USER MOD reduce.3.24.130724 H: found=0, std=0, add=763, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 757 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 2 SER OG : rot -130:sc= 0.141 USER MOD Set 1.2: A 5 SER OG : rot 147:sc= 0.764 USER MOD Single : A 1 CYS N :NH3+ -167:sc= -0.0342 (180deg=-0.374) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.047 USER MOD Single : A 20 THR OG1 : rot 100:sc= -0.751 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot -160:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.00895 USER MOD Single : A 52 LYS NZ :NH3+ -129:sc= -4.26! (180deg=-5.6!) USER MOD Single : A 53 THR OG1 : rot -10:sc= 0.411 USER MOD Single : A 62 GLN : amide:sc= -0.0568 X(o=-0.057,f=-0.21) USER MOD Single : A 63 ASN : amide:sc= -0.386 K(o=-0.39,f=-9.3!) USER MOD Single : B 1 CYS N :NH3+ -157:sc= 0.244 (180deg=0.0832) USER MOD Single : B 2 SER OG : rot -170:sc= -0.24! USER MOD Single : B 3 THR OG1 : rot 68:sc= 0.242 USER MOD Single : B 5 SER OG : rot 160:sc= -1.38 USER MOD Single : B 20 THR OG1 : rot 67:sc= 0.413 USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 1 72.697 21.281 -20.719 1.00 0.00 N ATOM 2 CA CYS A 1 72.187 20.748 -19.424 1.00 0.00 C ATOM 3 C CYS A 1 71.963 19.245 -19.548 1.00 0.00 C ATOM 4 O CYS A 1 72.044 18.512 -18.561 1.00 0.00 O ATOM 5 CB CYS A 1 70.873 21.445 -19.069 1.00 0.00 C ATOM 6 SG CYS A 1 70.127 20.632 -17.635 1.00 0.00 S ATOM 0 H1 CYS A 1 73.057 22.247 -20.579 1.00 0.00 H new ATOM 0 H2 CYS A 1 73.465 20.672 -21.066 1.00 0.00 H new ATOM 0 H3 CYS A 1 71.925 21.296 -21.416 1.00 0.00 H new ATOM 0 HA CYS A 1 72.916 20.937 -18.636 1.00 0.00 H new ATOM 0 HB2 CYS A 1 71.055 22.497 -18.850 1.00 0.00 H new ATOM 0 HB3 CYS A 1 70.189 21.409 -19.917 1.00 0.00 H new ATOM 10 N SER A 2 71.678 18.792 -20.764 1.00 0.00 N ATOM 11 CA SER A 2 71.443 17.373 -21.005 1.00 0.00 C ATOM 12 C SER A 2 72.640 16.546 -20.552 1.00 0.00 C ATOM 13 O SER A 2 73.785 16.863 -20.877 1.00 0.00 O ATOM 14 CB SER A 2 71.187 17.131 -22.492 1.00 0.00 C ATOM 15 OG SER A 2 72.371 17.418 -23.224 1.00 0.00 O ATOM 0 H SER A 2 71.604 19.382 -21.593 1.00 0.00 H new ATOM 0 HA SER A 2 70.568 17.068 -20.432 1.00 0.00 H new ATOM 0 HB2 SER A 2 70.885 16.097 -22.657 1.00 0.00 H new ATOM 0 HB3 SER A 2 70.369 17.762 -22.840 1.00 0.00 H new ATOM 0 HG SER A 2 72.157 18.013 -23.972 1.00 0.00 H new ATOM 21 N THR A 3 72.370 15.482 -19.801 1.00 0.00 N ATOM 22 CA THR A 3 73.432 14.611 -19.307 1.00 0.00 C ATOM 23 C THR A 3 73.824 13.592 -20.373 1.00 0.00 C ATOM 24 O THR A 3 73.129 13.436 -21.377 1.00 0.00 O ATOM 25 CB THR A 3 72.962 13.879 -18.049 1.00 0.00 C ATOM 26 OG1 THR A 3 71.956 12.938 -18.398 1.00 0.00 O ATOM 27 CG2 THR A 3 72.393 14.890 -17.051 1.00 0.00 C ATOM 0 H THR A 3 71.429 15.203 -19.522 1.00 0.00 H new ATOM 0 HA THR A 3 74.300 15.225 -19.068 1.00 0.00 H new ATOM 0 HB THR A 3 73.805 13.358 -17.595 1.00 0.00 H new ATOM 0 HG1 THR A 3 71.655 12.467 -17.593 1.00 0.00 H new ATOM 0 HG21 THR A 3 72.058 14.368 -16.155 1.00 0.00 H new ATOM 0 HG22 THR A 3 73.165 15.611 -16.784 1.00 0.00 H new ATOM 0 HG23 THR A 3 71.550 15.412 -17.503 1.00 0.00 H new ATOM 35 N VAL A 4 74.942 12.901 -20.141 1.00 0.00 N ATOM 36 CA VAL A 4 75.438 11.886 -21.078 1.00 0.00 C ATOM 37 C VAL A 4 75.147 12.273 -22.525 1.00 0.00 C ATOM 38 O VAL A 4 74.893 11.418 -23.371 1.00 0.00 O ATOM 39 CB VAL A 4 74.816 10.523 -20.760 1.00 0.00 C ATOM 40 CG1 VAL A 4 75.268 10.075 -19.368 1.00 0.00 C ATOM 41 CG2 VAL A 4 73.287 10.622 -20.787 1.00 0.00 C ATOM 0 H VAL A 4 75.523 13.025 -19.312 1.00 0.00 H new ATOM 0 HA VAL A 4 76.520 11.822 -20.960 1.00 0.00 H new ATOM 0 HB VAL A 4 75.140 9.799 -21.508 1.00 0.00 H new ATOM 0 HG11 VAL A 4 74.828 9.105 -19.137 1.00 0.00 H new ATOM 0 HG12 VAL A 4 76.355 9.994 -19.347 1.00 0.00 H new ATOM 0 HG13 VAL A 4 74.944 10.806 -18.627 1.00 0.00 H new ATOM 0 HG21 VAL A 4 72.855 9.647 -20.560 1.00 0.00 H new ATOM 0 HG22 VAL A 4 72.956 11.348 -20.044 1.00 0.00 H new ATOM 0 HG23 VAL A 4 72.960 10.941 -21.777 1.00 0.00 H new ATOM 51 N SER A 5 75.206 13.573 -22.797 1.00 0.00 N ATOM 52 CA SER A 5 74.970 14.081 -24.143 1.00 0.00 C ATOM 53 C SER A 5 76.255 14.002 -24.976 1.00 0.00 C ATOM 54 O SER A 5 76.211 13.651 -26.155 1.00 0.00 O ATOM 55 CB SER A 5 74.452 15.528 -24.082 1.00 0.00 C ATOM 56 OG SER A 5 73.452 15.706 -25.077 1.00 0.00 O ATOM 0 H SER A 5 75.415 14.292 -22.104 1.00 0.00 H new ATOM 0 HA SER A 5 74.212 13.462 -24.623 1.00 0.00 H new ATOM 0 HB2 SER A 5 74.042 15.739 -23.094 1.00 0.00 H new ATOM 0 HB3 SER A 5 75.272 16.228 -24.243 1.00 0.00 H new ATOM 0 HG SER A 5 72.778 16.339 -24.754 1.00 0.00 H new ATOM 62 N PRO A 6 77.390 14.310 -24.390 1.00 0.00 N ATOM 63 CA PRO A 6 78.704 14.260 -25.102 1.00 0.00 C ATOM 64 C PRO A 6 78.904 12.966 -25.870 1.00 0.00 C ATOM 65 O PRO A 6 79.387 12.985 -27.002 1.00 0.00 O ATOM 66 CB PRO A 6 79.717 14.415 -23.966 1.00 0.00 C ATOM 67 CG PRO A 6 78.999 15.265 -22.978 1.00 0.00 C ATOM 68 CD PRO A 6 77.568 14.744 -22.988 1.00 0.00 C ATOM 0 HA PRO A 6 78.795 15.031 -25.867 1.00 0.00 H new ATOM 0 HB2 PRO A 6 79.994 13.451 -23.540 1.00 0.00 H new ATOM 0 HB3 PRO A 6 80.637 14.888 -24.310 1.00 0.00 H new ATOM 0 HG2 PRO A 6 79.444 15.182 -21.986 1.00 0.00 H new ATOM 0 HG3 PRO A 6 79.039 16.318 -23.258 1.00 0.00 H new ATOM 0 HD2 PRO A 6 77.432 13.919 -22.288 1.00 0.00 H new ATOM 0 HD3 PRO A 6 76.853 15.518 -22.710 1.00 0.00 H new ATOM 76 N GLY A 7 78.542 11.844 -25.262 1.00 0.00 N ATOM 77 CA GLY A 7 78.722 10.558 -25.935 1.00 0.00 C ATOM 78 C GLY A 7 80.206 10.239 -25.996 1.00 0.00 C ATOM 79 O GLY A 7 80.636 9.137 -25.651 1.00 0.00 O ATOM 0 H GLY A 7 78.132 11.793 -24.329 1.00 0.00 H new ATOM 0 HA2 GLY A 7 78.189 9.773 -25.398 1.00 0.00 H new ATOM 0 HA3 GLY A 7 78.303 10.597 -26.940 1.00 0.00 H new ATOM 83 N VAL A 8 80.995 11.232 -26.402 1.00 0.00 N ATOM 84 CA VAL A 8 82.431 11.062 -26.461 1.00 0.00 C ATOM 85 C VAL A 8 82.908 10.621 -25.095 1.00 0.00 C ATOM 86 O VAL A 8 83.781 9.757 -24.976 1.00 0.00 O ATOM 87 CB VAL A 8 83.106 12.376 -26.858 1.00 0.00 C ATOM 88 CG1 VAL A 8 84.625 12.234 -26.733 1.00 0.00 C ATOM 89 CG2 VAL A 8 82.745 12.706 -28.305 1.00 0.00 C ATOM 0 H VAL A 8 80.661 12.151 -26.691 1.00 0.00 H new ATOM 0 HA VAL A 8 82.689 10.313 -27.210 1.00 0.00 H new ATOM 0 HB VAL A 8 82.764 13.175 -26.200 1.00 0.00 H new ATOM 0 HG11 VAL A 8 85.103 13.172 -27.017 1.00 0.00 H new ATOM 0 HG12 VAL A 8 84.884 11.992 -25.702 1.00 0.00 H new ATOM 0 HG13 VAL A 8 84.971 11.437 -27.391 1.00 0.00 H new ATOM 0 HG21 VAL A 8 83.223 13.642 -28.595 1.00 0.00 H new ATOM 0 HG22 VAL A 8 83.091 11.905 -28.958 1.00 0.00 H new ATOM 0 HG23 VAL A 8 81.664 12.807 -28.396 1.00 0.00 H new ATOM 99 N LEU A 9 82.304 11.191 -24.052 1.00 0.00 N ATOM 100 CA LEU A 9 82.682 10.788 -22.706 1.00 0.00 C ATOM 101 C LEU A 9 82.517 9.269 -22.592 1.00 0.00 C ATOM 102 O LEU A 9 83.351 8.572 -22.007 1.00 0.00 O ATOM 103 CB LEU A 9 81.835 11.502 -21.647 1.00 0.00 C ATOM 104 CG LEU A 9 82.205 12.996 -21.584 1.00 0.00 C ATOM 105 CD1 LEU A 9 81.265 13.698 -20.601 1.00 0.00 C ATOM 106 CD2 LEU A 9 83.666 13.177 -21.115 1.00 0.00 C ATOM 0 H LEU A 9 81.579 11.906 -24.111 1.00 0.00 H new ATOM 0 HA LEU A 9 83.720 11.068 -22.526 1.00 0.00 H new ATOM 0 HB2 LEU A 9 80.777 11.392 -21.884 1.00 0.00 H new ATOM 0 HB3 LEU A 9 81.993 11.040 -20.673 1.00 0.00 H new ATOM 0 HG LEU A 9 82.105 13.429 -22.579 1.00 0.00 H new ATOM 0 HD11 LEU A 9 81.518 14.757 -20.549 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.235 13.588 -20.940 1.00 0.00 H new ATOM 0 HD13 LEU A 9 81.371 13.250 -19.613 1.00 0.00 H new ATOM 0 HD21 LEU A 9 83.907 14.239 -21.077 1.00 0.00 H new ATOM 0 HD22 LEU A 9 83.786 12.742 -20.123 1.00 0.00 H new ATOM 0 HD23 LEU A 9 84.337 12.677 -21.814 1.00 0.00 H new ATOM 118 N ALA A 10 81.454 8.747 -23.205 1.00 0.00 N ATOM 119 CA ALA A 10 81.235 7.309 -23.201 1.00 0.00 C ATOM 120 C ALA A 10 82.433 6.648 -23.870 1.00 0.00 C ATOM 121 O ALA A 10 82.932 5.612 -23.418 1.00 0.00 O ATOM 122 CB ALA A 10 79.945 6.960 -23.955 1.00 0.00 C ATOM 0 H ALA A 10 80.746 9.290 -23.700 1.00 0.00 H new ATOM 0 HA ALA A 10 81.129 6.950 -22.177 1.00 0.00 H new ATOM 0 HB1 ALA A 10 79.797 5.880 -23.942 1.00 0.00 H new ATOM 0 HB2 ALA A 10 79.098 7.448 -23.473 1.00 0.00 H new ATOM 0 HB3 ALA A 10 80.022 7.303 -24.987 1.00 0.00 H new ATOM 128 N GLY A 11 82.908 7.286 -24.939 1.00 0.00 N ATOM 129 CA GLY A 11 84.070 6.788 -25.655 1.00 0.00 C ATOM 130 C GLY A 11 85.261 6.729 -24.712 1.00 0.00 C ATOM 131 O GLY A 11 86.162 5.911 -24.880 1.00 0.00 O ATOM 0 H GLY A 11 82.506 8.142 -25.322 1.00 0.00 H new ATOM 0 HA2 GLY A 11 83.864 5.797 -26.060 1.00 0.00 H new ATOM 0 HA3 GLY A 11 84.295 7.437 -26.501 1.00 0.00 H new ATOM 135 N ILE A 12 85.243 7.601 -23.706 1.00 0.00 N ATOM 136 CA ILE A 12 86.318 7.640 -22.716 1.00 0.00 C ATOM 137 C ILE A 12 86.255 6.364 -21.875 1.00 0.00 C ATOM 138 O ILE A 12 87.279 5.739 -21.601 1.00 0.00 O ATOM 139 CB ILE A 12 86.199 8.935 -21.841 1.00 0.00 C ATOM 140 CG1 ILE A 12 87.533 9.705 -21.820 1.00 0.00 C ATOM 141 CG2 ILE A 12 85.796 8.617 -20.385 1.00 0.00 C ATOM 142 CD1 ILE A 12 87.292 11.123 -21.296 1.00 0.00 C ATOM 0 H ILE A 12 84.502 8.285 -23.555 1.00 0.00 H new ATOM 0 HA ILE A 12 87.290 7.680 -23.207 1.00 0.00 H new ATOM 0 HB ILE A 12 85.419 9.545 -22.297 1.00 0.00 H new ATOM 0 HG12 ILE A 12 88.254 9.189 -21.186 1.00 0.00 H new ATOM 0 HG13 ILE A 12 87.960 9.743 -22.822 1.00 0.00 H new ATOM 0 HG21 ILE A 12 85.726 9.544 -19.816 1.00 0.00 H new ATOM 0 HG22 ILE A 12 84.830 8.112 -20.377 1.00 0.00 H new ATOM 0 HG23 ILE A 12 86.547 7.970 -19.933 1.00 0.00 H new ATOM 0 HD11 ILE A 12 88.235 11.670 -21.280 1.00 0.00 H new ATOM 0 HD12 ILE A 12 86.585 11.637 -21.948 1.00 0.00 H new ATOM 0 HD13 ILE A 12 86.884 11.073 -20.286 1.00 0.00 H new ATOM 154 N VAL A 13 85.043 5.974 -21.490 1.00 0.00 N ATOM 155 CA VAL A 13 84.873 4.755 -20.702 1.00 0.00 C ATOM 156 C VAL A 13 85.486 3.584 -21.460 1.00 0.00 C ATOM 157 O VAL A 13 86.343 2.850 -20.941 1.00 0.00 O ATOM 158 CB VAL A 13 83.385 4.480 -20.465 1.00 0.00 C ATOM 159 CG1 VAL A 13 83.228 3.194 -19.652 1.00 0.00 C ATOM 160 CG2 VAL A 13 82.756 5.647 -19.699 1.00 0.00 C ATOM 0 H VAL A 13 84.179 6.472 -21.705 1.00 0.00 H new ATOM 0 HA VAL A 13 85.368 4.879 -19.739 1.00 0.00 H new ATOM 0 HB VAL A 13 82.883 4.369 -21.426 1.00 0.00 H new ATOM 0 HG11 VAL A 13 82.169 2.997 -19.483 1.00 0.00 H new ATOM 0 HG12 VAL A 13 83.669 2.361 -20.200 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.734 3.306 -18.693 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.698 5.445 -19.534 1.00 0.00 H new ATOM 0 HG22 VAL A 13 83.258 5.764 -18.738 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.864 6.563 -20.279 1.00 0.00 H new ATOM 170 N VAL A 14 85.059 3.429 -22.709 1.00 0.00 N ATOM 171 CA VAL A 14 85.583 2.363 -23.546 1.00 0.00 C ATOM 172 C VAL A 14 87.098 2.491 -23.637 1.00 0.00 C ATOM 173 O VAL A 14 87.818 1.495 -23.603 1.00 0.00 O ATOM 174 CB VAL A 14 84.973 2.438 -24.947 1.00 0.00 C ATOM 175 CG1 VAL A 14 85.547 1.317 -25.816 1.00 0.00 C ATOM 176 CG2 VAL A 14 83.454 2.278 -24.851 1.00 0.00 C ATOM 0 H VAL A 14 84.360 4.022 -23.157 1.00 0.00 H new ATOM 0 HA VAL A 14 85.322 1.402 -23.103 1.00 0.00 H new ATOM 0 HB VAL A 14 85.211 3.403 -25.394 1.00 0.00 H new ATOM 0 HG11 VAL A 14 85.112 1.371 -26.814 1.00 0.00 H new ATOM 0 HG12 VAL A 14 86.629 1.428 -25.885 1.00 0.00 H new ATOM 0 HG13 VAL A 14 85.309 0.352 -25.369 1.00 0.00 H new ATOM 0 HG21 VAL A 14 83.019 2.331 -25.849 1.00 0.00 H new ATOM 0 HG22 VAL A 14 83.217 1.313 -24.403 1.00 0.00 H new ATOM 0 HG23 VAL A 14 83.042 3.076 -24.233 1.00 0.00 H new ATOM 186 N GLY A 15 87.569 3.731 -23.744 1.00 0.00 N ATOM 187 CA GLY A 15 88.998 4.005 -23.835 1.00 0.00 C ATOM 188 C GLY A 15 89.746 3.378 -22.664 1.00 0.00 C ATOM 189 O GLY A 15 90.829 2.820 -22.834 1.00 0.00 O ATOM 0 H GLY A 15 86.979 4.563 -23.770 1.00 0.00 H new ATOM 0 HA2 GLY A 15 89.389 3.613 -24.774 1.00 0.00 H new ATOM 0 HA3 GLY A 15 89.166 5.082 -23.845 1.00 0.00 H new ATOM 193 N ASP A 16 89.163 3.474 -21.476 1.00 0.00 N ATOM 194 CA ASP A 16 89.788 2.911 -20.286 1.00 0.00 C ATOM 195 C ASP A 16 89.873 1.394 -20.401 1.00 0.00 C ATOM 196 O ASP A 16 90.913 0.792 -20.110 1.00 0.00 O ATOM 197 CB ASP A 16 88.980 3.286 -19.041 1.00 0.00 C ATOM 198 CG ASP A 16 89.744 2.886 -17.783 1.00 0.00 C ATOM 199 OD1 ASP A 16 90.799 2.289 -17.919 1.00 0.00 O ATOM 200 OD2 ASP A 16 89.261 3.183 -16.703 1.00 0.00 O ATOM 0 H ASP A 16 88.267 3.932 -21.311 1.00 0.00 H new ATOM 0 HA ASP A 16 90.795 3.318 -20.198 1.00 0.00 H new ATOM 0 HB2 ASP A 16 88.786 4.359 -19.033 1.00 0.00 H new ATOM 0 HB3 ASP A 16 88.011 2.787 -19.062 1.00 0.00 H new ATOM 205 N LEU A 17 88.771 0.776 -20.823 1.00 0.00 N ATOM 206 CA LEU A 17 88.742 -0.679 -20.963 1.00 0.00 C ATOM 207 C LEU A 17 89.871 -1.162 -21.876 1.00 0.00 C ATOM 208 O LEU A 17 90.630 -2.067 -21.515 1.00 0.00 O ATOM 209 CB LEU A 17 87.393 -1.129 -21.536 1.00 0.00 C ATOM 210 CG LEU A 17 87.258 -2.659 -21.440 1.00 0.00 C ATOM 211 CD1 LEU A 17 87.052 -3.102 -19.976 1.00 0.00 C ATOM 212 CD2 LEU A 17 86.060 -3.105 -22.286 1.00 0.00 C ATOM 0 H LEU A 17 87.902 1.249 -21.070 1.00 0.00 H new ATOM 0 HA LEU A 17 88.880 -1.116 -19.974 1.00 0.00 H new ATOM 0 HB2 LEU A 17 86.580 -0.650 -20.990 1.00 0.00 H new ATOM 0 HB3 LEU A 17 87.308 -0.814 -22.576 1.00 0.00 H new ATOM 0 HG LEU A 17 88.174 -3.120 -21.810 1.00 0.00 H new ATOM 0 HD11 LEU A 17 86.959 -4.187 -19.934 1.00 0.00 H new ATOM 0 HD12 LEU A 17 87.907 -2.787 -19.377 1.00 0.00 H new ATOM 0 HD13 LEU A 17 86.144 -2.645 -19.582 1.00 0.00 H new ATOM 0 HD21 LEU A 17 85.955 -4.188 -22.225 1.00 0.00 H new ATOM 0 HD22 LEU A 17 85.153 -2.631 -21.911 1.00 0.00 H new ATOM 0 HD23 LEU A 17 86.219 -2.814 -23.324 1.00 0.00 H new ATOM 224 N VAL A 18 89.979 -0.562 -23.060 1.00 0.00 N ATOM 225 CA VAL A 18 91.020 -0.955 -24.004 1.00 0.00 C ATOM 226 C VAL A 18 92.399 -0.561 -23.488 1.00 0.00 C ATOM 227 O VAL A 18 93.397 -1.154 -23.878 1.00 0.00 O ATOM 228 CB VAL A 18 90.782 -0.323 -25.375 1.00 0.00 C ATOM 229 CG1 VAL A 18 89.473 -0.851 -25.963 1.00 0.00 C ATOM 230 CG2 VAL A 18 90.695 1.190 -25.220 1.00 0.00 C ATOM 0 H VAL A 18 89.368 0.187 -23.384 1.00 0.00 H new ATOM 0 HA VAL A 18 90.979 -2.039 -24.106 1.00 0.00 H new ATOM 0 HB VAL A 18 91.605 -0.578 -26.043 1.00 0.00 H new ATOM 0 HG11 VAL A 18 89.305 -0.399 -26.941 1.00 0.00 H new ATOM 0 HG12 VAL A 18 89.533 -1.934 -26.069 1.00 0.00 H new ATOM 0 HG13 VAL A 18 88.647 -0.596 -25.299 1.00 0.00 H new ATOM 0 HG21 VAL A 18 90.525 1.646 -26.195 1.00 0.00 H new ATOM 0 HG22 VAL A 18 89.870 1.441 -24.553 1.00 0.00 H new ATOM 0 HG23 VAL A 18 91.628 1.567 -24.800 1.00 0.00 H new ATOM 240 N LEU A 19 92.461 0.441 -22.615 1.00 0.00 N ATOM 241 CA LEU A 19 93.752 0.864 -22.078 1.00 0.00 C ATOM 242 C LEU A 19 94.370 -0.284 -21.279 1.00 0.00 C ATOM 243 O LEU A 19 95.483 -0.728 -21.569 1.00 0.00 O ATOM 244 CB LEU A 19 93.572 2.103 -21.178 1.00 0.00 C ATOM 245 CG LEU A 19 94.862 2.944 -21.135 1.00 0.00 C ATOM 246 CD1 LEU A 19 96.041 2.065 -20.703 1.00 0.00 C ATOM 247 CD2 LEU A 19 95.152 3.572 -22.519 1.00 0.00 C ATOM 0 H LEU A 19 91.656 0.964 -22.271 1.00 0.00 H new ATOM 0 HA LEU A 19 94.416 1.128 -22.901 1.00 0.00 H new ATOM 0 HB2 LEU A 19 92.749 2.712 -21.551 1.00 0.00 H new ATOM 0 HB3 LEU A 19 93.304 1.789 -20.169 1.00 0.00 H new ATOM 0 HG LEU A 19 94.727 3.749 -20.412 1.00 0.00 H new ATOM 0 HD11 LEU A 19 96.951 2.665 -20.674 1.00 0.00 H new ATOM 0 HD12 LEU A 19 95.845 1.655 -19.712 1.00 0.00 H new ATOM 0 HD13 LEU A 19 96.167 1.249 -21.415 1.00 0.00 H new ATOM 0 HD21 LEU A 19 96.067 4.162 -22.466 1.00 0.00 H new ATOM 0 HD22 LEU A 19 95.272 2.781 -23.259 1.00 0.00 H new ATOM 0 HD23 LEU A 19 94.321 4.216 -22.807 1.00 0.00 H new ATOM 259 N THR A 20 93.634 -0.770 -20.279 1.00 0.00 N ATOM 260 CA THR A 20 94.119 -1.871 -19.452 1.00 0.00 C ATOM 261 C THR A 20 94.358 -3.134 -20.283 1.00 0.00 C ATOM 262 O THR A 20 95.389 -3.790 -20.144 1.00 0.00 O ATOM 263 CB THR A 20 93.096 -2.180 -18.357 1.00 0.00 C ATOM 264 OG1 THR A 20 92.998 -1.070 -17.484 1.00 0.00 O ATOM 265 CG2 THR A 20 93.536 -3.416 -17.568 1.00 0.00 C ATOM 0 H THR A 20 92.709 -0.422 -20.025 1.00 0.00 H new ATOM 0 HA THR A 20 95.067 -1.565 -19.010 1.00 0.00 H new ATOM 0 HB THR A 20 92.125 -2.376 -18.813 1.00 0.00 H new ATOM 0 HG1 THR A 20 92.206 -0.541 -17.715 1.00 0.00 H new ATOM 0 HG21 THR A 20 92.803 -3.631 -16.790 1.00 0.00 H new ATOM 0 HG22 THR A 20 93.611 -4.270 -18.241 1.00 0.00 H new ATOM 0 HG23 THR A 20 94.507 -3.229 -17.110 1.00 0.00 H new ATOM 273 N VAL A 21 93.388 -3.484 -21.120 1.00 0.00 N ATOM 274 CA VAL A 21 93.497 -4.691 -21.940 1.00 0.00 C ATOM 275 C VAL A 21 94.644 -4.602 -22.947 1.00 0.00 C ATOM 276 O VAL A 21 95.273 -5.609 -23.272 1.00 0.00 O ATOM 277 CB VAL A 21 92.185 -4.923 -22.690 1.00 0.00 C ATOM 278 CG1 VAL A 21 92.296 -6.189 -23.540 1.00 0.00 C ATOM 279 CG2 VAL A 21 91.044 -5.085 -21.683 1.00 0.00 C ATOM 0 H VAL A 21 92.524 -2.957 -21.250 1.00 0.00 H new ATOM 0 HA VAL A 21 93.705 -5.524 -21.269 1.00 0.00 H new ATOM 0 HB VAL A 21 91.983 -4.069 -23.337 1.00 0.00 H new ATOM 0 HG11 VAL A 21 91.360 -6.352 -24.074 1.00 0.00 H new ATOM 0 HG12 VAL A 21 93.108 -6.075 -24.258 1.00 0.00 H new ATOM 0 HG13 VAL A 21 92.500 -7.044 -22.895 1.00 0.00 H new ATOM 0 HG21 VAL A 21 90.108 -5.250 -22.217 1.00 0.00 H new ATOM 0 HG22 VAL A 21 91.248 -5.938 -21.036 1.00 0.00 H new ATOM 0 HG23 VAL A 21 90.962 -4.182 -21.078 1.00 0.00 H new ATOM 289 N LEU A 22 94.894 -3.404 -23.458 1.00 0.00 N ATOM 290 CA LEU A 22 95.946 -3.204 -24.452 1.00 0.00 C ATOM 291 C LEU A 22 97.335 -3.386 -23.845 1.00 0.00 C ATOM 292 O LEU A 22 98.138 -4.174 -24.346 1.00 0.00 O ATOM 293 CB LEU A 22 95.819 -1.799 -25.056 1.00 0.00 C ATOM 294 CG LEU A 22 97.003 -1.499 -25.987 1.00 0.00 C ATOM 295 CD1 LEU A 22 97.173 -2.631 -27.009 1.00 0.00 C ATOM 296 CD2 LEU A 22 96.734 -0.183 -26.724 1.00 0.00 C ATOM 0 H LEU A 22 94.386 -2.557 -23.203 1.00 0.00 H new ATOM 0 HA LEU A 22 95.824 -3.956 -25.232 1.00 0.00 H new ATOM 0 HB2 LEU A 22 94.884 -1.720 -25.611 1.00 0.00 H new ATOM 0 HB3 LEU A 22 95.780 -1.057 -24.258 1.00 0.00 H new ATOM 0 HG LEU A 22 97.916 -1.418 -25.396 1.00 0.00 H new ATOM 0 HD11 LEU A 22 98.015 -2.407 -27.663 1.00 0.00 H new ATOM 0 HD12 LEU A 22 97.359 -3.569 -26.486 1.00 0.00 H new ATOM 0 HD13 LEU A 22 96.265 -2.723 -27.605 1.00 0.00 H new ATOM 0 HD21 LEU A 22 97.569 0.039 -27.388 1.00 0.00 H new ATOM 0 HD22 LEU A 22 95.819 -0.274 -27.310 1.00 0.00 H new ATOM 0 HD23 LEU A 22 96.622 0.624 -25.999 1.00 0.00 H new ATOM 308 N ILE A 23 97.622 -2.655 -22.773 1.00 0.00 N ATOM 309 CA ILE A 23 98.930 -2.759 -22.134 1.00 0.00 C ATOM 310 C ILE A 23 99.100 -4.133 -21.491 1.00 0.00 C ATOM 311 O ILE A 23 100.164 -4.751 -21.590 1.00 0.00 O ATOM 312 CB ILE A 23 99.094 -1.651 -21.089 1.00 0.00 C ATOM 313 CG1 ILE A 23 98.888 -0.293 -21.769 1.00 0.00 C ATOM 314 CG2 ILE A 23 100.501 -1.716 -20.485 1.00 0.00 C ATOM 315 CD1 ILE A 23 98.970 0.832 -20.733 1.00 0.00 C ATOM 0 H ILE A 23 96.980 -1.995 -22.334 1.00 0.00 H new ATOM 0 HA ILE A 23 99.703 -2.639 -22.893 1.00 0.00 H new ATOM 0 HB ILE A 23 98.359 -1.782 -20.294 1.00 0.00 H new ATOM 0 HG12 ILE A 23 99.645 -0.145 -22.539 1.00 0.00 H new ATOM 0 HG13 ILE A 23 97.918 -0.270 -22.266 1.00 0.00 H new ATOM 0 HG21 ILE A 23 100.615 -0.927 -19.742 1.00 0.00 H new ATOM 0 HG22 ILE A 23 100.648 -2.686 -20.010 1.00 0.00 H new ATOM 0 HG23 ILE A 23 101.242 -1.582 -21.273 1.00 0.00 H new ATOM 0 HD11 ILE A 23 98.822 1.793 -21.227 1.00 0.00 H new ATOM 0 HD12 ILE A 23 98.196 0.689 -19.979 1.00 0.00 H new ATOM 0 HD13 ILE A 23 99.950 0.816 -20.256 1.00 0.00 H new ATOM 327 N ALA A 24 98.044 -4.613 -20.844 1.00 0.00 N ATOM 328 CA ALA A 24 98.085 -5.921 -20.202 1.00 0.00 C ATOM 329 C ALA A 24 98.383 -7.001 -21.236 1.00 0.00 C ATOM 330 O ALA A 24 99.172 -7.915 -20.993 1.00 0.00 O ATOM 331 CB ALA A 24 96.746 -6.212 -19.522 1.00 0.00 C ATOM 0 H ALA A 24 97.156 -4.120 -20.750 1.00 0.00 H new ATOM 0 HA ALA A 24 98.874 -5.920 -19.450 1.00 0.00 H new ATOM 0 HB1 ALA A 24 96.785 -7.191 -19.045 1.00 0.00 H new ATOM 0 HB2 ALA A 24 96.547 -5.449 -18.769 1.00 0.00 H new ATOM 0 HB3 ALA A 24 95.950 -6.203 -20.267 1.00 0.00 H new ATOM 337 N LEU A 25 97.751 -6.885 -22.398 1.00 0.00 N ATOM 338 CA LEU A 25 97.961 -7.849 -23.470 1.00 0.00 C ATOM 339 C LEU A 25 99.385 -7.728 -24.003 1.00 0.00 C ATOM 340 O LEU A 25 100.000 -8.718 -24.397 1.00 0.00 O ATOM 341 CB LEU A 25 96.952 -7.600 -24.598 1.00 0.00 C ATOM 342 CG LEU A 25 97.246 -8.510 -25.802 1.00 0.00 C ATOM 343 CD1 LEU A 25 97.283 -9.979 -25.357 1.00 0.00 C ATOM 344 CD2 LEU A 25 96.143 -8.321 -26.848 1.00 0.00 C ATOM 0 H LEU A 25 97.093 -6.138 -22.621 1.00 0.00 H new ATOM 0 HA LEU A 25 97.814 -8.856 -23.081 1.00 0.00 H new ATOM 0 HB2 LEU A 25 95.941 -7.784 -24.235 1.00 0.00 H new ATOM 0 HB3 LEU A 25 96.995 -6.555 -24.907 1.00 0.00 H new ATOM 0 HG LEU A 25 98.214 -8.246 -26.228 1.00 0.00 H new ATOM 0 HD11 LEU A 25 97.492 -10.615 -26.217 1.00 0.00 H new ATOM 0 HD12 LEU A 25 98.064 -10.113 -24.609 1.00 0.00 H new ATOM 0 HD13 LEU A 25 96.319 -10.254 -24.928 1.00 0.00 H new ATOM 0 HD21 LEU A 25 96.342 -8.962 -27.707 1.00 0.00 H new ATOM 0 HD22 LEU A 25 95.179 -8.586 -26.413 1.00 0.00 H new ATOM 0 HD23 LEU A 25 96.121 -7.280 -27.170 1.00 0.00 H new ATOM 356 N ALA A 26 99.902 -6.502 -24.013 1.00 0.00 N ATOM 357 CA ALA A 26 101.254 -6.258 -24.501 1.00 0.00 C ATOM 358 C ALA A 26 102.272 -7.062 -23.698 1.00 0.00 C ATOM 359 O ALA A 26 103.101 -7.770 -24.269 1.00 0.00 O ATOM 360 CB ALA A 26 101.584 -4.768 -24.397 1.00 0.00 C ATOM 0 H ALA A 26 99.409 -5.669 -23.691 1.00 0.00 H new ATOM 0 HA ALA A 26 101.304 -6.572 -25.544 1.00 0.00 H new ATOM 0 HB1 ALA A 26 102.596 -4.593 -24.763 1.00 0.00 H new ATOM 0 HB2 ALA A 26 100.877 -4.196 -24.997 1.00 0.00 H new ATOM 0 HB3 ALA A 26 101.515 -4.452 -23.356 1.00 0.00 H new ATOM 366 N VAL A 27 102.207 -6.949 -22.374 1.00 0.00 N ATOM 367 CA VAL A 27 103.139 -7.678 -21.519 1.00 0.00 C ATOM 368 C VAL A 27 102.894 -9.181 -21.618 1.00 0.00 C ATOM 369 O VAL A 27 103.835 -9.974 -21.588 1.00 0.00 O ATOM 370 CB VAL A 27 103.000 -7.228 -20.063 1.00 0.00 C ATOM 371 CG1 VAL A 27 103.535 -5.804 -19.914 1.00 0.00 C ATOM 372 CG2 VAL A 27 101.528 -7.263 -19.650 1.00 0.00 C ATOM 0 H VAL A 27 101.531 -6.370 -21.876 1.00 0.00 H new ATOM 0 HA VAL A 27 104.151 -7.460 -21.861 1.00 0.00 H new ATOM 0 HB VAL A 27 103.571 -7.901 -19.424 1.00 0.00 H new ATOM 0 HG11 VAL A 27 103.435 -5.485 -18.877 1.00 0.00 H new ATOM 0 HG12 VAL A 27 104.586 -5.778 -20.202 1.00 0.00 H new ATOM 0 HG13 VAL A 27 102.966 -5.132 -20.557 1.00 0.00 H new ATOM 0 HG21 VAL A 27 101.433 -6.942 -18.613 1.00 0.00 H new ATOM 0 HG22 VAL A 27 100.954 -6.593 -20.291 1.00 0.00 H new ATOM 0 HG23 VAL A 27 101.146 -8.279 -19.752 1.00 0.00 H new ATOM 382 N TYR A 28 101.628 -9.569 -21.739 1.00 0.00 N ATOM 383 CA TYR A 28 101.285 -10.983 -21.843 1.00 0.00 C ATOM 384 C TYR A 28 101.961 -11.611 -23.059 1.00 0.00 C ATOM 385 O TYR A 28 102.467 -12.730 -22.992 1.00 0.00 O ATOM 386 CB TYR A 28 99.770 -11.153 -21.957 1.00 0.00 C ATOM 387 CG TYR A 28 99.434 -12.624 -22.016 1.00 0.00 C ATOM 388 CD1 TYR A 28 99.232 -13.344 -20.831 1.00 0.00 C ATOM 389 CD2 TYR A 28 99.327 -13.270 -23.253 1.00 0.00 C ATOM 390 CE1 TYR A 28 98.924 -14.709 -20.885 1.00 0.00 C ATOM 391 CE2 TYR A 28 99.018 -14.635 -23.306 1.00 0.00 C ATOM 392 CZ TYR A 28 98.817 -15.354 -22.122 1.00 0.00 C ATOM 393 OH TYR A 28 98.514 -16.700 -22.175 1.00 0.00 O ATOM 0 H TYR A 28 100.831 -8.933 -21.767 1.00 0.00 H new ATOM 0 HA TYR A 28 101.637 -11.486 -20.942 1.00 0.00 H new ATOM 0 HB2 TYR A 28 99.276 -10.690 -21.103 1.00 0.00 H new ATOM 0 HB3 TYR A 28 99.402 -10.648 -22.851 1.00 0.00 H new ATOM 0 HD1 TYR A 28 99.314 -12.846 -19.876 1.00 0.00 H new ATOM 0 HD2 TYR A 28 99.483 -12.716 -24.167 1.00 0.00 H new ATOM 0 HE1 TYR A 28 98.769 -15.264 -19.972 1.00 0.00 H new ATOM 0 HE2 TYR A 28 98.935 -15.133 -24.261 1.00 0.00 H new ATOM 0 HH TYR A 28 98.477 -16.990 -23.110 1.00 0.00 H new ATOM 403 N PHE A 29 101.963 -10.881 -24.172 1.00 0.00 N ATOM 404 CA PHE A 29 102.578 -11.378 -25.399 1.00 0.00 C ATOM 405 C PHE A 29 104.059 -11.672 -25.178 1.00 0.00 C ATOM 406 O PHE A 29 104.557 -12.727 -25.571 1.00 0.00 O ATOM 407 CB PHE A 29 102.423 -10.344 -26.516 1.00 0.00 C ATOM 408 CG PHE A 29 102.975 -10.906 -27.805 1.00 0.00 C ATOM 409 CD1 PHE A 29 104.332 -10.747 -28.114 1.00 0.00 C ATOM 410 CD2 PHE A 29 102.130 -11.581 -28.692 1.00 0.00 C ATOM 411 CE1 PHE A 29 104.843 -11.266 -29.309 1.00 0.00 C ATOM 412 CE2 PHE A 29 102.641 -12.101 -29.889 1.00 0.00 C ATOM 413 CZ PHE A 29 103.998 -11.942 -30.197 1.00 0.00 C ATOM 0 H PHE A 29 101.550 -9.952 -24.249 1.00 0.00 H new ATOM 0 HA PHE A 29 102.076 -12.302 -25.685 1.00 0.00 H new ATOM 0 HB2 PHE A 29 101.372 -10.084 -26.641 1.00 0.00 H new ATOM 0 HB3 PHE A 29 102.949 -9.427 -26.252 1.00 0.00 H new ATOM 0 HD1 PHE A 29 104.984 -10.224 -27.430 1.00 0.00 H new ATOM 0 HD2 PHE A 29 101.083 -11.702 -28.454 1.00 0.00 H new ATOM 0 HE1 PHE A 29 105.890 -11.145 -29.546 1.00 0.00 H new ATOM 0 HE2 PHE A 29 101.989 -12.624 -30.573 1.00 0.00 H new ATOM 0 HZ PHE A 29 104.393 -12.341 -31.120 1.00 0.00 H new ATOM 423 N LEU A 30 104.756 -10.732 -24.548 1.00 0.00 N ATOM 424 CA LEU A 30 106.181 -10.900 -24.282 1.00 0.00 C ATOM 425 C LEU A 30 106.419 -12.081 -23.345 1.00 0.00 C ATOM 426 O LEU A 30 107.308 -12.900 -23.576 1.00 0.00 O ATOM 427 CB LEU A 30 106.748 -9.623 -23.649 1.00 0.00 C ATOM 428 CG LEU A 30 108.290 -9.635 -23.712 1.00 0.00 C ATOM 429 CD1 LEU A 30 108.772 -9.090 -25.063 1.00 0.00 C ATOM 430 CD2 LEU A 30 108.860 -8.755 -22.592 1.00 0.00 C ATOM 0 H LEU A 30 104.362 -9.853 -24.214 1.00 0.00 H new ATOM 0 HA LEU A 30 106.686 -11.095 -25.228 1.00 0.00 H new ATOM 0 HB2 LEU A 30 106.362 -8.748 -24.171 1.00 0.00 H new ATOM 0 HB3 LEU A 30 106.420 -9.546 -22.612 1.00 0.00 H new ATOM 0 HG LEU A 30 108.634 -10.662 -23.592 1.00 0.00 H new ATOM 0 HD11 LEU A 30 109.861 -9.104 -25.093 1.00 0.00 H new ATOM 0 HD12 LEU A 30 108.378 -9.711 -25.867 1.00 0.00 H new ATOM 0 HD13 LEU A 30 108.419 -8.067 -25.189 1.00 0.00 H new ATOM 0 HD21 LEU A 30 109.949 -8.766 -22.639 1.00 0.00 H new ATOM 0 HD22 LEU A 30 108.502 -7.733 -22.714 1.00 0.00 H new ATOM 0 HD23 LEU A 30 108.535 -9.140 -21.626 1.00 0.00 H new ATOM 442 N GLY A 31 105.621 -12.159 -22.285 1.00 0.00 N ATOM 443 CA GLY A 31 105.756 -13.242 -21.317 1.00 0.00 C ATOM 444 C GLY A 31 105.474 -14.593 -21.962 1.00 0.00 C ATOM 445 O GLY A 31 104.683 -14.692 -22.900 1.00 0.00 O ATOM 0 H GLY A 31 104.879 -11.491 -22.075 1.00 0.00 H new ATOM 0 HA2 GLY A 31 106.763 -13.238 -20.900 1.00 0.00 H new ATOM 0 HA3 GLY A 31 105.067 -13.081 -20.488 1.00 0.00 H new ATOM 449 N ARG A 32 106.125 -15.634 -21.452 1.00 0.00 N ATOM 450 CA ARG A 32 105.938 -16.979 -21.984 1.00 0.00 C ATOM 451 C ARG A 32 106.362 -18.024 -20.956 1.00 0.00 C ATOM 452 O ARG A 32 107.366 -18.712 -21.135 1.00 0.00 O ATOM 453 CB ARG A 32 106.761 -17.154 -23.261 1.00 0.00 C ATOM 454 CG ARG A 32 106.313 -18.424 -23.988 1.00 0.00 C ATOM 455 CD ARG A 32 107.176 -18.631 -25.234 1.00 0.00 C ATOM 456 NE ARG A 32 106.923 -17.572 -26.204 1.00 0.00 N ATOM 457 CZ ARG A 32 107.718 -17.398 -27.256 1.00 0.00 C ATOM 458 NH1 ARG A 32 108.745 -18.183 -27.434 1.00 0.00 N ATOM 459 NH2 ARG A 32 107.469 -16.444 -28.111 1.00 0.00 N ATOM 0 H ARG A 32 106.783 -15.573 -20.675 1.00 0.00 H new ATOM 0 HA ARG A 32 104.881 -17.117 -22.212 1.00 0.00 H new ATOM 0 HB2 ARG A 32 106.634 -16.287 -23.910 1.00 0.00 H new ATOM 0 HB3 ARG A 32 107.821 -17.217 -23.017 1.00 0.00 H new ATOM 0 HG2 ARG A 32 106.400 -19.285 -23.325 1.00 0.00 H new ATOM 0 HG3 ARG A 32 105.263 -18.343 -24.269 1.00 0.00 H new ATOM 0 HD2 ARG A 32 108.230 -18.637 -24.958 1.00 0.00 H new ATOM 0 HD3 ARG A 32 106.958 -19.602 -25.679 1.00 0.00 H new ATOM 0 HE ARG A 32 106.122 -16.954 -26.073 1.00 0.00 H new ATOM 0 HH11 ARG A 32 108.938 -18.930 -26.767 1.00 0.00 H new ATOM 0 HH12 ARG A 32 109.355 -18.050 -28.241 1.00 0.00 H new ATOM 0 HH21 ARG A 32 106.665 -15.832 -27.972 1.00 0.00 H new ATOM 0 HH22 ARG A 32 108.079 -16.310 -28.918 1.00 0.00 H new ATOM 473 N LEU A 33 105.590 -18.134 -19.879 1.00 0.00 N ATOM 474 CA LEU A 33 105.897 -19.098 -18.828 1.00 0.00 C ATOM 475 C LEU A 33 107.351 -18.952 -18.383 1.00 0.00 C ATOM 476 O LEU A 33 108.212 -19.740 -18.775 1.00 0.00 O ATOM 477 CB LEU A 33 105.653 -20.524 -19.339 1.00 0.00 C ATOM 478 CG LEU A 33 104.151 -20.828 -19.341 1.00 0.00 C ATOM 479 CD1 LEU A 33 103.417 -19.808 -20.218 1.00 0.00 C ATOM 480 CD2 LEU A 33 103.922 -22.237 -19.893 1.00 0.00 C ATOM 0 H LEU A 33 104.755 -17.573 -19.712 1.00 0.00 H new ATOM 0 HA LEU A 33 105.246 -18.905 -17.976 1.00 0.00 H new ATOM 0 HB2 LEU A 33 106.056 -20.633 -20.346 1.00 0.00 H new ATOM 0 HB3 LEU A 33 106.177 -21.241 -18.707 1.00 0.00 H new ATOM 0 HG LEU A 33 103.767 -20.766 -18.323 1.00 0.00 H new ATOM 0 HD11 LEU A 33 102.349 -20.028 -20.216 1.00 0.00 H new ATOM 0 HD12 LEU A 33 103.581 -18.805 -19.824 1.00 0.00 H new ATOM 0 HD13 LEU A 33 103.798 -19.864 -21.238 1.00 0.00 H new ATOM 0 HD21 LEU A 33 102.855 -22.457 -19.896 1.00 0.00 H new ATOM 0 HD22 LEU A 33 104.308 -22.296 -20.911 1.00 0.00 H new ATOM 0 HD23 LEU A 33 104.440 -22.962 -19.266 1.00 0.00 H new ATOM 492 N GLY A 34 107.616 -17.939 -17.563 1.00 0.00 N ATOM 493 CA GLY A 34 108.969 -17.701 -17.073 1.00 0.00 C ATOM 494 C GLY A 34 108.978 -16.638 -15.980 1.00 0.00 C ATOM 495 O GLY A 34 109.531 -16.850 -14.900 1.00 0.00 O ATOM 0 H GLY A 34 106.918 -17.275 -17.227 1.00 0.00 H new ATOM 0 HA2 GLY A 34 109.387 -18.630 -16.685 1.00 0.00 H new ATOM 0 HA3 GLY A 34 109.607 -17.384 -17.898 1.00 0.00 H new ATOM 499 N THR A 35 108.365 -15.495 -16.265 1.00 0.00 N ATOM 500 CA THR A 35 108.312 -14.404 -15.298 1.00 0.00 C ATOM 501 C THR A 35 107.620 -14.854 -14.013 1.00 0.00 C ATOM 502 O THR A 35 106.550 -15.461 -14.053 1.00 0.00 O ATOM 503 CB THR A 35 107.559 -13.212 -15.894 1.00 0.00 C ATOM 504 OG1 THR A 35 107.442 -12.190 -14.915 1.00 0.00 O ATOM 505 CG2 THR A 35 106.165 -13.657 -16.340 1.00 0.00 C ATOM 0 H THR A 35 107.900 -15.300 -17.152 1.00 0.00 H new ATOM 0 HA THR A 35 109.334 -14.107 -15.061 1.00 0.00 H new ATOM 0 HB THR A 35 108.108 -12.829 -16.755 1.00 0.00 H new ATOM 0 HG1 THR A 35 106.715 -11.582 -15.163 1.00 0.00 H new ATOM 0 HG21 THR A 35 105.630 -12.807 -16.764 1.00 0.00 H new ATOM 0 HG22 THR A 35 106.257 -14.440 -17.092 1.00 0.00 H new ATOM 0 HG23 THR A 35 105.614 -14.041 -15.482 1.00 0.00 H new ATOM 513 N ALA A 36 108.242 -14.550 -12.876 1.00 0.00 N ATOM 514 CA ALA A 36 107.683 -14.924 -11.578 1.00 0.00 C ATOM 515 C ALA A 36 106.701 -13.863 -11.091 1.00 0.00 C ATOM 516 O ALA A 36 106.461 -12.866 -11.771 1.00 0.00 O ATOM 517 CB ALA A 36 108.809 -15.086 -10.556 1.00 0.00 C ATOM 0 H ALA A 36 109.129 -14.048 -12.826 1.00 0.00 H new ATOM 0 HA ALA A 36 107.152 -15.869 -11.689 1.00 0.00 H new ATOM 0 HB1 ALA A 36 108.387 -15.365 -9.591 1.00 0.00 H new ATOM 0 HB2 ALA A 36 109.495 -15.864 -10.890 1.00 0.00 H new ATOM 0 HB3 ALA A 36 109.349 -14.144 -10.458 1.00 0.00 H new ATOM 523 N GLU A 37 106.135 -14.086 -9.907 1.00 0.00 N ATOM 524 CA GLU A 37 105.180 -13.142 -9.336 1.00 0.00 C ATOM 525 C GLU A 37 104.064 -12.841 -10.330 1.00 0.00 C ATOM 526 O GLU A 37 103.532 -11.731 -10.364 1.00 0.00 O ATOM 527 CB GLU A 37 105.890 -11.841 -8.961 1.00 0.00 C ATOM 528 CG GLU A 37 106.926 -12.117 -7.868 1.00 0.00 C ATOM 529 CD GLU A 37 106.222 -12.450 -6.557 1.00 0.00 C ATOM 530 OE1 GLU A 37 105.379 -11.671 -6.145 1.00 0.00 O ATOM 531 OE2 GLU A 37 106.538 -13.480 -5.983 1.00 0.00 O ATOM 0 H GLU A 37 106.320 -14.906 -9.329 1.00 0.00 H new ATOM 0 HA GLU A 37 104.747 -13.592 -8.442 1.00 0.00 H new ATOM 0 HB2 GLU A 37 106.377 -11.415 -9.838 1.00 0.00 H new ATOM 0 HB3 GLU A 37 105.164 -11.107 -8.611 1.00 0.00 H new ATOM 0 HG2 GLU A 37 107.570 -12.945 -8.166 1.00 0.00 H new ATOM 0 HG3 GLU A 37 107.568 -11.246 -7.735 1.00 0.00 H new ATOM 538 N VAL A 38 103.713 -13.835 -11.136 1.00 0.00 N ATOM 539 CA VAL A 38 102.658 -13.669 -12.128 1.00 0.00 C ATOM 540 C VAL A 38 101.416 -13.054 -11.488 1.00 0.00 C ATOM 541 O VAL A 38 100.620 -12.397 -12.159 1.00 0.00 O ATOM 542 CB VAL A 38 102.302 -15.023 -12.741 1.00 0.00 C ATOM 543 CG1 VAL A 38 103.439 -15.482 -13.657 1.00 0.00 C ATOM 544 CG2 VAL A 38 102.103 -16.050 -11.625 1.00 0.00 C ATOM 0 H VAL A 38 104.141 -14.761 -11.123 1.00 0.00 H new ATOM 0 HA VAL A 38 103.019 -13.001 -12.910 1.00 0.00 H new ATOM 0 HB VAL A 38 101.383 -14.930 -13.319 1.00 0.00 H new ATOM 0 HG11 VAL A 38 103.186 -16.448 -14.095 1.00 0.00 H new ATOM 0 HG12 VAL A 38 103.584 -14.750 -14.452 1.00 0.00 H new ATOM 0 HG13 VAL A 38 104.358 -15.576 -13.078 1.00 0.00 H new ATOM 0 HG21 VAL A 38 101.849 -17.016 -12.061 1.00 0.00 H new ATOM 0 HG22 VAL A 38 103.023 -16.143 -11.048 1.00 0.00 H new ATOM 0 HG23 VAL A 38 101.295 -15.724 -10.970 1.00 0.00 H new ATOM 554 N LEU A 39 101.257 -13.278 -10.189 1.00 0.00 N ATOM 555 CA LEU A 39 100.107 -12.749 -9.464 1.00 0.00 C ATOM 556 C LEU A 39 99.905 -11.268 -9.778 1.00 0.00 C ATOM 557 O LEU A 39 98.785 -10.766 -9.724 1.00 0.00 O ATOM 558 CB LEU A 39 100.314 -12.935 -7.956 1.00 0.00 C ATOM 559 CG LEU A 39 99.056 -12.506 -7.181 1.00 0.00 C ATOM 560 CD1 LEU A 39 97.881 -13.452 -7.496 1.00 0.00 C ATOM 561 CD2 LEU A 39 99.363 -12.547 -5.680 1.00 0.00 C ATOM 0 H LEU A 39 101.906 -13.819 -9.618 1.00 0.00 H new ATOM 0 HA LEU A 39 99.218 -13.295 -9.780 1.00 0.00 H new ATOM 0 HB2 LEU A 39 100.542 -13.979 -7.741 1.00 0.00 H new ATOM 0 HB3 LEU A 39 101.170 -12.347 -7.625 1.00 0.00 H new ATOM 0 HG LEU A 39 98.775 -11.496 -7.479 1.00 0.00 H new ATOM 0 HD11 LEU A 39 96.999 -13.134 -6.940 1.00 0.00 H new ATOM 0 HD12 LEU A 39 97.666 -13.422 -8.564 1.00 0.00 H new ATOM 0 HD13 LEU A 39 98.145 -14.469 -7.207 1.00 0.00 H new ATOM 0 HD21 LEU A 39 98.478 -12.245 -5.119 1.00 0.00 H new ATOM 0 HD22 LEU A 39 99.645 -13.560 -5.394 1.00 0.00 H new ATOM 0 HD23 LEU A 39 100.184 -11.865 -5.458 1.00 0.00 H new ATOM 573 N GLY A 40 100.992 -10.573 -10.100 1.00 0.00 N ATOM 574 CA GLY A 40 100.909 -9.148 -10.411 1.00 0.00 C ATOM 575 C GLY A 40 99.963 -8.897 -11.583 1.00 0.00 C ATOM 576 O GLY A 40 99.051 -8.072 -11.495 1.00 0.00 O ATOM 0 H GLY A 40 101.931 -10.967 -10.152 1.00 0.00 H new ATOM 0 HA2 GLY A 40 100.561 -8.601 -9.535 1.00 0.00 H new ATOM 0 HA3 GLY A 40 101.901 -8.766 -10.652 1.00 0.00 H new ATOM 580 N ILE A 41 100.182 -9.615 -12.679 1.00 0.00 N ATOM 581 CA ILE A 41 99.339 -9.460 -13.859 1.00 0.00 C ATOM 582 C ILE A 41 97.866 -9.613 -13.474 1.00 0.00 C ATOM 583 O ILE A 41 97.028 -8.777 -13.821 1.00 0.00 O ATOM 584 CB ILE A 41 99.727 -10.509 -14.916 1.00 0.00 C ATOM 585 CG1 ILE A 41 101.071 -10.128 -15.552 1.00 0.00 C ATOM 586 CG2 ILE A 41 98.656 -10.572 -16.013 1.00 0.00 C ATOM 587 CD1 ILE A 41 102.194 -10.205 -14.511 1.00 0.00 C ATOM 0 H ILE A 41 100.928 -10.304 -12.775 1.00 0.00 H new ATOM 0 HA ILE A 41 99.488 -8.465 -14.278 1.00 0.00 H new ATOM 0 HB ILE A 41 99.809 -11.482 -14.432 1.00 0.00 H new ATOM 0 HG12 ILE A 41 101.290 -10.798 -16.383 1.00 0.00 H new ATOM 0 HG13 ILE A 41 101.014 -9.119 -15.962 1.00 0.00 H new ATOM 0 HG21 ILE A 41 98.940 -11.317 -16.756 1.00 0.00 H new ATOM 0 HG22 ILE A 41 97.698 -10.847 -15.571 1.00 0.00 H new ATOM 0 HG23 ILE A 41 98.568 -9.597 -16.492 1.00 0.00 H new ATOM 0 HD11 ILE A 41 103.141 -9.932 -14.977 1.00 0.00 H new ATOM 0 HD12 ILE A 41 101.980 -9.517 -13.693 1.00 0.00 H new ATOM 0 HD13 ILE A 41 102.260 -11.221 -14.122 1.00 0.00 H new ATOM 599 N ILE A 42 97.558 -10.681 -12.753 1.00 0.00 N ATOM 600 CA ILE A 42 96.187 -10.928 -12.328 1.00 0.00 C ATOM 601 C ILE A 42 95.697 -9.812 -11.408 1.00 0.00 C ATOM 602 O ILE A 42 94.503 -9.539 -11.332 1.00 0.00 O ATOM 603 CB ILE A 42 96.101 -12.273 -11.600 1.00 0.00 C ATOM 604 CG1 ILE A 42 96.444 -13.402 -12.577 1.00 0.00 C ATOM 605 CG2 ILE A 42 94.683 -12.476 -11.064 1.00 0.00 C ATOM 606 CD1 ILE A 42 96.616 -14.713 -11.806 1.00 0.00 C ATOM 0 H ILE A 42 98.232 -11.385 -12.452 1.00 0.00 H new ATOM 0 HA ILE A 42 95.551 -10.953 -13.213 1.00 0.00 H new ATOM 0 HB ILE A 42 96.806 -12.282 -10.769 1.00 0.00 H new ATOM 0 HG12 ILE A 42 95.653 -13.506 -13.320 1.00 0.00 H new ATOM 0 HG13 ILE A 42 97.360 -13.163 -13.117 1.00 0.00 H new ATOM 0 HG21 ILE A 42 94.623 -13.433 -10.546 1.00 0.00 H new ATOM 0 HG22 ILE A 42 94.438 -11.672 -10.370 1.00 0.00 H new ATOM 0 HG23 ILE A 42 93.976 -12.467 -11.893 1.00 0.00 H new ATOM 0 HD11 ILE A 42 96.860 -15.515 -12.502 1.00 0.00 H new ATOM 0 HD12 ILE A 42 97.422 -14.605 -11.080 1.00 0.00 H new ATOM 0 HD13 ILE A 42 95.689 -14.954 -11.286 1.00 0.00 H new ATOM 618 N SER A 43 96.627 -9.177 -10.704 1.00 0.00 N ATOM 619 CA SER A 43 96.274 -8.102 -9.783 1.00 0.00 C ATOM 620 C SER A 43 95.739 -6.881 -10.529 1.00 0.00 C ATOM 621 O SER A 43 94.732 -6.296 -10.130 1.00 0.00 O ATOM 622 CB SER A 43 97.498 -7.699 -8.958 1.00 0.00 C ATOM 623 OG SER A 43 97.072 -6.981 -7.808 1.00 0.00 O ATOM 0 H SER A 43 97.624 -9.385 -10.752 1.00 0.00 H new ATOM 0 HA SER A 43 95.489 -8.472 -9.124 1.00 0.00 H new ATOM 0 HB2 SER A 43 98.059 -8.585 -8.661 1.00 0.00 H new ATOM 0 HB3 SER A 43 98.169 -7.084 -9.558 1.00 0.00 H new ATOM 0 HG SER A 43 97.853 -6.722 -7.276 1.00 0.00 H new ATOM 629 N ILE A 44 96.419 -6.492 -11.604 1.00 0.00 N ATOM 630 CA ILE A 44 95.992 -5.326 -12.376 1.00 0.00 C ATOM 631 C ILE A 44 94.718 -5.624 -13.165 1.00 0.00 C ATOM 632 O ILE A 44 93.870 -4.751 -13.346 1.00 0.00 O ATOM 633 CB ILE A 44 97.106 -4.874 -13.326 1.00 0.00 C ATOM 634 CG1 ILE A 44 97.610 -6.069 -14.136 1.00 0.00 C ATOM 635 CG2 ILE A 44 98.261 -4.289 -12.510 1.00 0.00 C ATOM 636 CD1 ILE A 44 98.546 -5.585 -15.248 1.00 0.00 C ATOM 0 H ILE A 44 97.255 -6.957 -11.957 1.00 0.00 H new ATOM 0 HA ILE A 44 95.778 -4.521 -11.673 1.00 0.00 H new ATOM 0 HB ILE A 44 96.716 -4.117 -14.006 1.00 0.00 H new ATOM 0 HG12 ILE A 44 98.136 -6.766 -13.484 1.00 0.00 H new ATOM 0 HG13 ILE A 44 96.767 -6.609 -14.567 1.00 0.00 H new ATOM 0 HG21 ILE A 44 99.055 -3.966 -13.183 1.00 0.00 H new ATOM 0 HG22 ILE A 44 97.904 -3.435 -11.935 1.00 0.00 H new ATOM 0 HG23 ILE A 44 98.648 -5.048 -11.830 1.00 0.00 H new ATOM 0 HD11 ILE A 44 98.902 -6.441 -15.822 1.00 0.00 H new ATOM 0 HD12 ILE A 44 98.007 -4.905 -15.907 1.00 0.00 H new ATOM 0 HD13 ILE A 44 99.396 -5.065 -14.807 1.00 0.00 H new ATOM 648 N VAL A 45 94.578 -6.855 -13.638 1.00 0.00 N ATOM 649 CA VAL A 45 93.389 -7.220 -14.399 1.00 0.00 C ATOM 650 C VAL A 45 92.153 -7.228 -13.495 1.00 0.00 C ATOM 651 O VAL A 45 91.097 -6.693 -13.854 1.00 0.00 O ATOM 652 CB VAL A 45 93.580 -8.602 -15.035 1.00 0.00 C ATOM 653 CG1 VAL A 45 92.270 -9.063 -15.678 1.00 0.00 C ATOM 654 CG2 VAL A 45 94.667 -8.521 -16.110 1.00 0.00 C ATOM 0 H VAL A 45 95.258 -7.605 -13.512 1.00 0.00 H new ATOM 0 HA VAL A 45 93.239 -6.480 -15.185 1.00 0.00 H new ATOM 0 HB VAL A 45 93.875 -9.314 -14.264 1.00 0.00 H new ATOM 0 HG11 VAL A 45 92.412 -10.045 -16.128 1.00 0.00 H new ATOM 0 HG12 VAL A 45 91.492 -9.121 -14.917 1.00 0.00 H new ATOM 0 HG13 VAL A 45 91.972 -8.351 -16.447 1.00 0.00 H new ATOM 0 HG21 VAL A 45 94.804 -9.503 -16.563 1.00 0.00 H new ATOM 0 HG22 VAL A 45 94.368 -7.806 -16.876 1.00 0.00 H new ATOM 0 HG23 VAL A 45 95.604 -8.197 -15.657 1.00 0.00 H new ATOM 664 N LEU A 46 92.292 -7.847 -12.327 1.00 0.00 N ATOM 665 CA LEU A 46 91.181 -7.939 -11.381 1.00 0.00 C ATOM 666 C LEU A 46 90.849 -6.576 -10.765 1.00 0.00 C ATOM 667 O LEU A 46 89.676 -6.269 -10.544 1.00 0.00 O ATOM 668 CB LEU A 46 91.525 -8.955 -10.268 1.00 0.00 C ATOM 669 CG LEU A 46 91.095 -10.388 -10.661 1.00 0.00 C ATOM 670 CD1 LEU A 46 89.567 -10.549 -10.552 1.00 0.00 C ATOM 671 CD2 LEU A 46 91.548 -10.708 -12.098 1.00 0.00 C ATOM 0 H LEU A 46 93.155 -8.290 -12.013 1.00 0.00 H new ATOM 0 HA LEU A 46 90.301 -8.278 -11.927 1.00 0.00 H new ATOM 0 HB2 LEU A 46 92.597 -8.935 -10.074 1.00 0.00 H new ATOM 0 HB3 LEU A 46 91.028 -8.665 -9.342 1.00 0.00 H new ATOM 0 HG LEU A 46 91.571 -11.085 -9.971 1.00 0.00 H new ATOM 0 HD11 LEU A 46 89.287 -11.564 -10.833 1.00 0.00 H new ATOM 0 HD12 LEU A 46 89.253 -10.357 -9.526 1.00 0.00 H new ATOM 0 HD13 LEU A 46 89.078 -9.840 -11.220 1.00 0.00 H new ATOM 0 HD21 LEU A 46 91.238 -11.720 -12.360 1.00 0.00 H new ATOM 0 HD22 LEU A 46 91.093 -9.999 -12.789 1.00 0.00 H new ATOM 0 HD23 LEU A 46 92.633 -10.633 -12.163 1.00 0.00 H new ATOM 683 N VAL A 47 91.861 -5.760 -10.480 1.00 0.00 N ATOM 684 CA VAL A 47 91.596 -4.459 -9.884 1.00 0.00 C ATOM 685 C VAL A 47 90.933 -3.547 -10.910 1.00 0.00 C ATOM 686 O VAL A 47 90.126 -2.690 -10.560 1.00 0.00 O ATOM 687 CB VAL A 47 92.902 -3.835 -9.336 1.00 0.00 C ATOM 688 CG1 VAL A 47 93.659 -3.091 -10.443 1.00 0.00 C ATOM 689 CG2 VAL A 47 92.572 -2.850 -8.206 1.00 0.00 C ATOM 0 H VAL A 47 92.845 -5.970 -10.647 1.00 0.00 H new ATOM 0 HA VAL A 47 90.914 -4.583 -9.043 1.00 0.00 H new ATOM 0 HB VAL A 47 93.531 -4.641 -8.958 1.00 0.00 H new ATOM 0 HG11 VAL A 47 94.573 -2.661 -10.033 1.00 0.00 H new ATOM 0 HG12 VAL A 47 93.912 -3.788 -11.242 1.00 0.00 H new ATOM 0 HG13 VAL A 47 93.031 -2.295 -10.841 1.00 0.00 H new ATOM 0 HG21 VAL A 47 93.494 -2.413 -7.823 1.00 0.00 H new ATOM 0 HG22 VAL A 47 91.928 -2.059 -8.590 1.00 0.00 H new ATOM 0 HG23 VAL A 47 92.059 -3.378 -7.402 1.00 0.00 H new ATOM 699 N ALA A 48 91.277 -3.743 -12.179 1.00 0.00 N ATOM 700 CA ALA A 48 90.703 -2.931 -13.243 1.00 0.00 C ATOM 701 C ALA A 48 89.218 -3.215 -13.418 1.00 0.00 C ATOM 702 O ALA A 48 88.404 -2.292 -13.442 1.00 0.00 O ATOM 703 CB ALA A 48 91.435 -3.199 -14.557 1.00 0.00 C ATOM 0 H ALA A 48 91.943 -4.449 -12.492 1.00 0.00 H new ATOM 0 HA ALA A 48 90.820 -1.884 -12.965 1.00 0.00 H new ATOM 0 HB1 ALA A 48 90.999 -2.588 -15.347 1.00 0.00 H new ATOM 0 HB2 ALA A 48 92.490 -2.948 -14.444 1.00 0.00 H new ATOM 0 HB3 ALA A 48 91.339 -4.253 -14.819 1.00 0.00 H new ATOM 709 N THR A 49 88.862 -4.487 -13.550 1.00 0.00 N ATOM 710 CA THR A 49 87.459 -4.845 -13.730 1.00 0.00 C ATOM 711 C THR A 49 86.629 -4.431 -12.515 1.00 0.00 C ATOM 712 O THR A 49 85.525 -3.898 -12.658 1.00 0.00 O ATOM 713 CB THR A 49 87.328 -6.354 -13.959 1.00 0.00 C ATOM 714 OG1 THR A 49 88.123 -7.046 -13.007 1.00 0.00 O ATOM 715 CG2 THR A 49 87.801 -6.700 -15.374 1.00 0.00 C ATOM 0 H THR A 49 89.510 -5.275 -13.537 1.00 0.00 H new ATOM 0 HA THR A 49 87.081 -4.313 -14.603 1.00 0.00 H new ATOM 0 HB THR A 49 86.285 -6.651 -13.845 1.00 0.00 H new ATOM 0 HG1 THR A 49 88.039 -8.012 -13.151 1.00 0.00 H new ATOM 0 HG21 THR A 49 87.708 -7.774 -15.536 1.00 0.00 H new ATOM 0 HG22 THR A 49 87.189 -6.168 -16.102 1.00 0.00 H new ATOM 0 HG23 THR A 49 88.844 -6.405 -15.492 1.00 0.00 H new ATOM 723 N VAL A 50 87.160 -4.681 -11.322 1.00 0.00 N ATOM 724 CA VAL A 50 86.447 -4.336 -10.095 1.00 0.00 C ATOM 725 C VAL A 50 86.251 -2.825 -9.965 1.00 0.00 C ATOM 726 O VAL A 50 85.167 -2.369 -9.600 1.00 0.00 O ATOM 727 CB VAL A 50 87.211 -4.869 -8.879 1.00 0.00 C ATOM 728 CG1 VAL A 50 86.528 -4.397 -7.593 1.00 0.00 C ATOM 729 CG2 VAL A 50 87.215 -6.399 -8.916 1.00 0.00 C ATOM 0 H VAL A 50 88.071 -5.116 -11.178 1.00 0.00 H new ATOM 0 HA VAL A 50 85.461 -4.800 -10.139 1.00 0.00 H new ATOM 0 HB VAL A 50 88.235 -4.496 -8.903 1.00 0.00 H new ATOM 0 HG11 VAL A 50 87.074 -4.778 -6.730 1.00 0.00 H new ATOM 0 HG12 VAL A 50 86.519 -3.307 -7.565 1.00 0.00 H new ATOM 0 HG13 VAL A 50 85.504 -4.769 -7.567 1.00 0.00 H new ATOM 0 HG21 VAL A 50 87.758 -6.782 -8.052 1.00 0.00 H new ATOM 0 HG22 VAL A 50 86.189 -6.766 -8.892 1.00 0.00 H new ATOM 0 HG23 VAL A 50 87.701 -6.740 -9.830 1.00 0.00 H new ATOM 739 N LEU A 51 87.291 -2.045 -10.259 1.00 0.00 N ATOM 740 CA LEU A 51 87.182 -0.598 -10.156 1.00 0.00 C ATOM 741 C LEU A 51 86.173 -0.077 -11.173 1.00 0.00 C ATOM 742 O LEU A 51 85.231 0.625 -10.817 1.00 0.00 O ATOM 743 CB LEU A 51 88.567 0.020 -10.394 1.00 0.00 C ATOM 744 CG LEU A 51 88.679 1.436 -9.790 1.00 0.00 C ATOM 745 CD1 LEU A 51 87.584 2.349 -10.351 1.00 0.00 C ATOM 746 CD2 LEU A 51 88.576 1.380 -8.250 1.00 0.00 C ATOM 0 H LEU A 51 88.202 -2.387 -10.565 1.00 0.00 H new ATOM 0 HA LEU A 51 86.831 -0.319 -9.162 1.00 0.00 H new ATOM 0 HB2 LEU A 51 89.331 -0.623 -9.956 1.00 0.00 H new ATOM 0 HB3 LEU A 51 88.765 0.066 -11.465 1.00 0.00 H new ATOM 0 HG LEU A 51 89.652 1.844 -10.063 1.00 0.00 H new ATOM 0 HD11 LEU A 51 87.679 3.343 -9.913 1.00 0.00 H new ATOM 0 HD12 LEU A 51 87.687 2.418 -11.434 1.00 0.00 H new ATOM 0 HD13 LEU A 51 86.605 1.937 -10.105 1.00 0.00 H new ATOM 0 HD21 LEU A 51 88.657 2.388 -7.843 1.00 0.00 H new ATOM 0 HD22 LEU A 51 87.616 0.950 -7.965 1.00 0.00 H new ATOM 0 HD23 LEU A 51 89.382 0.763 -7.854 1.00 0.00 H new ATOM 758 N LYS A 52 86.365 -0.438 -12.435 1.00 0.00 N ATOM 759 CA LYS A 52 85.454 0.007 -13.483 1.00 0.00 C ATOM 760 C LYS A 52 84.004 -0.194 -13.064 1.00 0.00 C ATOM 761 O LYS A 52 83.204 0.728 -13.138 1.00 0.00 O ATOM 762 CB LYS A 52 85.727 -0.765 -14.784 1.00 0.00 C ATOM 763 CG LYS A 52 85.165 0.014 -15.991 1.00 0.00 C ATOM 764 CD LYS A 52 86.206 1.035 -16.497 1.00 0.00 C ATOM 765 CE LYS A 52 87.195 0.357 -17.458 1.00 0.00 C ATOM 766 NZ LYS A 52 86.656 0.425 -18.844 1.00 0.00 N ATOM 0 H LYS A 52 87.132 -1.029 -12.756 1.00 0.00 H new ATOM 0 HA LYS A 52 85.624 1.071 -13.650 1.00 0.00 H new ATOM 0 HB2 LYS A 52 86.799 -0.918 -14.907 1.00 0.00 H new ATOM 0 HB3 LYS A 52 85.268 -1.752 -14.733 1.00 0.00 H new ATOM 0 HG2 LYS A 52 84.905 -0.679 -16.791 1.00 0.00 H new ATOM 0 HG3 LYS A 52 84.248 0.529 -15.706 1.00 0.00 H new ATOM 0 HD2 LYS A 52 85.702 1.858 -17.004 1.00 0.00 H new ATOM 0 HD3 LYS A 52 86.745 1.464 -15.652 1.00 0.00 H new ATOM 0 HE2 LYS A 52 88.166 0.851 -17.408 1.00 0.00 H new ATOM 0 HE3 LYS A 52 87.350 -0.682 -17.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 86.674 -0.523 -19.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 85.677 0.775 -18.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 87.240 1.071 -19.412 1.00 0.00 H new ATOM 780 N THR A 53 83.664 -1.398 -12.635 1.00 0.00 N ATOM 781 CA THR A 53 82.291 -1.688 -12.230 1.00 0.00 C ATOM 782 C THR A 53 81.822 -0.788 -11.084 1.00 0.00 C ATOM 783 O THR A 53 80.707 -0.260 -11.116 1.00 0.00 O ATOM 784 CB THR A 53 82.181 -3.151 -11.797 1.00 0.00 C ATOM 785 OG1 THR A 53 83.193 -3.436 -10.840 1.00 0.00 O ATOM 786 CG2 THR A 53 82.357 -4.060 -13.014 1.00 0.00 C ATOM 0 H THR A 53 84.308 -2.185 -12.557 1.00 0.00 H new ATOM 0 HA THR A 53 81.650 -1.494 -13.090 1.00 0.00 H new ATOM 0 HB THR A 53 81.201 -3.327 -11.354 1.00 0.00 H new ATOM 0 HG1 THR A 53 83.824 -2.688 -10.799 1.00 0.00 H new ATOM 0 HG21 THR A 53 82.278 -5.102 -12.704 1.00 0.00 H new ATOM 0 HG22 THR A 53 81.581 -3.840 -13.748 1.00 0.00 H new ATOM 0 HG23 THR A 53 83.337 -3.887 -13.459 1.00 0.00 H new ATOM 794 N ILE A 54 82.655 -0.644 -10.057 1.00 0.00 N ATOM 795 CA ILE A 54 82.281 0.155 -8.890 1.00 0.00 C ATOM 796 C ILE A 54 81.978 1.612 -9.231 1.00 0.00 C ATOM 797 O ILE A 54 80.930 2.116 -8.840 1.00 0.00 O ATOM 798 CB ILE A 54 83.390 0.086 -7.829 1.00 0.00 C ATOM 799 CG1 ILE A 54 83.461 -1.334 -7.257 1.00 0.00 C ATOM 800 CG2 ILE A 54 83.094 1.070 -6.690 1.00 0.00 C ATOM 801 CD1 ILE A 54 84.769 -1.507 -6.484 1.00 0.00 C ATOM 0 H ILE A 54 83.583 -1.064 -10.007 1.00 0.00 H new ATOM 0 HA ILE A 54 81.359 -0.275 -8.499 1.00 0.00 H new ATOM 0 HB ILE A 54 84.340 0.349 -8.294 1.00 0.00 H new ATOM 0 HG12 ILE A 54 82.611 -1.516 -6.600 1.00 0.00 H new ATOM 0 HG13 ILE A 54 83.403 -2.066 -8.063 1.00 0.00 H new ATOM 0 HG21 ILE A 54 83.887 1.012 -5.944 1.00 0.00 H new ATOM 0 HG22 ILE A 54 83.044 2.083 -7.088 1.00 0.00 H new ATOM 0 HG23 ILE A 54 82.141 0.815 -6.227 1.00 0.00 H new ATOM 0 HD11 ILE A 54 84.820 -2.517 -6.077 1.00 0.00 H new ATOM 0 HD12 ILE A 54 85.612 -1.343 -7.155 1.00 0.00 H new ATOM 0 HD13 ILE A 54 84.808 -0.785 -5.669 1.00 0.00 H new ATOM 813 N VAL A 55 82.881 2.302 -9.921 1.00 0.00 N ATOM 814 CA VAL A 55 82.631 3.708 -10.244 1.00 0.00 C ATOM 815 C VAL A 55 81.610 3.844 -11.371 1.00 0.00 C ATOM 816 O VAL A 55 80.875 4.822 -11.431 1.00 0.00 O ATOM 817 CB VAL A 55 83.931 4.433 -10.626 1.00 0.00 C ATOM 818 CG1 VAL A 55 84.879 4.446 -9.426 1.00 0.00 C ATOM 819 CG2 VAL A 55 84.616 3.735 -11.807 1.00 0.00 C ATOM 0 H VAL A 55 83.767 1.928 -10.260 1.00 0.00 H new ATOM 0 HA VAL A 55 82.224 4.175 -9.347 1.00 0.00 H new ATOM 0 HB VAL A 55 83.686 5.454 -10.918 1.00 0.00 H new ATOM 0 HG11 VAL A 55 85.801 4.960 -9.696 1.00 0.00 H new ATOM 0 HG12 VAL A 55 84.405 4.965 -8.593 1.00 0.00 H new ATOM 0 HG13 VAL A 55 85.108 3.422 -9.132 1.00 0.00 H new ATOM 0 HG21 VAL A 55 85.534 4.265 -12.060 1.00 0.00 H new ATOM 0 HG22 VAL A 55 84.854 2.707 -11.534 1.00 0.00 H new ATOM 0 HG23 VAL A 55 83.947 3.736 -12.668 1.00 0.00 H new ATOM 829 N LEU A 56 81.587 2.869 -12.268 1.00 0.00 N ATOM 830 CA LEU A 56 80.678 2.902 -13.408 1.00 0.00 C ATOM 831 C LEU A 56 79.203 2.786 -13.010 1.00 0.00 C ATOM 832 O LEU A 56 78.343 3.345 -13.690 1.00 0.00 O ATOM 833 CB LEU A 56 81.047 1.779 -14.386 1.00 0.00 C ATOM 834 CG LEU A 56 80.111 1.792 -15.626 1.00 0.00 C ATOM 835 CD1 LEU A 56 80.929 1.500 -16.896 1.00 0.00 C ATOM 836 CD2 LEU A 56 79.018 0.719 -15.481 1.00 0.00 C ATOM 0 H LEU A 56 82.187 2.045 -12.230 1.00 0.00 H new ATOM 0 HA LEU A 56 80.794 3.877 -13.882 1.00 0.00 H new ATOM 0 HB2 LEU A 56 82.082 1.896 -14.706 1.00 0.00 H new ATOM 0 HB3 LEU A 56 80.976 0.815 -13.882 1.00 0.00 H new ATOM 0 HG LEU A 56 79.646 2.775 -15.699 1.00 0.00 H new ATOM 0 HD11 LEU A 56 80.270 1.510 -17.764 1.00 0.00 H new ATOM 0 HD12 LEU A 56 81.699 2.262 -17.016 1.00 0.00 H new ATOM 0 HD13 LEU A 56 81.399 0.521 -16.809 1.00 0.00 H new ATOM 0 HD21 LEU A 56 78.370 0.740 -16.357 1.00 0.00 H new ATOM 0 HD22 LEU A 56 79.482 -0.264 -15.396 1.00 0.00 H new ATOM 0 HD23 LEU A 56 78.427 0.920 -14.587 1.00 0.00 H new ATOM 848 N ILE A 57 78.888 2.049 -11.943 1.00 0.00 N ATOM 849 CA ILE A 57 77.478 1.896 -11.565 1.00 0.00 C ATOM 850 C ILE A 57 76.857 3.215 -11.054 1.00 0.00 C ATOM 851 O ILE A 57 75.828 3.641 -11.577 1.00 0.00 O ATOM 852 CB ILE A 57 77.327 0.740 -10.538 1.00 0.00 C ATOM 853 CG1 ILE A 57 77.173 -0.595 -11.282 1.00 0.00 C ATOM 854 CG2 ILE A 57 76.096 0.952 -9.645 1.00 0.00 C ATOM 855 CD1 ILE A 57 77.345 -1.757 -10.302 1.00 0.00 C ATOM 0 H ILE A 57 79.558 1.565 -11.345 1.00 0.00 H new ATOM 0 HA ILE A 57 76.915 1.635 -12.461 1.00 0.00 H new ATOM 0 HB ILE A 57 78.220 0.726 -9.913 1.00 0.00 H new ATOM 0 HG12 ILE A 57 76.192 -0.648 -11.754 1.00 0.00 H new ATOM 0 HG13 ILE A 57 77.914 -0.666 -12.078 1.00 0.00 H new ATOM 0 HG21 ILE A 57 76.015 0.128 -8.936 1.00 0.00 H new ATOM 0 HG22 ILE A 57 76.199 1.891 -9.101 1.00 0.00 H new ATOM 0 HG23 ILE A 57 75.199 0.988 -10.264 1.00 0.00 H new ATOM 0 HD11 ILE A 57 77.235 -2.702 -10.835 1.00 0.00 H new ATOM 0 HD12 ILE A 57 78.336 -1.708 -9.850 1.00 0.00 H new ATOM 0 HD13 ILE A 57 76.587 -1.690 -9.522 1.00 0.00 H new ATOM 867 N PRO A 58 77.426 3.871 -10.072 1.00 0.00 N ATOM 868 CA PRO A 58 76.861 5.151 -9.549 1.00 0.00 C ATOM 869 C PRO A 58 77.050 6.296 -10.543 1.00 0.00 C ATOM 870 O PRO A 58 76.263 7.241 -10.576 1.00 0.00 O ATOM 871 CB PRO A 58 77.647 5.393 -8.252 1.00 0.00 C ATOM 872 CG PRO A 58 78.952 4.698 -8.463 1.00 0.00 C ATOM 873 CD PRO A 58 78.652 3.490 -9.356 1.00 0.00 C ATOM 0 HA PRO A 58 75.785 5.098 -9.383 1.00 0.00 H new ATOM 0 HB2 PRO A 58 77.791 6.458 -8.069 1.00 0.00 H new ATOM 0 HB3 PRO A 58 77.119 4.990 -7.388 1.00 0.00 H new ATOM 0 HG2 PRO A 58 79.675 5.362 -8.936 1.00 0.00 H new ATOM 0 HG3 PRO A 58 79.383 4.383 -7.513 1.00 0.00 H new ATOM 0 HD2 PRO A 58 79.472 3.291 -10.046 1.00 0.00 H new ATOM 0 HD3 PRO A 58 78.505 2.585 -8.767 1.00 0.00 H new ATOM 881 N PHE A 59 78.102 6.198 -11.348 1.00 0.00 N ATOM 882 CA PHE A 59 78.401 7.211 -12.335 1.00 0.00 C ATOM 883 C PHE A 59 77.249 7.338 -13.332 1.00 0.00 C ATOM 884 O PHE A 59 76.827 8.444 -13.667 1.00 0.00 O ATOM 885 CB PHE A 59 79.699 6.833 -13.069 1.00 0.00 C ATOM 886 CG PHE A 59 80.935 7.246 -12.277 1.00 0.00 C ATOM 887 CD1 PHE A 59 80.899 7.387 -10.875 1.00 0.00 C ATOM 888 CD2 PHE A 59 82.129 7.494 -12.965 1.00 0.00 C ATOM 889 CE1 PHE A 59 82.052 7.774 -10.181 1.00 0.00 C ATOM 890 CE2 PHE A 59 83.278 7.878 -12.266 1.00 0.00 C ATOM 891 CZ PHE A 59 83.240 8.019 -10.876 1.00 0.00 C ATOM 0 H PHE A 59 78.761 5.420 -11.330 1.00 0.00 H new ATOM 0 HA PHE A 59 78.531 8.172 -11.838 1.00 0.00 H new ATOM 0 HB2 PHE A 59 79.720 5.757 -13.241 1.00 0.00 H new ATOM 0 HB3 PHE A 59 79.717 7.313 -14.048 1.00 0.00 H new ATOM 0 HD1 PHE A 59 79.983 7.197 -10.336 1.00 0.00 H new ATOM 0 HD2 PHE A 59 82.163 7.388 -14.039 1.00 0.00 H new ATOM 0 HE1 PHE A 59 82.023 7.883 -9.107 1.00 0.00 H new ATOM 0 HE2 PHE A 59 84.197 8.066 -12.802 1.00 0.00 H new ATOM 0 HZ PHE A 59 84.128 8.317 -10.339 1.00 0.00 H new ATOM 901 N LEU A 60 76.747 6.201 -13.805 1.00 0.00 N ATOM 902 CA LEU A 60 75.648 6.212 -14.765 1.00 0.00 C ATOM 903 C LEU A 60 74.445 6.959 -14.181 1.00 0.00 C ATOM 904 O LEU A 60 73.603 7.476 -14.914 1.00 0.00 O ATOM 905 CB LEU A 60 75.266 4.757 -15.126 1.00 0.00 C ATOM 906 CG LEU A 60 74.842 4.628 -16.605 1.00 0.00 C ATOM 907 CD1 LEU A 60 73.689 5.592 -16.908 1.00 0.00 C ATOM 908 CD2 LEU A 60 76.033 4.924 -17.543 1.00 0.00 C ATOM 0 H LEU A 60 77.078 5.272 -13.544 1.00 0.00 H new ATOM 0 HA LEU A 60 75.962 6.730 -15.671 1.00 0.00 H new ATOM 0 HB2 LEU A 60 76.113 4.099 -14.932 1.00 0.00 H new ATOM 0 HB3 LEU A 60 74.451 4.425 -14.483 1.00 0.00 H new ATOM 0 HG LEU A 60 74.510 3.604 -16.778 1.00 0.00 H new ATOM 0 HD11 LEU A 60 73.397 5.493 -17.954 1.00 0.00 H new ATOM 0 HD12 LEU A 60 72.838 5.353 -16.270 1.00 0.00 H new ATOM 0 HD13 LEU A 60 74.011 6.616 -16.716 1.00 0.00 H new ATOM 0 HD21 LEU A 60 75.712 4.827 -18.580 1.00 0.00 H new ATOM 0 HD22 LEU A 60 76.391 5.938 -17.367 1.00 0.00 H new ATOM 0 HD23 LEU A 60 76.837 4.215 -17.345 1.00 0.00 H new ATOM 920 N GLU A 61 74.375 7.017 -12.852 1.00 0.00 N ATOM 921 CA GLU A 61 73.273 7.705 -12.174 1.00 0.00 C ATOM 922 C GLU A 61 73.683 9.119 -11.778 1.00 0.00 C ATOM 923 O GLU A 61 74.861 9.472 -11.834 1.00 0.00 O ATOM 924 CB GLU A 61 72.865 6.924 -10.923 1.00 0.00 C ATOM 925 CG GLU A 61 72.382 5.528 -11.322 1.00 0.00 C ATOM 926 CD GLU A 61 71.098 5.631 -12.138 1.00 0.00 C ATOM 927 OE1 GLU A 61 70.210 6.354 -11.720 1.00 0.00 O ATOM 928 OE2 GLU A 61 71.022 4.985 -13.171 1.00 0.00 O ATOM 0 H GLU A 61 75.063 6.599 -12.225 1.00 0.00 H new ATOM 0 HA GLU A 61 72.429 7.764 -12.862 1.00 0.00 H new ATOM 0 HB2 GLU A 61 73.711 6.845 -10.240 1.00 0.00 H new ATOM 0 HB3 GLU A 61 72.075 7.455 -10.392 1.00 0.00 H new ATOM 0 HG2 GLU A 61 73.152 5.021 -11.903 1.00 0.00 H new ATOM 0 HG3 GLU A 61 72.208 4.926 -10.430 1.00 0.00 H new ATOM 935 N GLN A 62 72.704 9.923 -11.374 1.00 0.00 N ATOM 936 CA GLN A 62 72.975 11.298 -10.969 1.00 0.00 C ATOM 937 C GLN A 62 73.929 11.324 -9.779 1.00 0.00 C ATOM 938 O GLN A 62 74.900 12.081 -9.764 1.00 0.00 O ATOM 939 CB GLN A 62 71.669 12.001 -10.591 1.00 0.00 C ATOM 940 CG GLN A 62 70.690 11.932 -11.765 1.00 0.00 C ATOM 941 CD GLN A 62 71.183 12.812 -12.909 1.00 0.00 C ATOM 942 OE1 GLN A 62 71.904 12.342 -13.789 1.00 0.00 O ATOM 943 NE2 GLN A 62 70.834 14.069 -12.950 1.00 0.00 N ATOM 0 H GLN A 62 71.723 9.649 -11.319 1.00 0.00 H new ATOM 0 HA GLN A 62 73.438 11.819 -11.807 1.00 0.00 H new ATOM 0 HB2 GLN A 62 71.231 11.529 -9.711 1.00 0.00 H new ATOM 0 HB3 GLN A 62 71.866 13.041 -10.330 1.00 0.00 H new ATOM 0 HG2 GLN A 62 70.590 10.901 -12.105 1.00 0.00 H new ATOM 0 HG3 GLN A 62 69.701 12.259 -11.444 1.00 0.00 H new ATOM 0 HE21 GLN A 62 70.236 14.456 -12.220 1.00 0.00 H new ATOM 0 HE22 GLN A 62 71.159 14.664 -13.712 1.00 0.00 H new ATOM 952 N ASN A 63 73.645 10.490 -8.783 1.00 0.00 N ATOM 953 CA ASN A 63 74.484 10.424 -7.593 1.00 0.00 C ATOM 954 C ASN A 63 75.815 9.751 -7.912 1.00 0.00 C ATOM 955 CB ASN A 63 73.766 9.642 -6.490 1.00 0.00 C ATOM 956 CG ASN A 63 73.402 8.248 -6.991 1.00 0.00 C ATOM 957 OD1 ASN A 63 73.251 8.039 -8.194 1.00 0.00 O ATOM 958 ND2 ASN A 63 73.251 7.277 -6.133 1.00 0.00 N ATOM 0 H ASN A 63 72.846 9.855 -8.776 1.00 0.00 H new ATOM 0 HA ASN A 63 74.677 11.441 -7.251 1.00 0.00 H new ATOM 0 HB2 ASN A 63 74.406 9.566 -5.611 1.00 0.00 H new ATOM 0 HB3 ASN A 63 72.865 10.174 -6.183 1.00 0.00 H new ATOM 0 HD21 ASN A 63 73.007 6.342 -6.459 1.00 0.00 H new ATOM 0 HD22 ASN A 63 73.377 7.453 -5.136 1.00 0.00 H new TER 965 ASN A 63 ATOM 966 N CYS B 1 73.111 22.978 -15.029 1.00 0.00 N ATOM 967 CA CYS B 1 72.243 22.160 -14.139 1.00 0.00 C ATOM 968 C CYS B 1 73.046 20.984 -13.590 1.00 0.00 C ATOM 969 O CYS B 1 74.190 21.147 -13.166 1.00 0.00 O ATOM 970 CB CYS B 1 71.040 21.648 -14.935 1.00 0.00 C ATOM 971 SG CYS B 1 71.614 20.568 -16.271 1.00 0.00 S ATOM 0 H1 CYS B 1 72.732 23.944 -15.091 1.00 0.00 H new ATOM 0 H2 CYS B 1 74.075 23.009 -14.641 1.00 0.00 H new ATOM 0 H3 CYS B 1 73.133 22.553 -15.978 1.00 0.00 H new ATOM 0 HA CYS B 1 71.888 22.769 -13.307 1.00 0.00 H new ATOM 0 HB2 CYS B 1 70.362 21.103 -14.279 1.00 0.00 H new ATOM 0 HB3 CYS B 1 70.479 22.487 -15.347 1.00 0.00 H new ATOM 975 N SER B 2 72.441 19.801 -13.602 1.00 0.00 N ATOM 976 CA SER B 2 73.113 18.606 -13.102 1.00 0.00 C ATOM 977 C SER B 2 74.464 18.428 -13.788 1.00 0.00 C ATOM 978 O SER B 2 75.512 18.497 -13.145 1.00 0.00 O ATOM 979 CB SER B 2 72.240 17.376 -13.356 1.00 0.00 C ATOM 980 OG SER B 2 72.250 17.072 -14.745 1.00 0.00 O ATOM 0 H SER B 2 71.495 19.644 -13.949 1.00 0.00 H new ATOM 0 HA SER B 2 73.276 18.720 -12.030 1.00 0.00 H new ATOM 0 HB2 SER B 2 72.613 16.527 -12.783 1.00 0.00 H new ATOM 0 HB3 SER B 2 71.220 17.564 -13.020 1.00 0.00 H new ATOM 0 HG SER B 2 71.574 16.389 -14.935 1.00 0.00 H new ATOM 986 N THR B 3 74.431 18.205 -15.098 1.00 0.00 N ATOM 987 CA THR B 3 75.657 18.025 -15.869 1.00 0.00 C ATOM 988 C THR B 3 76.642 17.122 -15.130 1.00 0.00 C ATOM 989 O THR B 3 77.800 17.486 -14.930 1.00 0.00 O ATOM 990 CB THR B 3 76.310 19.383 -16.132 1.00 0.00 C ATOM 991 OG1 THR B 3 76.814 19.909 -14.912 1.00 0.00 O ATOM 992 CG2 THR B 3 75.273 20.345 -16.715 1.00 0.00 C ATOM 0 H THR B 3 73.573 18.145 -15.646 1.00 0.00 H new ATOM 0 HA THR B 3 75.396 17.552 -16.816 1.00 0.00 H new ATOM 0 HB THR B 3 77.129 19.262 -16.841 1.00 0.00 H new ATOM 0 HG1 THR B 3 77.569 19.363 -14.607 1.00 0.00 H new ATOM 0 HG21 THR B 3 75.739 21.312 -16.902 1.00 0.00 H new ATOM 0 HG22 THR B 3 74.887 19.941 -17.651 1.00 0.00 H new ATOM 0 HG23 THR B 3 74.453 20.468 -16.008 1.00 0.00 H new ATOM 1000 N VAL B 4 76.176 15.942 -14.733 1.00 0.00 N ATOM 1001 CA VAL B 4 77.032 14.996 -14.024 1.00 0.00 C ATOM 1002 C VAL B 4 77.989 14.316 -14.997 1.00 0.00 C ATOM 1003 O VAL B 4 79.158 14.093 -14.682 1.00 0.00 O ATOM 1004 CB VAL B 4 76.177 13.942 -13.321 1.00 0.00 C ATOM 1005 CG1 VAL B 4 75.191 14.633 -12.378 1.00 0.00 C ATOM 1006 CG2 VAL B 4 75.402 13.136 -14.365 1.00 0.00 C ATOM 0 H VAL B 4 75.221 15.620 -14.888 1.00 0.00 H new ATOM 0 HA VAL B 4 77.612 15.542 -13.280 1.00 0.00 H new ATOM 0 HB VAL B 4 76.821 13.274 -12.749 1.00 0.00 H new ATOM 0 HG11 VAL B 4 74.581 13.882 -11.876 1.00 0.00 H new ATOM 0 HG12 VAL B 4 75.742 15.209 -11.635 1.00 0.00 H new ATOM 0 HG13 VAL B 4 74.547 15.301 -12.950 1.00 0.00 H new ATOM 0 HG21 VAL B 4 74.792 12.384 -13.865 1.00 0.00 H new ATOM 0 HG22 VAL B 4 74.758 13.805 -14.936 1.00 0.00 H new ATOM 0 HG23 VAL B 4 76.103 12.644 -15.039 1.00 0.00 H new ATOM 1016 N SER B 5 77.485 13.993 -16.185 1.00 0.00 N ATOM 1017 CA SER B 5 78.298 13.342 -17.209 1.00 0.00 C ATOM 1018 C SER B 5 79.714 13.935 -17.245 1.00 0.00 C ATOM 1019 O SER B 5 80.687 13.228 -16.984 1.00 0.00 O ATOM 1020 CB SER B 5 77.608 13.481 -18.582 1.00 0.00 C ATOM 1021 OG SER B 5 76.662 14.540 -18.521 1.00 0.00 O ATOM 0 H SER B 5 76.520 14.171 -16.462 1.00 0.00 H new ATOM 0 HA SER B 5 78.392 12.284 -16.965 1.00 0.00 H new ATOM 0 HB2 SER B 5 78.348 13.682 -19.356 1.00 0.00 H new ATOM 0 HB3 SER B 5 77.112 12.548 -18.850 1.00 0.00 H new ATOM 0 HG SER B 5 76.457 14.849 -19.428 1.00 0.00 H new ATOM 1027 N PRO B 6 79.854 15.203 -17.556 1.00 0.00 N ATOM 1028 CA PRO B 6 81.196 15.866 -17.613 1.00 0.00 C ATOM 1029 C PRO B 6 81.912 15.833 -16.260 1.00 0.00 C ATOM 1030 O PRO B 6 82.941 16.484 -16.078 1.00 0.00 O ATOM 1031 CB PRO B 6 80.880 17.310 -18.054 1.00 0.00 C ATOM 1032 CG PRO B 6 79.434 17.512 -17.727 1.00 0.00 C ATOM 1033 CD PRO B 6 78.772 16.146 -17.891 1.00 0.00 C ATOM 0 HA PRO B 6 81.877 15.359 -18.297 1.00 0.00 H new ATOM 0 HB2 PRO B 6 81.507 18.029 -17.527 1.00 0.00 H new ATOM 0 HB3 PRO B 6 81.066 17.446 -19.119 1.00 0.00 H new ATOM 0 HG2 PRO B 6 79.312 17.885 -16.710 1.00 0.00 H new ATOM 0 HG3 PRO B 6 78.982 18.247 -18.393 1.00 0.00 H new ATOM 0 HD2 PRO B 6 77.917 16.031 -17.225 1.00 0.00 H new ATOM 0 HD3 PRO B 6 78.407 15.995 -18.907 1.00 0.00 H new ATOM 1041 N GLY B 7 81.361 15.068 -15.314 1.00 0.00 N ATOM 1042 CA GLY B 7 81.950 14.950 -13.977 1.00 0.00 C ATOM 1043 C GLY B 7 82.242 13.493 -13.628 1.00 0.00 C ATOM 1044 O GLY B 7 83.398 13.100 -13.482 1.00 0.00 O ATOM 0 H GLY B 7 80.510 14.522 -15.448 1.00 0.00 H new ATOM 0 HA2 GLY B 7 82.872 15.529 -13.931 1.00 0.00 H new ATOM 0 HA3 GLY B 7 81.270 15.374 -13.238 1.00 0.00 H new ATOM 1048 N VAL B 8 81.191 12.691 -13.488 1.00 0.00 N ATOM 1049 CA VAL B 8 81.369 11.287 -13.147 1.00 0.00 C ATOM 1050 C VAL B 8 82.229 10.580 -14.202 1.00 0.00 C ATOM 1051 O VAL B 8 83.237 9.936 -13.879 1.00 0.00 O ATOM 1052 CB VAL B 8 79.999 10.608 -13.023 1.00 0.00 C ATOM 1053 CG1 VAL B 8 79.125 11.375 -12.029 1.00 0.00 C ATOM 1054 CG2 VAL B 8 79.305 10.565 -14.388 1.00 0.00 C ATOM 0 H VAL B 8 80.221 12.985 -13.604 1.00 0.00 H new ATOM 0 HA VAL B 8 81.886 11.218 -12.190 1.00 0.00 H new ATOM 0 HB VAL B 8 80.145 9.589 -12.665 1.00 0.00 H new ATOM 0 HG11 VAL B 8 78.154 10.887 -11.946 1.00 0.00 H new ATOM 0 HG12 VAL B 8 79.609 11.387 -11.053 1.00 0.00 H new ATOM 0 HG13 VAL B 8 78.988 12.398 -12.379 1.00 0.00 H new ATOM 0 HG21 VAL B 8 78.334 10.081 -14.287 1.00 0.00 H new ATOM 0 HG22 VAL B 8 79.167 11.581 -14.758 1.00 0.00 H new ATOM 0 HG23 VAL B 8 79.919 10.003 -15.091 1.00 0.00 H new ATOM 1064 N LEU B 9 81.855 10.720 -15.468 1.00 0.00 N ATOM 1065 CA LEU B 9 82.631 10.103 -16.533 1.00 0.00 C ATOM 1066 C LEU B 9 84.075 10.601 -16.437 1.00 0.00 C ATOM 1067 O LEU B 9 85.036 9.826 -16.569 1.00 0.00 O ATOM 1068 CB LEU B 9 82.009 10.434 -17.898 1.00 0.00 C ATOM 1069 CG LEU B 9 80.502 10.109 -17.865 1.00 0.00 C ATOM 1070 CD1 LEU B 9 79.839 10.557 -19.171 1.00 0.00 C ATOM 1071 CD2 LEU B 9 80.296 8.596 -17.684 1.00 0.00 C ATOM 0 H LEU B 9 81.036 11.244 -15.777 1.00 0.00 H new ATOM 0 HA LEU B 9 82.625 9.018 -16.427 1.00 0.00 H new ATOM 0 HB2 LEU B 9 82.160 11.487 -18.133 1.00 0.00 H new ATOM 0 HB3 LEU B 9 82.500 9.858 -18.683 1.00 0.00 H new ATOM 0 HG LEU B 9 80.048 10.641 -17.029 1.00 0.00 H new ATOM 0 HD11 LEU B 9 78.775 10.323 -19.138 1.00 0.00 H new ATOM 0 HD12 LEU B 9 79.971 11.632 -19.296 1.00 0.00 H new ATOM 0 HD13 LEU B 9 80.299 10.035 -20.010 1.00 0.00 H new ATOM 0 HD21 LEU B 9 79.229 8.374 -17.662 1.00 0.00 H new ATOM 0 HD22 LEU B 9 80.760 8.064 -18.514 1.00 0.00 H new ATOM 0 HD23 LEU B 9 80.753 8.276 -16.747 1.00 0.00 H new ATOM 1083 N ALA B 10 84.233 11.891 -16.139 1.00 0.00 N ATOM 1084 CA ALA B 10 85.568 12.441 -15.965 1.00 0.00 C ATOM 1085 C ALA B 10 86.294 11.573 -14.936 1.00 0.00 C ATOM 1086 O ALA B 10 87.490 11.286 -15.043 1.00 0.00 O ATOM 1087 CB ALA B 10 85.489 13.895 -15.477 1.00 0.00 C ATOM 0 H ALA B 10 83.470 12.557 -16.016 1.00 0.00 H new ATOM 0 HA ALA B 10 86.106 12.440 -16.913 1.00 0.00 H new ATOM 0 HB1 ALA B 10 86.496 14.292 -15.352 1.00 0.00 H new ATOM 0 HB2 ALA B 10 84.951 14.496 -16.210 1.00 0.00 H new ATOM 0 HB3 ALA B 10 84.964 13.930 -14.523 1.00 0.00 H new ATOM 1093 N GLY B 11 85.523 11.132 -13.947 1.00 0.00 N ATOM 1094 CA GLY B 11 86.050 10.272 -12.905 1.00 0.00 C ATOM 1095 C GLY B 11 86.544 8.959 -13.498 1.00 0.00 C ATOM 1096 O GLY B 11 87.526 8.386 -13.022 1.00 0.00 O ATOM 0 H GLY B 11 84.533 11.358 -13.849 1.00 0.00 H new ATOM 0 HA2 GLY B 11 86.867 10.775 -12.388 1.00 0.00 H new ATOM 0 HA3 GLY B 11 85.277 10.075 -12.162 1.00 0.00 H new ATOM 1100 N ILE B 12 85.867 8.474 -14.542 1.00 0.00 N ATOM 1101 CA ILE B 12 86.286 7.227 -15.154 1.00 0.00 C ATOM 1102 C ILE B 12 87.699 7.392 -15.727 1.00 0.00 C ATOM 1103 O ILE B 12 88.540 6.507 -15.568 1.00 0.00 O ATOM 1104 CB ILE B 12 85.251 6.777 -16.227 1.00 0.00 C ATOM 1105 CG1 ILE B 12 84.972 5.260 -16.109 1.00 0.00 C ATOM 1106 CG2 ILE B 12 85.752 7.083 -17.646 1.00 0.00 C ATOM 1107 CD1 ILE B 12 83.933 5.004 -15.009 1.00 0.00 C ATOM 0 H ILE B 12 85.051 8.916 -14.966 1.00 0.00 H new ATOM 0 HA ILE B 12 86.323 6.435 -14.406 1.00 0.00 H new ATOM 0 HB ILE B 12 84.332 7.335 -16.047 1.00 0.00 H new ATOM 0 HG12 ILE B 12 84.609 4.873 -17.061 1.00 0.00 H new ATOM 0 HG13 ILE B 12 85.896 4.728 -15.880 1.00 0.00 H new ATOM 0 HG21 ILE B 12 85.008 6.757 -18.373 1.00 0.00 H new ATOM 0 HG22 ILE B 12 85.916 8.155 -17.750 1.00 0.00 H new ATOM 0 HG23 ILE B 12 86.688 6.554 -17.823 1.00 0.00 H new ATOM 0 HD11 ILE B 12 83.741 3.934 -14.931 1.00 0.00 H new ATOM 0 HD12 ILE B 12 84.312 5.375 -14.057 1.00 0.00 H new ATOM 0 HD13 ILE B 12 83.006 5.522 -15.256 1.00 0.00 H new ATOM 1119 N VAL B 13 87.971 8.532 -16.377 1.00 0.00 N ATOM 1120 CA VAL B 13 89.319 8.745 -16.927 1.00 0.00 C ATOM 1121 C VAL B 13 90.337 8.698 -15.797 1.00 0.00 C ATOM 1122 O VAL B 13 91.387 8.067 -15.922 1.00 0.00 O ATOM 1123 CB VAL B 13 89.438 10.078 -17.728 1.00 0.00 C ATOM 1124 CG1 VAL B 13 88.062 10.530 -18.170 1.00 0.00 C ATOM 1125 CG2 VAL B 13 90.083 11.209 -16.904 1.00 0.00 C ATOM 0 H VAL B 13 87.308 9.292 -16.532 1.00 0.00 H new ATOM 0 HA VAL B 13 89.521 7.944 -17.638 1.00 0.00 H new ATOM 0 HB VAL B 13 90.080 9.876 -18.585 1.00 0.00 H new ATOM 0 HG11 VAL B 13 88.147 11.462 -18.729 1.00 0.00 H new ATOM 0 HG12 VAL B 13 87.614 9.765 -18.805 1.00 0.00 H new ATOM 0 HG13 VAL B 13 87.433 10.689 -17.294 1.00 0.00 H new ATOM 0 HG21 VAL B 13 90.141 12.113 -17.510 1.00 0.00 H new ATOM 0 HG22 VAL B 13 89.479 11.404 -16.018 1.00 0.00 H new ATOM 0 HG23 VAL B 13 91.086 10.911 -16.600 1.00 0.00 H new ATOM 1135 N VAL B 14 90.022 9.362 -14.688 1.00 0.00 N ATOM 1136 CA VAL B 14 90.933 9.366 -13.552 1.00 0.00 C ATOM 1137 C VAL B 14 91.326 7.934 -13.206 1.00 0.00 C ATOM 1138 O VAL B 14 92.507 7.623 -13.032 1.00 0.00 O ATOM 1139 CB VAL B 14 90.276 10.032 -12.343 1.00 0.00 C ATOM 1140 CG1 VAL B 14 91.228 9.968 -11.147 1.00 0.00 C ATOM 1141 CG2 VAL B 14 89.969 11.493 -12.674 1.00 0.00 C ATOM 0 H VAL B 14 89.161 9.893 -14.554 1.00 0.00 H new ATOM 0 HA VAL B 14 91.825 9.932 -13.818 1.00 0.00 H new ATOM 0 HB VAL B 14 89.350 9.512 -12.098 1.00 0.00 H new ATOM 0 HG11 VAL B 14 90.761 10.443 -10.284 1.00 0.00 H new ATOM 0 HG12 VAL B 14 91.449 8.927 -10.913 1.00 0.00 H new ATOM 0 HG13 VAL B 14 92.154 10.489 -11.391 1.00 0.00 H new ATOM 0 HG21 VAL B 14 89.500 11.970 -11.813 1.00 0.00 H new ATOM 0 HG22 VAL B 14 90.895 12.013 -12.918 1.00 0.00 H new ATOM 0 HG23 VAL B 14 89.292 11.538 -13.527 1.00 0.00 H new ATOM 1151 N GLY B 15 90.327 7.061 -13.127 1.00 0.00 N ATOM 1152 CA GLY B 15 90.579 5.658 -12.821 1.00 0.00 C ATOM 1153 C GLY B 15 91.536 5.056 -13.844 1.00 0.00 C ATOM 1154 O GLY B 15 92.449 4.307 -13.493 1.00 0.00 O ATOM 0 H GLY B 15 89.345 7.297 -13.269 1.00 0.00 H new ATOM 0 HA2 GLY B 15 91.002 5.567 -11.820 1.00 0.00 H new ATOM 0 HA3 GLY B 15 89.640 5.104 -12.822 1.00 0.00 H new ATOM 1158 N ASP B 16 91.320 5.396 -15.112 1.00 0.00 N ATOM 1159 CA ASP B 16 92.171 4.890 -16.184 1.00 0.00 C ATOM 1160 C ASP B 16 93.622 5.292 -15.948 1.00 0.00 C ATOM 1161 O ASP B 16 94.534 4.477 -16.089 1.00 0.00 O ATOM 1162 CB ASP B 16 91.703 5.446 -17.530 1.00 0.00 C ATOM 1163 CG ASP B 16 92.388 4.697 -18.668 1.00 0.00 C ATOM 1164 OD1 ASP B 16 92.824 3.580 -18.440 1.00 0.00 O ATOM 1165 OD2 ASP B 16 92.465 5.250 -19.753 1.00 0.00 O ATOM 0 H ASP B 16 90.570 6.014 -15.420 1.00 0.00 H new ATOM 0 HA ASP B 16 92.101 3.802 -16.195 1.00 0.00 H new ATOM 0 HB2 ASP B 16 90.621 5.347 -17.618 1.00 0.00 H new ATOM 0 HB3 ASP B 16 91.932 6.510 -17.593 1.00 0.00 H new ATOM 1170 N LEU B 17 93.828 6.554 -15.586 1.00 0.00 N ATOM 1171 CA LEU B 17 95.173 7.053 -15.331 1.00 0.00 C ATOM 1172 C LEU B 17 95.847 6.210 -14.255 1.00 0.00 C ATOM 1173 O LEU B 17 97.005 5.809 -14.395 1.00 0.00 O ATOM 1174 CB LEU B 17 95.107 8.521 -14.887 1.00 0.00 C ATOM 1175 CG LEU B 17 96.496 9.025 -14.469 1.00 0.00 C ATOM 1176 CD1 LEU B 17 97.512 8.771 -15.593 1.00 0.00 C ATOM 1177 CD2 LEU B 17 96.416 10.529 -14.184 1.00 0.00 C ATOM 0 H LEU B 17 93.087 7.244 -15.464 1.00 0.00 H new ATOM 0 HA LEU B 17 95.759 6.985 -16.248 1.00 0.00 H new ATOM 0 HB2 LEU B 17 94.722 9.135 -15.701 1.00 0.00 H new ATOM 0 HB3 LEU B 17 94.412 8.623 -14.054 1.00 0.00 H new ATOM 0 HG LEU B 17 96.819 8.492 -13.575 1.00 0.00 H new ATOM 0 HD11 LEU B 17 98.493 9.133 -15.285 1.00 0.00 H new ATOM 0 HD12 LEU B 17 97.567 7.702 -15.799 1.00 0.00 H new ATOM 0 HD13 LEU B 17 97.197 9.298 -16.494 1.00 0.00 H new ATOM 0 HD21 LEU B 17 97.398 10.896 -13.886 1.00 0.00 H new ATOM 0 HD22 LEU B 17 96.090 11.053 -15.083 1.00 0.00 H new ATOM 0 HD23 LEU B 17 95.702 10.710 -13.380 1.00 0.00 H new ATOM 1189 N VAL B 18 95.112 5.938 -13.181 1.00 0.00 N ATOM 1190 CA VAL B 18 95.652 5.134 -12.093 1.00 0.00 C ATOM 1191 C VAL B 18 96.125 3.782 -12.621 1.00 0.00 C ATOM 1192 O VAL B 18 97.227 3.334 -12.304 1.00 0.00 O ATOM 1193 CB VAL B 18 94.587 4.934 -11.010 1.00 0.00 C ATOM 1194 CG1 VAL B 18 95.094 3.942 -9.960 1.00 0.00 C ATOM 1195 CG2 VAL B 18 94.294 6.277 -10.336 1.00 0.00 C ATOM 0 H VAL B 18 94.154 6.258 -13.042 1.00 0.00 H new ATOM 0 HA VAL B 18 96.504 5.657 -11.658 1.00 0.00 H new ATOM 0 HB VAL B 18 93.678 4.542 -11.466 1.00 0.00 H new ATOM 0 HG11 VAL B 18 94.333 3.804 -9.192 1.00 0.00 H new ATOM 0 HG12 VAL B 18 95.307 2.985 -10.436 1.00 0.00 H new ATOM 0 HG13 VAL B 18 96.004 4.330 -9.502 1.00 0.00 H new ATOM 0 HG21 VAL B 18 93.536 6.139 -9.564 1.00 0.00 H new ATOM 0 HG22 VAL B 18 95.207 6.664 -9.883 1.00 0.00 H new ATOM 0 HG23 VAL B 18 93.930 6.986 -11.080 1.00 0.00 H new ATOM 1205 N LEU B 19 95.291 3.138 -13.434 1.00 0.00 N ATOM 1206 CA LEU B 19 95.656 1.843 -13.996 1.00 0.00 C ATOM 1207 C LEU B 19 96.925 1.975 -14.835 1.00 0.00 C ATOM 1208 O LEU B 19 97.788 1.105 -14.804 1.00 0.00 O ATOM 1209 CB LEU B 19 94.512 1.289 -14.867 1.00 0.00 C ATOM 1210 CG LEU B 19 93.430 0.631 -13.984 1.00 0.00 C ATOM 1211 CD1 LEU B 19 92.095 0.618 -14.743 1.00 0.00 C ATOM 1212 CD2 LEU B 19 93.829 -0.818 -13.646 1.00 0.00 C ATOM 0 H LEU B 19 94.374 3.485 -13.714 1.00 0.00 H new ATOM 0 HA LEU B 19 95.838 1.150 -13.174 1.00 0.00 H new ATOM 0 HB2 LEU B 19 94.071 2.095 -15.453 1.00 0.00 H new ATOM 0 HB3 LEU B 19 94.906 0.559 -15.574 1.00 0.00 H new ATOM 0 HG LEU B 19 93.331 1.201 -13.060 1.00 0.00 H new ATOM 0 HD11 LEU B 19 91.328 0.154 -14.123 1.00 0.00 H new ATOM 0 HD12 LEU B 19 91.801 1.641 -14.979 1.00 0.00 H new ATOM 0 HD13 LEU B 19 92.207 0.050 -15.667 1.00 0.00 H new ATOM 0 HD21 LEU B 19 93.058 -1.272 -13.023 1.00 0.00 H new ATOM 0 HD22 LEU B 19 93.934 -1.391 -14.567 1.00 0.00 H new ATOM 0 HD23 LEU B 19 94.777 -0.818 -13.108 1.00 0.00 H new ATOM 1224 N THR B 20 97.032 3.064 -15.583 1.00 0.00 N ATOM 1225 CA THR B 20 98.206 3.281 -16.419 1.00 0.00 C ATOM 1226 C THR B 20 99.473 3.271 -15.569 1.00 0.00 C ATOM 1227 O THR B 20 100.500 2.726 -15.974 1.00 0.00 O ATOM 1228 CB THR B 20 98.094 4.620 -17.153 1.00 0.00 C ATOM 1229 OG1 THR B 20 96.818 4.715 -17.768 1.00 0.00 O ATOM 1230 CG2 THR B 20 99.187 4.711 -18.220 1.00 0.00 C ATOM 0 H THR B 20 96.330 3.803 -15.629 1.00 0.00 H new ATOM 0 HA THR B 20 98.260 2.474 -17.150 1.00 0.00 H new ATOM 0 HB THR B 20 98.216 5.437 -16.442 1.00 0.00 H new ATOM 0 HG1 THR B 20 96.126 4.777 -17.077 1.00 0.00 H new ATOM 0 HG21 THR B 20 99.107 5.664 -18.742 1.00 0.00 H new ATOM 0 HG22 THR B 20 100.166 4.638 -17.746 1.00 0.00 H new ATOM 0 HG23 THR B 20 99.068 3.895 -18.933 1.00 0.00 H new ATOM 1238 N VAL B 21 99.394 3.887 -14.395 1.00 0.00 N ATOM 1239 CA VAL B 21 100.546 3.953 -13.499 1.00 0.00 C ATOM 1240 C VAL B 21 100.926 2.566 -12.971 1.00 0.00 C ATOM 1241 O VAL B 21 102.089 2.163 -13.047 1.00 0.00 O ATOM 1242 CB VAL B 21 100.231 4.882 -12.323 1.00 0.00 C ATOM 1243 CG1 VAL B 21 101.387 4.857 -11.320 1.00 0.00 C ATOM 1244 CG2 VAL B 21 100.040 6.310 -12.841 1.00 0.00 C ATOM 0 H VAL B 21 98.553 4.344 -14.042 1.00 0.00 H new ATOM 0 HA VAL B 21 101.392 4.343 -14.065 1.00 0.00 H new ATOM 0 HB VAL B 21 99.319 4.544 -11.831 1.00 0.00 H new ATOM 0 HG11 VAL B 21 101.159 5.519 -10.485 1.00 0.00 H new ATOM 0 HG12 VAL B 21 101.526 3.841 -10.950 1.00 0.00 H new ATOM 0 HG13 VAL B 21 102.301 5.193 -11.810 1.00 0.00 H new ATOM 0 HG21 VAL B 21 99.816 6.973 -12.006 1.00 0.00 H new ATOM 0 HG22 VAL B 21 100.953 6.643 -13.334 1.00 0.00 H new ATOM 0 HG23 VAL B 21 99.215 6.331 -13.553 1.00 0.00 H new ATOM 1254 N LEU B 22 99.951 1.845 -12.421 1.00 0.00 N ATOM 1255 CA LEU B 22 100.218 0.517 -11.867 1.00 0.00 C ATOM 1256 C LEU B 22 100.703 -0.451 -12.952 1.00 0.00 C ATOM 1257 O LEU B 22 101.746 -1.091 -12.802 1.00 0.00 O ATOM 1258 CB LEU B 22 98.942 -0.038 -11.201 1.00 0.00 C ATOM 1259 CG LEU B 22 98.846 0.448 -9.749 1.00 0.00 C ATOM 1260 CD1 LEU B 22 98.778 1.975 -9.714 1.00 0.00 C ATOM 1261 CD2 LEU B 22 97.584 -0.129 -9.104 1.00 0.00 C ATOM 0 H LEU B 22 98.981 2.152 -12.347 1.00 0.00 H new ATOM 0 HA LEU B 22 101.007 0.613 -11.121 1.00 0.00 H new ATOM 0 HB2 LEU B 22 98.063 0.284 -11.759 1.00 0.00 H new ATOM 0 HB3 LEU B 22 98.954 -1.128 -11.227 1.00 0.00 H new ATOM 0 HG LEU B 22 99.727 0.115 -9.201 1.00 0.00 H new ATOM 0 HD11 LEU B 22 98.710 2.313 -8.680 1.00 0.00 H new ATOM 0 HD12 LEU B 22 99.676 2.390 -10.173 1.00 0.00 H new ATOM 0 HD13 LEU B 22 97.900 2.313 -10.264 1.00 0.00 H new ATOM 0 HD21 LEU B 22 97.513 0.215 -8.072 1.00 0.00 H new ATOM 0 HD22 LEU B 22 96.707 0.205 -9.659 1.00 0.00 H new ATOM 0 HD23 LEU B 22 97.632 -1.218 -9.121 1.00 0.00 H new ATOM 1273 N ILE B 23 99.946 -0.562 -14.037 1.00 0.00 N ATOM 1274 CA ILE B 23 100.325 -1.463 -15.117 1.00 0.00 C ATOM 1275 C ILE B 23 101.718 -1.113 -15.627 1.00 0.00 C ATOM 1276 O ILE B 23 102.584 -1.976 -15.717 1.00 0.00 O ATOM 1277 CB ILE B 23 99.311 -1.383 -16.258 1.00 0.00 C ATOM 1278 CG1 ILE B 23 97.914 -1.730 -15.726 1.00 0.00 C ATOM 1279 CG2 ILE B 23 99.695 -2.386 -17.349 1.00 0.00 C ATOM 1280 CD1 ILE B 23 96.855 -1.277 -16.734 1.00 0.00 C ATOM 0 H ILE B 23 99.079 -0.048 -14.191 1.00 0.00 H new ATOM 0 HA ILE B 23 100.336 -2.483 -14.732 1.00 0.00 H new ATOM 0 HB ILE B 23 99.307 -0.374 -16.669 1.00 0.00 H new ATOM 0 HG12 ILE B 23 97.834 -2.804 -15.557 1.00 0.00 H new ATOM 0 HG13 ILE B 23 97.748 -1.243 -14.765 1.00 0.00 H new ATOM 0 HG21 ILE B 23 98.973 -2.331 -18.164 1.00 0.00 H new ATOM 0 HG22 ILE B 23 100.689 -2.149 -17.728 1.00 0.00 H new ATOM 0 HG23 ILE B 23 99.696 -3.393 -16.933 1.00 0.00 H new ATOM 0 HD11 ILE B 23 95.863 -1.524 -16.355 1.00 0.00 H new ATOM 0 HD12 ILE B 23 96.930 -0.199 -16.881 1.00 0.00 H new ATOM 0 HD13 ILE B 23 97.017 -1.785 -17.685 1.00 0.00 H new ATOM 1292 N ALA B 24 101.933 0.160 -15.949 1.00 0.00 N ATOM 1293 CA ALA B 24 103.239 0.596 -16.433 1.00 0.00 C ATOM 1294 C ALA B 24 104.336 0.054 -15.523 1.00 0.00 C ATOM 1295 O ALA B 24 105.339 -0.493 -15.990 1.00 0.00 O ATOM 1296 CB ALA B 24 103.303 2.124 -16.466 1.00 0.00 C ATOM 0 H ALA B 24 101.231 0.898 -15.885 1.00 0.00 H new ATOM 0 HA ALA B 24 103.388 0.212 -17.442 1.00 0.00 H new ATOM 0 HB1 ALA B 24 104.281 2.439 -16.828 1.00 0.00 H new ATOM 0 HB2 ALA B 24 102.529 2.506 -17.131 1.00 0.00 H new ATOM 0 HB3 ALA B 24 103.144 2.517 -15.462 1.00 0.00 H new ATOM 1302 N LEU B 25 104.131 0.191 -14.217 1.00 0.00 N ATOM 1303 CA LEU B 25 105.101 -0.309 -13.255 1.00 0.00 C ATOM 1304 C LEU B 25 105.315 -1.802 -13.496 1.00 0.00 C ATOM 1305 O LEU B 25 106.436 -2.305 -13.420 1.00 0.00 O ATOM 1306 CB LEU B 25 104.591 -0.059 -11.820 1.00 0.00 C ATOM 1307 CG LEU B 25 105.767 0.138 -10.839 1.00 0.00 C ATOM 1308 CD1 LEU B 25 106.752 -1.032 -10.958 1.00 0.00 C ATOM 1309 CD2 LEU B 25 106.500 1.469 -11.125 1.00 0.00 C ATOM 0 H LEU B 25 103.312 0.639 -13.806 1.00 0.00 H new ATOM 0 HA LEU B 25 106.050 0.213 -13.378 1.00 0.00 H new ATOM 0 HB2 LEU B 25 103.951 0.823 -11.807 1.00 0.00 H new ATOM 0 HB3 LEU B 25 103.980 -0.901 -11.496 1.00 0.00 H new ATOM 0 HG LEU B 25 105.367 0.171 -9.826 1.00 0.00 H new ATOM 0 HD11 LEU B 25 107.578 -0.884 -10.262 1.00 0.00 H new ATOM 0 HD12 LEU B 25 106.240 -1.964 -10.720 1.00 0.00 H new ATOM 0 HD13 LEU B 25 107.139 -1.080 -11.976 1.00 0.00 H new ATOM 0 HD21 LEU B 25 107.325 1.588 -10.423 1.00 0.00 H new ATOM 0 HD22 LEU B 25 106.889 1.459 -12.143 1.00 0.00 H new ATOM 0 HD23 LEU B 25 105.804 2.300 -11.011 1.00 0.00 H new ATOM 1321 N ALA B 26 104.226 -2.500 -13.801 1.00 0.00 N ATOM 1322 CA ALA B 26 104.298 -3.933 -14.065 1.00 0.00 C ATOM 1323 C ALA B 26 105.143 -4.205 -15.308 1.00 0.00 C ATOM 1324 O ALA B 26 105.905 -5.171 -15.350 1.00 0.00 O ATOM 1325 CB ALA B 26 102.890 -4.502 -14.259 1.00 0.00 C ATOM 0 H ALA B 26 103.290 -2.101 -13.871 1.00 0.00 H new ATOM 0 HA ALA B 26 104.766 -4.420 -13.210 1.00 0.00 H new ATOM 0 HB1 ALA B 26 102.954 -5.572 -14.456 1.00 0.00 H new ATOM 0 HB2 ALA B 26 102.302 -4.333 -13.357 1.00 0.00 H new ATOM 0 HB3 ALA B 26 102.410 -4.006 -15.103 1.00 0.00 H new ATOM 1331 N VAL B 27 105.006 -3.347 -16.316 1.00 0.00 N ATOM 1332 CA VAL B 27 105.769 -3.508 -17.547 1.00 0.00 C ATOM 1333 C VAL B 27 107.257 -3.488 -17.237 1.00 0.00 C ATOM 1334 O VAL B 27 108.011 -4.340 -17.707 1.00 0.00 O ATOM 1335 CB VAL B 27 105.438 -2.383 -18.530 1.00 0.00 C ATOM 1336 CG1 VAL B 27 106.214 -2.598 -19.831 1.00 0.00 C ATOM 1337 CG2 VAL B 27 103.935 -2.383 -18.824 1.00 0.00 C ATOM 0 H VAL B 27 104.380 -2.542 -16.304 1.00 0.00 H new ATOM 0 HA VAL B 27 105.503 -4.464 -17.999 1.00 0.00 H new ATOM 0 HB VAL B 27 105.720 -1.425 -18.093 1.00 0.00 H new ATOM 0 HG11 VAL B 27 105.979 -1.797 -20.532 1.00 0.00 H new ATOM 0 HG12 VAL B 27 107.284 -2.594 -19.622 1.00 0.00 H new ATOM 0 HG13 VAL B 27 105.933 -3.556 -20.268 1.00 0.00 H new ATOM 0 HG21 VAL B 27 103.701 -1.581 -19.524 1.00 0.00 H new ATOM 0 HG22 VAL B 27 103.650 -3.340 -19.260 1.00 0.00 H new ATOM 0 HG23 VAL B 27 103.383 -2.228 -17.897 1.00 0.00 H new ATOM 1347 N TYR B 28 107.673 -2.512 -16.437 1.00 0.00 N ATOM 1348 CA TYR B 28 109.078 -2.399 -16.066 1.00 0.00 C ATOM 1349 C TYR B 28 109.509 -3.618 -15.258 1.00 0.00 C ATOM 1350 O TYR B 28 110.601 -4.152 -15.452 1.00 0.00 O ATOM 1351 CB TYR B 28 109.306 -1.133 -15.239 1.00 0.00 C ATOM 1352 CG TYR B 28 110.782 -0.979 -14.964 1.00 0.00 C ATOM 1353 CD1 TYR B 28 111.347 -1.564 -13.825 1.00 0.00 C ATOM 1354 CD2 TYR B 28 111.586 -0.255 -15.852 1.00 0.00 C ATOM 1355 CE1 TYR B 28 112.717 -1.424 -13.573 1.00 0.00 C ATOM 1356 CE2 TYR B 28 112.956 -0.116 -15.600 1.00 0.00 C ATOM 1357 CZ TYR B 28 113.521 -0.700 -14.461 1.00 0.00 C ATOM 1358 OH TYR B 28 114.871 -0.562 -14.213 1.00 0.00 O ATOM 0 H TYR B 28 107.066 -1.796 -16.038 1.00 0.00 H new ATOM 0 HA TYR B 28 109.673 -2.344 -16.978 1.00 0.00 H new ATOM 0 HB2 TYR B 28 108.931 -0.261 -15.775 1.00 0.00 H new ATOM 0 HB3 TYR B 28 108.753 -1.192 -14.301 1.00 0.00 H new ATOM 0 HD1 TYR B 28 110.726 -2.123 -13.141 1.00 0.00 H new ATOM 0 HD2 TYR B 28 111.150 0.196 -16.731 1.00 0.00 H new ATOM 0 HE1 TYR B 28 113.153 -1.874 -12.694 1.00 0.00 H new ATOM 0 HE2 TYR B 28 113.577 0.442 -16.285 1.00 0.00 H new ATOM 0 HH TYR B 28 115.282 -0.032 -14.927 1.00 0.00 H new ATOM 1368 N PHE B 29 108.640 -4.052 -14.351 1.00 0.00 N ATOM 1369 CA PHE B 29 108.930 -5.209 -13.512 1.00 0.00 C ATOM 1370 C PHE B 29 109.245 -6.431 -14.375 1.00 0.00 C ATOM 1371 O PHE B 29 110.216 -7.144 -14.123 1.00 0.00 O ATOM 1372 CB PHE B 29 107.724 -5.497 -12.610 1.00 0.00 C ATOM 1373 CG PHE B 29 107.899 -6.827 -11.905 1.00 0.00 C ATOM 1374 CD1 PHE B 29 109.010 -7.042 -11.079 1.00 0.00 C ATOM 1375 CD2 PHE B 29 106.951 -7.847 -12.080 1.00 0.00 C ATOM 1376 CE1 PHE B 29 109.172 -8.272 -10.429 1.00 0.00 C ATOM 1377 CE2 PHE B 29 107.114 -9.075 -11.430 1.00 0.00 C ATOM 1378 CZ PHE B 29 108.226 -9.287 -10.605 1.00 0.00 C ATOM 0 H PHE B 29 107.732 -3.621 -14.178 1.00 0.00 H new ATOM 0 HA PHE B 29 109.802 -4.992 -12.895 1.00 0.00 H new ATOM 0 HB2 PHE B 29 107.613 -4.700 -11.875 1.00 0.00 H new ATOM 0 HB3 PHE B 29 106.811 -5.511 -13.206 1.00 0.00 H new ATOM 0 HD1 PHE B 29 109.742 -6.259 -10.943 1.00 0.00 H new ATOM 0 HD2 PHE B 29 106.095 -7.684 -12.717 1.00 0.00 H new ATOM 0 HE1 PHE B 29 110.028 -8.437 -9.791 1.00 0.00 H new ATOM 0 HE2 PHE B 29 106.383 -9.859 -11.564 1.00 0.00 H new ATOM 0 HZ PHE B 29 108.353 -10.235 -10.104 1.00 0.00 H new ATOM 1388 N LEU B 30 108.419 -6.666 -15.387 1.00 0.00 N ATOM 1389 CA LEU B 30 108.620 -7.807 -16.273 1.00 0.00 C ATOM 1390 C LEU B 30 110.000 -7.737 -16.923 1.00 0.00 C ATOM 1391 O LEU B 30 110.719 -8.735 -16.979 1.00 0.00 O ATOM 1392 CB LEU B 30 107.530 -7.822 -17.354 1.00 0.00 C ATOM 1393 CG LEU B 30 107.800 -8.931 -18.382 1.00 0.00 C ATOM 1394 CD1 LEU B 30 107.971 -10.282 -17.673 1.00 0.00 C ATOM 1395 CD2 LEU B 30 106.616 -9.008 -19.351 1.00 0.00 C ATOM 0 H LEU B 30 107.610 -6.088 -15.614 1.00 0.00 H new ATOM 0 HA LEU B 30 108.557 -8.724 -15.688 1.00 0.00 H new ATOM 0 HB2 LEU B 30 106.555 -7.977 -16.892 1.00 0.00 H new ATOM 0 HB3 LEU B 30 107.495 -6.855 -17.856 1.00 0.00 H new ATOM 0 HG LEU B 30 108.716 -8.703 -18.927 1.00 0.00 H new ATOM 0 HD11 LEU B 30 108.162 -11.060 -18.413 1.00 0.00 H new ATOM 0 HD12 LEU B 30 108.811 -10.226 -16.981 1.00 0.00 H new ATOM 0 HD13 LEU B 30 107.062 -10.521 -17.122 1.00 0.00 H new ATOM 0 HD21 LEU B 30 106.797 -9.793 -20.086 1.00 0.00 H new ATOM 0 HD22 LEU B 30 105.706 -9.234 -18.796 1.00 0.00 H new ATOM 0 HD23 LEU B 30 106.501 -8.052 -19.862 1.00 0.00 H new ATOM 1407 N GLY B 31 110.361 -6.556 -17.410 1.00 0.00 N ATOM 1408 CA GLY B 31 111.658 -6.372 -18.052 1.00 0.00 C ATOM 1409 C GLY B 31 111.743 -5.007 -18.726 1.00 0.00 C ATOM 1410 O GLY B 31 111.983 -3.993 -18.070 1.00 0.00 O ATOM 0 H GLY B 31 109.781 -5.718 -17.374 1.00 0.00 H new ATOM 0 HA2 GLY B 31 112.452 -6.466 -17.311 1.00 0.00 H new ATOM 0 HA3 GLY B 31 111.817 -7.157 -18.791 1.00 0.00 H new ATOM 1414 N ARG B 32 111.546 -4.988 -20.040 1.00 0.00 N ATOM 1415 CA ARG B 32 111.604 -3.740 -20.792 1.00 0.00 C ATOM 1416 C ARG B 32 110.356 -2.901 -20.522 1.00 0.00 C ATOM 1417 O ARG B 32 109.232 -3.357 -20.733 1.00 0.00 O ATOM 1418 CB ARG B 32 111.722 -4.045 -22.295 1.00 0.00 C ATOM 1419 CG ARG B 32 112.392 -2.872 -23.024 1.00 0.00 C ATOM 1420 CD ARG B 32 111.552 -1.599 -22.861 1.00 0.00 C ATOM 1421 NE ARG B 32 111.849 -0.957 -21.585 1.00 0.00 N ATOM 1422 CZ ARG B 32 112.966 -0.257 -21.414 1.00 0.00 C ATOM 1423 NH1 ARG B 32 113.815 -0.133 -22.396 1.00 0.00 N ATOM 1424 NH2 ARG B 32 113.212 0.308 -20.263 1.00 0.00 N ATOM 0 H ARG B 32 111.346 -5.815 -20.602 1.00 0.00 H new ATOM 0 HA ARG B 32 112.479 -3.174 -20.473 1.00 0.00 H new ATOM 0 HB2 ARG B 32 112.303 -4.955 -22.444 1.00 0.00 H new ATOM 0 HB3 ARG B 32 110.733 -4.226 -22.715 1.00 0.00 H new ATOM 0 HG2 ARG B 32 113.393 -2.710 -22.624 1.00 0.00 H new ATOM 0 HG3 ARG B 32 112.506 -3.109 -24.082 1.00 0.00 H new ATOM 0 HD2 ARG B 32 111.760 -0.910 -23.680 1.00 0.00 H new ATOM 0 HD3 ARG B 32 110.492 -1.845 -22.914 1.00 0.00 H new ATOM 0 HE ARG B 32 111.189 -1.047 -20.812 1.00 0.00 H new ATOM 0 HH11 ARG B 32 113.622 -0.573 -23.296 1.00 0.00 H new ATOM 0 HH12 ARG B 32 114.672 0.404 -22.264 1.00 0.00 H new ATOM 0 HH21 ARG B 32 112.547 0.212 -19.495 1.00 0.00 H new ATOM 0 HH22 ARG B 32 114.069 0.845 -20.131 1.00 0.00 H new TER 1438 ARG B 32