USER MOD reduce.3.24.130724 H: found=0, std=0, add=826, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 824 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 51 THR OG1 : rot 80:sc= 0.952 USER MOD Set 1.2: A 55 THR OG1 : rot 6:sc= 1.06 USER MOD Single : A 1 GLY N :NH3+ -114:sc= 0.0785 (180deg=0) USER MOD Single : A 2 SER OG : rot 38:sc= 0.428 USER MOD Single : A 3 SER OG : rot 18:sc= 0.494 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 49:sc= 0.715 USER MOD Single : A 12 SER OG : rot 180:sc=-0.00567 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 CYS SG : rot -9:sc= -1.13 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 31:sc= 0.204 USER MOD Single : A 26 LYS NZ :NH3+ -114:sc= -0.802 (180deg=-4.18!) USER MOD Single : A 27 THR OG1 : rot 160:sc= -0.631 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 2:sc= 0.363! USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 CYS SG : rot -120:sc= -0.293 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0.0369 X(o=0.037,f=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.452 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot -168:sc= 0.225 USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.017 USER MOD Single : A 77 LYS NZ :NH3+ 156:sc= -0.0677 (180deg=-0.374) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 37:sc= 1.27 USER MOD Single : A 84 TYR OH : rot 30:sc= 0 USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot 67:sc= -0.505 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.00355 USER MOD Single : A 107 THR OG1 : rot -55:sc= 0.617 USER MOD Single : A 115 ASN : amide:sc= -0.0177 X(o=-0.018,f=0) USER MOD Single : A 117 CYS SG : rot 40:sc= -1.37 USER MOD Single : A 119 SER OG : rot 22:sc= 0.211 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.282 -42.787 -8.922 1.00 0.00 N ATOM 2 CA GLY A 1 -3.503 -41.369 -9.136 1.00 0.00 C ATOM 3 C GLY A 1 -2.540 -40.778 -10.147 1.00 0.00 C ATOM 4 O GLY A 1 -1.530 -41.394 -10.485 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.104 -43.322 -9.267 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.431 -43.088 -9.439 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.152 -42.969 -7.906 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.526 -41.211 -9.478 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.399 -40.841 -8.188 1.00 0.00 H new ATOM 8 N SER A 2 -2.854 -39.580 -10.630 1.00 0.00 N ATOM 9 CA SER A 2 -2.011 -38.908 -11.613 1.00 0.00 C ATOM 10 C SER A 2 -2.444 -37.457 -11.797 1.00 0.00 C ATOM 11 O SER A 2 -3.574 -37.181 -12.200 1.00 0.00 O ATOM 12 CB SER A 2 -2.067 -39.644 -12.953 1.00 0.00 C ATOM 13 OG SER A 2 -3.397 -39.722 -13.436 1.00 0.00 O ATOM 0 H SER A 2 -3.685 -39.055 -10.357 1.00 0.00 H new ATOM 0 HA SER A 2 -0.985 -38.919 -11.244 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.442 -39.128 -13.682 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.659 -40.648 -12.837 1.00 0.00 H new ATOM 0 HG SER A 2 -3.866 -38.884 -13.239 1.00 0.00 H new ATOM 19 N SER A 3 -1.536 -36.532 -11.501 1.00 0.00 N ATOM 20 CA SER A 3 -1.824 -35.109 -11.630 1.00 0.00 C ATOM 21 C SER A 3 -0.543 -34.314 -11.868 1.00 0.00 C ATOM 22 O SER A 3 0.557 -34.798 -11.606 1.00 0.00 O ATOM 23 CB SER A 3 -2.530 -34.594 -10.374 1.00 0.00 C ATOM 24 OG SER A 3 -3.910 -34.913 -10.399 1.00 0.00 O ATOM 0 H SER A 3 -0.595 -36.743 -11.170 1.00 0.00 H new ATOM 0 HA SER A 3 -2.480 -34.973 -12.490 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.068 -35.031 -9.488 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.404 -33.514 -10.299 1.00 0.00 H new ATOM 0 HG SER A 3 -4.069 -35.628 -11.050 1.00 0.00 H new ATOM 30 N GLY A 4 -0.696 -33.092 -12.367 1.00 0.00 N ATOM 31 CA GLY A 4 0.455 -32.249 -12.634 1.00 0.00 C ATOM 32 C GLY A 4 0.738 -31.280 -11.504 1.00 0.00 C ATOM 33 O GLY A 4 1.514 -31.581 -10.598 1.00 0.00 O ATOM 0 H GLY A 4 -1.597 -32.670 -12.591 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.331 -32.877 -12.798 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.286 -31.690 -13.554 1.00 0.00 H new ATOM 37 N SER A 5 0.106 -30.111 -11.558 1.00 0.00 N ATOM 38 CA SER A 5 0.298 -29.090 -10.534 1.00 0.00 C ATOM 39 C SER A 5 -0.965 -28.919 -9.695 1.00 0.00 C ATOM 40 O SER A 5 -2.075 -29.158 -10.169 1.00 0.00 O ATOM 41 CB SER A 5 0.680 -27.757 -11.179 1.00 0.00 C ATOM 42 OG SER A 5 1.888 -27.872 -11.912 1.00 0.00 O ATOM 0 H SER A 5 -0.543 -29.848 -12.300 1.00 0.00 H new ATOM 0 HA SER A 5 1.107 -29.414 -9.879 1.00 0.00 H new ATOM 0 HB2 SER A 5 -0.121 -27.427 -11.841 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.790 -26.995 -10.408 1.00 0.00 H new ATOM 0 HG SER A 5 2.109 -27.007 -12.316 1.00 0.00 H new ATOM 48 N SER A 6 -0.785 -28.504 -8.445 1.00 0.00 N ATOM 49 CA SER A 6 -1.909 -28.304 -7.537 1.00 0.00 C ATOM 50 C SER A 6 -1.946 -26.867 -7.027 1.00 0.00 C ATOM 51 O SER A 6 -0.925 -26.182 -6.994 1.00 0.00 O ATOM 52 CB SER A 6 -1.817 -29.274 -6.357 1.00 0.00 C ATOM 53 OG SER A 6 -0.691 -28.984 -5.546 1.00 0.00 O ATOM 0 H SER A 6 0.128 -28.300 -8.038 1.00 0.00 H new ATOM 0 HA SER A 6 -2.829 -28.499 -8.088 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.726 -29.211 -5.759 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.749 -30.297 -6.727 1.00 0.00 H new ATOM 0 HG SER A 6 -0.655 -29.616 -4.798 1.00 0.00 H new ATOM 59 N GLY A 7 -3.133 -26.416 -6.632 1.00 0.00 N ATOM 60 CA GLY A 7 -3.283 -25.063 -6.129 1.00 0.00 C ATOM 61 C GLY A 7 -4.447 -24.332 -6.769 1.00 0.00 C ATOM 62 O GLY A 7 -4.253 -23.488 -7.646 1.00 0.00 O ATOM 0 H GLY A 7 -3.993 -26.964 -6.651 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.427 -25.094 -5.049 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.364 -24.507 -6.312 1.00 0.00 H new ATOM 66 N THR A 8 -5.660 -24.657 -6.333 1.00 0.00 N ATOM 67 CA THR A 8 -6.859 -24.028 -6.871 1.00 0.00 C ATOM 68 C THR A 8 -7.363 -22.926 -5.948 1.00 0.00 C ATOM 69 O THR A 8 -7.994 -23.197 -4.927 1.00 0.00 O ATOM 70 CB THR A 8 -7.985 -25.056 -7.086 1.00 0.00 C ATOM 71 OG1 THR A 8 -8.270 -25.734 -5.857 1.00 0.00 O ATOM 72 CG2 THR A 8 -7.596 -26.070 -8.151 1.00 0.00 C ATOM 0 H THR A 8 -5.838 -25.353 -5.608 1.00 0.00 H new ATOM 0 HA THR A 8 -6.584 -23.595 -7.833 1.00 0.00 H new ATOM 0 HB THR A 8 -8.874 -24.523 -7.422 1.00 0.00 H new ATOM 0 HG1 THR A 8 -8.380 -25.077 -5.139 1.00 0.00 H new ATOM 0 HG21 THR A 8 -8.407 -26.786 -8.285 1.00 0.00 H new ATOM 0 HG22 THR A 8 -7.407 -25.554 -9.093 1.00 0.00 H new ATOM 0 HG23 THR A 8 -6.694 -26.597 -7.839 1.00 0.00 H new ATOM 80 N GLY A 9 -7.081 -21.678 -6.313 1.00 0.00 N ATOM 81 CA GLY A 9 -7.514 -20.553 -5.505 1.00 0.00 C ATOM 82 C GLY A 9 -7.975 -19.379 -6.347 1.00 0.00 C ATOM 83 O GLY A 9 -7.172 -18.741 -7.027 1.00 0.00 O ATOM 0 H GLY A 9 -6.561 -21.427 -7.154 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.327 -20.870 -4.852 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -6.694 -20.235 -4.861 1.00 0.00 H new ATOM 87 N ASP A 10 -9.272 -19.095 -6.303 1.00 0.00 N ATOM 88 CA ASP A 10 -9.839 -17.991 -7.068 1.00 0.00 C ATOM 89 C ASP A 10 -9.471 -16.649 -6.440 1.00 0.00 C ATOM 90 O ASP A 10 -9.304 -16.547 -5.226 1.00 0.00 O ATOM 91 CB ASP A 10 -11.361 -18.128 -7.151 1.00 0.00 C ATOM 92 CG ASP A 10 -11.791 -19.497 -7.639 1.00 0.00 C ATOM 93 OD1 ASP A 10 -11.774 -20.449 -6.830 1.00 0.00 O ATOM 94 OD2 ASP A 10 -12.148 -19.617 -8.830 1.00 0.00 O ATOM 0 H ASP A 10 -9.950 -19.614 -5.746 1.00 0.00 H new ATOM 0 HA ASP A 10 -9.423 -18.028 -8.075 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -11.794 -17.943 -6.168 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -11.756 -17.365 -7.822 1.00 0.00 H new ATOM 99 N ALA A 11 -9.346 -15.625 -7.278 1.00 0.00 N ATOM 100 CA ALA A 11 -8.998 -14.291 -6.805 1.00 0.00 C ATOM 101 C ALA A 11 -10.230 -13.393 -6.740 1.00 0.00 C ATOM 102 O ALA A 11 -10.492 -12.756 -5.720 1.00 0.00 O ATOM 103 CB ALA A 11 -7.938 -13.672 -7.704 1.00 0.00 C ATOM 0 H ALA A 11 -9.480 -15.694 -8.287 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.594 -14.384 -5.797 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -7.688 -12.676 -7.339 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -7.045 -14.296 -7.696 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.321 -13.600 -8.722 1.00 0.00 H new ATOM 109 N SER A 12 -10.982 -13.349 -7.835 1.00 0.00 N ATOM 110 CA SER A 12 -12.183 -12.525 -7.903 1.00 0.00 C ATOM 111 C SER A 12 -13.051 -12.725 -6.664 1.00 0.00 C ATOM 112 O SER A 12 -13.742 -11.808 -6.220 1.00 0.00 O ATOM 113 CB SER A 12 -12.987 -12.862 -9.161 1.00 0.00 C ATOM 114 OG SER A 12 -12.254 -12.547 -10.333 1.00 0.00 O ATOM 0 H SER A 12 -10.781 -13.874 -8.686 1.00 0.00 H new ATOM 0 HA SER A 12 -11.875 -11.480 -7.945 1.00 0.00 H new ATOM 0 HB2 SER A 12 -13.241 -13.922 -9.161 1.00 0.00 H new ATOM 0 HB3 SER A 12 -13.926 -12.309 -9.156 1.00 0.00 H new ATOM 0 HG SER A 12 -12.788 -12.773 -11.123 1.00 0.00 H new ATOM 120 N LYS A 13 -13.010 -13.933 -6.110 1.00 0.00 N ATOM 121 CA LYS A 13 -13.789 -14.255 -4.922 1.00 0.00 C ATOM 122 C LYS A 13 -13.230 -13.544 -3.693 1.00 0.00 C ATOM 123 O LYS A 13 -13.977 -13.162 -2.792 1.00 0.00 O ATOM 124 CB LYS A 13 -13.797 -15.768 -4.687 1.00 0.00 C ATOM 125 CG LYS A 13 -14.219 -16.570 -5.906 1.00 0.00 C ATOM 126 CD LYS A 13 -15.676 -16.321 -6.259 1.00 0.00 C ATOM 127 CE LYS A 13 -16.609 -17.173 -5.412 1.00 0.00 C ATOM 128 NZ LYS A 13 -18.029 -16.746 -5.549 1.00 0.00 N ATOM 0 H LYS A 13 -12.445 -14.704 -6.466 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.811 -13.912 -5.085 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.800 -16.085 -4.381 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.471 -15.996 -3.861 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -13.588 -16.305 -6.754 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.066 -17.632 -5.715 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.912 -15.267 -6.113 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -15.838 -16.541 -7.314 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -16.514 -18.218 -5.707 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -16.310 -17.109 -4.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -18.632 -17.351 -4.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.125 -15.756 -5.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.323 -16.832 -6.543 1.00 0.00 H new ATOM 142 N CYS A 14 -11.914 -13.368 -3.666 1.00 0.00 N ATOM 143 CA CYS A 14 -11.255 -12.701 -2.548 1.00 0.00 C ATOM 144 C CYS A 14 -11.746 -11.265 -2.407 1.00 0.00 C ATOM 145 O CYS A 14 -12.326 -10.701 -3.335 1.00 0.00 O ATOM 146 CB CYS A 14 -9.737 -12.718 -2.741 1.00 0.00 C ATOM 147 SG CYS A 14 -8.798 -12.726 -1.196 1.00 0.00 S ATOM 0 H CYS A 14 -11.282 -13.677 -4.405 1.00 0.00 H new ATOM 0 HA CYS A 14 -11.504 -13.242 -1.635 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -9.465 -13.598 -3.324 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -9.446 -11.846 -3.326 1.00 0.00 H new ATOM 0 HG CYS A 14 -9.603 -12.511 -0.198 1.00 0.00 H new ATOM 153 N LEU A 15 -11.512 -10.677 -1.238 1.00 0.00 N ATOM 154 CA LEU A 15 -11.932 -9.306 -0.973 1.00 0.00 C ATOM 155 C LEU A 15 -10.809 -8.510 -0.315 1.00 0.00 C ATOM 156 O LEU A 15 -9.891 -9.081 0.271 1.00 0.00 O ATOM 157 CB LEU A 15 -13.172 -9.296 -0.077 1.00 0.00 C ATOM 158 CG LEU A 15 -14.519 -9.366 -0.796 1.00 0.00 C ATOM 159 CD1 LEU A 15 -14.916 -10.812 -1.046 1.00 0.00 C ATOM 160 CD2 LEU A 15 -15.593 -8.649 0.011 1.00 0.00 C ATOM 0 H LEU A 15 -11.033 -11.129 -0.459 1.00 0.00 H new ATOM 0 HA LEU A 15 -12.176 -8.836 -1.926 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -13.106 -10.139 0.611 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -13.152 -8.389 0.527 1.00 0.00 H new ATOM 0 HG LEU A 15 -14.421 -8.865 -1.759 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -15.877 -10.842 -1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.160 -11.295 -1.665 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -14.996 -11.337 -0.094 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -16.545 -8.709 -0.516 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -15.689 -9.121 0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -15.314 -7.603 0.139 1.00 0.00 H new ATOM 172 N ALA A 16 -10.891 -7.187 -0.416 1.00 0.00 N ATOM 173 CA ALA A 16 -9.885 -6.312 0.172 1.00 0.00 C ATOM 174 C ALA A 16 -10.532 -5.227 1.026 1.00 0.00 C ATOM 175 O ALA A 16 -11.236 -4.357 0.513 1.00 0.00 O ATOM 176 CB ALA A 16 -9.026 -5.688 -0.918 1.00 0.00 C ATOM 0 H ALA A 16 -11.644 -6.698 -0.900 1.00 0.00 H new ATOM 0 HA ALA A 16 -9.249 -6.915 0.820 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.279 -5.037 -0.464 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.526 -6.475 -1.483 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.657 -5.104 -1.589 1.00 0.00 H new ATOM 182 N THR A 17 -10.288 -5.284 2.332 1.00 0.00 N ATOM 183 CA THR A 17 -10.849 -4.307 3.257 1.00 0.00 C ATOM 184 C THR A 17 -9.748 -3.537 3.977 1.00 0.00 C ATOM 185 O THR A 17 -8.615 -4.005 4.080 1.00 0.00 O ATOM 186 CB THR A 17 -11.758 -4.980 4.303 1.00 0.00 C ATOM 187 OG1 THR A 17 -11.047 -6.032 4.965 1.00 0.00 O ATOM 188 CG2 THR A 17 -13.011 -5.543 3.648 1.00 0.00 C ATOM 0 H THR A 17 -9.706 -5.996 2.773 1.00 0.00 H new ATOM 0 HA THR A 17 -11.444 -3.614 2.662 1.00 0.00 H new ATOM 0 HB THR A 17 -12.055 -4.227 5.033 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.631 -6.454 5.629 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.638 -6.013 4.406 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.565 -4.736 3.169 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.729 -6.284 2.900 1.00 0.00 H new ATOM 196 N GLY A 18 -10.090 -2.353 4.476 1.00 0.00 N ATOM 197 CA GLY A 18 -9.118 -1.538 5.182 1.00 0.00 C ATOM 198 C GLY A 18 -9.114 -0.099 4.705 1.00 0.00 C ATOM 199 O GLY A 18 -9.499 0.205 3.575 1.00 0.00 O ATOM 0 H GLY A 18 -11.022 -1.944 4.404 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.334 -1.563 6.250 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.124 -1.965 5.048 1.00 0.00 H new ATOM 203 N PRO A 19 -8.671 0.817 5.580 1.00 0.00 N ATOM 204 CA PRO A 19 -8.608 2.248 5.264 1.00 0.00 C ATOM 205 C PRO A 19 -7.531 2.567 4.233 1.00 0.00 C ATOM 206 O PRO A 19 -7.625 3.558 3.510 1.00 0.00 O ATOM 207 CB PRO A 19 -8.268 2.893 6.610 1.00 0.00 C ATOM 208 CG PRO A 19 -7.571 1.823 7.377 1.00 0.00 C ATOM 209 CD PRO A 19 -8.196 0.527 6.943 1.00 0.00 C ATOM 0 HA PRO A 19 -9.538 2.610 4.825 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.630 3.767 6.480 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -9.167 3.229 7.127 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -6.501 1.829 7.170 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -7.689 1.973 8.450 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -7.474 -0.290 6.952 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -9.015 0.236 7.601 1.00 0.00 H new ATOM 217 N GLY A 20 -6.507 1.721 4.171 1.00 0.00 N ATOM 218 CA GLY A 20 -5.427 1.932 3.225 1.00 0.00 C ATOM 219 C GLY A 20 -5.902 1.905 1.787 1.00 0.00 C ATOM 220 O GLY A 20 -5.460 2.709 0.965 1.00 0.00 O ATOM 0 H GLY A 20 -6.406 0.894 4.759 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.952 2.891 3.429 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.668 1.163 3.368 1.00 0.00 H new ATOM 224 N ILE A 21 -6.805 0.979 1.480 1.00 0.00 N ATOM 225 CA ILE A 21 -7.341 0.852 0.130 1.00 0.00 C ATOM 226 C ILE A 21 -8.482 1.836 -0.103 1.00 0.00 C ATOM 227 O ILE A 21 -9.274 1.674 -1.032 1.00 0.00 O ATOM 228 CB ILE A 21 -7.844 -0.577 -0.142 1.00 0.00 C ATOM 229 CG1 ILE A 21 -8.934 -0.958 0.863 1.00 0.00 C ATOM 230 CG2 ILE A 21 -6.691 -1.566 -0.082 1.00 0.00 C ATOM 231 CD1 ILE A 21 -9.606 -2.277 0.554 1.00 0.00 C ATOM 0 H ILE A 21 -7.181 0.306 2.148 1.00 0.00 H new ATOM 0 HA ILE A 21 -6.526 1.078 -0.557 1.00 0.00 H new ATOM 0 HB ILE A 21 -8.272 -0.610 -1.144 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -8.496 -1.007 1.860 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -9.688 -0.171 0.884 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -7.064 -2.572 -0.276 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.947 -1.303 -0.834 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -6.235 -1.533 0.907 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -10.367 -2.483 1.307 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -10.073 -2.226 -0.429 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.863 -3.074 0.561 1.00 0.00 H new ATOM 243 N ALA A 22 -8.560 2.856 0.746 1.00 0.00 N ATOM 244 CA ALA A 22 -9.603 3.868 0.629 1.00 0.00 C ATOM 245 C ALA A 22 -9.374 4.753 -0.591 1.00 0.00 C ATOM 246 O ALA A 22 -8.247 5.158 -0.874 1.00 0.00 O ATOM 247 CB ALA A 22 -9.661 4.712 1.893 1.00 0.00 C ATOM 0 H ALA A 22 -7.914 3.003 1.522 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.558 3.359 0.501 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -10.444 5.464 1.793 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -9.880 4.072 2.748 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.701 5.206 2.045 1.00 0.00 H new ATOM 253 N SER A 23 -10.452 5.051 -1.310 1.00 0.00 N ATOM 254 CA SER A 23 -10.367 5.885 -2.503 1.00 0.00 C ATOM 255 C SER A 23 -9.427 7.064 -2.277 1.00 0.00 C ATOM 256 O SER A 23 -8.626 7.412 -3.146 1.00 0.00 O ATOM 257 CB SER A 23 -11.756 6.395 -2.895 1.00 0.00 C ATOM 258 OG SER A 23 -11.693 7.214 -4.049 1.00 0.00 O ATOM 0 H SER A 23 -11.393 4.728 -1.087 1.00 0.00 H new ATOM 0 HA SER A 23 -9.968 5.275 -3.314 1.00 0.00 H new ATOM 0 HB2 SER A 23 -12.418 5.549 -3.082 1.00 0.00 H new ATOM 0 HB3 SER A 23 -12.186 6.960 -2.068 1.00 0.00 H new ATOM 0 HG SER A 23 -12.593 7.525 -4.279 1.00 0.00 H new ATOM 264 N THR A 24 -9.528 7.677 -1.101 1.00 0.00 N ATOM 265 CA THR A 24 -8.688 8.817 -0.759 1.00 0.00 C ATOM 266 C THR A 24 -8.086 8.660 0.632 1.00 0.00 C ATOM 267 O THR A 24 -8.797 8.383 1.599 1.00 0.00 O ATOM 268 CB THR A 24 -9.481 10.137 -0.817 1.00 0.00 C ATOM 269 OG1 THR A 24 -10.498 10.142 0.192 1.00 0.00 O ATOM 270 CG2 THR A 24 -10.117 10.327 -2.185 1.00 0.00 C ATOM 0 H THR A 24 -10.184 7.402 -0.370 1.00 0.00 H new ATOM 0 HA THR A 24 -7.886 8.850 -1.497 1.00 0.00 H new ATOM 0 HB THR A 24 -8.788 10.959 -0.639 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.197 9.616 0.962 1.00 0.00 H new ATOM 0 HG21 THR A 24 -10.671 11.265 -2.201 1.00 0.00 H new ATOM 0 HG22 THR A 24 -9.339 10.352 -2.948 1.00 0.00 H new ATOM 0 HG23 THR A 24 -10.798 9.500 -2.388 1.00 0.00 H new ATOM 278 N VAL A 25 -6.773 8.839 0.729 1.00 0.00 N ATOM 279 CA VAL A 25 -6.076 8.718 2.003 1.00 0.00 C ATOM 280 C VAL A 25 -5.299 9.988 2.328 1.00 0.00 C ATOM 281 O VAL A 25 -5.033 10.808 1.449 1.00 0.00 O ATOM 282 CB VAL A 25 -5.105 7.522 2.001 1.00 0.00 C ATOM 283 CG1 VAL A 25 -5.867 6.215 1.840 1.00 0.00 C ATOM 284 CG2 VAL A 25 -4.066 7.681 0.901 1.00 0.00 C ATOM 0 H VAL A 25 -6.170 9.069 -0.061 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.838 8.557 2.766 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.586 7.497 2.959 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.164 5.382 1.841 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.569 6.099 2.666 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.415 6.227 0.898 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.388 6.827 0.914 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.565 7.733 -0.066 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.499 8.597 1.066 1.00 0.00 H new ATOM 294 N LYS A 26 -4.936 10.146 3.596 1.00 0.00 N ATOM 295 CA LYS A 26 -4.187 11.316 4.039 1.00 0.00 C ATOM 296 C LYS A 26 -2.686 11.043 4.010 1.00 0.00 C ATOM 297 O LYS A 26 -2.227 9.990 4.452 1.00 0.00 O ATOM 298 CB LYS A 26 -4.617 11.718 5.451 1.00 0.00 C ATOM 299 CG LYS A 26 -4.216 13.134 5.828 1.00 0.00 C ATOM 300 CD LYS A 26 -4.895 13.582 7.112 1.00 0.00 C ATOM 301 CE LYS A 26 -4.902 15.097 7.240 1.00 0.00 C ATOM 302 NZ LYS A 26 -5.522 15.544 8.518 1.00 0.00 N ATOM 0 H LYS A 26 -5.149 9.477 4.336 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.403 12.136 3.354 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.700 11.622 5.534 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.179 11.022 6.167 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -3.134 13.187 5.950 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -4.479 13.815 5.019 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -5.919 13.209 7.132 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.380 13.146 7.968 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -3.880 15.471 7.182 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -5.447 15.530 6.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.403 16.058 8.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.733 14.715 9.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.863 16.171 9.023 1.00 0.00 H new ATOM 316 N THR A 27 -1.924 12.002 3.489 1.00 0.00 N ATOM 317 CA THR A 27 -0.476 11.866 3.405 1.00 0.00 C ATOM 318 C THR A 27 0.160 11.878 4.790 1.00 0.00 C ATOM 319 O THR A 27 -0.422 12.390 5.746 1.00 0.00 O ATOM 320 CB THR A 27 0.145 12.991 2.557 1.00 0.00 C ATOM 321 OG1 THR A 27 -0.209 14.267 3.101 1.00 0.00 O ATOM 322 CG2 THR A 27 -0.324 12.902 1.112 1.00 0.00 C ATOM 0 H THR A 27 -2.287 12.881 3.119 1.00 0.00 H new ATOM 0 HA THR A 27 -0.276 10.907 2.926 1.00 0.00 H new ATOM 0 HB THR A 27 1.229 12.876 2.578 1.00 0.00 H new ATOM 0 HG1 THR A 27 0.420 14.946 2.779 1.00 0.00 H new ATOM 0 HG21 THR A 27 0.128 13.707 0.533 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.027 11.941 0.692 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.410 12.994 1.075 1.00 0.00 H new ATOM 330 N GLY A 28 1.358 11.313 4.891 1.00 0.00 N ATOM 331 CA GLY A 28 2.054 11.271 6.165 1.00 0.00 C ATOM 332 C GLY A 28 1.538 10.171 7.071 1.00 0.00 C ATOM 333 O GLY A 28 2.319 9.483 7.727 1.00 0.00 O ATOM 0 H GLY A 28 1.860 10.883 4.114 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.119 11.123 5.989 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.945 12.232 6.667 1.00 0.00 H new ATOM 337 N GLU A 29 0.220 10.005 7.107 1.00 0.00 N ATOM 338 CA GLU A 29 -0.398 8.981 7.942 1.00 0.00 C ATOM 339 C GLU A 29 -0.099 7.586 7.402 1.00 0.00 C ATOM 340 O GLU A 29 0.139 7.409 6.208 1.00 0.00 O ATOM 341 CB GLU A 29 -1.911 9.198 8.018 1.00 0.00 C ATOM 342 CG GLU A 29 -2.315 10.362 8.909 1.00 0.00 C ATOM 343 CD GLU A 29 -3.780 10.319 9.296 1.00 0.00 C ATOM 344 OE1 GLU A 29 -4.635 10.315 8.385 1.00 0.00 O ATOM 345 OE2 GLU A 29 -4.072 10.288 10.510 1.00 0.00 O ATOM 0 H GLU A 29 -0.440 10.566 6.568 1.00 0.00 H new ATOM 0 HA GLU A 29 0.024 9.062 8.944 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.296 9.370 7.013 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.382 8.287 8.388 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.704 10.353 9.812 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.107 11.299 8.393 1.00 0.00 H new ATOM 352 N GLU A 30 -0.116 6.598 8.291 1.00 0.00 N ATOM 353 CA GLU A 30 0.153 5.218 7.904 1.00 0.00 C ATOM 354 C GLU A 30 -1.121 4.379 7.959 1.00 0.00 C ATOM 355 O GLU A 30 -1.684 4.155 9.029 1.00 0.00 O ATOM 356 CB GLU A 30 1.219 4.607 8.817 1.00 0.00 C ATOM 357 CG GLU A 30 1.537 3.157 8.495 1.00 0.00 C ATOM 358 CD GLU A 30 2.960 2.778 8.856 1.00 0.00 C ATOM 359 OE1 GLU A 30 3.832 3.673 8.856 1.00 0.00 O ATOM 360 OE2 GLU A 30 3.203 1.587 9.138 1.00 0.00 O ATOM 0 H GLU A 30 -0.313 6.727 9.283 1.00 0.00 H new ATOM 0 HA GLU A 30 0.522 5.221 6.878 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.133 5.196 8.740 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.882 4.675 9.851 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.845 2.509 9.033 1.00 0.00 H new ATOM 0 HG3 GLU A 30 1.377 2.981 7.431 1.00 0.00 H new ATOM 367 N VAL A 31 -1.567 3.916 6.796 1.00 0.00 N ATOM 368 CA VAL A 31 -2.773 3.101 6.710 1.00 0.00 C ATOM 369 C VAL A 31 -2.463 1.630 6.966 1.00 0.00 C ATOM 370 O VAL A 31 -1.300 1.238 7.061 1.00 0.00 O ATOM 371 CB VAL A 31 -3.447 3.239 5.331 1.00 0.00 C ATOM 372 CG1 VAL A 31 -3.861 4.681 5.081 1.00 0.00 C ATOM 373 CG2 VAL A 31 -2.518 2.744 4.232 1.00 0.00 C ATOM 0 H VAL A 31 -1.111 4.091 5.900 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.455 3.465 7.478 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.345 2.621 5.321 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.335 4.759 4.103 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.565 4.996 5.851 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.980 5.323 5.110 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -3.010 2.849 3.265 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.601 3.333 4.238 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.277 1.695 4.405 1.00 0.00 H new ATOM 383 N GLY A 32 -3.511 0.821 7.076 1.00 0.00 N ATOM 384 CA GLY A 32 -3.329 -0.599 7.320 1.00 0.00 C ATOM 385 C GLY A 32 -4.529 -1.419 6.892 1.00 0.00 C ATOM 386 O GLY A 32 -5.529 -1.489 7.607 1.00 0.00 O ATOM 0 H GLY A 32 -4.483 1.122 7.001 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.446 -0.946 6.784 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -3.142 -0.761 8.382 1.00 0.00 H new ATOM 390 N PHE A 33 -4.432 -2.041 5.721 1.00 0.00 N ATOM 391 CA PHE A 33 -5.519 -2.859 5.197 1.00 0.00 C ATOM 392 C PHE A 33 -5.165 -4.341 5.263 1.00 0.00 C ATOM 393 O PHE A 33 -3.999 -4.707 5.411 1.00 0.00 O ATOM 394 CB PHE A 33 -5.835 -2.461 3.754 1.00 0.00 C ATOM 395 CG PHE A 33 -4.757 -2.837 2.779 1.00 0.00 C ATOM 396 CD1 PHE A 33 -3.653 -2.020 2.597 1.00 0.00 C ATOM 397 CD2 PHE A 33 -4.847 -4.008 2.044 1.00 0.00 C ATOM 398 CE1 PHE A 33 -2.658 -2.363 1.702 1.00 0.00 C ATOM 399 CE2 PHE A 33 -3.855 -4.356 1.147 1.00 0.00 C ATOM 400 CZ PHE A 33 -2.760 -3.533 0.975 1.00 0.00 C ATOM 0 H PHE A 33 -3.611 -1.994 5.117 1.00 0.00 H new ATOM 0 HA PHE A 33 -6.400 -2.687 5.815 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.769 -2.934 3.451 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -5.995 -1.384 3.709 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -3.569 -1.103 3.162 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -5.701 -4.656 2.173 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -1.802 -1.718 1.571 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.936 -5.272 0.580 1.00 0.00 H new ATOM 0 HZ PHE A 33 -1.985 -3.803 0.273 1.00 0.00 H new ATOM 410 N VAL A 34 -6.181 -5.192 5.152 1.00 0.00 N ATOM 411 CA VAL A 34 -5.978 -6.636 5.197 1.00 0.00 C ATOM 412 C VAL A 34 -6.908 -7.352 4.224 1.00 0.00 C ATOM 413 O VAL A 34 -8.070 -6.976 4.068 1.00 0.00 O ATOM 414 CB VAL A 34 -6.211 -7.190 6.615 1.00 0.00 C ATOM 415 CG1 VAL A 34 -7.589 -6.799 7.123 1.00 0.00 C ATOM 416 CG2 VAL A 34 -6.036 -8.701 6.630 1.00 0.00 C ATOM 0 H VAL A 34 -7.153 -4.906 5.030 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.943 -6.820 4.908 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.469 -6.754 7.283 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -7.734 -7.200 8.126 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.672 -5.713 7.151 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -8.351 -7.204 6.457 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -6.204 -9.077 7.639 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.754 -9.157 5.949 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.024 -8.953 6.313 1.00 0.00 H new ATOM 426 N VAL A 35 -6.389 -8.386 3.571 1.00 0.00 N ATOM 427 CA VAL A 35 -7.172 -9.158 2.614 1.00 0.00 C ATOM 428 C VAL A 35 -7.909 -10.302 3.302 1.00 0.00 C ATOM 429 O VAL A 35 -7.320 -11.055 4.077 1.00 0.00 O ATOM 430 CB VAL A 35 -6.284 -9.733 1.494 1.00 0.00 C ATOM 431 CG1 VAL A 35 -7.073 -10.707 0.633 1.00 0.00 C ATOM 432 CG2 VAL A 35 -5.702 -8.611 0.648 1.00 0.00 C ATOM 0 H VAL A 35 -5.428 -8.709 3.687 1.00 0.00 H new ATOM 0 HA VAL A 35 -7.898 -8.474 2.175 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.459 -10.278 1.952 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.429 -11.102 -0.152 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.437 -11.527 1.252 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.920 -10.190 0.182 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.077 -9.035 -0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.512 -8.037 0.198 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -5.099 -7.956 1.277 1.00 0.00 H new ATOM 442 N ASP A 36 -9.199 -10.426 3.012 1.00 0.00 N ATOM 443 CA ASP A 36 -10.017 -11.480 3.602 1.00 0.00 C ATOM 444 C ASP A 36 -10.492 -12.461 2.534 1.00 0.00 C ATOM 445 O ASP A 36 -11.107 -12.066 1.544 1.00 0.00 O ATOM 446 CB ASP A 36 -11.220 -10.876 4.327 1.00 0.00 C ATOM 447 CG ASP A 36 -11.697 -11.741 5.477 1.00 0.00 C ATOM 448 OD1 ASP A 36 -12.472 -12.686 5.227 1.00 0.00 O ATOM 449 OD2 ASP A 36 -11.295 -11.472 6.629 1.00 0.00 O ATOM 0 H ASP A 36 -9.701 -9.810 2.372 1.00 0.00 H new ATOM 0 HA ASP A 36 -9.403 -12.022 4.322 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -10.955 -9.889 4.705 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.036 -10.737 3.618 1.00 0.00 H new ATOM 454 N ALA A 37 -10.199 -13.740 2.743 1.00 0.00 N ATOM 455 CA ALA A 37 -10.597 -14.778 1.799 1.00 0.00 C ATOM 456 C ALA A 37 -11.558 -15.770 2.445 1.00 0.00 C ATOM 457 O ALA A 37 -11.265 -16.337 3.498 1.00 0.00 O ATOM 458 CB ALA A 37 -9.370 -15.502 1.262 1.00 0.00 C ATOM 0 H ALA A 37 -9.688 -14.083 3.557 1.00 0.00 H new ATOM 0 HA ALA A 37 -11.116 -14.299 0.969 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.682 -16.274 0.559 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.720 -14.789 0.754 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.828 -15.962 2.088 1.00 0.00 H new ATOM 464 N LYS A 38 -12.706 -15.974 1.810 1.00 0.00 N ATOM 465 CA LYS A 38 -13.711 -16.898 2.323 1.00 0.00 C ATOM 466 C LYS A 38 -13.709 -18.200 1.527 1.00 0.00 C ATOM 467 O LYS A 38 -13.576 -19.285 2.094 1.00 0.00 O ATOM 468 CB LYS A 38 -15.100 -16.257 2.267 1.00 0.00 C ATOM 469 CG LYS A 38 -15.103 -14.781 2.633 1.00 0.00 C ATOM 470 CD LYS A 38 -16.454 -14.344 3.172 1.00 0.00 C ATOM 471 CE LYS A 38 -16.643 -12.841 3.050 1.00 0.00 C ATOM 472 NZ LYS A 38 -17.046 -12.441 1.674 1.00 0.00 N ATOM 0 H LYS A 38 -12.965 -15.512 0.938 1.00 0.00 H new ATOM 0 HA LYS A 38 -13.464 -17.125 3.360 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -15.505 -16.375 1.262 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -15.766 -16.792 2.944 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.333 -14.589 3.380 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -14.851 -14.187 1.755 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -17.247 -14.857 2.628 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -16.542 -14.639 4.218 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -17.401 -12.512 3.760 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -15.715 -12.336 3.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -17.165 -11.409 1.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -16.311 -12.732 0.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -17.945 -12.903 1.427 1.00 0.00 H new ATOM 486 N THR A 39 -13.856 -18.085 0.211 1.00 0.00 N ATOM 487 CA THR A 39 -13.872 -19.251 -0.661 1.00 0.00 C ATOM 488 C THR A 39 -12.736 -19.194 -1.676 1.00 0.00 C ATOM 489 O THR A 39 -12.378 -20.205 -2.279 1.00 0.00 O ATOM 490 CB THR A 39 -15.211 -19.374 -1.413 1.00 0.00 C ATOM 491 OG1 THR A 39 -15.064 -20.250 -2.536 1.00 0.00 O ATOM 492 CG2 THR A 39 -15.693 -18.011 -1.885 1.00 0.00 C ATOM 0 H THR A 39 -13.966 -17.194 -0.274 1.00 0.00 H new ATOM 0 HA THR A 39 -13.742 -20.124 -0.022 1.00 0.00 H new ATOM 0 HB THR A 39 -15.951 -19.786 -0.727 1.00 0.00 H new ATOM 0 HG1 THR A 39 -14.149 -20.601 -2.559 1.00 0.00 H new ATOM 0 HG21 THR A 39 -16.640 -18.123 -2.413 1.00 0.00 H new ATOM 0 HG22 THR A 39 -15.833 -17.356 -1.025 1.00 0.00 H new ATOM 0 HG23 THR A 39 -14.953 -17.575 -2.556 1.00 0.00 H new ATOM 500 N ALA A 40 -12.173 -18.004 -1.860 1.00 0.00 N ATOM 501 CA ALA A 40 -11.075 -17.815 -2.800 1.00 0.00 C ATOM 502 C ALA A 40 -10.110 -18.995 -2.762 1.00 0.00 C ATOM 503 O ALA A 40 -9.538 -19.377 -3.783 1.00 0.00 O ATOM 504 CB ALA A 40 -10.339 -16.519 -2.499 1.00 0.00 C ATOM 0 H ALA A 40 -12.459 -17.156 -1.370 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.496 -17.756 -3.804 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.522 -16.391 -3.209 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -11.029 -15.680 -2.586 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.937 -16.555 -1.486 1.00 0.00 H new ATOM 510 N GLY A 41 -9.932 -19.571 -1.576 1.00 0.00 N ATOM 511 CA GLY A 41 -9.036 -20.702 -1.428 1.00 0.00 C ATOM 512 C GLY A 41 -7.652 -20.287 -0.966 1.00 0.00 C ATOM 513 O GLY A 41 -7.501 -19.312 -0.230 1.00 0.00 O ATOM 0 H GLY A 41 -10.393 -19.274 -0.716 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.459 -21.406 -0.712 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -8.956 -21.226 -2.381 1.00 0.00 H new ATOM 517 N LYS A 42 -6.639 -21.030 -1.397 1.00 0.00 N ATOM 518 CA LYS A 42 -5.260 -20.737 -1.024 1.00 0.00 C ATOM 519 C LYS A 42 -4.588 -19.859 -2.075 1.00 0.00 C ATOM 520 O LYS A 42 -5.099 -19.698 -3.183 1.00 0.00 O ATOM 521 CB LYS A 42 -4.470 -22.035 -0.847 1.00 0.00 C ATOM 522 CG LYS A 42 -3.118 -21.838 -0.183 1.00 0.00 C ATOM 523 CD LYS A 42 -2.615 -23.126 0.447 1.00 0.00 C ATOM 524 CE LYS A 42 -1.095 -23.165 0.496 1.00 0.00 C ATOM 525 NZ LYS A 42 -0.595 -24.261 1.372 1.00 0.00 N ATOM 0 H LYS A 42 -6.747 -21.841 -2.006 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.273 -20.196 -0.078 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -5.060 -22.731 -0.251 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.322 -22.497 -1.823 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.397 -21.487 -0.921 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.196 -21.064 0.581 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -3.015 -23.219 1.457 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.984 -23.979 -0.122 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.703 -23.299 -0.512 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.719 -22.209 0.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.445 -24.253 1.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -0.948 -24.120 2.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.932 -25.176 1.010 1.00 0.00 H new ATOM 539 N GLY A 43 -3.438 -19.294 -1.720 1.00 0.00 N ATOM 540 CA GLY A 43 -2.714 -18.441 -2.644 1.00 0.00 C ATOM 541 C GLY A 43 -1.949 -17.339 -1.939 1.00 0.00 C ATOM 542 O GLY A 43 -2.325 -16.912 -0.847 1.00 0.00 O ATOM 0 H GLY A 43 -2.995 -19.412 -0.809 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.019 -19.047 -3.224 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.416 -17.997 -3.350 1.00 0.00 H new ATOM 546 N LYS A 44 -0.870 -16.877 -2.562 1.00 0.00 N ATOM 547 CA LYS A 44 -0.048 -15.818 -1.988 1.00 0.00 C ATOM 548 C LYS A 44 -0.493 -14.450 -2.495 1.00 0.00 C ATOM 549 O LYS A 44 -0.610 -14.230 -3.700 1.00 0.00 O ATOM 550 CB LYS A 44 1.425 -16.046 -2.330 1.00 0.00 C ATOM 551 CG LYS A 44 2.122 -17.024 -1.398 1.00 0.00 C ATOM 552 CD LYS A 44 3.625 -17.031 -1.619 1.00 0.00 C ATOM 553 CE LYS A 44 4.276 -18.247 -0.981 1.00 0.00 C ATOM 554 NZ LYS A 44 4.280 -19.420 -1.898 1.00 0.00 N ATOM 0 H LYS A 44 -0.544 -17.220 -3.466 1.00 0.00 H new ATOM 0 HA LYS A 44 -0.171 -15.843 -0.905 1.00 0.00 H new ATOM 0 HB2 LYS A 44 1.499 -16.416 -3.353 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.949 -15.091 -2.298 1.00 0.00 H new ATOM 0 HG2 LYS A 44 1.907 -16.758 -0.363 1.00 0.00 H new ATOM 0 HG3 LYS A 44 1.725 -18.026 -1.558 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.837 -17.023 -2.688 1.00 0.00 H new ATOM 0 HD3 LYS A 44 4.060 -16.123 -1.201 1.00 0.00 H new ATOM 0 HE2 LYS A 44 5.300 -18.004 -0.698 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.745 -18.504 -0.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 4.732 -20.228 -1.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 3.302 -19.668 -2.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 4.809 -19.184 -2.762 1.00 0.00 H new ATOM 568 N VAL A 45 -0.739 -13.531 -1.565 1.00 0.00 N ATOM 569 CA VAL A 45 -1.168 -12.182 -1.917 1.00 0.00 C ATOM 570 C VAL A 45 -0.003 -11.202 -1.855 1.00 0.00 C ATOM 571 O VAL A 45 0.512 -10.899 -0.777 1.00 0.00 O ATOM 572 CB VAL A 45 -2.291 -11.690 -0.987 1.00 0.00 C ATOM 573 CG1 VAL A 45 -2.700 -10.270 -1.347 1.00 0.00 C ATOM 574 CG2 VAL A 45 -3.485 -12.630 -1.048 1.00 0.00 C ATOM 0 H VAL A 45 -0.648 -13.696 -0.563 1.00 0.00 H new ATOM 0 HA VAL A 45 -1.547 -12.226 -2.938 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.915 -11.685 0.036 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.495 -9.940 -0.678 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -1.841 -9.607 -1.245 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.058 -10.244 -2.376 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.269 -12.266 -0.384 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -3.864 -12.671 -2.069 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -3.179 -13.628 -0.735 1.00 0.00 H new ATOM 584 N THR A 46 0.410 -10.705 -3.017 1.00 0.00 N ATOM 585 CA THR A 46 1.515 -9.759 -3.095 1.00 0.00 C ATOM 586 C THR A 46 1.008 -8.342 -3.344 1.00 0.00 C ATOM 587 O THR A 46 0.114 -8.127 -4.164 1.00 0.00 O ATOM 588 CB THR A 46 2.505 -10.141 -4.211 1.00 0.00 C ATOM 589 OG1 THR A 46 1.817 -10.245 -5.462 1.00 0.00 O ATOM 590 CG2 THR A 46 3.194 -11.459 -3.894 1.00 0.00 C ATOM 0 H THR A 46 -0.005 -10.943 -3.918 1.00 0.00 H new ATOM 0 HA THR A 46 2.030 -9.795 -2.135 1.00 0.00 H new ATOM 0 HB THR A 46 3.262 -9.360 -4.278 1.00 0.00 H new ATOM 0 HG1 THR A 46 2.454 -10.487 -6.167 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.889 -11.709 -4.696 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.741 -11.367 -2.956 1.00 0.00 H new ATOM 0 HG23 THR A 46 2.447 -12.247 -3.803 1.00 0.00 H new ATOM 598 N CYS A 47 1.585 -7.379 -2.634 1.00 0.00 N ATOM 599 CA CYS A 47 1.192 -5.982 -2.778 1.00 0.00 C ATOM 600 C CYS A 47 2.363 -5.134 -3.263 1.00 0.00 C ATOM 601 O CYS A 47 3.516 -5.393 -2.917 1.00 0.00 O ATOM 602 CB CYS A 47 0.669 -5.438 -1.448 1.00 0.00 C ATOM 603 SG CYS A 47 0.439 -3.645 -1.424 1.00 0.00 S ATOM 0 H CYS A 47 2.327 -7.540 -1.953 1.00 0.00 H new ATOM 0 HA CYS A 47 0.397 -5.929 -3.522 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -0.282 -5.919 -1.220 1.00 0.00 H new ATOM 0 HB3 CYS A 47 1.364 -5.715 -0.656 1.00 0.00 H new ATOM 0 HG CYS A 47 1.185 -3.124 -0.495 1.00 0.00 H new ATOM 609 N THR A 48 2.061 -4.121 -4.070 1.00 0.00 N ATOM 610 CA THR A 48 3.089 -3.238 -4.605 1.00 0.00 C ATOM 611 C THR A 48 2.582 -1.803 -4.703 1.00 0.00 C ATOM 612 O THR A 48 1.750 -1.485 -5.551 1.00 0.00 O ATOM 613 CB THR A 48 3.557 -3.701 -5.997 1.00 0.00 C ATOM 614 OG1 THR A 48 4.044 -5.046 -5.928 1.00 0.00 O ATOM 615 CG2 THR A 48 4.650 -2.788 -6.531 1.00 0.00 C ATOM 0 H THR A 48 1.112 -3.892 -4.367 1.00 0.00 H new ATOM 0 HA THR A 48 3.932 -3.277 -3.915 1.00 0.00 H new ATOM 0 HB THR A 48 2.705 -3.658 -6.676 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.338 -5.333 -6.818 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.965 -3.135 -7.515 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.268 -1.770 -6.610 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.502 -2.804 -5.851 1.00 0.00 H new ATOM 623 N VAL A 49 3.093 -0.940 -3.830 1.00 0.00 N ATOM 624 CA VAL A 49 2.694 0.463 -3.819 1.00 0.00 C ATOM 625 C VAL A 49 3.436 1.252 -4.891 1.00 0.00 C ATOM 626 O VAL A 49 4.661 1.374 -4.853 1.00 0.00 O ATOM 627 CB VAL A 49 2.956 1.110 -2.447 1.00 0.00 C ATOM 628 CG1 VAL A 49 2.550 2.575 -2.461 1.00 0.00 C ATOM 629 CG2 VAL A 49 2.217 0.354 -1.352 1.00 0.00 C ATOM 0 H VAL A 49 3.784 -1.188 -3.122 1.00 0.00 H new ATOM 0 HA VAL A 49 1.624 0.490 -4.026 1.00 0.00 H new ATOM 0 HB VAL A 49 4.024 1.056 -2.237 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.743 3.015 -1.483 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.128 3.105 -3.218 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.488 2.656 -2.693 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.413 0.825 -0.389 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.146 0.375 -1.555 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.562 -0.680 -1.327 1.00 0.00 H new ATOM 639 N LEU A 50 2.686 1.790 -5.847 1.00 0.00 N ATOM 640 CA LEU A 50 3.273 2.570 -6.931 1.00 0.00 C ATOM 641 C LEU A 50 3.074 4.064 -6.695 1.00 0.00 C ATOM 642 O LEU A 50 1.954 4.526 -6.478 1.00 0.00 O ATOM 643 CB LEU A 50 2.652 2.167 -8.270 1.00 0.00 C ATOM 644 CG LEU A 50 3.322 2.738 -9.520 1.00 0.00 C ATOM 645 CD1 LEU A 50 4.602 1.979 -9.834 1.00 0.00 C ATOM 646 CD2 LEU A 50 2.369 2.692 -10.705 1.00 0.00 C ATOM 0 H LEU A 50 1.671 1.700 -5.893 1.00 0.00 H new ATOM 0 HA LEU A 50 4.343 2.363 -6.957 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.664 1.079 -8.341 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.606 2.475 -8.270 1.00 0.00 H new ATOM 0 HG LEU A 50 3.579 3.779 -9.326 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.065 2.400 -10.727 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.291 2.064 -8.994 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.369 0.928 -10.007 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.863 3.102 -11.586 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.080 1.659 -10.900 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.480 3.281 -10.480 1.00 0.00 H new ATOM 658 N THR A 51 4.170 4.816 -6.742 1.00 0.00 N ATOM 659 CA THR A 51 4.117 6.258 -6.536 1.00 0.00 C ATOM 660 C THR A 51 3.776 6.987 -7.830 1.00 0.00 C ATOM 661 O THR A 51 4.065 6.516 -8.930 1.00 0.00 O ATOM 662 CB THR A 51 5.453 6.797 -5.992 1.00 0.00 C ATOM 663 OG1 THR A 51 6.520 6.450 -6.882 1.00 0.00 O ATOM 664 CG2 THR A 51 5.739 6.237 -4.606 1.00 0.00 C ATOM 0 H THR A 51 5.105 4.450 -6.921 1.00 0.00 H new ATOM 0 HA THR A 51 3.333 6.443 -5.802 1.00 0.00 H new ATOM 0 HB THR A 51 5.379 7.882 -5.920 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.531 7.073 -7.638 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.688 6.632 -4.243 1.00 0.00 H new ATOM 0 HG22 THR A 51 4.940 6.528 -3.924 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.794 5.150 -4.657 1.00 0.00 H new ATOM 672 N PRO A 52 3.148 8.166 -7.699 1.00 0.00 N ATOM 673 CA PRO A 52 2.757 8.985 -8.849 1.00 0.00 C ATOM 674 C PRO A 52 3.958 9.595 -9.563 1.00 0.00 C ATOM 675 O PRO A 52 3.808 10.304 -10.558 1.00 0.00 O ATOM 676 CB PRO A 52 1.893 10.084 -8.224 1.00 0.00 C ATOM 677 CG PRO A 52 2.365 10.179 -6.814 1.00 0.00 C ATOM 678 CD PRO A 52 2.773 8.787 -6.418 1.00 0.00 C ATOM 0 HA PRO A 52 2.242 8.398 -9.610 1.00 0.00 H new ATOM 0 HB2 PRO A 52 2.017 11.032 -8.748 1.00 0.00 H new ATOM 0 HB3 PRO A 52 0.834 9.830 -8.271 1.00 0.00 H new ATOM 0 HG2 PRO A 52 3.204 10.870 -6.729 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.575 10.554 -6.163 1.00 0.00 H new ATOM 0 HD2 PRO A 52 3.607 8.797 -5.716 1.00 0.00 H new ATOM 0 HD3 PRO A 52 1.956 8.251 -5.935 1.00 0.00 H new ATOM 686 N ASP A 53 5.151 9.313 -9.050 1.00 0.00 N ATOM 687 CA ASP A 53 6.380 9.831 -9.640 1.00 0.00 C ATOM 688 C ASP A 53 6.828 8.964 -10.812 1.00 0.00 C ATOM 689 O ASP A 53 7.485 9.442 -11.735 1.00 0.00 O ATOM 690 CB ASP A 53 7.487 9.900 -8.587 1.00 0.00 C ATOM 691 CG ASP A 53 7.469 11.203 -7.813 1.00 0.00 C ATOM 692 OD1 ASP A 53 7.152 12.249 -8.419 1.00 0.00 O ATOM 693 OD2 ASP A 53 7.773 11.179 -6.602 1.00 0.00 O ATOM 0 H ASP A 53 5.293 8.728 -8.226 1.00 0.00 H new ATOM 0 HA ASP A 53 6.180 10.836 -10.011 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.377 9.067 -7.893 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.455 9.783 -9.074 1.00 0.00 H new ATOM 698 N GLY A 54 6.469 7.684 -10.767 1.00 0.00 N ATOM 699 CA GLY A 54 6.844 6.770 -11.829 1.00 0.00 C ATOM 700 C GLY A 54 7.719 5.636 -11.336 1.00 0.00 C ATOM 701 O GLY A 54 8.494 5.060 -12.102 1.00 0.00 O ATOM 0 H GLY A 54 5.925 7.264 -10.013 1.00 0.00 H new ATOM 0 HA2 GLY A 54 5.943 6.358 -12.284 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.372 7.320 -12.608 1.00 0.00 H new ATOM 705 N THR A 55 7.599 5.312 -10.052 1.00 0.00 N ATOM 706 CA THR A 55 8.388 4.242 -9.457 1.00 0.00 C ATOM 707 C THR A 55 7.511 3.305 -8.633 1.00 0.00 C ATOM 708 O THR A 55 6.398 3.662 -8.249 1.00 0.00 O ATOM 709 CB THR A 55 9.508 4.802 -8.558 1.00 0.00 C ATOM 710 OG1 THR A 55 8.952 5.681 -7.574 1.00 0.00 O ATOM 711 CG2 THR A 55 10.543 5.547 -9.385 1.00 0.00 C ATOM 0 H THR A 55 6.962 5.776 -9.404 1.00 0.00 H new ATOM 0 HA THR A 55 8.837 3.686 -10.280 1.00 0.00 H new ATOM 0 HB THR A 55 9.998 3.965 -8.061 1.00 0.00 H new ATOM 0 HG1 THR A 55 7.974 5.662 -7.634 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.323 5.933 -8.729 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.985 4.867 -10.113 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.064 6.376 -9.906 1.00 0.00 H new ATOM 719 N GLU A 56 8.021 2.107 -8.365 1.00 0.00 N ATOM 720 CA GLU A 56 7.283 1.120 -7.587 1.00 0.00 C ATOM 721 C GLU A 56 8.026 0.774 -6.301 1.00 0.00 C ATOM 722 O GLU A 56 9.171 0.325 -6.335 1.00 0.00 O ATOM 723 CB GLU A 56 7.055 -0.147 -8.414 1.00 0.00 C ATOM 724 CG GLU A 56 8.325 -0.938 -8.679 1.00 0.00 C ATOM 725 CD GLU A 56 8.269 -1.714 -9.981 1.00 0.00 C ATOM 726 OE1 GLU A 56 7.184 -2.230 -10.318 1.00 0.00 O ATOM 727 OE2 GLU A 56 9.312 -1.803 -10.663 1.00 0.00 O ATOM 0 H GLU A 56 8.942 1.797 -8.675 1.00 0.00 H new ATOM 0 HA GLU A 56 6.318 1.552 -7.323 1.00 0.00 H new ATOM 0 HB2 GLU A 56 6.341 -0.786 -7.895 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.603 0.128 -9.367 1.00 0.00 H new ATOM 0 HG2 GLU A 56 9.175 -0.256 -8.703 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.496 -1.631 -7.855 1.00 0.00 H new ATOM 734 N ALA A 57 7.366 0.988 -5.167 1.00 0.00 N ATOM 735 CA ALA A 57 7.963 0.698 -3.870 1.00 0.00 C ATOM 736 C ALA A 57 7.364 -0.565 -3.260 1.00 0.00 C ATOM 737 O ALA A 57 6.325 -1.048 -3.707 1.00 0.00 O ATOM 738 CB ALA A 57 7.778 1.880 -2.928 1.00 0.00 C ATOM 0 H ALA A 57 6.418 1.361 -5.121 1.00 0.00 H new ATOM 0 HA ALA A 57 9.029 0.528 -4.018 1.00 0.00 H new ATOM 0 HB1 ALA A 57 8.229 1.650 -1.963 1.00 0.00 H new ATOM 0 HB2 ALA A 57 8.259 2.762 -3.352 1.00 0.00 H new ATOM 0 HB3 ALA A 57 6.714 2.076 -2.794 1.00 0.00 H new ATOM 744 N GLU A 58 8.029 -1.095 -2.237 1.00 0.00 N ATOM 745 CA GLU A 58 7.562 -2.304 -1.568 1.00 0.00 C ATOM 746 C GLU A 58 6.641 -1.959 -0.401 1.00 0.00 C ATOM 747 O GLU A 58 6.507 -0.794 -0.027 1.00 0.00 O ATOM 748 CB GLU A 58 8.750 -3.128 -1.068 1.00 0.00 C ATOM 749 CG GLU A 58 9.707 -3.549 -2.172 1.00 0.00 C ATOM 750 CD GLU A 58 8.992 -4.159 -3.362 1.00 0.00 C ATOM 751 OE1 GLU A 58 8.342 -5.212 -3.190 1.00 0.00 O ATOM 752 OE2 GLU A 58 9.081 -3.583 -4.466 1.00 0.00 O ATOM 0 H GLU A 58 8.891 -0.707 -1.854 1.00 0.00 H new ATOM 0 HA GLU A 58 6.998 -2.894 -2.291 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.298 -2.547 -0.326 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.377 -4.019 -0.563 1.00 0.00 H new ATOM 0 HG2 GLU A 58 10.279 -2.682 -2.502 1.00 0.00 H new ATOM 0 HG3 GLU A 58 10.421 -4.269 -1.773 1.00 0.00 H new ATOM 759 N ALA A 59 6.009 -2.979 0.168 1.00 0.00 N ATOM 760 CA ALA A 59 5.103 -2.785 1.293 1.00 0.00 C ATOM 761 C ALA A 59 5.251 -3.906 2.317 1.00 0.00 C ATOM 762 O ALA A 59 5.569 -5.042 1.967 1.00 0.00 O ATOM 763 CB ALA A 59 3.664 -2.702 0.803 1.00 0.00 C ATOM 0 H ALA A 59 6.108 -3.949 -0.132 1.00 0.00 H new ATOM 0 HA ALA A 59 5.365 -1.846 1.781 1.00 0.00 H new ATOM 0 HB1 ALA A 59 2.998 -2.557 1.653 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.562 -1.863 0.115 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.401 -3.627 0.289 1.00 0.00 H new ATOM 769 N ASP A 60 5.018 -3.578 3.583 1.00 0.00 N ATOM 770 CA ASP A 60 5.125 -4.557 4.659 1.00 0.00 C ATOM 771 C ASP A 60 3.921 -5.492 4.663 1.00 0.00 C ATOM 772 O ASP A 60 2.798 -5.075 4.947 1.00 0.00 O ATOM 773 CB ASP A 60 5.245 -3.851 6.010 1.00 0.00 C ATOM 774 CG ASP A 60 6.097 -2.599 5.936 1.00 0.00 C ATOM 775 OD1 ASP A 60 7.237 -2.687 5.435 1.00 0.00 O ATOM 776 OD2 ASP A 60 5.625 -1.532 6.381 1.00 0.00 O ATOM 0 H ASP A 60 4.754 -2.642 3.890 1.00 0.00 H new ATOM 0 HA ASP A 60 6.023 -5.151 4.489 1.00 0.00 H new ATOM 0 HB2 ASP A 60 4.250 -3.589 6.369 1.00 0.00 H new ATOM 0 HB3 ASP A 60 5.676 -4.538 6.738 1.00 0.00 H new ATOM 781 N VAL A 61 4.161 -6.761 4.348 1.00 0.00 N ATOM 782 CA VAL A 61 3.097 -7.756 4.317 1.00 0.00 C ATOM 783 C VAL A 61 3.267 -8.780 5.434 1.00 0.00 C ATOM 784 O VAL A 61 4.314 -9.419 5.550 1.00 0.00 O ATOM 785 CB VAL A 61 3.056 -8.492 2.963 1.00 0.00 C ATOM 786 CG1 VAL A 61 1.965 -9.552 2.965 1.00 0.00 C ATOM 787 CG2 VAL A 61 2.848 -7.503 1.826 1.00 0.00 C ATOM 0 H VAL A 61 5.084 -7.124 4.111 1.00 0.00 H new ATOM 0 HA VAL A 61 2.159 -7.220 4.460 1.00 0.00 H new ATOM 0 HB VAL A 61 4.013 -8.990 2.810 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.951 -10.061 2.001 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.163 -10.276 3.755 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.999 -9.079 3.140 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.822 -8.039 0.877 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.905 -6.975 1.971 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.668 -6.785 1.814 1.00 0.00 H new ATOM 797 N ILE A 62 2.233 -8.930 6.253 1.00 0.00 N ATOM 798 CA ILE A 62 2.268 -9.877 7.361 1.00 0.00 C ATOM 799 C ILE A 62 1.231 -10.980 7.174 1.00 0.00 C ATOM 800 O ILE A 62 0.028 -10.733 7.242 1.00 0.00 O ATOM 801 CB ILE A 62 2.017 -9.176 8.709 1.00 0.00 C ATOM 802 CG1 ILE A 62 3.059 -8.080 8.940 1.00 0.00 C ATOM 803 CG2 ILE A 62 2.045 -10.188 9.845 1.00 0.00 C ATOM 804 CD1 ILE A 62 2.715 -6.770 8.265 1.00 0.00 C ATOM 0 H ILE A 62 1.360 -8.408 6.171 1.00 0.00 H new ATOM 0 HA ILE A 62 3.266 -10.316 7.369 1.00 0.00 H new ATOM 0 HB ILE A 62 1.030 -8.714 8.684 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.166 -7.911 10.011 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.026 -8.426 8.574 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.866 -9.678 10.791 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.270 -10.937 9.684 1.00 0.00 H new ATOM 0 HG23 ILE A 62 3.020 -10.675 9.874 1.00 0.00 H new ATOM 0 HD11 ILE A 62 3.496 -6.039 8.471 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.637 -6.925 7.189 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.763 -6.402 8.649 1.00 0.00 H new ATOM 816 N GLU A 63 1.708 -12.199 6.940 1.00 0.00 N ATOM 817 CA GLU A 63 0.822 -13.341 6.744 1.00 0.00 C ATOM 818 C GLU A 63 0.157 -13.745 8.056 1.00 0.00 C ATOM 819 O GLU A 63 0.777 -13.700 9.118 1.00 0.00 O ATOM 820 CB GLU A 63 1.600 -14.525 6.168 1.00 0.00 C ATOM 821 CG GLU A 63 2.524 -15.193 7.172 1.00 0.00 C ATOM 822 CD GLU A 63 3.304 -16.346 6.571 1.00 0.00 C ATOM 823 OE1 GLU A 63 3.544 -16.324 5.345 1.00 0.00 O ATOM 824 OE2 GLU A 63 3.676 -17.269 7.325 1.00 0.00 O ATOM 0 H GLU A 63 2.702 -12.421 6.882 1.00 0.00 H new ATOM 0 HA GLU A 63 0.045 -13.048 6.038 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.893 -15.264 5.790 1.00 0.00 H new ATOM 0 HB3 GLU A 63 2.189 -14.182 5.317 1.00 0.00 H new ATOM 0 HG2 GLU A 63 3.222 -14.454 7.566 1.00 0.00 H new ATOM 0 HG3 GLU A 63 1.936 -15.557 8.015 1.00 0.00 H new ATOM 831 N ASN A 64 -1.110 -14.138 7.975 1.00 0.00 N ATOM 832 CA ASN A 64 -1.860 -14.548 9.156 1.00 0.00 C ATOM 833 C ASN A 64 -2.257 -16.019 9.065 1.00 0.00 C ATOM 834 O ASN A 64 -2.306 -16.591 7.976 1.00 0.00 O ATOM 835 CB ASN A 64 -3.110 -13.681 9.318 1.00 0.00 C ATOM 836 CG ASN A 64 -2.856 -12.456 10.175 1.00 0.00 C ATOM 837 OD1 ASN A 64 -3.150 -12.448 11.371 1.00 0.00 O ATOM 838 ND2 ASN A 64 -2.308 -11.412 9.564 1.00 0.00 N ATOM 0 H ASN A 64 -1.639 -14.181 7.104 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.218 -14.416 10.027 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -3.461 -13.367 8.335 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -3.906 -14.276 9.766 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -2.114 -10.559 10.088 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.081 -11.464 8.571 1.00 0.00 H new ATOM 845 N GLU A 65 -2.537 -16.623 10.214 1.00 0.00 N ATOM 846 CA GLU A 65 -2.929 -18.027 10.263 1.00 0.00 C ATOM 847 C GLU A 65 -4.443 -18.175 10.130 1.00 0.00 C ATOM 848 O GLU A 65 -4.991 -19.257 10.338 1.00 0.00 O ATOM 849 CB GLU A 65 -2.456 -18.666 11.571 1.00 0.00 C ATOM 850 CG GLU A 65 -3.249 -18.219 12.788 1.00 0.00 C ATOM 851 CD GLU A 65 -2.990 -19.088 14.004 1.00 0.00 C ATOM 852 OE1 GLU A 65 -3.001 -20.328 13.861 1.00 0.00 O ATOM 853 OE2 GLU A 65 -2.776 -18.526 15.098 1.00 0.00 O ATOM 0 H GLU A 65 -2.500 -16.163 11.124 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.456 -18.539 9.425 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -2.524 -19.750 11.481 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -1.404 -18.424 11.724 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.994 -17.186 13.024 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -4.313 -18.239 12.551 1.00 0.00 H new ATOM 860 N ASP A 66 -5.109 -17.080 9.785 1.00 0.00 N ATOM 861 CA ASP A 66 -6.558 -17.086 9.623 1.00 0.00 C ATOM 862 C ASP A 66 -6.945 -16.824 8.170 1.00 0.00 C ATOM 863 O ASP A 66 -8.062 -16.398 7.882 1.00 0.00 O ATOM 864 CB ASP A 66 -7.199 -16.036 10.532 1.00 0.00 C ATOM 865 CG ASP A 66 -7.544 -16.588 11.900 1.00 0.00 C ATOM 866 OD1 ASP A 66 -8.163 -17.671 11.966 1.00 0.00 O ATOM 867 OD2 ASP A 66 -7.193 -15.938 12.907 1.00 0.00 O ATOM 0 H ASP A 66 -4.669 -16.176 9.612 1.00 0.00 H new ATOM 0 HA ASP A 66 -6.926 -18.073 9.905 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.518 -15.193 10.645 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -8.104 -15.654 10.059 1.00 0.00 H new ATOM 872 N GLY A 67 -6.011 -17.079 7.259 1.00 0.00 N ATOM 873 CA GLY A 67 -6.271 -16.863 5.848 1.00 0.00 C ATOM 874 C GLY A 67 -6.406 -15.393 5.501 1.00 0.00 C ATOM 875 O GLY A 67 -7.313 -15.001 4.766 1.00 0.00 O ATOM 0 H GLY A 67 -5.078 -17.432 7.473 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -5.462 -17.299 5.262 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -7.185 -17.385 5.566 1.00 0.00 H new ATOM 879 N THR A 68 -5.502 -14.576 6.033 1.00 0.00 N ATOM 880 CA THR A 68 -5.525 -13.142 5.779 1.00 0.00 C ATOM 881 C THR A 68 -4.113 -12.575 5.697 1.00 0.00 C ATOM 882 O THR A 68 -3.152 -13.214 6.126 1.00 0.00 O ATOM 883 CB THR A 68 -6.306 -12.389 6.873 1.00 0.00 C ATOM 884 OG1 THR A 68 -5.666 -12.571 8.143 1.00 0.00 O ATOM 885 CG2 THR A 68 -7.743 -12.881 6.949 1.00 0.00 C ATOM 0 H THR A 68 -4.745 -14.884 6.643 1.00 0.00 H new ATOM 0 HA THR A 68 -6.027 -12.999 4.822 1.00 0.00 H new ATOM 0 HB THR A 68 -6.315 -11.329 6.618 1.00 0.00 H new ATOM 0 HG1 THR A 68 -6.166 -12.088 8.834 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.274 -12.335 7.728 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.235 -12.716 5.991 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.751 -13.946 7.183 1.00 0.00 H new ATOM 893 N TYR A 69 -3.994 -11.373 5.144 1.00 0.00 N ATOM 894 CA TYR A 69 -2.697 -10.721 5.005 1.00 0.00 C ATOM 895 C TYR A 69 -2.795 -9.236 5.343 1.00 0.00 C ATOM 896 O TYR A 69 -3.515 -8.485 4.686 1.00 0.00 O ATOM 897 CB TYR A 69 -2.164 -10.898 3.581 1.00 0.00 C ATOM 898 CG TYR A 69 -1.720 -12.310 3.272 1.00 0.00 C ATOM 899 CD1 TYR A 69 -2.649 -13.310 3.012 1.00 0.00 C ATOM 900 CD2 TYR A 69 -0.372 -12.644 3.242 1.00 0.00 C ATOM 901 CE1 TYR A 69 -2.249 -14.601 2.730 1.00 0.00 C ATOM 902 CE2 TYR A 69 0.038 -13.933 2.958 1.00 0.00 C ATOM 903 CZ TYR A 69 -0.904 -14.907 2.703 1.00 0.00 C ATOM 904 OH TYR A 69 -0.501 -16.193 2.422 1.00 0.00 O ATOM 0 H TYR A 69 -4.780 -10.831 4.785 1.00 0.00 H new ATOM 0 HA TYR A 69 -2.006 -11.190 5.705 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -2.940 -10.607 2.873 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -1.324 -10.220 3.430 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -3.703 -13.073 3.031 1.00 0.00 H new ATOM 0 HD2 TYR A 69 0.368 -11.884 3.444 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -2.984 -15.367 2.532 1.00 0.00 H new ATOM 0 HE2 TYR A 69 1.090 -14.176 2.936 1.00 0.00 H new ATOM 0 HH TYR A 69 0.478 -16.241 2.441 1.00 0.00 H new ATOM 914 N ASP A 70 -2.063 -8.821 6.371 1.00 0.00 N ATOM 915 CA ASP A 70 -2.065 -7.427 6.796 1.00 0.00 C ATOM 916 C ASP A 70 -0.966 -6.641 6.088 1.00 0.00 C ATOM 917 O ASP A 70 0.204 -7.025 6.120 1.00 0.00 O ATOM 918 CB ASP A 70 -1.878 -7.333 8.312 1.00 0.00 C ATOM 919 CG ASP A 70 -3.159 -7.621 9.072 1.00 0.00 C ATOM 920 OD1 ASP A 70 -4.037 -6.734 9.110 1.00 0.00 O ATOM 921 OD2 ASP A 70 -3.283 -8.732 9.629 1.00 0.00 O ATOM 0 H ASP A 70 -1.461 -9.430 6.925 1.00 0.00 H new ATOM 0 HA ASP A 70 -3.028 -6.993 6.528 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.107 -8.037 8.625 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.522 -6.336 8.570 1.00 0.00 H new ATOM 926 N ILE A 71 -1.351 -5.542 5.448 1.00 0.00 N ATOM 927 CA ILE A 71 -0.399 -4.703 4.731 1.00 0.00 C ATOM 928 C ILE A 71 -0.566 -3.235 5.108 1.00 0.00 C ATOM 929 O ILE A 71 -1.678 -2.708 5.116 1.00 0.00 O ATOM 930 CB ILE A 71 -0.555 -4.851 3.206 1.00 0.00 C ATOM 931 CG1 ILE A 71 -0.449 -6.323 2.801 1.00 0.00 C ATOM 932 CG2 ILE A 71 0.496 -4.021 2.484 1.00 0.00 C ATOM 933 CD1 ILE A 71 -0.933 -6.598 1.395 1.00 0.00 C ATOM 0 H ILE A 71 -2.315 -5.212 5.411 1.00 0.00 H new ATOM 0 HA ILE A 71 0.597 -5.038 5.020 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.541 -4.485 2.919 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.590 -6.642 2.888 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.027 -6.927 3.500 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.373 -4.136 1.407 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.378 -2.971 2.753 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.490 -4.361 2.774 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.829 -7.661 1.176 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -1.981 -6.311 1.308 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.339 -6.021 0.686 1.00 0.00 H new ATOM 945 N PHE A 72 0.547 -2.579 5.419 1.00 0.00 N ATOM 946 CA PHE A 72 0.524 -1.171 5.796 1.00 0.00 C ATOM 947 C PHE A 72 1.441 -0.350 4.894 1.00 0.00 C ATOM 948 O PHE A 72 2.443 -0.854 4.385 1.00 0.00 O ATOM 949 CB PHE A 72 0.947 -1.005 7.257 1.00 0.00 C ATOM 950 CG PHE A 72 0.305 -2.000 8.183 1.00 0.00 C ATOM 951 CD1 PHE A 72 0.711 -3.323 8.187 1.00 0.00 C ATOM 952 CD2 PHE A 72 -0.703 -1.609 9.049 1.00 0.00 C ATOM 953 CE1 PHE A 72 0.124 -4.241 9.038 1.00 0.00 C ATOM 954 CE2 PHE A 72 -1.294 -2.521 9.902 1.00 0.00 C ATOM 955 CZ PHE A 72 -0.881 -3.839 9.896 1.00 0.00 C ATOM 0 H PHE A 72 1.476 -3.000 5.417 1.00 0.00 H new ATOM 0 HA PHE A 72 -0.496 -0.806 5.676 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.030 -1.102 7.327 1.00 0.00 H new ATOM 0 HB3 PHE A 72 0.695 0.003 7.588 1.00 0.00 H new ATOM 0 HD1 PHE A 72 1.496 -3.642 7.517 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -1.030 -0.580 9.057 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.451 -5.270 9.032 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -2.078 -2.204 10.573 1.00 0.00 H new ATOM 0 HZ PHE A 72 -1.343 -4.554 10.561 1.00 0.00 H new ATOM 965 N TYR A 73 1.091 0.916 4.699 1.00 0.00 N ATOM 966 CA TYR A 73 1.881 1.806 3.856 1.00 0.00 C ATOM 967 C TYR A 73 1.571 3.267 4.166 1.00 0.00 C ATOM 968 O TYR A 73 0.470 3.603 4.602 1.00 0.00 O ATOM 969 CB TYR A 73 1.608 1.517 2.379 1.00 0.00 C ATOM 970 CG TYR A 73 0.338 2.156 1.861 1.00 0.00 C ATOM 971 CD1 TYR A 73 0.283 3.518 1.592 1.00 0.00 C ATOM 972 CD2 TYR A 73 -0.804 1.397 1.641 1.00 0.00 C ATOM 973 CE1 TYR A 73 -0.876 4.105 1.121 1.00 0.00 C ATOM 974 CE2 TYR A 73 -1.966 1.976 1.169 1.00 0.00 C ATOM 975 CZ TYR A 73 -1.997 3.331 0.910 1.00 0.00 C ATOM 976 OH TYR A 73 -3.152 3.912 0.438 1.00 0.00 O ATOM 0 H TYR A 73 0.266 1.349 5.113 1.00 0.00 H new ATOM 0 HA TYR A 73 2.935 1.625 4.066 1.00 0.00 H new ATOM 0 HB2 TYR A 73 2.451 1.872 1.786 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.547 0.438 2.234 1.00 0.00 H new ATOM 0 HD1 TYR A 73 1.160 4.128 1.754 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -0.783 0.336 1.842 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.903 5.166 0.919 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -2.845 1.371 1.004 1.00 0.00 H new ATOM 0 HH TYR A 73 -3.895 3.279 0.524 1.00 0.00 H new ATOM 986 N THR A 74 2.552 4.135 3.937 1.00 0.00 N ATOM 987 CA THR A 74 2.386 5.560 4.192 1.00 0.00 C ATOM 988 C THR A 74 2.586 6.373 2.918 1.00 0.00 C ATOM 989 O THR A 74 3.476 6.084 2.119 1.00 0.00 O ATOM 990 CB THR A 74 3.373 6.057 5.265 1.00 0.00 C ATOM 991 OG1 THR A 74 3.226 5.286 6.461 1.00 0.00 O ATOM 992 CG2 THR A 74 3.142 7.529 5.573 1.00 0.00 C ATOM 0 H THR A 74 3.470 3.875 3.575 1.00 0.00 H new ATOM 0 HA THR A 74 1.367 5.700 4.553 1.00 0.00 H new ATOM 0 HB THR A 74 4.385 5.937 4.879 1.00 0.00 H new ATOM 0 HG1 THR A 74 3.858 5.607 7.137 1.00 0.00 H new ATOM 0 HG21 THR A 74 3.851 7.857 6.333 1.00 0.00 H new ATOM 0 HG22 THR A 74 3.284 8.117 4.666 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.125 7.669 5.940 1.00 0.00 H new ATOM 1000 N ALA A 75 1.752 7.393 2.735 1.00 0.00 N ATOM 1001 CA ALA A 75 1.840 8.249 1.558 1.00 0.00 C ATOM 1002 C ALA A 75 2.708 9.473 1.835 1.00 0.00 C ATOM 1003 O ALA A 75 2.236 10.469 2.382 1.00 0.00 O ATOM 1004 CB ALA A 75 0.450 8.675 1.111 1.00 0.00 C ATOM 0 H ALA A 75 1.009 7.646 3.386 1.00 0.00 H new ATOM 0 HA ALA A 75 2.308 7.678 0.756 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.530 9.314 0.231 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.140 7.792 0.865 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.038 9.225 1.915 1.00 0.00 H new ATOM 1010 N ALA A 76 3.977 9.391 1.452 1.00 0.00 N ATOM 1011 CA ALA A 76 4.910 10.493 1.657 1.00 0.00 C ATOM 1012 C ALA A 76 4.418 11.762 0.970 1.00 0.00 C ATOM 1013 O ALA A 76 4.250 12.801 1.607 1.00 0.00 O ATOM 1014 CB ALA A 76 6.293 10.116 1.149 1.00 0.00 C ATOM 0 H ALA A 76 4.383 8.573 0.998 1.00 0.00 H new ATOM 0 HA ALA A 76 4.971 10.691 2.727 1.00 0.00 H new ATOM 0 HB1 ALA A 76 6.979 10.948 1.309 1.00 0.00 H new ATOM 0 HB2 ALA A 76 6.653 9.240 1.689 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.240 9.889 0.084 1.00 0.00 H new ATOM 1020 N LYS A 77 4.191 11.672 -0.336 1.00 0.00 N ATOM 1021 CA LYS A 77 3.719 12.813 -1.111 1.00 0.00 C ATOM 1022 C LYS A 77 2.379 12.505 -1.771 1.00 0.00 C ATOM 1023 O LYS A 77 2.051 11.354 -2.060 1.00 0.00 O ATOM 1024 CB LYS A 77 4.750 13.192 -2.179 1.00 0.00 C ATOM 1025 CG LYS A 77 6.050 13.727 -1.605 1.00 0.00 C ATOM 1026 CD LYS A 77 5.893 15.153 -1.103 1.00 0.00 C ATOM 1027 CE LYS A 77 7.211 15.910 -1.154 1.00 0.00 C ATOM 1028 NZ LYS A 77 7.658 16.152 -2.554 1.00 0.00 N ATOM 0 H LYS A 77 4.326 10.820 -0.880 1.00 0.00 H new ATOM 0 HA LYS A 77 3.584 13.653 -0.429 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.966 12.316 -2.791 1.00 0.00 H new ATOM 0 HB3 LYS A 77 4.317 13.944 -2.839 1.00 0.00 H new ATOM 0 HG2 LYS A 77 6.378 13.086 -0.787 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.827 13.693 -2.368 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.150 15.673 -1.708 1.00 0.00 H new ATOM 0 HD3 LYS A 77 5.519 15.140 -0.079 1.00 0.00 H new ATOM 0 HE2 LYS A 77 7.102 16.864 -0.638 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.975 15.344 -0.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 8.292 16.976 -2.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 8.165 15.315 -2.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.830 16.334 -3.156 1.00 0.00 H new ATOM 1042 N PRO A 78 1.584 13.557 -2.018 1.00 0.00 N ATOM 1043 CA PRO A 78 0.268 13.424 -2.648 1.00 0.00 C ATOM 1044 C PRO A 78 0.365 13.030 -4.118 1.00 0.00 C ATOM 1045 O PRO A 78 1.449 13.028 -4.699 1.00 0.00 O ATOM 1046 CB PRO A 78 -0.335 14.825 -2.510 1.00 0.00 C ATOM 1047 CG PRO A 78 0.840 15.735 -2.416 1.00 0.00 C ATOM 1048 CD PRO A 78 1.911 14.957 -1.701 1.00 0.00 C ATOM 0 HA PRO A 78 -0.328 12.640 -2.182 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.960 15.073 -3.368 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -0.965 14.899 -1.624 1.00 0.00 H new ATOM 0 HG2 PRO A 78 1.176 16.042 -3.406 1.00 0.00 H new ATOM 0 HG3 PRO A 78 0.587 16.644 -1.870 1.00 0.00 H new ATOM 0 HD2 PRO A 78 2.907 15.227 -2.053 1.00 0.00 H new ATOM 0 HD3 PRO A 78 1.892 15.141 -0.627 1.00 0.00 H new ATOM 1056 N GLY A 79 -0.776 12.695 -4.713 1.00 0.00 N ATOM 1057 CA GLY A 79 -0.796 12.303 -6.111 1.00 0.00 C ATOM 1058 C GLY A 79 -1.602 11.041 -6.348 1.00 0.00 C ATOM 1059 O GLY A 79 -2.352 10.601 -5.476 1.00 0.00 O ATOM 0 H GLY A 79 -1.686 12.688 -4.253 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -1.214 13.115 -6.707 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.226 12.148 -6.456 1.00 0.00 H new ATOM 1063 N THR A 80 -1.449 10.457 -7.531 1.00 0.00 N ATOM 1064 CA THR A 80 -2.170 9.240 -7.882 1.00 0.00 C ATOM 1065 C THR A 80 -1.310 8.003 -7.642 1.00 0.00 C ATOM 1066 O THR A 80 -0.335 7.766 -8.355 1.00 0.00 O ATOM 1067 CB THR A 80 -2.623 9.259 -9.354 1.00 0.00 C ATOM 1068 OG1 THR A 80 -3.416 10.423 -9.608 1.00 0.00 O ATOM 1069 CG2 THR A 80 -3.423 8.011 -9.690 1.00 0.00 C ATOM 0 H THR A 80 -0.832 10.807 -8.263 1.00 0.00 H new ATOM 0 HA THR A 80 -3.050 9.198 -7.240 1.00 0.00 H new ATOM 0 HB THR A 80 -1.734 9.282 -9.984 1.00 0.00 H new ATOM 0 HG1 THR A 80 -3.698 10.428 -10.546 1.00 0.00 H new ATOM 0 HG21 THR A 80 -3.732 8.047 -10.735 1.00 0.00 H new ATOM 0 HG22 THR A 80 -2.806 7.128 -9.524 1.00 0.00 H new ATOM 0 HG23 THR A 80 -4.306 7.962 -9.052 1.00 0.00 H new ATOM 1077 N TYR A 81 -1.679 7.219 -6.635 1.00 0.00 N ATOM 1078 CA TYR A 81 -0.940 6.007 -6.301 1.00 0.00 C ATOM 1079 C TYR A 81 -1.643 4.770 -6.854 1.00 0.00 C ATOM 1080 O TYR A 81 -2.866 4.651 -6.779 1.00 0.00 O ATOM 1081 CB TYR A 81 -0.784 5.882 -4.784 1.00 0.00 C ATOM 1082 CG TYR A 81 0.313 6.753 -4.216 1.00 0.00 C ATOM 1083 CD1 TYR A 81 0.234 8.139 -4.287 1.00 0.00 C ATOM 1084 CD2 TYR A 81 1.428 6.191 -3.608 1.00 0.00 C ATOM 1085 CE1 TYR A 81 1.234 8.938 -3.769 1.00 0.00 C ATOM 1086 CE2 TYR A 81 2.433 6.983 -3.086 1.00 0.00 C ATOM 1087 CZ TYR A 81 2.332 8.356 -3.169 1.00 0.00 C ATOM 1088 OH TYR A 81 3.330 9.148 -2.652 1.00 0.00 O ATOM 0 H TYR A 81 -2.485 7.401 -6.036 1.00 0.00 H new ATOM 0 HA TYR A 81 0.047 6.077 -6.758 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.728 6.144 -4.307 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -0.578 4.842 -4.533 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.624 8.599 -4.755 1.00 0.00 H new ATOM 0 HD2 TYR A 81 1.511 5.116 -3.542 1.00 0.00 H new ATOM 0 HE1 TYR A 81 1.157 10.013 -3.833 1.00 0.00 H new ATOM 0 HE2 TYR A 81 3.293 6.529 -2.616 1.00 0.00 H new ATOM 0 HH TYR A 81 2.936 9.950 -2.250 1.00 0.00 H new ATOM 1098 N VAL A 82 -0.860 3.853 -7.412 1.00 0.00 N ATOM 1099 CA VAL A 82 -1.404 2.624 -7.977 1.00 0.00 C ATOM 1100 C VAL A 82 -0.926 1.403 -7.201 1.00 0.00 C ATOM 1101 O VAL A 82 0.250 1.043 -7.253 1.00 0.00 O ATOM 1102 CB VAL A 82 -1.010 2.464 -9.457 1.00 0.00 C ATOM 1103 CG1 VAL A 82 -1.484 1.123 -9.995 1.00 0.00 C ATOM 1104 CG2 VAL A 82 -1.574 3.609 -10.286 1.00 0.00 C ATOM 0 H VAL A 82 0.154 3.938 -7.485 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.489 2.696 -7.903 1.00 0.00 H new ATOM 0 HB VAL A 82 0.077 2.494 -9.530 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.196 1.029 -11.042 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.027 0.318 -9.419 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.569 1.060 -9.910 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.286 3.479 -11.329 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.661 3.614 -10.208 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.180 4.555 -9.915 1.00 0.00 H new ATOM 1114 N ILE A 83 -1.845 0.769 -6.481 1.00 0.00 N ATOM 1115 CA ILE A 83 -1.517 -0.413 -5.694 1.00 0.00 C ATOM 1116 C ILE A 83 -1.898 -1.691 -6.435 1.00 0.00 C ATOM 1117 O ILE A 83 -3.054 -1.880 -6.815 1.00 0.00 O ATOM 1118 CB ILE A 83 -2.229 -0.396 -4.328 1.00 0.00 C ATOM 1119 CG1 ILE A 83 -1.849 0.864 -3.547 1.00 0.00 C ATOM 1120 CG2 ILE A 83 -1.878 -1.644 -3.532 1.00 0.00 C ATOM 1121 CD1 ILE A 83 -2.693 1.087 -2.312 1.00 0.00 C ATOM 0 H ILE A 83 -2.823 1.054 -6.426 1.00 0.00 H new ATOM 0 HA ILE A 83 -0.439 -0.395 -5.534 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.306 -0.387 -4.496 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.801 0.798 -3.254 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -1.943 1.730 -4.202 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.389 -1.617 -2.569 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.193 -2.529 -4.085 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.801 -1.681 -3.370 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -2.368 1.997 -1.809 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.740 1.185 -2.600 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.581 0.239 -1.636 1.00 0.00 H new ATOM 1133 N TYR A 84 -0.918 -2.564 -6.640 1.00 0.00 N ATOM 1134 CA TYR A 84 -1.150 -3.824 -7.336 1.00 0.00 C ATOM 1135 C TYR A 84 -1.403 -4.957 -6.346 1.00 0.00 C ATOM 1136 O TYR A 84 -0.649 -5.142 -5.391 1.00 0.00 O ATOM 1137 CB TYR A 84 0.047 -4.166 -8.226 1.00 0.00 C ATOM 1138 CG TYR A 84 0.315 -3.140 -9.302 1.00 0.00 C ATOM 1139 CD1 TYR A 84 -0.692 -2.734 -10.169 1.00 0.00 C ATOM 1140 CD2 TYR A 84 1.576 -2.575 -9.453 1.00 0.00 C ATOM 1141 CE1 TYR A 84 -0.452 -1.797 -11.155 1.00 0.00 C ATOM 1142 CE2 TYR A 84 1.825 -1.636 -10.434 1.00 0.00 C ATOM 1143 CZ TYR A 84 0.808 -1.249 -11.283 1.00 0.00 C ATOM 1144 OH TYR A 84 1.053 -0.315 -12.263 1.00 0.00 O ATOM 0 H TYR A 84 0.045 -2.422 -6.334 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.037 -3.707 -7.959 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.935 -4.266 -7.602 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.125 -5.135 -8.695 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.680 -3.159 -10.070 1.00 0.00 H new ATOM 0 HD2 TYR A 84 2.375 -2.876 -8.791 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -1.246 -1.495 -11.822 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.811 -1.206 -10.537 1.00 0.00 H new ATOM 0 HH TYR A 84 0.233 0.190 -12.446 1.00 0.00 H new ATOM 1154 N VAL A 85 -2.471 -5.713 -6.581 1.00 0.00 N ATOM 1155 CA VAL A 85 -2.824 -6.828 -5.712 1.00 0.00 C ATOM 1156 C VAL A 85 -3.273 -8.037 -6.526 1.00 0.00 C ATOM 1157 O VAL A 85 -4.025 -7.905 -7.491 1.00 0.00 O ATOM 1158 CB VAL A 85 -3.945 -6.441 -4.729 1.00 0.00 C ATOM 1159 CG1 VAL A 85 -4.227 -7.582 -3.764 1.00 0.00 C ATOM 1160 CG2 VAL A 85 -3.576 -5.173 -3.974 1.00 0.00 C ATOM 0 H VAL A 85 -3.107 -5.573 -7.366 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.928 -7.085 -5.147 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.853 -6.247 -5.299 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.022 -7.290 -3.077 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.537 -8.464 -4.324 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.324 -7.811 -3.198 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.379 -4.914 -3.284 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.655 -5.338 -3.414 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.429 -4.358 -4.682 1.00 0.00 H new ATOM 1170 N ARG A 86 -2.806 -9.216 -6.128 1.00 0.00 N ATOM 1171 CA ARG A 86 -3.158 -10.450 -6.820 1.00 0.00 C ATOM 1172 C ARG A 86 -3.283 -11.610 -5.836 1.00 0.00 C ATOM 1173 O ARG A 86 -2.852 -11.511 -4.687 1.00 0.00 O ATOM 1174 CB ARG A 86 -2.109 -10.780 -7.884 1.00 0.00 C ATOM 1175 CG ARG A 86 -0.906 -11.533 -7.339 1.00 0.00 C ATOM 1176 CD ARG A 86 0.140 -11.767 -8.417 1.00 0.00 C ATOM 1177 NE ARG A 86 -0.457 -11.862 -9.748 1.00 0.00 N ATOM 1178 CZ ARG A 86 -0.682 -10.811 -10.528 1.00 0.00 C ATOM 1179 NH1 ARG A 86 -0.361 -9.593 -10.115 1.00 0.00 N ATOM 1180 NH2 ARG A 86 -1.229 -10.978 -11.726 1.00 0.00 N ATOM 0 H ARG A 86 -2.183 -9.343 -5.330 1.00 0.00 H new ATOM 0 HA ARG A 86 -4.123 -10.302 -7.304 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -2.575 -11.376 -8.669 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -1.768 -9.853 -8.346 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.464 -10.969 -6.518 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -1.229 -12.490 -6.930 1.00 0.00 H new ATOM 0 HD2 ARG A 86 0.865 -10.953 -8.402 1.00 0.00 H new ATOM 0 HD3 ARG A 86 0.687 -12.684 -8.199 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.715 -12.785 -10.096 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.060 -9.461 -9.196 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.535 -8.788 -10.717 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.477 -11.914 -12.048 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.402 -10.171 -12.325 1.00 0.00 H new ATOM 1194 N PHE A 87 -3.874 -12.707 -6.295 1.00 0.00 N ATOM 1195 CA PHE A 87 -4.058 -13.885 -5.454 1.00 0.00 C ATOM 1196 C PHE A 87 -3.445 -15.120 -6.108 1.00 0.00 C ATOM 1197 O PHE A 87 -3.908 -15.578 -7.152 1.00 0.00 O ATOM 1198 CB PHE A 87 -5.546 -14.121 -5.188 1.00 0.00 C ATOM 1199 CG PHE A 87 -5.808 -15.104 -4.084 1.00 0.00 C ATOM 1200 CD1 PHE A 87 -5.529 -14.778 -2.766 1.00 0.00 C ATOM 1201 CD2 PHE A 87 -6.334 -16.356 -4.363 1.00 0.00 C ATOM 1202 CE1 PHE A 87 -5.769 -15.681 -1.748 1.00 0.00 C ATOM 1203 CE2 PHE A 87 -6.578 -17.263 -3.348 1.00 0.00 C ATOM 1204 CZ PHE A 87 -6.295 -16.925 -2.040 1.00 0.00 C ATOM 0 H PHE A 87 -4.234 -12.806 -7.244 1.00 0.00 H new ATOM 0 HA PHE A 87 -3.551 -13.707 -4.506 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -6.017 -13.171 -4.937 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.018 -14.479 -6.103 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -5.119 -13.807 -2.532 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.556 -16.626 -5.385 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.546 -15.415 -0.725 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -6.989 -18.235 -3.578 1.00 0.00 H new ATOM 0 HZ PHE A 87 -6.484 -17.632 -1.246 1.00 0.00 H new ATOM 1214 N GLY A 88 -2.399 -15.655 -5.486 1.00 0.00 N ATOM 1215 CA GLY A 88 -1.738 -16.832 -6.020 1.00 0.00 C ATOM 1216 C GLY A 88 -1.282 -16.638 -7.452 1.00 0.00 C ATOM 1217 O GLY A 88 -1.012 -17.607 -8.161 1.00 0.00 O ATOM 0 H GLY A 88 -1.997 -15.294 -4.621 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.877 -17.076 -5.397 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.419 -17.682 -5.970 1.00 0.00 H new ATOM 1221 N GLY A 89 -1.196 -15.383 -7.882 1.00 0.00 N ATOM 1222 CA GLY A 89 -0.771 -15.089 -9.238 1.00 0.00 C ATOM 1223 C GLY A 89 -1.919 -14.649 -10.123 1.00 0.00 C ATOM 1224 O GLY A 89 -1.878 -14.828 -11.340 1.00 0.00 O ATOM 0 H GLY A 89 -1.413 -14.564 -7.315 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.013 -14.306 -9.216 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.303 -15.974 -9.669 1.00 0.00 H new ATOM 1228 N VAL A 90 -2.950 -14.073 -9.511 1.00 0.00 N ATOM 1229 CA VAL A 90 -4.116 -13.607 -10.252 1.00 0.00 C ATOM 1230 C VAL A 90 -4.506 -12.195 -9.831 1.00 0.00 C ATOM 1231 O VAL A 90 -4.932 -11.969 -8.700 1.00 0.00 O ATOM 1232 CB VAL A 90 -5.322 -14.543 -10.048 1.00 0.00 C ATOM 1233 CG1 VAL A 90 -6.534 -14.025 -10.806 1.00 0.00 C ATOM 1234 CG2 VAL A 90 -4.976 -15.959 -10.483 1.00 0.00 C ATOM 0 H VAL A 90 -3.001 -13.918 -8.504 1.00 0.00 H new ATOM 0 HA VAL A 90 -3.841 -13.606 -11.307 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.569 -14.563 -8.987 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.376 -14.699 -10.650 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -6.793 -13.031 -10.442 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -6.303 -13.973 -11.870 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -5.839 -16.607 -10.332 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -4.702 -15.959 -11.538 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.138 -16.327 -9.891 1.00 0.00 H new ATOM 1244 N ASP A 91 -4.357 -11.248 -10.751 1.00 0.00 N ATOM 1245 CA ASP A 91 -4.695 -9.856 -10.476 1.00 0.00 C ATOM 1246 C ASP A 91 -6.203 -9.684 -10.320 1.00 0.00 C ATOM 1247 O ASP A 91 -6.924 -9.520 -11.305 1.00 0.00 O ATOM 1248 CB ASP A 91 -4.179 -8.952 -11.598 1.00 0.00 C ATOM 1249 CG ASP A 91 -4.373 -7.480 -11.290 1.00 0.00 C ATOM 1250 OD1 ASP A 91 -3.486 -6.889 -10.639 1.00 0.00 O ATOM 1251 OD2 ASP A 91 -5.409 -6.920 -11.701 1.00 0.00 O ATOM 0 H ASP A 91 -4.005 -11.419 -11.693 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.216 -9.569 -9.540 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.120 -9.150 -11.762 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.696 -9.198 -12.526 1.00 0.00 H new ATOM 1256 N ILE A 92 -6.673 -9.724 -9.078 1.00 0.00 N ATOM 1257 CA ILE A 92 -8.094 -9.572 -8.794 1.00 0.00 C ATOM 1258 C ILE A 92 -8.721 -8.501 -9.680 1.00 0.00 C ATOM 1259 O ILE A 92 -8.040 -7.620 -10.207 1.00 0.00 O ATOM 1260 CB ILE A 92 -8.338 -9.208 -7.318 1.00 0.00 C ATOM 1261 CG1 ILE A 92 -7.231 -8.282 -6.809 1.00 0.00 C ATOM 1262 CG2 ILE A 92 -8.415 -10.467 -6.468 1.00 0.00 C ATOM 1263 CD1 ILE A 92 -7.505 -7.712 -5.435 1.00 0.00 C ATOM 0 H ILE A 92 -6.090 -9.860 -8.252 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.562 -10.534 -9.005 1.00 0.00 H new ATOM 0 HB ILE A 92 -9.290 -8.682 -7.241 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -6.291 -8.833 -6.784 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -7.102 -7.462 -7.515 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.588 -10.193 -5.427 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -9.235 -11.094 -6.819 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.478 -11.018 -6.548 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.679 -7.065 -5.138 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.429 -7.134 -5.459 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.605 -8.526 -4.717 1.00 0.00 H new ATOM 1275 N PRO A 93 -10.050 -8.574 -9.848 1.00 0.00 N ATOM 1276 CA PRO A 93 -10.798 -7.617 -10.668 1.00 0.00 C ATOM 1277 C PRO A 93 -10.856 -6.231 -10.034 1.00 0.00 C ATOM 1278 O PRO A 93 -11.494 -5.322 -10.564 1.00 0.00 O ATOM 1279 CB PRO A 93 -12.199 -8.231 -10.741 1.00 0.00 C ATOM 1280 CG PRO A 93 -12.308 -9.071 -9.516 1.00 0.00 C ATOM 1281 CD PRO A 93 -10.924 -9.597 -9.250 1.00 0.00 C ATOM 0 HA PRO A 93 -10.333 -7.464 -11.642 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.969 -7.460 -10.762 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.323 -8.829 -11.644 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -12.672 -8.485 -8.672 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.014 -9.888 -9.665 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.736 -9.712 -8.183 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -10.771 -10.574 -9.708 1.00 0.00 H new ATOM 1289 N ASN A 94 -10.185 -6.077 -8.896 1.00 0.00 N ATOM 1290 CA ASN A 94 -10.161 -4.801 -8.191 1.00 0.00 C ATOM 1291 C ASN A 94 -8.843 -4.073 -8.428 1.00 0.00 C ATOM 1292 O ASN A 94 -8.724 -2.878 -8.160 1.00 0.00 O ATOM 1293 CB ASN A 94 -10.373 -5.021 -6.691 1.00 0.00 C ATOM 1294 CG ASN A 94 -11.842 -5.067 -6.315 1.00 0.00 C ATOM 1295 OD1 ASN A 94 -12.505 -4.034 -6.233 1.00 0.00 O ATOM 1296 ND2 ASN A 94 -12.356 -6.269 -6.084 1.00 0.00 N ATOM 0 H ASN A 94 -9.652 -6.819 -8.444 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.971 -4.184 -8.580 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.895 -5.954 -6.392 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.884 -4.220 -6.136 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.339 -6.363 -5.827 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -11.768 -7.099 -6.164 1.00 0.00 H new ATOM 1303 N SER A 95 -7.852 -4.803 -8.933 1.00 0.00 N ATOM 1304 CA SER A 95 -6.540 -4.228 -9.203 1.00 0.00 C ATOM 1305 C SER A 95 -6.445 -3.749 -10.650 1.00 0.00 C ATOM 1306 O SER A 95 -6.989 -4.360 -11.569 1.00 0.00 O ATOM 1307 CB SER A 95 -5.441 -5.255 -8.921 1.00 0.00 C ATOM 1308 OG SER A 95 -4.264 -4.624 -8.448 1.00 0.00 O ATOM 0 H SER A 95 -7.934 -5.793 -9.163 1.00 0.00 H new ATOM 0 HA SER A 95 -6.403 -3.371 -8.544 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.793 -5.976 -8.183 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.218 -5.813 -9.830 1.00 0.00 H new ATOM 0 HG SER A 95 -4.434 -4.235 -7.565 1.00 0.00 H new ATOM 1314 N PRO A 96 -5.736 -2.628 -10.855 1.00 0.00 N ATOM 1315 CA PRO A 96 -5.085 -1.893 -9.768 1.00 0.00 C ATOM 1316 C PRO A 96 -6.089 -1.206 -8.849 1.00 0.00 C ATOM 1317 O PRO A 96 -7.292 -1.212 -9.113 1.00 0.00 O ATOM 1318 CB PRO A 96 -4.233 -0.854 -10.502 1.00 0.00 C ATOM 1319 CG PRO A 96 -4.918 -0.661 -11.811 1.00 0.00 C ATOM 1320 CD PRO A 96 -5.517 -1.994 -12.166 1.00 0.00 C ATOM 0 HA PRO A 96 -4.511 -2.553 -9.118 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.178 0.080 -9.942 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.210 -1.205 -10.638 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.689 0.106 -11.739 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.213 -0.334 -12.576 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.450 -1.881 -12.719 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -4.845 -2.583 -12.790 1.00 0.00 H new ATOM 1328 N PHE A 97 -5.589 -0.612 -7.771 1.00 0.00 N ATOM 1329 CA PHE A 97 -6.443 0.079 -6.813 1.00 0.00 C ATOM 1330 C PHE A 97 -6.190 1.584 -6.846 1.00 0.00 C ATOM 1331 O PHE A 97 -5.096 2.049 -6.521 1.00 0.00 O ATOM 1332 CB PHE A 97 -6.202 -0.459 -5.401 1.00 0.00 C ATOM 1333 CG PHE A 97 -6.859 -1.784 -5.144 1.00 0.00 C ATOM 1334 CD1 PHE A 97 -6.553 -2.888 -5.925 1.00 0.00 C ATOM 1335 CD2 PHE A 97 -7.785 -1.927 -4.123 1.00 0.00 C ATOM 1336 CE1 PHE A 97 -7.156 -4.109 -5.691 1.00 0.00 C ATOM 1337 CE2 PHE A 97 -8.391 -3.146 -3.885 1.00 0.00 C ATOM 1338 CZ PHE A 97 -8.077 -4.238 -4.670 1.00 0.00 C ATOM 0 H PHE A 97 -4.596 -0.595 -7.539 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.481 -0.104 -7.091 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.129 -0.557 -5.236 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -6.571 0.267 -4.676 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -5.835 -2.792 -6.726 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -8.036 -1.076 -3.507 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -6.907 -4.961 -6.306 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -9.110 -3.245 -3.085 1.00 0.00 H new ATOM 0 HZ PHE A 97 -8.551 -5.191 -4.486 1.00 0.00 H new ATOM 1348 N THR A 98 -7.209 2.341 -7.241 1.00 0.00 N ATOM 1349 CA THR A 98 -7.098 3.792 -7.319 1.00 0.00 C ATOM 1350 C THR A 98 -7.059 4.415 -5.929 1.00 0.00 C ATOM 1351 O THR A 98 -8.054 4.402 -5.203 1.00 0.00 O ATOM 1352 CB THR A 98 -8.269 4.403 -8.111 1.00 0.00 C ATOM 1353 OG1 THR A 98 -8.289 3.874 -9.442 1.00 0.00 O ATOM 1354 CG2 THR A 98 -8.153 5.919 -8.164 1.00 0.00 C ATOM 0 H THR A 98 -8.121 1.973 -7.512 1.00 0.00 H new ATOM 0 HA THR A 98 -6.165 4.011 -7.838 1.00 0.00 H new ATOM 0 HB THR A 98 -9.198 4.143 -7.603 1.00 0.00 H new ATOM 0 HG1 THR A 98 -9.037 4.266 -9.939 1.00 0.00 H new ATOM 0 HG21 THR A 98 -8.991 6.329 -8.728 1.00 0.00 H new ATOM 0 HG22 THR A 98 -8.167 6.321 -7.151 1.00 0.00 H new ATOM 0 HG23 THR A 98 -7.218 6.196 -8.651 1.00 0.00 H new ATOM 1362 N VAL A 99 -5.904 4.963 -5.562 1.00 0.00 N ATOM 1363 CA VAL A 99 -5.737 5.594 -4.258 1.00 0.00 C ATOM 1364 C VAL A 99 -5.209 7.017 -4.401 1.00 0.00 C ATOM 1365 O VAL A 99 -4.101 7.233 -4.892 1.00 0.00 O ATOM 1366 CB VAL A 99 -4.776 4.788 -3.365 1.00 0.00 C ATOM 1367 CG1 VAL A 99 -4.590 5.479 -2.022 1.00 0.00 C ATOM 1368 CG2 VAL A 99 -5.287 3.368 -3.177 1.00 0.00 C ATOM 0 H VAL A 99 -5.070 4.982 -6.150 1.00 0.00 H new ATOM 0 HA VAL A 99 -6.721 5.620 -3.789 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.805 4.737 -3.859 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -3.908 4.895 -1.404 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -4.175 6.475 -2.179 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -5.554 5.563 -1.519 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -4.595 2.813 -2.543 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.269 3.394 -2.706 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.363 2.877 -4.147 1.00 0.00 H new ATOM 1378 N MET A 100 -6.009 7.985 -3.968 1.00 0.00 N ATOM 1379 CA MET A 100 -5.622 9.389 -4.045 1.00 0.00 C ATOM 1380 C MET A 100 -5.196 9.912 -2.677 1.00 0.00 C ATOM 1381 O MET A 100 -6.019 10.047 -1.771 1.00 0.00 O ATOM 1382 CB MET A 100 -6.778 10.231 -4.589 1.00 0.00 C ATOM 1383 CG MET A 100 -6.464 11.716 -4.667 1.00 0.00 C ATOM 1384 SD MET A 100 -5.343 12.119 -6.019 1.00 0.00 S ATOM 1385 CE MET A 100 -6.361 13.236 -6.980 1.00 0.00 C ATOM 0 H MET A 100 -6.930 7.823 -3.560 1.00 0.00 H new ATOM 0 HA MET A 100 -4.774 9.469 -4.725 1.00 0.00 H new ATOM 0 HB2 MET A 100 -7.042 9.871 -5.583 1.00 0.00 H new ATOM 0 HB3 MET A 100 -7.652 10.086 -3.955 1.00 0.00 H new ATOM 0 HG2 MET A 100 -7.392 12.274 -4.792 1.00 0.00 H new ATOM 0 HG3 MET A 100 -6.022 12.040 -3.725 1.00 0.00 H new ATOM 0 HE1 MET A 100 -5.805 13.574 -7.854 1.00 0.00 H new ATOM 0 HE2 MET A 100 -7.265 12.719 -7.302 1.00 0.00 H new ATOM 0 HE3 MET A 100 -6.634 14.096 -6.369 1.00 0.00 H new ATOM 1395 N ALA A 101 -3.907 10.203 -2.534 1.00 0.00 N ATOM 1396 CA ALA A 101 -3.374 10.712 -1.277 1.00 0.00 C ATOM 1397 C ALA A 101 -3.416 12.236 -1.239 1.00 0.00 C ATOM 1398 O ALA A 101 -2.675 12.906 -1.959 1.00 0.00 O ATOM 1399 CB ALA A 101 -1.951 10.216 -1.067 1.00 0.00 C ATOM 0 H ALA A 101 -3.213 10.095 -3.274 1.00 0.00 H new ATOM 0 HA ALA A 101 -4.001 10.337 -0.468 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.566 10.604 -0.124 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -1.946 9.126 -1.040 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.321 10.562 -1.886 1.00 0.00 H new ATOM 1405 N THR A 102 -4.289 12.779 -0.396 1.00 0.00 N ATOM 1406 CA THR A 102 -4.429 14.224 -0.266 1.00 0.00 C ATOM 1407 C THR A 102 -3.558 14.762 0.863 1.00 0.00 C ATOM 1408 O THR A 102 -3.402 14.117 1.900 1.00 0.00 O ATOM 1409 CB THR A 102 -5.893 14.625 -0.006 1.00 0.00 C ATOM 1410 OG1 THR A 102 -6.456 13.791 1.013 1.00 0.00 O ATOM 1411 CG2 THR A 102 -6.720 14.510 -1.277 1.00 0.00 C ATOM 0 H THR A 102 -4.910 12.239 0.207 1.00 0.00 H new ATOM 0 HA THR A 102 -4.103 14.659 -1.211 1.00 0.00 H new ATOM 0 HB THR A 102 -5.908 15.663 0.325 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.386 14.053 1.173 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.750 14.798 -1.068 1.00 0.00 H new ATOM 0 HG22 THR A 102 -6.307 15.169 -2.041 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.697 13.480 -1.634 1.00 0.00 H new ATOM 1419 N ASP A 103 -2.993 15.946 0.656 1.00 0.00 N ATOM 1420 CA ASP A 103 -2.139 16.572 1.658 1.00 0.00 C ATOM 1421 C ASP A 103 -2.920 16.858 2.936 1.00 0.00 C ATOM 1422 O ASP A 103 -2.368 16.820 4.035 1.00 0.00 O ATOM 1423 CB ASP A 103 -1.540 17.869 1.111 1.00 0.00 C ATOM 1424 CG ASP A 103 -2.592 18.791 0.527 1.00 0.00 C ATOM 1425 OD1 ASP A 103 -3.279 18.377 -0.430 1.00 0.00 O ATOM 1426 OD2 ASP A 103 -2.729 19.927 1.027 1.00 0.00 O ATOM 0 H ASP A 103 -3.111 16.492 -0.197 1.00 0.00 H new ATOM 0 HA ASP A 103 -1.331 15.879 1.894 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -1.011 18.387 1.911 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -0.804 17.630 0.344 1.00 0.00 H new ATOM 1431 N GLY A 104 -4.210 17.145 2.784 1.00 0.00 N ATOM 1432 CA GLY A 104 -5.046 17.435 3.935 1.00 0.00 C ATOM 1433 C GLY A 104 -4.518 18.591 4.759 1.00 0.00 C ATOM 1434 O GLY A 104 -3.598 19.293 4.338 1.00 0.00 O ATOM 0 H GLY A 104 -4.691 17.182 1.885 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -6.056 17.665 3.597 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.115 16.547 4.563 1.00 0.00 H new ATOM 1438 N GLU A 105 -5.100 18.791 5.937 1.00 0.00 N ATOM 1439 CA GLU A 105 -4.683 19.874 6.822 1.00 0.00 C ATOM 1440 C GLU A 105 -3.250 19.663 7.301 1.00 0.00 C ATOM 1441 O GLU A 105 -2.945 18.668 7.959 1.00 0.00 O ATOM 1442 CB GLU A 105 -5.626 19.973 8.022 1.00 0.00 C ATOM 1443 CG GLU A 105 -5.849 18.648 8.732 1.00 0.00 C ATOM 1444 CD GLU A 105 -6.505 18.817 10.089 1.00 0.00 C ATOM 1445 OE1 GLU A 105 -5.969 19.583 10.917 1.00 0.00 O ATOM 1446 OE2 GLU A 105 -7.556 18.183 10.322 1.00 0.00 O ATOM 0 H GLU A 105 -5.861 18.218 6.301 1.00 0.00 H new ATOM 0 HA GLU A 105 -4.725 20.807 6.259 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.221 20.693 8.733 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.587 20.362 7.687 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.472 18.006 8.109 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -4.892 18.141 8.856 1.00 0.00 H new ATOM 1453 N VAL A 106 -2.375 20.605 6.966 1.00 0.00 N ATOM 1454 CA VAL A 106 -0.975 20.523 7.364 1.00 0.00 C ATOM 1455 C VAL A 106 -0.713 21.339 8.625 1.00 0.00 C ATOM 1456 O VAL A 106 -1.338 22.376 8.849 1.00 0.00 O ATOM 1457 CB VAL A 106 -0.044 21.021 6.241 1.00 0.00 C ATOM 1458 CG1 VAL A 106 -0.206 20.165 4.994 1.00 0.00 C ATOM 1459 CG2 VAL A 106 -0.316 22.485 5.933 1.00 0.00 C ATOM 0 H VAL A 106 -2.611 21.434 6.420 1.00 0.00 H new ATOM 0 HA VAL A 106 -0.763 19.473 7.564 1.00 0.00 H new ATOM 0 HB VAL A 106 0.988 20.932 6.582 1.00 0.00 H new ATOM 0 HG11 VAL A 106 0.459 20.532 4.212 1.00 0.00 H new ATOM 0 HG12 VAL A 106 0.045 19.130 5.228 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -1.238 20.219 4.647 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.350 22.819 5.138 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -1.351 22.603 5.613 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.143 23.083 6.827 1.00 0.00 H new ATOM 1469 N THR A 107 0.218 20.865 9.447 1.00 0.00 N ATOM 1470 CA THR A 107 0.563 21.548 10.687 1.00 0.00 C ATOM 1471 C THR A 107 1.998 22.062 10.650 1.00 0.00 C ATOM 1472 O THR A 107 2.702 22.037 11.659 1.00 0.00 O ATOM 1473 CB THR A 107 0.391 20.623 11.906 1.00 0.00 C ATOM 1474 OG1 THR A 107 0.540 21.374 13.116 1.00 0.00 O ATOM 1475 CG2 THR A 107 1.411 19.494 11.875 1.00 0.00 C ATOM 0 H THR A 107 0.747 20.010 9.276 1.00 0.00 H new ATOM 0 HA THR A 107 -0.120 22.392 10.783 1.00 0.00 H new ATOM 0 HB THR A 107 -0.609 20.190 11.869 1.00 0.00 H new ATOM 0 HG1 THR A 107 1.402 21.839 13.108 1.00 0.00 H new ATOM 0 HG21 THR A 107 1.271 18.853 12.745 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.276 18.907 10.967 1.00 0.00 H new ATOM 0 HG23 THR A 107 2.417 19.912 11.891 1.00 0.00 H new ATOM 1483 N ALA A 108 2.425 22.528 9.481 1.00 0.00 N ATOM 1484 CA ALA A 108 3.776 23.050 9.315 1.00 0.00 C ATOM 1485 C ALA A 108 3.898 24.453 9.900 1.00 0.00 C ATOM 1486 O ALA A 108 2.909 25.178 10.013 1.00 0.00 O ATOM 1487 CB ALA A 108 4.162 23.055 7.843 1.00 0.00 C ATOM 0 H ALA A 108 1.855 22.555 8.635 1.00 0.00 H new ATOM 0 HA ALA A 108 4.460 22.398 9.857 1.00 0.00 H new ATOM 0 HB1 ALA A 108 5.173 23.447 7.733 1.00 0.00 H new ATOM 0 HB2 ALA A 108 4.123 22.038 7.453 1.00 0.00 H new ATOM 0 HB3 ALA A 108 3.467 23.684 7.287 1.00 0.00 H new ATOM 1493 N VAL A 109 5.118 24.830 10.271 1.00 0.00 N ATOM 1494 CA VAL A 109 5.369 26.146 10.845 1.00 0.00 C ATOM 1495 C VAL A 109 6.362 26.934 9.998 1.00 0.00 C ATOM 1496 O VAL A 109 7.564 26.672 10.030 1.00 0.00 O ATOM 1497 CB VAL A 109 5.912 26.037 12.284 1.00 0.00 C ATOM 1498 CG1 VAL A 109 6.210 27.418 12.847 1.00 0.00 C ATOM 1499 CG2 VAL A 109 4.925 25.293 13.169 1.00 0.00 C ATOM 0 H VAL A 109 5.947 24.242 10.184 1.00 0.00 H new ATOM 0 HA VAL A 109 4.414 26.671 10.864 1.00 0.00 H new ATOM 0 HB VAL A 109 6.843 25.471 12.262 1.00 0.00 H new ATOM 0 HG11 VAL A 109 6.592 27.322 13.863 1.00 0.00 H new ATOM 0 HG12 VAL A 109 6.956 27.912 12.224 1.00 0.00 H new ATOM 0 HG13 VAL A 109 5.296 28.012 12.858 1.00 0.00 H new ATOM 0 HG21 VAL A 109 5.324 25.225 14.181 1.00 0.00 H new ATOM 0 HG22 VAL A 109 3.977 25.830 13.188 1.00 0.00 H new ATOM 0 HG23 VAL A 109 4.766 24.290 12.773 1.00 0.00 H new ATOM 1509 N GLU A 110 5.850 27.901 9.242 1.00 0.00 N ATOM 1510 CA GLU A 110 6.693 28.726 8.385 1.00 0.00 C ATOM 1511 C GLU A 110 7.635 29.589 9.219 1.00 0.00 C ATOM 1512 O GLU A 110 7.203 30.305 10.123 1.00 0.00 O ATOM 1513 CB GLU A 110 5.830 29.616 7.488 1.00 0.00 C ATOM 1514 CG GLU A 110 6.620 30.349 6.417 1.00 0.00 C ATOM 1515 CD GLU A 110 6.734 29.555 5.130 1.00 0.00 C ATOM 1516 OE1 GLU A 110 5.857 28.702 4.878 1.00 0.00 O ATOM 1517 OE2 GLU A 110 7.702 29.786 4.376 1.00 0.00 O ATOM 0 H GLU A 110 4.857 28.132 9.206 1.00 0.00 H new ATOM 0 HA GLU A 110 7.291 28.063 7.760 1.00 0.00 H new ATOM 0 HB2 GLU A 110 5.067 29.003 7.009 1.00 0.00 H new ATOM 0 HB3 GLU A 110 5.310 30.346 8.108 1.00 0.00 H new ATOM 0 HG2 GLU A 110 6.141 31.306 6.208 1.00 0.00 H new ATOM 0 HG3 GLU A 110 7.619 30.568 6.794 1.00 0.00 H new ATOM 1524 N GLU A 111 8.926 29.515 8.910 1.00 0.00 N ATOM 1525 CA GLU A 111 9.930 30.288 9.631 1.00 0.00 C ATOM 1526 C GLU A 111 10.162 31.639 8.960 1.00 0.00 C ATOM 1527 O GLU A 111 10.091 32.685 9.607 1.00 0.00 O ATOM 1528 CB GLU A 111 11.247 29.512 9.707 1.00 0.00 C ATOM 1529 CG GLU A 111 11.302 28.518 10.855 1.00 0.00 C ATOM 1530 CD GLU A 111 12.337 27.431 10.636 1.00 0.00 C ATOM 1531 OE1 GLU A 111 12.633 27.121 9.464 1.00 0.00 O ATOM 1532 OE2 GLU A 111 12.850 26.891 11.639 1.00 0.00 O ATOM 0 H GLU A 111 9.301 28.928 8.165 1.00 0.00 H new ATOM 0 HA GLU A 111 9.560 30.462 10.641 1.00 0.00 H new ATOM 0 HB2 GLU A 111 11.400 28.979 8.768 1.00 0.00 H new ATOM 0 HB3 GLU A 111 12.070 30.219 9.810 1.00 0.00 H new ATOM 0 HG2 GLU A 111 11.528 29.049 11.780 1.00 0.00 H new ATOM 0 HG3 GLU A 111 10.321 28.060 10.982 1.00 0.00 H new ATOM 1539 N ALA A 112 10.438 31.609 7.661 1.00 0.00 N ATOM 1540 CA ALA A 112 10.678 32.830 6.903 1.00 0.00 C ATOM 1541 C ALA A 112 11.964 33.513 7.355 1.00 0.00 C ATOM 1542 O ALA A 112 11.985 34.703 7.675 1.00 0.00 O ATOM 1543 CB ALA A 112 9.497 33.780 7.042 1.00 0.00 C ATOM 0 H ALA A 112 10.501 30.752 7.111 1.00 0.00 H new ATOM 0 HA ALA A 112 10.790 32.559 5.853 1.00 0.00 H new ATOM 0 HB1 ALA A 112 9.691 34.688 6.470 1.00 0.00 H new ATOM 0 HB2 ALA A 112 8.596 33.298 6.663 1.00 0.00 H new ATOM 0 HB3 ALA A 112 9.357 34.036 8.092 1.00 0.00 H new ATOM 1549 N PRO A 113 13.064 32.746 7.384 1.00 0.00 N ATOM 1550 CA PRO A 113 14.375 33.256 7.796 1.00 0.00 C ATOM 1551 C PRO A 113 14.963 34.231 6.781 1.00 0.00 C ATOM 1552 O PRO A 113 15.705 33.834 5.881 1.00 0.00 O ATOM 1553 CB PRO A 113 15.235 31.993 7.885 1.00 0.00 C ATOM 1554 CG PRO A 113 14.587 31.026 6.956 1.00 0.00 C ATOM 1555 CD PRO A 113 13.113 31.321 7.016 1.00 0.00 C ATOM 0 HA PRO A 113 14.319 33.817 8.729 1.00 0.00 H new ATOM 0 HB2 PRO A 113 16.265 32.194 7.591 1.00 0.00 H new ATOM 0 HB3 PRO A 113 15.264 31.605 8.903 1.00 0.00 H new ATOM 0 HG2 PRO A 113 14.968 31.144 5.942 1.00 0.00 H new ATOM 0 HG3 PRO A 113 14.792 29.998 7.256 1.00 0.00 H new ATOM 0 HD2 PRO A 113 12.627 31.137 6.058 1.00 0.00 H new ATOM 0 HD3 PRO A 113 12.608 30.698 7.754 1.00 0.00 H new ATOM 1563 N VAL A 114 14.626 35.509 6.930 1.00 0.00 N ATOM 1564 CA VAL A 114 15.122 36.540 6.028 1.00 0.00 C ATOM 1565 C VAL A 114 15.211 37.890 6.731 1.00 0.00 C ATOM 1566 O VAL A 114 14.323 38.261 7.497 1.00 0.00 O ATOM 1567 CB VAL A 114 14.222 36.678 4.785 1.00 0.00 C ATOM 1568 CG1 VAL A 114 14.268 35.409 3.948 1.00 0.00 C ATOM 1569 CG2 VAL A 114 12.795 37.006 5.196 1.00 0.00 C ATOM 0 H VAL A 114 14.011 35.854 7.667 1.00 0.00 H new ATOM 0 HA VAL A 114 16.119 36.232 5.713 1.00 0.00 H new ATOM 0 HB VAL A 114 14.598 37.499 4.174 1.00 0.00 H new ATOM 0 HG11 VAL A 114 13.626 35.526 3.075 1.00 0.00 H new ATOM 0 HG12 VAL A 114 15.292 35.224 3.624 1.00 0.00 H new ATOM 0 HG13 VAL A 114 13.919 34.567 4.545 1.00 0.00 H new ATOM 0 HG21 VAL A 114 12.173 37.100 4.306 1.00 0.00 H new ATOM 0 HG22 VAL A 114 12.406 36.208 5.828 1.00 0.00 H new ATOM 0 HG23 VAL A 114 12.782 37.945 5.749 1.00 0.00 H new ATOM 1579 N ASN A 115 16.288 38.621 6.463 1.00 0.00 N ATOM 1580 CA ASN A 115 16.493 39.931 7.071 1.00 0.00 C ATOM 1581 C ASN A 115 16.527 41.025 6.008 1.00 0.00 C ATOM 1582 O ASN A 115 17.139 40.860 4.953 1.00 0.00 O ATOM 1583 CB ASN A 115 17.794 39.946 7.875 1.00 0.00 C ATOM 1584 CG ASN A 115 17.987 38.679 8.685 1.00 0.00 C ATOM 1585 OD1 ASN A 115 17.540 38.585 9.829 1.00 0.00 O ATOM 1586 ND2 ASN A 115 18.655 37.695 8.093 1.00 0.00 N ATOM 0 H ASN A 115 17.032 38.329 5.829 1.00 0.00 H new ATOM 0 HA ASN A 115 15.657 40.127 7.742 1.00 0.00 H new ATOM 0 HB2 ASN A 115 18.637 40.071 7.195 1.00 0.00 H new ATOM 0 HB3 ASN A 115 17.794 40.806 8.545 1.00 0.00 H new ATOM 0 HD21 ASN A 115 18.815 36.818 8.588 1.00 0.00 H new ATOM 0 HD22 ASN A 115 19.007 37.817 7.144 1.00 0.00 H new ATOM 1593 N ALA A 116 15.864 42.141 6.293 1.00 0.00 N ATOM 1594 CA ALA A 116 15.821 43.263 5.363 1.00 0.00 C ATOM 1595 C ALA A 116 16.712 44.405 5.839 1.00 0.00 C ATOM 1596 O ALA A 116 17.202 44.393 6.969 1.00 0.00 O ATOM 1597 CB ALA A 116 14.390 43.746 5.185 1.00 0.00 C ATOM 0 H ALA A 116 15.349 42.292 7.161 1.00 0.00 H new ATOM 0 HA ALA A 116 16.199 42.920 4.400 1.00 0.00 H new ATOM 0 HB1 ALA A 116 14.373 44.584 4.488 1.00 0.00 H new ATOM 0 HB2 ALA A 116 13.778 42.934 4.791 1.00 0.00 H new ATOM 0 HB3 ALA A 116 13.992 44.067 6.148 1.00 0.00 H new ATOM 1603 N CYS A 117 16.917 45.391 4.972 1.00 0.00 N ATOM 1604 CA CYS A 117 17.750 46.541 5.304 1.00 0.00 C ATOM 1605 C CYS A 117 17.393 47.741 4.433 1.00 0.00 C ATOM 1606 O CYS A 117 17.240 47.631 3.216 1.00 0.00 O ATOM 1607 CB CYS A 117 19.229 46.191 5.131 1.00 0.00 C ATOM 1608 SG CYS A 117 20.348 47.215 6.115 1.00 0.00 S ATOM 0 H CYS A 117 16.518 45.417 4.034 1.00 0.00 H new ATOM 0 HA CYS A 117 17.565 46.804 6.345 1.00 0.00 H new ATOM 0 HB2 CYS A 117 19.378 45.146 5.401 1.00 0.00 H new ATOM 0 HB3 CYS A 117 19.494 46.289 4.078 1.00 0.00 H new ATOM 0 HG CYS A 117 19.829 47.421 7.289 1.00 0.00 H new ATOM 1614 N PRO A 118 17.255 48.913 5.068 1.00 0.00 N ATOM 1615 CA PRO A 118 16.913 50.157 4.371 1.00 0.00 C ATOM 1616 C PRO A 118 18.051 50.657 3.488 1.00 0.00 C ATOM 1617 O PRO A 118 19.214 50.320 3.706 1.00 0.00 O ATOM 1618 CB PRO A 118 16.649 51.142 5.511 1.00 0.00 C ATOM 1619 CG PRO A 118 17.437 50.614 6.660 1.00 0.00 C ATOM 1620 CD PRO A 118 17.423 49.117 6.517 1.00 0.00 C ATOM 0 HA PRO A 118 16.066 50.027 3.698 1.00 0.00 H new ATOM 0 HB2 PRO A 118 16.966 52.150 5.244 1.00 0.00 H new ATOM 0 HB3 PRO A 118 15.587 51.195 5.750 1.00 0.00 H new ATOM 0 HG2 PRO A 118 18.457 50.998 6.643 1.00 0.00 H new ATOM 0 HG3 PRO A 118 16.996 50.920 7.609 1.00 0.00 H new ATOM 0 HD2 PRO A 118 18.348 48.670 6.881 1.00 0.00 H new ATOM 0 HD3 PRO A 118 16.607 48.667 7.083 1.00 0.00 H new ATOM 1628 N SER A 119 17.707 51.465 2.488 1.00 0.00 N ATOM 1629 CA SER A 119 18.699 52.010 1.570 1.00 0.00 C ATOM 1630 C SER A 119 18.272 53.383 1.061 1.00 0.00 C ATOM 1631 O SER A 119 17.148 53.821 1.295 1.00 0.00 O ATOM 1632 CB SER A 119 18.910 51.058 0.390 1.00 0.00 C ATOM 1633 OG SER A 119 19.824 50.028 0.722 1.00 0.00 O ATOM 0 H SER A 119 16.749 51.756 2.294 1.00 0.00 H new ATOM 0 HA SER A 119 19.638 52.119 2.112 1.00 0.00 H new ATOM 0 HB2 SER A 119 17.956 50.621 0.097 1.00 0.00 H new ATOM 0 HB3 SER A 119 19.283 51.616 -0.469 1.00 0.00 H new ATOM 0 HG SER A 119 19.858 49.922 1.696 1.00 0.00 H new ATOM 1639 N GLY A 120 19.180 54.056 0.361 1.00 0.00 N ATOM 1640 CA GLY A 120 18.880 55.373 -0.170 1.00 0.00 C ATOM 1641 C GLY A 120 17.451 55.487 -0.662 1.00 0.00 C ATOM 1642 O GLY A 120 16.875 54.536 -1.191 1.00 0.00 O ATOM 0 H GLY A 120 20.118 53.713 0.152 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.056 56.122 0.602 1.00 0.00 H new ATOM 0 HA3 GLY A 120 19.562 55.595 -0.990 1.00 0.00 H new ATOM 1646 N PRO A 121 16.853 56.675 -0.485 1.00 0.00 N ATOM 1647 CA PRO A 121 15.475 56.939 -0.907 1.00 0.00 C ATOM 1648 C PRO A 121 15.330 56.982 -2.424 1.00 0.00 C ATOM 1649 O PRO A 121 16.319 56.902 -3.154 1.00 0.00 O ATOM 1650 CB PRO A 121 15.175 58.313 -0.302 1.00 0.00 C ATOM 1651 CG PRO A 121 16.508 58.962 -0.158 1.00 0.00 C ATOM 1652 CD PRO A 121 17.479 57.854 0.139 1.00 0.00 C ATOM 0 HA PRO A 121 14.792 56.155 -0.579 1.00 0.00 H new ATOM 0 HB2 PRO A 121 14.519 58.896 -0.949 1.00 0.00 H new ATOM 0 HB3 PRO A 121 14.673 58.221 0.661 1.00 0.00 H new ATOM 0 HG2 PRO A 121 16.786 59.490 -1.070 1.00 0.00 H new ATOM 0 HG3 PRO A 121 16.499 59.698 0.646 1.00 0.00 H new ATOM 0 HD2 PRO A 121 18.463 58.058 -0.284 1.00 0.00 H new ATOM 0 HD3 PRO A 121 17.615 57.716 1.212 1.00 0.00 H new ATOM 1660 N SER A 122 14.093 57.107 -2.892 1.00 0.00 N ATOM 1661 CA SER A 122 13.819 57.157 -4.324 1.00 0.00 C ATOM 1662 C SER A 122 12.744 58.194 -4.636 1.00 0.00 C ATOM 1663 O SER A 122 12.042 58.664 -3.741 1.00 0.00 O ATOM 1664 CB SER A 122 13.379 55.782 -4.828 1.00 0.00 C ATOM 1665 OG SER A 122 12.220 55.335 -4.147 1.00 0.00 O ATOM 0 H SER A 122 13.264 57.176 -2.301 1.00 0.00 H new ATOM 0 HA SER A 122 14.737 57.447 -4.835 1.00 0.00 H new ATOM 0 HB2 SER A 122 13.179 55.831 -5.898 1.00 0.00 H new ATOM 0 HB3 SER A 122 14.187 55.064 -4.687 1.00 0.00 H new ATOM 0 HG SER A 122 11.959 54.455 -4.489 1.00 0.00 H new ATOM 1671 N SER A 123 12.622 58.545 -5.912 1.00 0.00 N ATOM 1672 CA SER A 123 11.636 59.530 -6.343 1.00 0.00 C ATOM 1673 C SER A 123 10.322 58.852 -6.719 1.00 0.00 C ATOM 1674 O SER A 123 10.310 57.836 -7.412 1.00 0.00 O ATOM 1675 CB SER A 123 12.169 60.329 -7.533 1.00 0.00 C ATOM 1676 OG SER A 123 12.300 59.511 -8.682 1.00 0.00 O ATOM 0 H SER A 123 13.193 58.162 -6.665 1.00 0.00 H new ATOM 0 HA SER A 123 11.450 60.210 -5.512 1.00 0.00 H new ATOM 0 HB2 SER A 123 11.495 61.158 -7.749 1.00 0.00 H new ATOM 0 HB3 SER A 123 13.137 60.762 -7.279 1.00 0.00 H new ATOM 0 HG SER A 123 12.641 60.047 -9.428 1.00 0.00 H new ATOM 1682 N GLY A 124 9.214 59.425 -6.255 1.00 0.00 N ATOM 1683 CA GLY A 124 7.909 58.863 -6.553 1.00 0.00 C ATOM 1684 C GLY A 124 6.789 59.595 -5.842 1.00 0.00 C ATOM 1685 O GLY A 124 7.037 60.467 -5.009 1.00 0.00 O ATOM 0 H GLY A 124 9.197 60.267 -5.679 1.00 0.00 H new ATOM 0 HA2 GLY A 124 7.738 58.899 -7.629 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.894 57.812 -6.263 1.00 0.00 H new TER 1689 GLY A 124