.99 C ATOM 1063 CG2 ILE C 39 3.113 -12.462 -7.118 1.00 99.99 C ATOM 1064 CD1 ILE C 39 3.406 -12.748 -4.031 1.00 99.99 C ATOM 0 H ILE C 39 2.585 -9.026 -5.092 1.00 99.99 H new ATOM 0 HA ILE C 39 4.454 -9.961 -6.933 1.00 99.99 H new ATOM 0 HB ILE C 39 1.929 -11.236 -5.806 1.00 99.99 H new ATOM 0 HG12 ILE C 39 4.882 -11.692 -5.188 1.00 99.99 H new ATOM 0 HG13 ILE C 39 3.835 -10.650 -4.245 1.00 99.99 H new ATOM 0 HG21 ILE C 39 2.825 -13.394 -6.633 1.00 99.99 H new ATOM 0 HG22 ILE C 39 2.466 -12.285 -7.977 1.00 99.99 H new ATOM 0 HG23 ILE C 39 4.148 -12.532 -7.452 1.00 99.99 H new ATOM 0 HD11 ILE C 39 4.069 -12.858 -3.173 1.00 99.99 H new ATOM 0 HD12 ILE C 39 2.385 -12.593 -3.683 1.00 99.99 H new ATOM 0 HD13 ILE C 39 3.448 -13.651 -4.640 1.00 99.99 H new ATOM 1076 N LEU C 40 1.384 -9.566 -8.008 1.00 99.99 N ATOM 1077 CA LEU C 40 0.515 -9.478 -9.175 1.00 99.99 C ATOM 1078 C LEU C 40 1.048 -8.414 -10.123 1.00 99.99 C ATOM 1079 O LEU C 40 1.084 -8.647 -11.305 1.00 99.99 O ATOM 1080 CB LEU C 40 -0.920 -9.063 -8.824 1.00 99.99 C ATOM 1081 CG LEU C 40 -1.756 -10.125 -8.075 1.00 99.99 C ATOM 1082 CD1 LEU C 40 -3.124 -9.529 -7.690 1.00 99.99 C ATOM 1083 CD2 LEU C 40 -1.955 -11.402 -8.903 1.00 99.99 C ATOM 0 H LEU C 40 0.921 -9.337 -7.128 1.00 99.99 H new ATOM 0 HA LEU C 40 0.503 -10.473 -9.620 1.00 99.99 H new ATOM 0 HB2 LEU C 40 -0.880 -8.161 -8.213 1.00 99.99 H new ATOM 0 HB3 LEU C 40 -1.439 -8.801 -9.746 1.00 99.99 H new ATOM 0 HG LEU C 40 -1.204 -10.405 -7.178 1.00 99.99 H new ATOM 0 HD11 LEU C 40 -3.712 -10.279 -7.162 1.00 99.99 H new ATOM 0 HD12 LEU C 40 -2.975 -8.664 -7.044 1.00 99.99 H new ATOM 0 HD13 LEU C 40 -3.654 -9.221 -8.592 1.00 99.99 H new ATOM 0 HD21 LEU C 40 -2.548 -12.117 -8.333 1.00 99.99 H new ATOM 0 HD22 LEU C 40 -2.474 -11.157 -9.830 1.00 99.99 H new ATOM 0 HD23 LEU C 40 -0.984 -11.840 -9.135 1.00 99.99 H new ATOM 1095 N TRP C 41 1.425 -7.329 -9.599 1.00 99.99 N ATOM 1096 CA TRP C 41 1.932 -6.215 -10.390 1.00 99.99 C ATOM 1097 C TRP C 41 3.260 -6.610 -11.018 1.00 99.99 C ATOM 1098 O TRP C 41 3.478 -6.311 -12.166 1.00 99.99 O ATOM 1099 CB TRP C 41 2.204 -4.960 -9.549 1.00 99.99 C ATOM 1100 CG TRP C 41 2.632 -3.752 -10.362 1.00 99.99 C ATOM 1101 CD1 TRP C 41 1.833 -2.934 -11.100 1.00 99.99 C ATOM 1102 CD2 TRP C 41 3.985 -3.320 -10.589 1.00 99.99 C ATOM 1103 NE1 TRP C 41 2.580 -1.965 -11.708 1.00 99.99 N ATOM 1104 CE2 TRP C 41 3.907 -2.205 -11.444 1.00 99.99 C ATOM 1105 CE3 TRP C 41 5.211 -3.798 -10.116 1.00 99.99 C ATOM 1106 CZ2 TRP C 41 5.054 -1.530 -11.835 1.00 99.99 C ATOM 1107 CZ3 TRP C 41 6.363 -3.122 -10.524 1.00 99.99 C ATOM 1108 CH2 TRP C 41 6.294 -2.002 -11.371 1.00 99.99 C ATOM 0 H TRP C 41 1.404 -7.150 -8.595 1.00 99.99 H new ATOM 0 HA TRP C 41 1.165 -5.989 -11.131 1.00 99.99 H new ATOM 0 HB2 TRP C 41 1.303 -4.708 -8.990 1.00 99.99 H new ATOM 0 HB3 TRP C 41 2.980 -5.186 -8.818 1.00 99.99 H new ATOM 0 HD1 TRP C 41 0.762 -3.036 -11.192 1.00 99.99 H new ATOM 0 HE1 TRP C 41 2.214 -1.193 -12.265 1.00 99.99 H new ATOM 0 HE3 TRP C 41 5.265 -4.655 -9.462 1.00 99.99 H new ATOM 0 HZ2 TRP C 41 4.996 -0.665 -12.479 1.00 99.99 H new ATOM 0 HZ3 TRP C 41 7.327 -3.467 -10.182 1.00 99.99 H new ATOM 0 HH2 TRP C 41 7.203 -1.499 -11.668 1.00 99.99 H new ATOM 1119 N ILE C 42 4.072 -7.229 -10.276 1.00 99.99 N ATOM 1120 CA ILE C 42 5.393 -7.644 -10.739 1.00 99.99 C ATOM 1121 C ILE C 42 5.236 -8.719 -11.805 1.00 99.99 C ATOM 1122 O ILE C 42 5.922 -8.666 -12.795 1.00 99.99 O ATOM 1123 CB ILE C 42 6.249 -8.260 -9.627 1.00 99.99 C ATOM 1124 CG1 ILE C 42 6.693 -7.165 -8.629 1.00 99.99 C ATOM 1125 CG2 ILE C 42 7.483 -8.978 -10.216 1.00 99.99 C ATOM 1126 CD1 ILE C 42 7.477 -7.710 -7.425 1.00 99.99 C ATOM 0 H ILE C 42 3.871 -7.484 -9.309 1.00 99.99 H new ATOM 0 HA ILE C 42 5.883 -6.745 -11.112 1.00 99.99 H new ATOM 0 HB ILE C 42 5.645 -8.998 -9.099 1.00 99.99 H new ATOM 0 HG12 ILE C 42 7.310 -6.436 -9.154 1.00 99.99 H new ATOM 0 HG13 ILE C 42 5.811 -6.635 -8.268 1.00 99.99 H new ATOM 0 HG21 ILE C 42 8.075 -9.407 -9.407 1.00 99.99 H new ATOM 0 HG22 ILE C 42 7.156 -9.772 -10.887 1.00 99.99 H new ATOM 0 HG23 ILE C 42 8.090 -8.262 -10.770 1.00 99.99 H new ATOM 0 HD11 ILE C 42 7.755 -6.885 -6.769 1.00 99.99 H new ATOM 0 HD12 ILE C 42 6.855 -8.417 -6.876 1.00 99.99 H new ATOM 0 HD13 ILE C 42 8.377 -8.215 -7.775 1.00 99.99 H new ATOM 1138 N LEU C 43 4.386 -9.622 -11.576 1.00 99.99 N ATOM 1139 CA LEU C 43 4.153 -10.726 -12.499 1.00 99.99 C ATOM 1140 C LEU C 43 3.603 -10.180 -13.809 1.00 99.99 C ATOM 1141 O LEU C 43 3.938 -10.696 -14.845 1.00 99.99 O ATOM 1142 CB LEU C 43 3.116 -11.730 -11.979 1.00 99.99 C ATOM 1143 CG LEU C 43 3.589 -12.567 -10.767 1.00 99.99 C ATOM 1144 CD1 LEU C 43 2.404 -13.338 -10.157 1.00 99.99 C ATOM 1145 CD2 LEU C 43 4.713 -13.544 -11.146 1.00 99.99 C ATOM 0 H LEU C 43 3.804 -9.650 -10.739 1.00 99.99 H new ATOM 0 HA LEU C 43 5.112 -11.230 -12.621 1.00 99.99 H new ATOM 0 HB2 LEU C 43 2.212 -11.189 -11.701 1.00 99.99 H new ATOM 0 HB3 LEU C 43 2.845 -12.407 -12.789 1.00 99.99 H new ATOM 0 HG LEU C 43 3.990 -11.873 -10.028 1.00 99.99 H new ATOM 0 HD11 LEU C 43 2.750 -13.923 -9.305 1.00 99.99 H new ATOM 0 HD12 LEU C 43 1.642 -12.632 -9.827 1.00 99.99 H new ATOM 0 HD13 LEU C 43 1.980 -14.006 -10.907 1.00 99.99 H new ATOM 0 HD21 LEU C 43 5.015 -14.111 -10.265 1.00 99.99 H new ATOM 0 HD22 LEU C 43 4.355 -14.230 -11.914 1.00 99.99 H new ATOM 0 HD23 LEU C 43 5.567 -12.985 -11.528 1.00 99.99 H new ATOM 1157 N ASP C 44 2.804 -9.208 -13.724 1.00 99.99 N ATOM 1158 CA ASP C 44 2.182 -8.604 -14.894 1.00 99.99 C ATOM 1159 C ASP C 44 3.252 -7.931 -15.743 1.00 99.99 C ATOM 1160 O ASP C 44 3.191 -8.023 -16.944 1.00 99.99 O ATOM 1161 CB ASP C 44 1.164 -7.512 -14.536 1.00 99.99 C ATOM 1162 CG ASP C 44 0.448 -6.944 -15.777 1.00 99.99 C ATOM 1163 OD1 ASP C 44 -0.321 -7.699 -16.418 1.00 99.99 O ATOM 1164 OD2 ASP C 44 0.616 -5.726 -16.084 1.00 99.99 O ATOM 0 H ASP C 44 2.535 -8.775 -12.840 1.00 99.99 H new ATOM 0 HA ASP C 44 1.671 -9.412 -15.418 1.00 99.99 H new ATOM 0 HB2 ASP C 44 0.424 -7.921 -13.849 1.00 99.99 H new ATOM 0 HB3 ASP C 44 1.673 -6.703 -14.012 1.00 99.99 H new ATOM 1169 N ARG C 45 4.151 -7.301 -15.123 1.00 99.99 N ATOM 1170 CA ARG C 45 5.223 -6.590 -15.810 1.00 99.99 C ATOM 1171 C ARG C 45 6.088 -7.588 -16.566 1.00 99.99 C ATOM 1172 O ARG C 45 6.459 -7.315 -17.679 1.00 99.99 O ATOM 1173 CB ARG C 45 6.161 -5.850 -14.847 1.00 99.99 C ATOM 1174 CG ARG C 45 5.478 -4.702 -14.075 1.00 99.99 C ATOM 1175 CD ARG C 45 5.242 -3.453 -14.936 1.00 99.99 C ATOM 1176 NE ARG C 45 3.855 -3.528 -15.520 1.00 99.99 N ATOM 1177 CZ ARG C 45 3.525 -2.834 -16.626 1.00 99.99 C ATOM 1178 NH1 ARG C 45 4.407 -2.027 -17.241 1.00 99.99 N ATOM 1179 NH2 ARG C 45 2.269 -2.938 -17.092 1.00 99.99 N ATOM 0 H ARG C 45 4.198 -7.241 -14.106 1.00 99.99 H new ATOM 0 HA ARG C 45 4.738 -5.868 -16.467 1.00 99.99 H new ATOM 0 HB2 ARG C 45 6.570 -6.564 -14.132 1.00 99.99 H new ATOM 0 HB3 ARG C 45 7.002 -5.447 -15.411 1.00 99.99 H new ATOM 0 HG2 ARG C 45 4.523 -5.053 -13.685 1.00 99.99 H new ATOM 0 HG3 ARG C 45 6.093 -4.433 -13.217 1.00 99.99 H new ATOM 0 HD2 ARG C 45 5.350 -2.552 -14.333 1.00 99.99 H new ATOM 0 HD3 ARG C 45 5.985 -3.396 -15.731 1.00 99.99 H new ATOM 0 HE ARG C 45 3.153 -4.115 -15.069 1.00 99.99 H new ATOM 0 HH11 ARG C 45 5.353 -1.929 -16.871 1.00 99.99 H new ATOM 0 HH12 ARG C 45 4.131 -1.513 -18.077 1.00 99.99 H new ATOM 0 HH21 ARG C 45 1.594 -3.531 -16.610 1.00 99.99 H new ATOM 0 HH22 ARG C 45 1.991 -2.424 -17.928 1.00 99.99 H new ATOM 1193 N LEU C 46 6.370 -8.660 -15.963 1.00 99.99 N ATOM 1194 CA LEU C 46 7.209 -9.693 -16.559 1.00 99.99 C ATOM 1195 C LEU C 46 6.482 -10.312 -17.743 1.00 99.99 C ATOM 1196 O LEU C 46 5.463 -10.981 -17.581 1.00 99.99 O ATOM 1197 CB LEU C 46 7.519 -10.843 -15.592 1.00 99.99 C ATOM 1198 CG LEU C 46 8.257 -10.489 -14.278 1.00 99.99 C ATOM 1199 CD1 LEU C 46 8.245 -11.729 -13.364 1.00 99.99 C ATOM 1200 CD2 LEU C 46 9.695 -10.008 -14.499 1.00 99.99 C ATOM 0 H LEU C 46 6.038 -8.884 -15.025 1.00 99.99 H new ATOM 0 HA LEU C 46 8.140 -9.203 -16.844 1.00 99.99 H new ATOM 0 HB2 LEU C 46 6.578 -11.326 -15.330 1.00 99.99 H new ATOM 0 HB3 LEU C 46 8.118 -11.581 -16.127 1.00 99.99 H new ATOM 0 HG LEU C 46 7.731 -9.655 -13.815 1.00 99.99 H new ATOM 0 HD11 LEU C 46 8.761 -11.499 -12.432 1.00 99.99 H new ATOM 0 HD12 LEU C 46 7.215 -12.012 -13.148 1.00 99.99 H new ATOM 0 HD13 LEU C 46 8.751 -12.555 -13.864 1.00 99.99 H new ATOM 0 HD21 LEU C 46 10.153 -9.777 -13.537 1.00 99.99 H new ATOM 0 HD22 LEU C 46 10.268 -10.791 -14.996 1.00 99.99 H new ATOM 0 HD23 LEU C 46 9.688 -9.113 -15.121 1.00 99.99 H new ATOM 1213 N SER D 22 10.412 -0.606 18.987 1.00 99.99 N ATOM 1214 CA SER D 22 10.116 -1.253 17.676 1.00 99.99 C ATOM 1215 C SER D 22 8.656 -1.594 17.532 1.00 99.99 C ATOM 1216 O SER D 22 7.871 -1.457 18.471 1.00 99.99 O ATOM 1217 CB SER D 22 11.011 -2.513 17.450 1.00 99.99 C ATOM 1218 OG SER D 22 10.783 -3.544 18.408 1.00 99.99 O ATOM 0 HA SER D 22 10.356 -0.525 16.901 1.00 99.99 H new ATOM 0 HB2 SER D 22 10.826 -2.907 16.451 1.00 99.99 H new ATOM 0 HB3 SER D 22 12.059 -2.217 17.487 1.00 99.99 H new ATOM 0 HG SER D 22 11.369 -4.305 18.215 1.00 99.99 H new ATOM 1223 N SER D 23 8.271 -2.058 16.319 1.00 99.99 N ATOM 1224 CA SER D 23 6.940 -2.534 16.024 1.00 99.99 C ATOM 1225 C SER D 23 7.110 -3.961 15.569 1.00 99.99 C ATOM 1226 O SER D 23 8.169 -4.557 15.765 1.00 99.99 O ATOM 1227 CB SER D 23 6.227 -1.685 14.944 1.00 99.99 C ATOM 1228 OG SER D 23 6.050 -0.352 15.404 1.00 99.99 O ATOM 0 H SER D 23 8.903 -2.104 15.520 1.00 99.99 H new ATOM 0 HA SER D 23 6.304 -2.458 16.906 1.00 99.99 H new ATOM 0 HB2 SER D 23 6.814 -1.685 14.025 1.00 99.99 H new ATOM 0 HB3 SER D 23 5.259 -2.126 14.705 1.00 99.99 H new ATOM 0 HG SER D 23 5.600 0.176 14.712 1.00 99.99 H new ATOM 1234 N ASP D 24 6.047 -4.560 14.971 1.00 99.99 N ATOM 1235 CA ASP D 24 6.007 -5.966 14.611 1.00 99.99 C ATOM 1236 C ASP D 24 6.563 -6.121 13.212 1.00 99.99 C ATOM 1237 O ASP D 24 6.427 -5.187 12.429 1.00 99.99 O ATOM 1238 CB ASP D 24 4.560 -6.533 14.628 1.00 99.99 C ATOM 1239 CG ASP D 24 3.944 -6.462 16.029 1.00 99.99 C ATOM 1240 OD1 ASP D 24 4.705 -6.373 17.031 1.00 99.99 O ATOM 1241 OD2 ASP D 24 2.687 -6.509 16.112 1.00 99.99 O ATOM 0 H ASP D 24 5.193 -4.057 14.731 1.00 99.99 H new ATOM 0 HA ASP D 24 6.597 -6.517 15.343 1.00 99.99 H new ATOM 0 HB2 ASP D 24 3.940 -5.972 13.928 1.00 99.99 H new ATOM 0 HB3 ASP D 24 4.570 -7.568 14.286 1.00 99.99 H new ATOM 1246 N PRO D 25 7.208 -7.225 12.828 1.00 99.99 N ATOM 1247 CA PRO D 25 8.048 -7.272 11.641 1.00 99.99 C ATOM 1248 C PRO D 25 7.252 -7.309 10.356 1.00 99.99 C ATOM 1249 O PRO D 25 7.813 -6.927 9.341 1.00 99.99 O ATOM 1250 CB PRO D 25 8.883 -8.553 11.804 1.00 99.99 C ATOM 1251 CG PRO D 25 8.053 -9.429 12.745 1.00 99.99 C ATOM 1252 CD PRO D 25 7.409 -8.401 13.672 1.00 99.99 C ATOM 0 HA PRO D 25 8.659 -6.373 11.563 1.00 99.99 H new ATOM 0 HB2 PRO D 25 9.048 -9.045 10.845 1.00 99.99 H new ATOM 0 HB3 PRO D 25 9.865 -8.337 12.225 1.00 99.99 H new ATOM 0 HG2 PRO D 25 7.307 -10.011 12.204 1.00 99.99 H new ATOM 0 HG3 PRO D 25 8.674 -10.137 13.294 1.00 99.99 H new ATOM 0 HD2 PRO D 25 6.465 -8.766 14.075 1.00 99.99 H new ATOM 0 HD3 PRO D 25 8.052 -8.175 14.522 1.00 99.99 H new ATOM 1260 N LEU D 26 5.980 -7.768 10.380 1.00 99.99 N ATOM 1261 CA LEU D 26 5.015 -7.772 9.288 1.00 99.99 C ATOM 1262 C LEU D 26 4.571 -6.346 9.001 1.00 99.99 C ATOM 1263 O LEU D 26 4.479 -5.981 7.856 1.00 99.99 O ATOM 1264 CB LEU D 26 3.741 -8.563 9.617 1.00 99.99 C ATOM 1265 CG LEU D 26 2.577 -8.438 8.608 1.00 99.99 C ATOM 1266 CD1 LEU D 26 2.924 -9.009 7.231 1.00 99.99 C ATOM 1267 CD2 LEU D 26 1.314 -9.108 9.169 1.00 99.99 C ATOM 0 H LEU D 26 5.586 -8.171 11.230 1.00 99.99 H new ATOM 0 HA LEU D 26 5.518 -8.237 8.440 1.00 99.99 H new ATOM 0 HB2 LEU D 26 4.006 -9.617 9.705 1.00 99.99 H new ATOM 0 HB3 LEU D 26 3.382 -8.242 10.595 1.00 99.99 H new ATOM 0 HG LEU D 26 2.389 -7.374 8.466 1.00 99.99 H new ATOM 0 HD11 LEU D 26 2.070 -8.894 6.564 1.00 99.99 H new ATOM 0 HD12 LEU D 26 3.780 -8.474 6.820 1.00 99.99 H new ATOM 0 HD13 LEU D 26 3.170 -10.067 7.327 1.00 99.99 H new ATOM 0 HD21 LEU D 26 0.501 -9.013 8.449 1.00 99.99 H new ATOM 0 HD22 LEU D 26 1.514 -10.164 9.354 1.00 99.99 H new ATOM 0 HD23 LEU D 26 1.029 -8.624 10.103 1.00 99.99 H new ATOM 1279 N VAL D 27 4.316 -5.623 10.004 1.00 99.99 N ATOM 1280 CA VAL D 27 3.857 -4.244 9.876 1.00 99.99 C ATOM 1281 C VAL D 27 4.997 -3.381 9.357 1.00 99.99 C ATOM 1282 O VAL D 27 4.779 -2.598 8.466 1.00 99.99 O ATOM 1283 CB VAL D 27 3.425 -3.632 11.215 1.00 99.99 C ATOM 1284 CG1 VAL D 27 3.067 -2.143 11.044 1.00 99.99 C ATOM 1285 CG2 VAL D 27 2.198 -4.396 11.760 1.00 99.99 C ATOM 0 H VAL D 27 4.410 -5.942 10.968 1.00 99.99 H new ATOM 0 HA VAL D 27 3.002 -4.267 9.200 1.00 99.99 H new ATOM 0 HB VAL D 27 4.255 -3.713 11.917 1.00 99.99 H new ATOM 0 HG11 VAL D 27 2.763 -1.729 12.006 1.00 99.99 H new ATOM 0 HG12 VAL D 27 3.936 -1.600 10.673 1.00 99.99 H new ATOM 0 HG13 VAL D 27 2.248 -2.045 10.332 1.00 99.99 H new ATOM 0 HG21 VAL D 27 1.892 -3.961 12.711 1.00 99.99 H new ATOM 0 HG22 VAL D 27 1.377 -4.323 11.046 1.00 99.99 H new ATOM 0 HG23 VAL D 27 2.458 -5.444 11.908 1.00 99.99 H new ATOM 1295 N VAL D 28 6.121 -3.537 9.908 1.00 99.99 N ATOM 1296 CA VAL D 28 7.294 -2.758 9.528 1.00 99.99 C ATOM 1297 C VAL D 28 7.746 -3.176 8.137 1.00 99.99 C ATOM 1298 O VAL D 28 8.045 -2.325 7.338 1.00 99.99 O ATOM 1299 CB VAL D 28 8.490 -2.986 10.461 1.00 99.99 C ATOM 1300 CG1 VAL D 28 9.757 -2.287 9.928 1.00 99.99 C ATOM 1301 CG2 VAL D 28 8.154 -2.470 11.874 1.00 99.99 C ATOM 0 H VAL D 28 6.294 -4.212 10.653 1.00 99.99 H new ATOM 0 HA VAL D 28 6.996 -1.711 9.578 1.00 99.99 H new ATOM 0 HB VAL D 28 8.691 -4.056 10.503 1.00 99.99 H new ATOM 0 HG11 VAL D 28 10.587 -2.467 10.611 1.00 99.99 H new ATOM 0 HG12 VAL D 28 10.005 -2.684 8.944 1.00 99.99 H new ATOM 0 HG13 VAL D 28 9.576 -1.215 9.852 1.00 99.99 H new ATOM 0 HG21 VAL D 28 9.006 -2.634 12.533 1.00 99.99 H new ATOM 0 HG22 VAL D 28 7.930 -1.404 11.828 1.00 99.99 H new ATOM 0 HG23 VAL D 28 7.288 -3.006 12.261 1.00 99.99 H new ATOM 1311 N ALA D 29 7.788 -4.415 7.906 1.00 99.99 N ATOM 1312 CA ALA D 29 8.229 -4.957 6.625 1.00 99.99 C ATOM 1313 C ALA D 29 7.300 -4.465 5.525 1.00 99.99 C ATOM 1314 O ALA D 29 7.774 -4.129 4.468 1.00 99.99 O ATOM 1315 CB ALA D 29 8.181 -6.489 6.576 1.00 99.99 C ATOM 0 H ALA D 29 7.520 -5.125 8.588 1.00 99.99 H new ATOM 0 HA ALA D 29 9.259 -4.625 6.491 1.00 99.99 H new ATOM 0 HB1 ALA D 29 8.520 -6.833 5.599 1.00 99.99 H new ATOM 0 HB2 ALA D 29 8.830 -6.898 7.350 1.00 99.99 H new ATOM 0 HB3 ALA D 29 7.158 -6.827 6.744 1.00 99.99 H new ATOM 1321 N ALA D 30 6.067 -4.445 5.792 1.00 99.99 N ATOM 1322 CA ALA D 30 5.065 -4.020 4.823 1.00 99.99 C ATOM 1323 C ALA D 30 5.275 -2.551 4.490 1.00 99.99 C ATOM 1324 O ALA D 30 5.079 -2.173 3.361 1.00 99.99 O ATOM 1325 CB ALA D 30 3.631 -4.140 5.356 1.00 99.99 C ATOM 0 H ALA D 30 5.681 -4.721 6.695 1.00 99.99 H new ATOM 0 HA ALA D 30 5.184 -4.671 3.957 1.00 99.99 H new ATOM 0 HB1 ALA D 30 2.929 -3.809 4.590 1.00 99.99 H new ATOM 0 HB2 ALA D 30 3.424 -5.179 5.613 1.00 99.99 H new ATOM 0 HB3 ALA D 30 3.519 -3.517 6.244 1.00 99.99 H new ATOM 1331 N SER D 31 5.648 -1.806 5.436 1.00 99.99 N ATOM 1332 CA SER D 31 5.863 -0.374 5.265 1.00 99.99 C ATOM 1333 C SER D 31 6.960 -0.150 4.234 1.00 99.99 C ATOM 1334 O SER D 31 6.789 0.666 3.364 1.00 99.99 O ATOM 1335 CB SER D 31 6.329 0.319 6.551 1.00 99.99 C ATOM 1336 OG SER D 31 5.307 0.281 7.546 1.00 99.99 O ATOM 0 H SER D 31 5.826 -2.143 6.382 1.00 99.99 H new ATOM 0 HA SER D 31 4.904 0.045 4.960 1.00 99.99 H new ATOM 0 HB2 SER D 31 7.228 -0.170 6.928 1.00 99.99 H new ATOM 0 HB3 SER D 31 6.595 1.354 6.336 1.00 99.99 H new ATOM 0 HG SER D 31 5.166 -0.645 7.835 1.00 99.99 H new ATOM 1342 N ILE D 32 8.007 -0.844 4.365 1.00 99.99 N ATOM 1343 CA ILE D 32 9.146 -0.714 3.465 1.00 99.99 C ATOM 1344 C ILE D 32 8.735 -1.139 2.063 1.00 99.99 C ATOM 1345 O ILE D 32 9.169 -0.536 1.117 1.00 99.99 O ATOM 1346 CB ILE D 32 10.325 -1.612 3.862 1.00 99.99 C ATOM 1347 CG1 ILE D 32 10.907 -1.160 5.220 1.00 99.99 C ATOM 1348 CG2 ILE D 32 11.426 -1.586 2.781 1.00 99.99 C ATOM 1349 CD1 ILE D 32 11.838 -2.203 5.851 1.00 99.99 C ATOM 0 H ILE D 32 8.135 -1.539 5.100 1.00 99.99 H new ATOM 0 HA ILE D 32 9.456 0.330 3.514 1.00 99.99 H new ATOM 0 HB ILE D 32 9.957 -2.634 3.954 1.00 99.99 H new ATOM 0 HG12 ILE D 32 11.455 -0.228 5.082 1.00 99.99 H new ATOM 0 HG13 ILE D 32 10.088 -0.949 5.908 1.00 99.99 H new ATOM 0 HG21 ILE D 32 12.251 -2.230 3.086 1.00 99.99 H new ATOM 0 HG22 ILE D 32 11.017 -1.943 1.836 1.00 99.99 H new ATOM 0 HG23 ILE D 32 11.790 -0.566 2.656 1.00 99.99 H new ATOM 0 HD11 ILE D 32 12.214 -1.827 6.802 1.00 99.99 H new ATOM 0 HD12 ILE D 32 11.287 -3.128 6.019 1.00 99.99 H new ATOM 0 HD13 ILE D 32 12.675 -2.396 5.181 1.00 99.99 H new ATOM 1361 N ILE D 33 7.950 -2.123 1.982 1.00 99.99 N ATOM 1362 CA ILE D 33 7.495 -2.656 0.703 1.00 99.99 C ATOM 1363 C ILE D 33 6.721 -1.579 -0.045 1.00 99.99 C ATOM 1364 O ILE D 33 6.953 -1.395 -1.212 1.00 99.99 O ATOM 1365 CB ILE D 33 6.537 -3.846 0.856 1.00 99.99 C ATOM 1366 CG1 ILE D 33 7.377 -5.129 1.074 1.00 99.99 C ATOM 1367 CG2 ILE D 33 5.602 -4.000 -0.357 1.00 99.99 C ATOM 1368 CD1 ILE D 33 6.588 -6.328 1.613 1.00 99.99 C ATOM 0 H ILE D 33 7.578 -2.616 2.794 1.00 99.99 H new ATOM 0 HA ILE D 33 8.390 -2.981 0.173 1.00 99.99 H new ATOM 0 HB ILE D 33 5.893 -3.669 1.717 1.00 99.99 H new ATOM 0 HG12 ILE D 33 7.837 -5.411 0.127 1.00 99.99 H new ATOM 0 HG13 ILE D 33 8.187 -4.903 1.768 1.00 99.99 H new ATOM 0 HG21 ILE D 33 4.943 -4.855 -0.203 1.00 99.99 H new ATOM 0 HG22 ILE D 33 5.003 -3.096 -0.472 1.00 99.99 H new ATOM 0 HG23 ILE D 33 6.196 -4.158 -1.257 1.00 99.99 H new ATOM 0 HD11 ILE D 33 7.258 -7.180 1.734 1.00 99.99 H new ATOM 0 HD12 ILE D 33 6.150 -6.071 2.577 1.00 99.99 H new ATOM 0 HD13 ILE D 33 5.795 -6.587 0.911 1.00 99.99 H new ATOM 1380 N GLY D 34 5.866 -0.934 0.623 1.00 99.99 N ATOM 1381 CA GLY D 34 5.038 0.110 0.027 1.00 99.99 C ATOM 1382 C GLY D 34 5.921 1.268 -0.407 1.00 99.99 C ATOM 1383 O GLY D 34 5.657 1.855 -1.426 1.00 99.99 O ATOM 0 H GLY D 34 5.690 -1.090 1.616 1.00 99.99 H new ATOM 0 HA2 GLY D 34 4.493 -0.287 -0.829 1.00 99.99 H new ATOM 0 HA3 GLY D 34 4.295 0.455 0.746 1.00 99.99 H new ATOM 1387 N ILE D 35 7.188 1.233 -0.027 1.00 99.99 N ATOM 1388 CA ILE D 35 8.067 2.268 -0.562 1.00 99.99 C ATOM 1389 C ILE D 35 8.785 1.735 -1.792 1.00 99.99 C ATOM 1390 O ILE D 35 8.859 2.430 -2.772 1.00 99.99 O ATOM 1391 CB ILE D 35 9.160 2.693 0.427 1.00 99.99 C ATOM 1392 CG1 ILE D 35 8.524 3.244 1.728 1.00 99.99 C ATOM 1393 CG2 ILE D 35 10.068 3.759 -0.222 1.00 99.99 C ATOM 1394 CD1 ILE D 35 9.496 3.406 2.901 1.00 99.99 C ATOM 0 H ILE D 35 7.612 0.553 0.604 1.00 99.99 H new ATOM 0 HA ILE D 35 7.430 3.124 -0.783 1.00 99.99 H new ATOM 0 HB ILE D 35 9.765 1.823 0.682 1.00 99.99 H new ATOM 0 HG12 ILE D 35 8.072 4.212 1.513 1.00 99.99 H new ATOM 0 HG13 ILE D 35 7.718 2.577 2.032 1.00 99.99 H new ATOM 0 HG21 ILE D 35 10.842 4.057 0.485 1.00 99.99 H new ATOM 0 HG22 ILE D 35 10.533 3.345 -1.116 1.00 99.99 H new ATOM 0 HG23 ILE D 35 9.471 4.629 -0.494 1.00 99.99 H new ATOM 0 HD11 ILE D 35 8.960 3.797 3.766 1.00 99.99 H new ATOM 0 HD12 ILE D 35 9.930 2.438 3.150 1.00 99.99 H new ATOM 0 HD13 ILE D 35 10.290 4.099 2.623 1.00 99.99 H new ATOM 1406 N LEU D 36 9.269 0.573 -1.703 1.00 99.99 N ATOM 1407 CA LEU D 36 10.007 -0.051 -2.795 1.00 99.99 C ATOM 1408 C LEU D 36 9.104 -0.155 -4.015 1.00 99.99 C ATOM 1409 O LEU D 36 9.546 0.135 -5.097 1.00 99.99 O ATOM 1410 CB LEU D 36 10.461 -1.480 -2.469 1.00 99.99 C ATOM 1411 CG LEU D 36 11.131 -2.244 -3.631 1.00 99.99 C ATOM 1412 CD1 LEU D 36 12.434 -1.559 -4.067 1.00 99.99 C ATOM 1413 CD2 LEU D 36 11.385 -3.709 -3.252 1.00 99.99 C ATOM 0 H LEU D 36 9.183 -0.012 -0.872 1.00 99.99 H new ATOM 0 HA LEU D 36 10.884 0.573 -2.969 1.00 99.99 H new ATOM 0 HB2 LEU D 36 11.159 -1.439 -1.633 1.00 99.99 H new ATOM 0 HB3 LEU D 36 9.595 -2.050 -2.133 1.00 99.99 H new ATOM 0 HG LEU D 36 10.445 -2.228 -4.478 1.00 99.99 H new ATOM 0 HD11 LEU D 36 12.883 -2.120 -4.887 1.00 99.99 H new ATOM 0 HD12 LEU D 36 12.218 -0.543 -4.398 1.00 99.99 H new ATOM 0 HD13 LEU D 36 13.127 -1.527 -3.226 1.00 99.99 H new ATOM 0 HD21 LEU D 36 11.858 -4.224 -4.088 1.00 99.99 H new ATOM 0 HD22 LEU D 36 12.041 -3.751 -2.382 1.00 99.99 H new ATOM 0 HD23 LEU D 36 10.437 -4.193 -3.016 1.00 99.99 H new ATOM 1425 N HIS D 37 7.836 -0.592 -3.838 1.00 99.99 N ATOM 1426 CA HIS D 37 6.876 -0.792 -4.896 1.00 99.99 C ATOM 1427 C HIS D 37 6.579 0.515 -5.581 1.00 99.99 C ATOM 1428 O HIS D 37 6.239 0.543 -6.762 1.00 99.99 O ATOM 1429 CB HIS D 37 5.554 -1.387 -4.352 1.00 99.99 C ATOM 1430 CG HIS D 37 4.575 -1.799 -5.421 1.00 99.99 C ATOM 1431 ND1 HIS D 37 3.252 -2.029 -5.157 1.00 99.99 N ATOM 1432 CD2 HIS D 37 4.771 -2.064 -6.735 1.00 99.99 C ATOM 1433 CE1 HIS D 37 2.662 -2.412 -6.281 1.00 99.99 C ATOM 1434 NE2 HIS D 37 3.562 -2.441 -7.254 1.00 99.99 N ATOM 0 H HIS D 37 7.462 -0.817 -2.916 1.00 99.99 H new ATOM 0 HA HIS D 37 7.311 -1.495 -5.607 1.00 99.99 H new ATOM 0 HB2 HIS D 37 5.786 -2.254 -3.734 1.00 99.99 H new ATOM 0 HB3 HIS D 37 5.078 -0.652 -3.703 1.00 99.99 H new ATOM 0 HD2 HIS D 37 5.705 -1.991 -7.272 1.00 99.99 H new ATOM 0 HE1 HIS D 37 1.616 -2.660 -6.387 1.00 99.99 H new ATOM 0 HE2 HIS D 37 3.384 -2.700 -8.224 1.00 99.99 H new ATOM 1442 N LEU D 38 6.748 1.637 -4.840 1.00 99.99 N ATOM 1443 CA LEU D 38 6.516 2.980 -5.359 1.00 99.99 C ATOM 1444 C LEU D 38 7.632 3.346 -6.327 1.00 99.99 C ATOM 1445 O LEU D 38 7.353 3.886 -7.366 1.00 99.99 O ATOM 1446 CB LEU D 38 6.524 4.055 -4.263 1.00 99.99 C ATOM 1447 CG LEU D 38 6.305 5.489 -4.804 1.00 99.99 C ATOM 1448 CD1 LEU D 38 4.965 5.620 -5.542 1.00 99.99 C ATOM 1449 CD2 LEU D 38 6.412 6.543 -3.702 1.00 99.99 C ATOM 0 H LEU D 38 7.050 1.621 -3.866 1.00 99.99 H new ATOM 0 HA LEU D 38 5.535 2.958 -5.833 1.00 99.99 H new ATOM 0 HB2 LEU D 38 5.745 3.827 -3.535 1.00 99.99 H new ATOM 0 HB3 LEU D 38 7.476 4.016 -3.734 1.00 99.99 H new ATOM 0 HG LEU D 38 7.107 5.673 -5.519 1.00 99.99 H new ATOM 0 HD11 LEU D 38 4.849 6.641 -5.906 1.00 99.99 H new ATOM 0 HD12 LEU D 38 4.945 4.929 -6.385 1.00 99.99 H new ATOM 0 HD13 LEU D 38 4.149 5.383 -4.859 1.00 99.99 H new ATOM 0 HD21 LEU D 38 6.251 7.533 -4.129 1.00 99.99 H new ATOM 0 HD22 LEU D 38 5.658 6.350 -2.939 1.00 99.99 H new ATOM 0 HD23 LEU D 38 7.403 6.499 -3.251 1.00 99.99 H new ATOM 1461 N ILE D 39 8.805 3.057 -5.969 1.00 99.99 N ATOM 1462 CA ILE D 39 9.973 3.374 -6.785 1.00 99.99 C ATOM 1463 C ILE D 39 9.896 2.597 -8.090 1.00 99.99 C ATOM 1464 O ILE D 39 10.159 3.160 -9.124 1.00 99.99 O ATOM 1465 CB ILE D 39 11.296 2.972 -6.118 1.00 99.99 C ATOM 1466 CG1 ILE D 39 11.542 3.850 -4.871 1.00 99.99 C ATOM 1467 CG2 ILE D 39 12.462 3.113 -7.118 1.00 99.99 C ATOM 1468 CD1 ILE D 39 12.748 3.406 -4.031 1.00 99.99 C ATOM 0 H ILE D 39 9.026 2.585 -5.092 1.00 99.99 H new ATOM 0 HA ILE D 39 9.961 4.454 -6.933 1.00 99.99 H new ATOM 0 HB ILE D 39 11.236 1.929 -5.806 1.00 99.99 H new ATOM 0 HG12 ILE D 39 11.692 4.882 -5.188 1.00 99.99 H new ATOM 0 HG13 ILE D 39 10.650 3.835 -4.245 1.00 99.99 H new ATOM 0 HG21 ILE D 39 13.394 2.825 -6.633 1.00 99.99 H new ATOM 0 HG22 ILE D 39 12.285 2.466 -7.977 1.00 99.99 H new ATOM 0 HG23 ILE D 39 12.532 4.148 -7.452 1.00 99.99 H new ATOM 0 HD11 ILE D 39 12.858 4.069 -3.173 1.00 99.99 H new ATOM 0 HD12 ILE D 39 12.593 2.385 -3.683 1.00 99.99 H new ATOM 0 HD13 ILE D 39 13.651 3.448 -4.640 1.00 99.99 H new ATOM 1480 N LEU D 40 9.566 1.384 -8.008 1.00 99.99 N ATOM 1481 CA LEU D 40 9.478 0.515 -9.175 1.00 99.99 C ATOM 1482 C LEU D 40 8.414 1.048 -10.123 1.00 99.99 C ATOM 1483 O LEU D 40 8.647 1.084 -11.305 1.00 99.99 O ATOM 1484 CB LEU D 40 9.063 -0.920 -8.824 1.00 99.99 C ATOM 1485 CG LEU D 40 10.125 -1.756 -8.075 1.00 99.99 C ATOM 1486 CD1 LEU D 40 9.529 -3.124 -7.690 1.00 99.99 C ATOM 1487 CD2 LEU D 40 11.402 -1.955 -8.903 1.00 99.99 C ATOM 0 H LEU D 40 9.337 0.921 -7.128 1.00 99.99 H new ATOM 0 HA LEU D 40 10.473 0.503 -9.620 1.00 99.99 H new ATOM 0 HB2 LEU D 40 8.161 -0.880 -8.213 1.00 99.99 H new ATOM 0 HB3 LEU D 40 8.801 -1.439 -9.746 1.00 99.99 H new ATOM 0 HG LEU D 40 10.405 -1.204 -7.178 1.00 99.99 H new ATOM 0 HD11 LEU D 40 10.279 -3.712 -7.162 1.00 99.99 H new ATOM 0 HD12 LEU D 40 8.664 -2.975 -7.044 1.00 99.99 H new ATOM 0 HD13 LEU D 40 9.221 -3.654 -8.592 1.00 99.99 H new ATOM 0 HD21 LEU D 40 12.117 -2.548 -8.333 1.00 99.99 H new ATOM 0 HD22 LEU D 40 11.157 -2.474 -9.830 1.00 99.99 H new ATOM 0 HD23 LEU D 40 11.840 -0.984 -9.135 1.00 99.99 H new ATOM 1499 N TRP D 41 7.329 1.425 -9.599 1.00 99.99 N ATOM 1500 CA TRP D 41 6.215 1.932 -10.390 1.00 99.99 C ATOM 1501 C TRP D 41 6.610 3.260 -11.018 1.00 99.99 C ATOM 1502 O TRP D 41 6.311 3.478 -12.166 1.00 99.99 O ATOM 1503 CB TRP D 41 4.960 2.204 -9.549 1.00 99.99 C ATOM 1504 CG TRP D 41 3.752 2.632 -10.362 1.00 99.99 C ATOM 1505 CD1 TRP D 41 2.934 1.833 -11.100 1.00 99.99 C ATOM 1506 CD2 TRP D 41 3.320 3.985 -10.589 1.00 99.99 C ATOM 1507 NE1 TRP D 41 1.965 2.580 -11.708 1.00 99.99 N ATOM 1508 CE2 TRP D 41 2.205 3.907 -11.444 1.00 99.99 C ATOM 1509 CE3 TRP D 41 3.798 5.211 -10.116 1.00 99.99 C ATOM 1510 CZ2 TRP D 41 1.530 5.054 -11.835 1.00 99.99 C ATOM 1511 CZ3 TRP D 41 3.122 6.363 -10.524 1.00 99.99 C ATOM 1512 CH2 TRP D 41 2.002 6.294 -11.371 1.00 99.99 C ATOM 0 H TRP D 41 7.150 1.404 -8.595 1.00 99.99 H new ATOM 0 HA TRP D 41 5.989 1.165 -11.131 1.00 99.99 H new ATOM 0 HB2 TRP D 41 4.708 1.303 -8.990 1.00 99.99 H new ATOM 0 HB3 TRP D 41 5.186 2.980 -8.818 1.00 99.99 H new ATOM 0 HD1 TRP D 41 3.036 0.762 -11.192 1.00 99.99 H new ATOM 0 HE1 TRP D 41 1.193 2.214 -12.265 1.00 99.99 H new ATOM 0 HE3 TRP D 41 4.655 5.265 -9.462 1.00 99.99 H new ATOM 0 HZ2 TRP D 41 0.665 4.996 -12.479 1.00 99.99 H new ATOM 0 HZ3 TRP D 41 3.467 7.327 -10.182 1.00 99.99 H new ATOM 0 HH2 TRP D 41 1.499 7.203 -11.668 1.00 99.99 H new ATOM 1523 N ILE D 42 7.229 4.072 -10.276 1.00 99.99 N ATOM 1524 CA ILE D 42 7.644 5.393 -10.739 1.00 99.99 C ATOM 1525 C ILE D 42 8.719 5.236 -11.805 1.00 99.99 C ATOM 1526 O ILE D 42 8.666 5.922 -12.795 1.00 99.99 O ATOM 1527 CB ILE D 42 8.260 6.249 -9.627 1.00 99.99 C ATOM 1528 CG1 ILE D 42 7.165 6.693 -8.629 1.00 99.99 C ATOM 1529 CG2 ILE D 42 8.978 7.483 -10.216 1.00 99.99 C ATOM 1530 CD1 ILE D 42 7.710 7.477 -7.425 1.00 99.99 C ATOM 0 H ILE D 42 7.484 3.871 -9.309 1.00 99.99 H new ATOM 0 HA ILE D 42 6.745 5.883 -11.112 1.00 99.99 H new ATOM 0 HB ILE D 42 8.998 5.645 -9.099 1.00 99.99 H new ATOM 0 HG12 ILE D 42 6.436 7.310 -9.154 1.00 99.99 H new ATOM 0 HG13 ILE D 42 6.635 5.811 -8.268 1.00 99.99 H new ATOM 0 HG21 ILE D 42 9.407 8.075 -9.407 1.00 99.99 H new ATOM 0 HG22 ILE D 42 9.772 7.156 -10.887 1.00 99.99 H new ATOM 0 HG23 ILE D 42 8.262 8.090 -10.770 1.00 99.99 H new ATOM 0 HD11 ILE D 42 6.885 7.755 -6.769 1.00 99.99 H new ATOM 0 HD12 ILE D 42 8.417 6.855 -6.876 1.00 99.99 H new ATOM 0 HD13 ILE D 42 8.215 8.377 -7.775 1.00 99.99 H new ATOM 1542 N LEU D 43 9.622 4.386 -11.576 1.00 99.99 N ATOM 1543 CA LEU D 43 10.726 4.153 -12.499 1.00 99.99 C ATOM 1544 C LEU D 43 10.180 3.603 -13.809 1.00 99.99 C ATOM 1545 O LEU D 43 10.696 3.938 -14.845 1.00 99.99 O ATOM 1546 CB LEU D 43 11.730 3.116 -11.979 1.00 99.99 C ATOM 1547 CG LEU D 43 12.567 3.589 -10.767 1.00 99.99 C ATOM 1548 CD1 LEU D 43 13.338 2.404 -10.157 1.00 99.99 C ATOM 1549 CD2 LEU D 43 13.544 4.713 -11.146 1.00 99.99 C ATOM 0 H LEU D 43 9.650 3.804 -10.739 1.00 99.99 H new ATOM 0 HA LEU D 43 11.230 5.112 -12.621 1.00 99.99 H new ATOM 0 HB2 LEU D 43 11.189 2.212 -11.701 1.00 99.99 H new ATOM 0 HB3 LEU D 43 12.407 2.845 -12.789 1.00 99.99 H new ATOM 0 HG LEU D 43 11.873 3.990 -10.028 1.00 99.99 H new ATOM 0 HD11 LEU D 43 13.923 2.750 -9.305 1.00 99.99 H new ATOM 0 HD12 LEU D 43 12.632 1.642 -9.827 1.00 99.99 H new ATOM 0 HD13 LEU D 43 14.006 1.980 -10.907 1.00 99.99 H new ATOM 0 HD21 LEU D 43 14.111 5.015 -10.265 1.00 99.99 H new ATOM 0 HD22 LEU D 43 14.230 4.355 -11.914 1.00 99.99 H new ATOM 0 HD23 LEU D 43 12.985 5.567 -11.528 1.00 99.99 H new ATOM 1561 N ASP D 44 9.208 2.804 -13.724 1.00 99.99 N ATOM 1562 CA ASP D 44 8.604 2.182 -14.894 1.00 99.99 C ATOM 1563 C ASP D 44 7.931 3.252 -15.743 1.00 99.99 C ATOM 1564 O ASP D 44 8.023 3.191 -16.944 1.00 99.99 O ATOM 1565 CB ASP D 44 7.512 1.164 -14.536 1.00 99.99 C ATOM 1566 CG ASP D 44 6.944 0.448 -15.777 1.00 99.99 C ATOM 1567 OD1 ASP D 44 7.699 -0.321 -16.418 1.00 99.99 O ATOM 1568 OD2 ASP D 44 5.726 0.616 -16.084 1.00 99.99 O ATOM 0 H ASP D 44 8.775 2.535 -12.840 1.00 99.99 H new ATOM 0 HA ASP D 44 9.412 1.671 -15.418 1.00 99.99 H new ATOM 0 HB2 ASP D 44 7.921 0.424 -13.849 1.00 99.99 H new ATOM 0 HB3 ASP D 44 6.703 1.673 -14.012 1.00 99.99 H new ATOM 1573 N ARG D 45 7.301 4.151 -15.123 1.00 99.99 N ATOM 1574 CA ARG D 45 6.590 5.223 -15.810 1.00 99.99 C ATOM 1575 C ARG D 45 7.588 6.088 -16.566 1.00 99.99 C ATOM 1576 O ARG D 45 7.315 6.459 -17.679 1.00 99.99 O ATOM 1577 CB ARG D 45 5.850 6.161 -14.847 1.00 99.99 C ATOM 1578 CG ARG D 45 4.702 5.478 -14.075 1.00 99.99 C ATOM 1579 CD ARG D 45 3.453 5.242 -14.936 1.00 99.99 C ATOM 1580 NE ARG D 45 3.528 3.855 -15.520 1.00 99.99 N ATOM 1581 CZ ARG D 45 2.834 3.525 -16.626 1.00 99.99 C ATOM 1582 NH1 ARG D 45 2.027 4.407 -17.241 1.00 99.99 N ATOM 1583 NH2 ARG D 45 2.938 2.269 -17.092 1.00 99.99 N ATOM 0 H ARG D 45 7.241 4.198 -14.106 1.00 99.99 H new ATOM 0 HA ARG D 45 5.868 4.738 -16.467 1.00 99.99 H new ATOM 0 HB2 ARG D 45 6.564 6.570 -14.132 1.00 99.99 H new ATOM 0 HB3 ARG D 45 5.447 7.002 -15.411 1.00 99.99 H new ATOM 0 HG2 ARG D 45 5.053 4.523 -13.685 1.00 99.99 H new ATOM 0 HG3 ARG D 45 4.433 6.093 -13.217 1.00 99.99 H new ATOM 0 HD2 ARG D 45 2.552 5.350 -14.333 1.00 99.99 H new ATOM 0 HD3 ARG D 45 3.396 5.985 -15.731 1.00 99.99 H new ATOM 0 HE ARG D 45 4.115 3.153 -15.069 1.00 99.99 H new ATOM 0 HH11 ARG D 45 1.929 5.353 -16.871 1.00 99.99 H new ATOM 0 HH12 ARG D 45 1.513 4.131 -18.077 1.00 99.99 H new ATOM 0 HH21 ARG D 45 3.531 1.594 -16.610 1.00 99.99 H new ATOM 0 HH22 ARG D 45 2.424 1.991 -17.928 1.00 99.99 H new ATOM 1597 N LEU D 46 8.660 6.370 -15.963 1.00 99.99 N ATOM 1598 CA LEU D 46 9.693 7.209 -16.559 1.00 99.99 C ATOM 1599 C LEU D 46 10.312 6.482 -17.743 1.00 99.99 C ATOM 1600 O LEU D 46 10.981 5.463 -17.581 1.00 99.99 O ATOM 1601 CB LEU D 46 10.843 7.519 -15.592 1.00 99.99 C ATOM 1602 CG LEU D 46 10.489 8.257 -14.278 1.00 99.99 C ATOM 1603 CD1 LEU D 46 11.729 8.245 -13.364 1.00 99.99 C ATOM 1604 CD2 LEU D 46 10.008 9.695 -14.499 1.00 99.99 C ATOM 0 H LEU D 46 8.884 6.038 -15.025 1.00 99.99 H new ATOM 0 HA LEU D 46 9.203 8.140 -16.844 1.00 99.99 H new ATOM 0 HB2 LEU D 46 11.326 6.578 -15.330 1.00 99.99 H new ATOM 0 HB3 LEU D 46 11.581 8.118 -16.127 1.00 99.99 H new ATOM 0 HG LEU D 46 9.655 7.731 -13.815 1.00 99.99 H new ATOM 0 HD11 LEU D 46 11.499 8.761 -12.432 1.00 99.99 H new ATOM 0 HD12 LEU D 46 12.012 7.215 -13.148 1.00 99.99 H new ATOM 0 HD13 LEU D 46 12.555 8.751 -13.864 1.00 99.99 H new ATOM 0 HD21 LEU D 46 9.777 10.153 -13.537 1.00 99.99 H new ATOM 0 HD22 LEU D 46 10.791 10.268 -14.996 1.00 99.99 H new ATOM 0 HD23 LEU D 46 9.113 9.688 -15.121 1.00 99.99 H new