USER MOD reduce.3.24.130724 H: found=0, std=0, add=826, rem=0, adj=36 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 -30:sc= 1.88 USER MOD Set 1.2: A 55 THR OG1 : rot -7:sc= 0.991 USER MOD Single : A 1 GLY N :NH3+ -105:sc= 0.0742 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0887 USER MOD Single : A 5 SER OG : rot 24:sc= 0.81 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 CYS SG : rot -8:sc= 0.164 USER MOD Single : A 17 THR OG1 : rot 42:sc= 0.191 USER MOD Single : A 23 SER OG : rot 180:sc= -0.0248 USER MOD Single : A 24 THR OG1 : rot 30:sc= 0.33 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.108 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -130:sc= -1.09 USER MOD Single : A 42 LYS NZ :NH3+ 152:sc= -0.513 (180deg=-1.55!) USER MOD Single : A 44 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.00422) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.242 USER MOD Single : A 47 CYS SG : rot -116:sc= -3.55! USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.0005 USER MOD Single : A 64 ASN : amide:sc= 0.624 K(o=0.62,f=-0.026) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.991 USER MOD Single : A 69 TYR OH : rot 180:sc= -0.016 USER MOD Single : A 73 TYR OH : rot -154:sc= 0.776 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -148:sc= 0.82 (180deg=-0.3) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 15:sc= 1.02 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 95 SER OG : rot 53:sc= -1.24 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= 0.00392 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.856 K(o=-0.86,f=-4.8!) USER MOD Single : A 117 CYS SG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot -2:sc= 0.666! USER MOD Single : A 122 SER OG : rot 28:sc= 0.425 USER MOD Single : A 123 SER OG : rot 180:sc=-0.00141 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.708 -34.587 -10.265 1.00 0.00 N ATOM 2 CA GLY A 1 -1.976 -33.781 -9.088 1.00 0.00 C ATOM 3 C GLY A 1 -1.052 -34.114 -7.934 1.00 0.00 C ATOM 4 O GLY A 1 -0.363 -35.136 -7.955 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.215 -34.010 -10.976 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.112 -35.397 -10.002 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.606 -34.932 -10.661 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -1.869 -32.726 -9.342 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.010 -33.931 -8.777 1.00 0.00 H new ATOM 8 N SER A 2 -1.033 -33.250 -6.924 1.00 0.00 N ATOM 9 CA SER A 2 -0.181 -33.454 -5.759 1.00 0.00 C ATOM 10 C SER A 2 -1.020 -33.713 -4.512 1.00 0.00 C ATOM 11 O SER A 2 -2.133 -33.204 -4.382 1.00 0.00 O ATOM 12 CB SER A 2 0.719 -32.237 -5.538 1.00 0.00 C ATOM 13 OG SER A 2 1.694 -32.497 -4.543 1.00 0.00 O ATOM 0 H SER A 2 -1.598 -32.402 -6.889 1.00 0.00 H new ATOM 0 HA SER A 2 0.443 -34.328 -5.945 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.211 -31.971 -6.473 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.112 -31.381 -5.242 1.00 0.00 H new ATOM 0 HG SER A 2 2.257 -31.704 -4.422 1.00 0.00 H new ATOM 19 N SER A 3 -0.478 -34.509 -3.595 1.00 0.00 N ATOM 20 CA SER A 3 -1.177 -34.839 -2.359 1.00 0.00 C ATOM 21 C SER A 3 -1.035 -33.716 -1.337 1.00 0.00 C ATOM 22 O SER A 3 -2.020 -33.256 -0.762 1.00 0.00 O ATOM 23 CB SER A 3 -0.635 -36.145 -1.776 1.00 0.00 C ATOM 24 OG SER A 3 0.756 -36.053 -1.522 1.00 0.00 O ATOM 0 H SER A 3 0.443 -34.937 -3.685 1.00 0.00 H new ATOM 0 HA SER A 3 -2.235 -34.963 -2.591 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.162 -36.380 -0.851 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.828 -36.964 -2.469 1.00 0.00 H new ATOM 0 HG SER A 3 1.077 -36.900 -1.148 1.00 0.00 H new ATOM 30 N GLY A 4 0.201 -33.277 -1.117 1.00 0.00 N ATOM 31 CA GLY A 4 0.451 -32.210 -0.165 1.00 0.00 C ATOM 32 C GLY A 4 -0.514 -31.052 -0.326 1.00 0.00 C ATOM 33 O GLY A 4 -1.457 -30.908 0.452 1.00 0.00 O ATOM 0 H GLY A 4 1.033 -33.641 -1.581 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.374 -32.605 0.848 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.472 -31.848 -0.289 1.00 0.00 H new ATOM 37 N SER A 5 -0.277 -30.222 -1.337 1.00 0.00 N ATOM 38 CA SER A 5 -1.129 -29.067 -1.593 1.00 0.00 C ATOM 39 C SER A 5 -0.988 -28.597 -3.038 1.00 0.00 C ATOM 40 O SER A 5 0.104 -28.245 -3.483 1.00 0.00 O ATOM 41 CB SER A 5 -0.778 -27.925 -0.637 1.00 0.00 C ATOM 42 OG SER A 5 -1.407 -28.100 0.620 1.00 0.00 O ATOM 0 H SER A 5 0.498 -30.328 -1.992 1.00 0.00 H new ATOM 0 HA SER A 5 -2.164 -29.366 -1.426 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.303 -27.878 -0.503 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.087 -26.975 -1.072 1.00 0.00 H new ATOM 0 HG SER A 5 -1.610 -29.049 0.755 1.00 0.00 H new ATOM 48 N SER A 6 -2.101 -28.596 -3.764 1.00 0.00 N ATOM 49 CA SER A 6 -2.101 -28.174 -5.160 1.00 0.00 C ATOM 50 C SER A 6 -2.328 -26.670 -5.273 1.00 0.00 C ATOM 51 O SER A 6 -2.662 -26.006 -4.293 1.00 0.00 O ATOM 52 CB SER A 6 -3.183 -28.924 -5.942 1.00 0.00 C ATOM 53 OG SER A 6 -2.867 -30.300 -6.058 1.00 0.00 O ATOM 0 H SER A 6 -3.014 -28.882 -3.409 1.00 0.00 H new ATOM 0 HA SER A 6 -1.125 -28.410 -5.585 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.144 -28.809 -5.440 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.288 -28.487 -6.935 1.00 0.00 H new ATOM 0 HG SER A 6 -3.574 -30.757 -6.560 1.00 0.00 H new ATOM 59 N GLY A 7 -2.143 -26.138 -6.478 1.00 0.00 N ATOM 60 CA GLY A 7 -2.331 -24.716 -6.698 1.00 0.00 C ATOM 61 C GLY A 7 -3.658 -24.402 -7.362 1.00 0.00 C ATOM 62 O GLY A 7 -3.703 -24.057 -8.543 1.00 0.00 O ATOM 0 H GLY A 7 -1.866 -26.667 -7.305 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.273 -24.193 -5.743 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.519 -24.337 -7.319 1.00 0.00 H new ATOM 66 N THR A 8 -4.742 -24.524 -6.601 1.00 0.00 N ATOM 67 CA THR A 8 -6.075 -24.254 -7.123 1.00 0.00 C ATOM 68 C THR A 8 -6.820 -23.257 -6.241 1.00 0.00 C ATOM 69 O THR A 8 -6.718 -23.301 -5.016 1.00 0.00 O ATOM 70 CB THR A 8 -6.907 -25.545 -7.234 1.00 0.00 C ATOM 71 OG1 THR A 8 -6.163 -26.548 -7.935 1.00 0.00 O ATOM 72 CG2 THR A 8 -8.219 -25.283 -7.957 1.00 0.00 C ATOM 0 H THR A 8 -4.722 -24.808 -5.622 1.00 0.00 H new ATOM 0 HA THR A 8 -5.944 -23.828 -8.118 1.00 0.00 H new ATOM 0 HB THR A 8 -7.129 -25.895 -6.226 1.00 0.00 H new ATOM 0 HG1 THR A 8 -6.698 -27.366 -8.000 1.00 0.00 H new ATOM 0 HG21 THR A 8 -8.789 -26.210 -8.023 1.00 0.00 H new ATOM 0 HG22 THR A 8 -8.796 -24.540 -7.406 1.00 0.00 H new ATOM 0 HG23 THR A 8 -8.013 -24.911 -8.961 1.00 0.00 H new ATOM 80 N GLY A 9 -7.569 -22.358 -6.873 1.00 0.00 N ATOM 81 CA GLY A 9 -8.319 -21.364 -6.129 1.00 0.00 C ATOM 82 C GLY A 9 -8.824 -20.240 -7.011 1.00 0.00 C ATOM 83 O GLY A 9 -8.605 -20.246 -8.223 1.00 0.00 O ATOM 0 H GLY A 9 -7.669 -22.301 -7.886 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -9.165 -21.844 -5.638 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -7.687 -20.950 -5.343 1.00 0.00 H new ATOM 87 N ASP A 10 -9.503 -19.273 -6.403 1.00 0.00 N ATOM 88 CA ASP A 10 -10.042 -18.137 -7.142 1.00 0.00 C ATOM 89 C ASP A 10 -9.694 -16.823 -6.447 1.00 0.00 C ATOM 90 O ASP A 10 -9.667 -16.748 -5.220 1.00 0.00 O ATOM 91 CB ASP A 10 -11.559 -18.267 -7.285 1.00 0.00 C ATOM 92 CG ASP A 10 -11.956 -19.270 -8.351 1.00 0.00 C ATOM 93 OD1 ASP A 10 -11.123 -19.556 -9.236 1.00 0.00 O ATOM 94 OD2 ASP A 10 -13.101 -19.768 -8.300 1.00 0.00 O ATOM 0 H ASP A 10 -9.693 -19.253 -5.401 1.00 0.00 H new ATOM 0 HA ASP A 10 -9.591 -18.133 -8.134 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -11.987 -18.569 -6.329 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -11.983 -17.293 -7.531 1.00 0.00 H new ATOM 99 N ALA A 11 -9.429 -15.791 -7.242 1.00 0.00 N ATOM 100 CA ALA A 11 -9.085 -14.482 -6.704 1.00 0.00 C ATOM 101 C ALA A 11 -10.314 -13.583 -6.619 1.00 0.00 C ATOM 102 O ALA A 11 -10.609 -13.017 -5.566 1.00 0.00 O ATOM 103 CB ALA A 11 -8.008 -13.827 -7.557 1.00 0.00 C ATOM 0 H ALA A 11 -9.446 -15.837 -8.261 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.699 -14.622 -5.694 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -7.761 -12.849 -7.143 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -7.117 -14.455 -7.563 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.374 -13.707 -8.577 1.00 0.00 H new ATOM 109 N SER A 12 -11.027 -13.456 -7.733 1.00 0.00 N ATOM 110 CA SER A 12 -12.222 -12.621 -7.785 1.00 0.00 C ATOM 111 C SER A 12 -13.050 -12.779 -6.514 1.00 0.00 C ATOM 112 O SER A 12 -13.668 -11.827 -6.039 1.00 0.00 O ATOM 113 CB SER A 12 -13.069 -12.983 -9.007 1.00 0.00 C ATOM 114 OG SER A 12 -13.527 -14.321 -8.932 1.00 0.00 O ATOM 0 H SER A 12 -10.798 -13.920 -8.612 1.00 0.00 H new ATOM 0 HA SER A 12 -11.906 -11.581 -7.865 1.00 0.00 H new ATOM 0 HB2 SER A 12 -13.921 -12.307 -9.076 1.00 0.00 H new ATOM 0 HB3 SER A 12 -12.480 -12.847 -9.914 1.00 0.00 H new ATOM 0 HG SER A 12 -14.067 -14.527 -9.724 1.00 0.00 H new ATOM 120 N LYS A 13 -13.058 -13.990 -5.966 1.00 0.00 N ATOM 121 CA LYS A 13 -13.808 -14.276 -4.750 1.00 0.00 C ATOM 122 C LYS A 13 -13.228 -13.516 -3.561 1.00 0.00 C ATOM 123 O LYS A 13 -13.966 -12.961 -2.747 1.00 0.00 O ATOM 124 CB LYS A 13 -13.800 -15.779 -4.461 1.00 0.00 C ATOM 125 CG LYS A 13 -14.296 -16.623 -5.621 1.00 0.00 C ATOM 126 CD LYS A 13 -15.784 -16.427 -5.858 1.00 0.00 C ATOM 127 CE LYS A 13 -16.613 -17.403 -5.036 1.00 0.00 C ATOM 128 NZ LYS A 13 -18.010 -17.504 -5.540 1.00 0.00 N ATOM 0 H LYS A 13 -12.552 -14.790 -6.346 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.836 -13.948 -4.903 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.786 -16.086 -4.207 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.421 -15.976 -3.587 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -13.745 -16.361 -6.524 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.094 -17.675 -5.419 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -16.063 -15.405 -5.601 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -16.006 -16.561 -6.917 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -16.146 -18.387 -5.061 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -16.625 -17.082 -3.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -18.543 -18.178 -4.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.465 -16.570 -5.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.000 -17.835 -6.526 1.00 0.00 H new ATOM 142 N CYS A 14 -11.902 -13.495 -3.470 1.00 0.00 N ATOM 143 CA CYS A 14 -11.223 -12.802 -2.381 1.00 0.00 C ATOM 144 C CYS A 14 -11.766 -11.386 -2.213 1.00 0.00 C ATOM 145 O CYS A 14 -12.526 -10.899 -3.051 1.00 0.00 O ATOM 146 CB CYS A 14 -9.717 -12.756 -2.639 1.00 0.00 C ATOM 147 SG CYS A 14 -8.709 -12.737 -1.138 1.00 0.00 S ATOM 0 H CYS A 14 -11.277 -13.949 -4.136 1.00 0.00 H new ATOM 0 HA CYS A 14 -11.410 -13.354 -1.460 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -9.436 -13.620 -3.241 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -9.488 -11.869 -3.229 1.00 0.00 H new ATOM 0 HG CYS A 14 -9.479 -12.594 -0.100 1.00 0.00 H new ATOM 153 N LEU A 15 -11.373 -10.732 -1.127 1.00 0.00 N ATOM 154 CA LEU A 15 -11.821 -9.371 -0.848 1.00 0.00 C ATOM 155 C LEU A 15 -10.718 -8.562 -0.176 1.00 0.00 C ATOM 156 O LEU A 15 -9.796 -9.122 0.418 1.00 0.00 O ATOM 157 CB LEU A 15 -13.066 -9.396 0.039 1.00 0.00 C ATOM 158 CG LEU A 15 -14.410 -9.439 -0.690 1.00 0.00 C ATOM 159 CD1 LEU A 15 -14.805 -10.875 -0.995 1.00 0.00 C ATOM 160 CD2 LEU A 15 -15.486 -8.751 0.136 1.00 0.00 C ATOM 0 H LEU A 15 -10.745 -11.121 -0.424 1.00 0.00 H new ATOM 0 HA LEU A 15 -12.068 -8.894 -1.796 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -13.003 -10.265 0.694 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -13.050 -8.513 0.678 1.00 0.00 H new ATOM 0 HG LEU A 15 -14.308 -8.904 -1.634 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -15.764 -10.886 -1.514 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.045 -11.335 -1.627 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -14.890 -11.435 -0.064 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -16.436 -8.791 -0.398 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -15.588 -9.258 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -15.207 -7.711 0.303 1.00 0.00 H new ATOM 172 N ALA A 16 -10.820 -7.240 -0.268 1.00 0.00 N ATOM 173 CA ALA A 16 -9.834 -6.352 0.335 1.00 0.00 C ATOM 174 C ALA A 16 -10.508 -5.274 1.176 1.00 0.00 C ATOM 175 O ALA A 16 -11.206 -4.407 0.650 1.00 0.00 O ATOM 176 CB ALA A 16 -8.965 -5.719 -0.741 1.00 0.00 C ATOM 0 H ALA A 16 -11.577 -6.760 -0.755 1.00 0.00 H new ATOM 0 HA ALA A 16 -9.201 -6.947 0.994 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.233 -5.058 -0.276 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.447 -6.501 -1.297 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.591 -5.144 -1.423 1.00 0.00 H new ATOM 182 N THR A 17 -10.296 -5.333 2.488 1.00 0.00 N ATOM 183 CA THR A 17 -10.884 -4.363 3.402 1.00 0.00 C ATOM 184 C THR A 17 -9.811 -3.674 4.237 1.00 0.00 C ATOM 185 O THR A 17 -9.060 -4.326 4.962 1.00 0.00 O ATOM 186 CB THR A 17 -11.905 -5.028 4.345 1.00 0.00 C ATOM 187 OG1 THR A 17 -11.321 -6.177 4.968 1.00 0.00 O ATOM 188 CG2 THR A 17 -13.157 -5.438 3.585 1.00 0.00 C ATOM 0 H THR A 17 -9.721 -6.043 2.940 1.00 0.00 H new ATOM 0 HA THR A 17 -11.396 -3.621 2.790 1.00 0.00 H new ATOM 0 HB THR A 17 -12.185 -4.304 5.110 1.00 0.00 H new ATOM 0 HG1 THR A 17 -10.399 -5.974 5.229 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.863 -5.905 4.272 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.616 -4.557 3.137 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.891 -6.147 2.801 1.00 0.00 H new ATOM 196 N GLY A 18 -9.746 -2.350 4.133 1.00 0.00 N ATOM 197 CA GLY A 18 -8.762 -1.595 4.885 1.00 0.00 C ATOM 198 C GLY A 18 -8.776 -0.118 4.540 1.00 0.00 C ATOM 199 O GLY A 18 -9.243 0.287 3.476 1.00 0.00 O ATOM 0 H GLY A 18 -10.357 -1.787 3.541 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.952 -1.718 5.951 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.770 -2.001 4.689 1.00 0.00 H new ATOM 203 N PRO A 19 -8.255 0.713 5.455 1.00 0.00 N ATOM 204 CA PRO A 19 -8.199 2.164 5.265 1.00 0.00 C ATOM 205 C PRO A 19 -7.201 2.570 4.185 1.00 0.00 C ATOM 206 O PRO A 19 -7.329 3.629 3.574 1.00 0.00 O ATOM 207 CB PRO A 19 -7.749 2.685 6.632 1.00 0.00 C ATOM 208 CG PRO A 19 -7.007 1.547 7.244 1.00 0.00 C ATOM 209 CD PRO A 19 -7.680 0.298 6.746 1.00 0.00 C ATOM 0 HA PRO A 19 -9.156 2.568 4.934 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.113 3.564 6.531 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -8.602 2.977 7.245 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -5.956 1.566 6.955 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -7.039 1.600 8.332 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -6.970 -0.520 6.625 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -8.450 -0.047 7.437 1.00 0.00 H new ATOM 217 N GLY A 20 -6.205 1.718 3.957 1.00 0.00 N ATOM 218 CA GLY A 20 -5.200 2.006 2.950 1.00 0.00 C ATOM 219 C GLY A 20 -5.774 2.026 1.547 1.00 0.00 C ATOM 220 O GLY A 20 -5.433 2.895 0.743 1.00 0.00 O ATOM 0 H GLY A 20 -6.077 0.835 4.451 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.741 2.971 3.165 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.410 1.257 3.005 1.00 0.00 H new ATOM 224 N ILE A 21 -6.643 1.066 1.250 1.00 0.00 N ATOM 225 CA ILE A 21 -7.263 0.977 -0.066 1.00 0.00 C ATOM 226 C ILE A 21 -8.503 1.862 -0.150 1.00 0.00 C ATOM 227 O ILE A 21 -9.375 1.648 -0.991 1.00 0.00 O ATOM 228 CB ILE A 21 -7.657 -0.472 -0.406 1.00 0.00 C ATOM 229 CG1 ILE A 21 -8.712 -0.982 0.579 1.00 0.00 C ATOM 230 CG2 ILE A 21 -6.431 -1.372 -0.388 1.00 0.00 C ATOM 231 CD1 ILE A 21 -9.262 -2.345 0.223 1.00 0.00 C ATOM 0 H ILE A 21 -6.934 0.339 1.903 1.00 0.00 H new ATOM 0 HA ILE A 21 -6.523 1.322 -0.788 1.00 0.00 H new ATOM 0 HB ILE A 21 -8.084 -0.491 -1.409 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -8.275 -1.025 1.577 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -9.534 -0.267 0.621 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -6.726 -2.393 -0.630 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.709 -1.018 -1.124 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -5.978 -1.350 0.603 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -10.004 -2.643 0.964 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -9.729 -2.303 -0.761 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.451 -3.073 0.209 1.00 0.00 H new ATOM 243 N ALA A 22 -8.572 2.859 0.727 1.00 0.00 N ATOM 244 CA ALA A 22 -9.702 3.778 0.749 1.00 0.00 C ATOM 245 C ALA A 22 -9.672 4.714 -0.455 1.00 0.00 C ATOM 246 O ALA A 22 -8.623 5.251 -0.810 1.00 0.00 O ATOM 247 CB ALA A 22 -9.706 4.579 2.043 1.00 0.00 C ATOM 0 H ALA A 22 -7.859 3.050 1.431 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.618 3.190 0.696 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -10.556 5.262 2.046 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -9.784 3.899 2.891 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.781 5.151 2.120 1.00 0.00 H new ATOM 253 N SER A 23 -10.830 4.905 -1.079 1.00 0.00 N ATOM 254 CA SER A 23 -10.936 5.773 -2.246 1.00 0.00 C ATOM 255 C SER A 23 -10.008 6.976 -2.113 1.00 0.00 C ATOM 256 O SER A 23 -9.352 7.379 -3.075 1.00 0.00 O ATOM 257 CB SER A 23 -12.379 6.245 -2.428 1.00 0.00 C ATOM 258 OG SER A 23 -12.781 7.080 -1.355 1.00 0.00 O ATOM 0 H SER A 23 -11.708 4.470 -0.796 1.00 0.00 H new ATOM 0 HA SER A 23 -10.636 5.200 -3.123 1.00 0.00 H new ATOM 0 HB2 SER A 23 -12.472 6.787 -3.369 1.00 0.00 H new ATOM 0 HB3 SER A 23 -13.042 5.382 -2.490 1.00 0.00 H new ATOM 0 HG SER A 23 -13.706 7.370 -1.495 1.00 0.00 H new ATOM 264 N THR A 24 -9.957 7.548 -0.914 1.00 0.00 N ATOM 265 CA THR A 24 -9.111 8.706 -0.654 1.00 0.00 C ATOM 266 C THR A 24 -8.468 8.619 0.725 1.00 0.00 C ATOM 267 O THR A 24 -9.156 8.458 1.733 1.00 0.00 O ATOM 268 CB THR A 24 -9.910 10.019 -0.754 1.00 0.00 C ATOM 269 OG1 THR A 24 -10.915 10.060 0.266 1.00 0.00 O ATOM 270 CG2 THR A 24 -10.563 10.153 -2.121 1.00 0.00 C ATOM 0 H THR A 24 -10.492 7.228 -0.107 1.00 0.00 H new ATOM 0 HA THR A 24 -8.331 8.705 -1.416 1.00 0.00 H new ATOM 0 HB THR A 24 -9.218 10.850 -0.616 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.610 9.552 1.047 1.00 0.00 H new ATOM 0 HG21 THR A 24 -11.121 11.088 -2.167 1.00 0.00 H new ATOM 0 HG22 THR A 24 -9.794 10.151 -2.893 1.00 0.00 H new ATOM 0 HG23 THR A 24 -11.242 9.316 -2.283 1.00 0.00 H new ATOM 278 N VAL A 25 -7.144 8.725 0.764 1.00 0.00 N ATOM 279 CA VAL A 25 -6.407 8.660 2.021 1.00 0.00 C ATOM 280 C VAL A 25 -5.599 9.932 2.251 1.00 0.00 C ATOM 281 O VAL A 25 -5.331 10.688 1.316 1.00 0.00 O ATOM 282 CB VAL A 25 -5.458 7.449 2.053 1.00 0.00 C ATOM 283 CG1 VAL A 25 -6.233 6.156 1.850 1.00 0.00 C ATOM 284 CG2 VAL A 25 -4.369 7.597 1.000 1.00 0.00 C ATOM 0 H VAL A 25 -6.559 8.856 -0.061 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.146 8.554 2.816 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.982 7.409 3.033 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.545 5.311 1.876 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.972 6.046 2.644 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.739 6.183 0.885 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.707 6.732 1.037 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.825 7.663 0.012 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.794 8.502 1.196 1.00 0.00 H new ATOM 294 N LYS A 26 -5.211 10.162 3.500 1.00 0.00 N ATOM 295 CA LYS A 26 -4.431 11.342 3.854 1.00 0.00 C ATOM 296 C LYS A 26 -2.936 11.054 3.761 1.00 0.00 C ATOM 297 O LYS A 26 -2.463 10.014 4.221 1.00 0.00 O ATOM 298 CB LYS A 26 -4.784 11.806 5.270 1.00 0.00 C ATOM 299 CG LYS A 26 -6.105 12.552 5.353 1.00 0.00 C ATOM 300 CD LYS A 26 -7.269 11.601 5.575 1.00 0.00 C ATOM 301 CE LYS A 26 -7.304 11.087 7.007 1.00 0.00 C ATOM 302 NZ LYS A 26 -8.043 9.799 7.117 1.00 0.00 N ATOM 0 H LYS A 26 -5.424 9.547 4.285 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.676 12.134 3.146 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.824 10.938 5.928 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.988 12.451 5.641 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.065 13.276 6.167 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.264 13.115 4.433 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -8.205 12.111 5.347 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.189 10.759 4.887 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -6.285 10.953 7.369 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -7.775 11.832 7.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -8.044 9.483 8.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -9.023 9.932 6.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -7.579 9.081 6.525 1.00 0.00 H new ATOM 316 N THR A 27 -2.195 11.982 3.164 1.00 0.00 N ATOM 317 CA THR A 27 -0.753 11.828 3.011 1.00 0.00 C ATOM 318 C THR A 27 -0.058 11.789 4.366 1.00 0.00 C ATOM 319 O THR A 27 -0.522 12.395 5.331 1.00 0.00 O ATOM 320 CB THR A 27 -0.152 12.970 2.171 1.00 0.00 C ATOM 321 OG1 THR A 27 -0.554 14.237 2.707 1.00 0.00 O ATOM 322 CG2 THR A 27 -0.596 12.866 0.720 1.00 0.00 C ATOM 0 H THR A 27 -2.570 12.849 2.778 1.00 0.00 H new ATOM 0 HA THR A 27 -0.589 10.882 2.494 1.00 0.00 H new ATOM 0 HB THR A 27 0.934 12.887 2.210 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.166 14.958 2.168 1.00 0.00 H new ATOM 0 HG21 THR A 27 -0.159 13.683 0.146 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.265 11.914 0.305 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.683 12.926 0.667 1.00 0.00 H new ATOM 330 N GLY A 28 1.059 11.070 4.433 1.00 0.00 N ATOM 331 CA GLY A 28 1.801 10.967 5.675 1.00 0.00 C ATOM 332 C GLY A 28 1.230 9.914 6.606 1.00 0.00 C ATOM 333 O GLY A 28 1.974 9.134 7.200 1.00 0.00 O ATOM 0 H GLY A 28 1.463 10.557 3.649 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.841 10.727 5.454 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.797 11.934 6.179 1.00 0.00 H new ATOM 337 N GLU A 29 -0.093 9.893 6.733 1.00 0.00 N ATOM 338 CA GLU A 29 -0.762 8.930 7.599 1.00 0.00 C ATOM 339 C GLU A 29 -0.424 7.501 7.186 1.00 0.00 C ATOM 340 O GLU A 29 -0.462 7.160 6.004 1.00 0.00 O ATOM 341 CB GLU A 29 -2.276 9.140 7.559 1.00 0.00 C ATOM 342 CG GLU A 29 -2.769 10.207 8.523 1.00 0.00 C ATOM 343 CD GLU A 29 -3.018 9.662 9.917 1.00 0.00 C ATOM 344 OE1 GLU A 29 -2.031 9.365 10.622 1.00 0.00 O ATOM 345 OE2 GLU A 29 -4.198 9.532 10.302 1.00 0.00 O ATOM 0 H GLU A 29 -0.722 10.532 6.247 1.00 0.00 H new ATOM 0 HA GLU A 29 -0.408 9.089 8.618 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.570 9.414 6.546 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.771 8.197 7.790 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.035 11.011 8.577 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.691 10.643 8.137 1.00 0.00 H new ATOM 352 N GLU A 30 -0.095 6.669 8.169 1.00 0.00 N ATOM 353 CA GLU A 30 0.251 5.277 7.907 1.00 0.00 C ATOM 354 C GLU A 30 -0.996 4.397 7.909 1.00 0.00 C ATOM 355 O GLU A 30 -1.589 4.143 8.958 1.00 0.00 O ATOM 356 CB GLU A 30 1.247 4.770 8.952 1.00 0.00 C ATOM 357 CG GLU A 30 1.417 3.260 8.950 1.00 0.00 C ATOM 358 CD GLU A 30 0.440 2.562 9.876 1.00 0.00 C ATOM 359 OE1 GLU A 30 0.195 3.085 10.984 1.00 0.00 O ATOM 360 OE2 GLU A 30 -0.080 1.493 9.493 1.00 0.00 O ATOM 0 H GLU A 30 -0.061 6.934 9.153 1.00 0.00 H new ATOM 0 HA GLU A 30 0.712 5.224 6.921 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.216 5.236 8.774 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.917 5.089 9.941 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.282 2.884 7.936 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.436 3.012 9.249 1.00 0.00 H new ATOM 367 N VAL A 31 -1.389 3.936 6.726 1.00 0.00 N ATOM 368 CA VAL A 31 -2.565 3.084 6.591 1.00 0.00 C ATOM 369 C VAL A 31 -2.202 1.614 6.762 1.00 0.00 C ATOM 370 O VAL A 31 -1.026 1.256 6.816 1.00 0.00 O ATOM 371 CB VAL A 31 -3.242 3.277 5.221 1.00 0.00 C ATOM 372 CG1 VAL A 31 -3.713 4.714 5.055 1.00 0.00 C ATOM 373 CG2 VAL A 31 -2.293 2.886 4.098 1.00 0.00 C ATOM 0 H VAL A 31 -0.911 4.138 5.848 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.260 3.377 7.378 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.115 2.626 5.172 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.189 4.831 4.081 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.430 4.955 5.840 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.859 5.387 5.125 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.788 3.029 3.137 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.400 3.510 4.142 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.010 1.839 4.209 1.00 0.00 H new ATOM 383 N GLY A 32 -3.220 0.764 6.849 1.00 0.00 N ATOM 384 CA GLY A 32 -2.988 -0.659 7.013 1.00 0.00 C ATOM 385 C GLY A 32 -4.203 -1.491 6.652 1.00 0.00 C ATOM 386 O GLY A 32 -5.134 -1.620 7.447 1.00 0.00 O ATOM 0 H GLY A 32 -4.202 1.036 6.809 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.147 -0.961 6.389 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.707 -0.861 8.047 1.00 0.00 H new ATOM 390 N PHE A 33 -4.196 -2.056 5.450 1.00 0.00 N ATOM 391 CA PHE A 33 -5.306 -2.878 4.984 1.00 0.00 C ATOM 392 C PHE A 33 -4.945 -4.359 5.031 1.00 0.00 C ATOM 393 O PHE A 33 -3.770 -4.725 4.973 1.00 0.00 O ATOM 394 CB PHE A 33 -5.698 -2.482 3.559 1.00 0.00 C ATOM 395 CG PHE A 33 -4.598 -2.685 2.557 1.00 0.00 C ATOM 396 CD1 PHE A 33 -3.678 -1.679 2.305 1.00 0.00 C ATOM 397 CD2 PHE A 33 -4.484 -3.881 1.865 1.00 0.00 C ATOM 398 CE1 PHE A 33 -2.664 -1.863 1.384 1.00 0.00 C ATOM 399 CE2 PHE A 33 -3.471 -4.069 0.943 1.00 0.00 C ATOM 400 CZ PHE A 33 -2.561 -3.059 0.701 1.00 0.00 C ATOM 0 H PHE A 33 -3.433 -1.960 4.780 1.00 0.00 H new ATOM 0 HA PHE A 33 -6.154 -2.708 5.648 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.568 -3.064 3.255 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -5.997 -1.434 3.551 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -3.755 -0.741 2.834 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -5.194 -4.674 2.048 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -1.953 -1.072 1.199 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.391 -5.006 0.412 1.00 0.00 H new ATOM 0 HZ PHE A 33 -1.771 -3.204 -0.021 1.00 0.00 H new ATOM 410 N VAL A 34 -5.962 -5.207 5.140 1.00 0.00 N ATOM 411 CA VAL A 34 -5.753 -6.650 5.194 1.00 0.00 C ATOM 412 C VAL A 34 -6.664 -7.374 4.211 1.00 0.00 C ATOM 413 O VAL A 34 -7.815 -6.987 4.011 1.00 0.00 O ATOM 414 CB VAL A 34 -6.004 -7.199 6.611 1.00 0.00 C ATOM 415 CG1 VAL A 34 -7.401 -6.832 7.087 1.00 0.00 C ATOM 416 CG2 VAL A 34 -5.800 -8.706 6.641 1.00 0.00 C ATOM 0 H VAL A 34 -6.939 -4.920 5.193 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.713 -6.831 4.921 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.284 -6.744 7.291 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -7.560 -7.229 8.090 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.506 -5.747 7.105 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -8.140 -7.257 6.408 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.981 -9.078 7.650 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.495 -9.181 5.949 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -4.777 -8.941 6.346 1.00 0.00 H new ATOM 426 N VAL A 35 -6.142 -8.432 3.598 1.00 0.00 N ATOM 427 CA VAL A 35 -6.908 -9.215 2.635 1.00 0.00 C ATOM 428 C VAL A 35 -7.581 -10.406 3.307 1.00 0.00 C ATOM 429 O VAL A 35 -6.916 -11.249 3.910 1.00 0.00 O ATOM 430 CB VAL A 35 -6.016 -9.723 1.487 1.00 0.00 C ATOM 431 CG1 VAL A 35 -6.812 -10.616 0.548 1.00 0.00 C ATOM 432 CG2 VAL A 35 -5.401 -8.554 0.733 1.00 0.00 C ATOM 0 H VAL A 35 -5.191 -8.767 3.751 1.00 0.00 H new ATOM 0 HA VAL A 35 -7.671 -8.553 2.225 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.207 -10.316 1.913 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.165 -10.966 -0.257 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.199 -11.472 1.101 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.643 -10.051 0.126 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.774 -8.931 -0.075 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.194 -7.932 0.317 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -4.794 -7.959 1.416 1.00 0.00 H new ATOM 442 N ASP A 36 -8.904 -10.469 3.199 1.00 0.00 N ATOM 443 CA ASP A 36 -9.667 -11.559 3.795 1.00 0.00 C ATOM 444 C ASP A 36 -10.058 -12.590 2.740 1.00 0.00 C ATOM 445 O ASP A 36 -10.391 -12.239 1.608 1.00 0.00 O ATOM 446 CB ASP A 36 -10.921 -11.015 4.482 1.00 0.00 C ATOM 447 CG ASP A 36 -11.370 -11.885 5.640 1.00 0.00 C ATOM 448 OD1 ASP A 36 -11.704 -13.065 5.402 1.00 0.00 O ATOM 449 OD2 ASP A 36 -11.388 -11.386 6.785 1.00 0.00 O ATOM 0 H ASP A 36 -9.469 -9.779 2.705 1.00 0.00 H new ATOM 0 HA ASP A 36 -9.036 -12.047 4.538 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -10.725 -10.006 4.844 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.728 -10.941 3.753 1.00 0.00 H new ATOM 454 N ALA A 37 -10.012 -13.863 3.118 1.00 0.00 N ATOM 455 CA ALA A 37 -10.361 -14.945 2.205 1.00 0.00 C ATOM 456 C ALA A 37 -11.366 -15.899 2.843 1.00 0.00 C ATOM 457 O ALA A 37 -11.144 -16.407 3.942 1.00 0.00 O ATOM 458 CB ALA A 37 -9.111 -15.699 1.779 1.00 0.00 C ATOM 0 H ALA A 37 -9.736 -14.171 4.051 1.00 0.00 H new ATOM 0 HA ALA A 37 -10.826 -14.507 1.322 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.386 -16.504 1.098 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.427 -15.015 1.276 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.622 -16.119 2.658 1.00 0.00 H new ATOM 464 N LYS A 38 -12.473 -16.137 2.148 1.00 0.00 N ATOM 465 CA LYS A 38 -13.512 -17.030 2.644 1.00 0.00 C ATOM 466 C LYS A 38 -13.730 -18.197 1.688 1.00 0.00 C ATOM 467 O LYS A 38 -13.770 -19.356 2.104 1.00 0.00 O ATOM 468 CB LYS A 38 -14.823 -16.264 2.837 1.00 0.00 C ATOM 469 CG LYS A 38 -15.205 -15.405 1.644 1.00 0.00 C ATOM 470 CD LYS A 38 -16.459 -14.591 1.922 1.00 0.00 C ATOM 471 CE LYS A 38 -17.719 -15.385 1.614 1.00 0.00 C ATOM 472 NZ LYS A 38 -18.935 -14.526 1.635 1.00 0.00 N ATOM 0 H LYS A 38 -12.673 -15.723 1.238 1.00 0.00 H new ATOM 0 HA LYS A 38 -13.185 -17.427 3.605 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -15.625 -16.976 3.034 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -14.737 -15.629 3.719 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.382 -14.734 1.399 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.368 -16.041 0.774 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.469 -14.282 2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -16.445 -13.682 1.321 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -17.622 -15.854 0.635 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -17.829 -16.188 2.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -19.772 -15.104 1.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -19.042 -14.098 2.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -18.841 -13.774 0.922 1.00 0.00 H new ATOM 486 N THR A 39 -13.868 -17.886 0.402 1.00 0.00 N ATOM 487 CA THR A 39 -14.080 -18.910 -0.613 1.00 0.00 C ATOM 488 C THR A 39 -12.909 -18.969 -1.587 1.00 0.00 C ATOM 489 O THR A 39 -12.676 -19.991 -2.232 1.00 0.00 O ATOM 490 CB THR A 39 -15.378 -18.655 -1.404 1.00 0.00 C ATOM 491 OG1 THR A 39 -15.327 -17.368 -2.028 1.00 0.00 O ATOM 492 CG2 THR A 39 -16.592 -18.735 -0.491 1.00 0.00 C ATOM 0 H THR A 39 -13.837 -16.933 0.040 1.00 0.00 H new ATOM 0 HA THR A 39 -14.162 -19.863 -0.090 1.00 0.00 H new ATOM 0 HB THR A 39 -15.468 -19.425 -2.170 1.00 0.00 H new ATOM 0 HG1 THR A 39 -16.149 -16.874 -1.827 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.496 -18.552 -1.071 1.00 0.00 H new ATOM 0 HG22 THR A 39 -16.644 -19.726 -0.041 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.507 -17.984 0.295 1.00 0.00 H new ATOM 500 N ALA A 40 -12.173 -17.867 -1.689 1.00 0.00 N ATOM 501 CA ALA A 40 -11.025 -17.795 -2.583 1.00 0.00 C ATOM 502 C ALA A 40 -10.257 -19.113 -2.597 1.00 0.00 C ATOM 503 O ALA A 40 -9.892 -19.620 -3.657 1.00 0.00 O ATOM 504 CB ALA A 40 -10.107 -16.652 -2.173 1.00 0.00 C ATOM 0 H ALA A 40 -12.352 -17.012 -1.163 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.393 -17.607 -3.592 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.254 -16.610 -2.850 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -10.654 -15.711 -2.221 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.755 -16.816 -1.155 1.00 0.00 H new ATOM 510 N GLY A 41 -10.013 -19.663 -1.411 1.00 0.00 N ATOM 511 CA GLY A 41 -9.289 -20.917 -1.309 1.00 0.00 C ATOM 512 C GLY A 41 -7.817 -20.714 -1.011 1.00 0.00 C ATOM 513 O GLY A 41 -7.453 -19.891 -0.170 1.00 0.00 O ATOM 0 H GLY A 41 -10.304 -19.262 -0.519 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.735 -21.527 -0.524 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -9.395 -21.471 -2.242 1.00 0.00 H new ATOM 517 N LYS A 42 -6.966 -21.466 -1.700 1.00 0.00 N ATOM 518 CA LYS A 42 -5.524 -21.367 -1.506 1.00 0.00 C ATOM 519 C LYS A 42 -4.915 -20.347 -2.463 1.00 0.00 C ATOM 520 O LYS A 42 -5.422 -20.136 -3.564 1.00 0.00 O ATOM 521 CB LYS A 42 -4.865 -22.732 -1.711 1.00 0.00 C ATOM 522 CG LYS A 42 -3.498 -22.852 -1.061 1.00 0.00 C ATOM 523 CD LYS A 42 -3.203 -24.281 -0.640 1.00 0.00 C ATOM 524 CE LYS A 42 -3.774 -24.586 0.736 1.00 0.00 C ATOM 525 NZ LYS A 42 -5.207 -24.986 0.665 1.00 0.00 N ATOM 0 H LYS A 42 -7.250 -22.152 -2.399 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.343 -21.034 -0.484 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -5.519 -23.506 -1.308 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.768 -22.922 -2.780 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.732 -22.512 -1.758 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.450 -22.198 -0.190 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -3.624 -24.971 -1.371 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.125 -24.444 -0.632 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -3.196 -25.385 1.200 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -3.673 -23.708 1.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.432 -25.614 1.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -5.807 -24.138 0.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.384 -25.486 -0.229 1.00 0.00 H new ATOM 539 N GLY A 43 -3.823 -19.720 -2.038 1.00 0.00 N ATOM 540 CA GLY A 43 -3.163 -18.732 -2.870 1.00 0.00 C ATOM 541 C GLY A 43 -2.448 -17.671 -2.055 1.00 0.00 C ATOM 542 O GLY A 43 -2.812 -17.409 -0.909 1.00 0.00 O ATOM 0 H GLY A 43 -3.383 -19.879 -1.131 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.445 -19.231 -3.521 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.900 -18.254 -3.516 1.00 0.00 H new ATOM 546 N LYS A 44 -1.428 -17.060 -2.647 1.00 0.00 N ATOM 547 CA LYS A 44 -0.660 -16.023 -1.971 1.00 0.00 C ATOM 548 C LYS A 44 -1.168 -14.635 -2.349 1.00 0.00 C ATOM 549 O LYS A 44 -1.895 -14.475 -3.329 1.00 0.00 O ATOM 550 CB LYS A 44 0.824 -16.147 -2.323 1.00 0.00 C ATOM 551 CG LYS A 44 1.376 -17.551 -2.150 1.00 0.00 C ATOM 552 CD LYS A 44 1.916 -17.769 -0.747 1.00 0.00 C ATOM 553 CE LYS A 44 0.847 -18.324 0.182 1.00 0.00 C ATOM 554 NZ LYS A 44 0.620 -19.780 -0.039 1.00 0.00 N ATOM 0 H LYS A 44 -1.114 -17.266 -3.595 1.00 0.00 H new ATOM 0 HA LYS A 44 -0.785 -16.156 -0.896 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.971 -15.833 -3.356 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.396 -15.462 -1.697 1.00 0.00 H new ATOM 0 HG2 LYS A 44 0.592 -18.279 -2.356 1.00 0.00 H new ATOM 0 HG3 LYS A 44 2.170 -17.723 -2.877 1.00 0.00 H new ATOM 0 HD2 LYS A 44 2.760 -18.457 -0.784 1.00 0.00 H new ATOM 0 HD3 LYS A 44 2.291 -16.826 -0.350 1.00 0.00 H new ATOM 0 HE2 LYS A 44 1.143 -18.156 1.217 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -0.086 -17.783 0.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -0.323 -20.041 0.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 0.682 -19.991 -1.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.343 -20.326 0.472 1.00 0.00 H new ATOM 568 N VAL A 45 -0.782 -13.634 -1.564 1.00 0.00 N ATOM 569 CA VAL A 45 -1.196 -12.260 -1.819 1.00 0.00 C ATOM 570 C VAL A 45 0.006 -11.324 -1.873 1.00 0.00 C ATOM 571 O VAL A 45 0.653 -11.064 -0.857 1.00 0.00 O ATOM 572 CB VAL A 45 -2.174 -11.760 -0.738 1.00 0.00 C ATOM 573 CG1 VAL A 45 -2.653 -10.352 -1.061 1.00 0.00 C ATOM 574 CG2 VAL A 45 -3.351 -12.714 -0.603 1.00 0.00 C ATOM 0 H VAL A 45 -0.183 -13.749 -0.746 1.00 0.00 H new ATOM 0 HA VAL A 45 -1.699 -12.255 -2.786 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.649 -11.729 0.217 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.343 -10.016 -0.287 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -1.798 -9.677 -1.103 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.162 -10.353 -2.025 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.032 -12.346 0.165 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -3.878 -12.778 -1.555 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -2.988 -13.702 -0.322 1.00 0.00 H new ATOM 584 N THR A 46 0.302 -10.817 -3.066 1.00 0.00 N ATOM 585 CA THR A 46 1.427 -9.911 -3.254 1.00 0.00 C ATOM 586 C THR A 46 0.953 -8.469 -3.406 1.00 0.00 C ATOM 587 O THR A 46 -0.023 -8.198 -4.107 1.00 0.00 O ATOM 588 CB THR A 46 2.260 -10.297 -4.491 1.00 0.00 C ATOM 589 OG1 THR A 46 1.426 -10.329 -5.653 1.00 0.00 O ATOM 590 CG2 THR A 46 2.919 -11.654 -4.295 1.00 0.00 C ATOM 0 H THR A 46 -0.223 -11.019 -3.917 1.00 0.00 H new ATOM 0 HA THR A 46 2.051 -9.995 -2.364 1.00 0.00 H new ATOM 0 HB THR A 46 3.040 -9.547 -4.626 1.00 0.00 H new ATOM 0 HG1 THR A 46 1.964 -10.573 -6.435 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.502 -11.907 -5.181 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.576 -11.617 -3.426 1.00 0.00 H new ATOM 0 HG23 THR A 46 2.152 -12.412 -4.138 1.00 0.00 H new ATOM 598 N CYS A 47 1.647 -7.550 -2.746 1.00 0.00 N ATOM 599 CA CYS A 47 1.296 -6.135 -2.809 1.00 0.00 C ATOM 600 C CYS A 47 2.469 -5.306 -3.319 1.00 0.00 C ATOM 601 O CYS A 47 3.630 -5.627 -3.061 1.00 0.00 O ATOM 602 CB CYS A 47 0.863 -5.635 -1.431 1.00 0.00 C ATOM 603 SG CYS A 47 0.509 -3.863 -1.365 1.00 0.00 S ATOM 0 H CYS A 47 2.456 -7.758 -2.161 1.00 0.00 H new ATOM 0 HA CYS A 47 0.466 -6.022 -3.506 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -0.026 -6.184 -1.120 1.00 0.00 H new ATOM 0 HB3 CYS A 47 1.648 -5.865 -0.710 1.00 0.00 H new ATOM 0 HG CYS A 47 1.355 -3.281 -0.568 1.00 0.00 H new ATOM 609 N THR A 48 2.160 -4.237 -4.047 1.00 0.00 N ATOM 610 CA THR A 48 3.189 -3.362 -4.596 1.00 0.00 C ATOM 611 C THR A 48 2.702 -1.920 -4.670 1.00 0.00 C ATOM 612 O THR A 48 1.822 -1.591 -5.466 1.00 0.00 O ATOM 613 CB THR A 48 3.621 -3.819 -6.002 1.00 0.00 C ATOM 614 OG1 THR A 48 4.090 -5.171 -5.956 1.00 0.00 O ATOM 615 CG2 THR A 48 4.717 -2.916 -6.551 1.00 0.00 C ATOM 0 H THR A 48 1.205 -3.956 -4.270 1.00 0.00 H new ATOM 0 HA THR A 48 4.045 -3.419 -3.924 1.00 0.00 H new ATOM 0 HB THR A 48 2.755 -3.758 -6.662 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.361 -5.454 -6.854 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.006 -3.258 -7.545 1.00 0.00 H new ATOM 0 HG22 THR A 48 4.348 -1.892 -6.613 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.582 -2.951 -5.889 1.00 0.00 H new ATOM 623 N VAL A 49 3.279 -1.061 -3.835 1.00 0.00 N ATOM 624 CA VAL A 49 2.905 0.347 -3.807 1.00 0.00 C ATOM 625 C VAL A 49 3.658 1.137 -4.872 1.00 0.00 C ATOM 626 O VAL A 49 4.887 1.212 -4.852 1.00 0.00 O ATOM 627 CB VAL A 49 3.181 0.974 -2.428 1.00 0.00 C ATOM 628 CG1 VAL A 49 2.793 2.444 -2.422 1.00 0.00 C ATOM 629 CG2 VAL A 49 2.438 0.215 -1.340 1.00 0.00 C ATOM 0 H VAL A 49 4.008 -1.317 -3.169 1.00 0.00 H new ATOM 0 HA VAL A 49 1.835 0.394 -4.012 1.00 0.00 H new ATOM 0 HB VAL A 49 4.249 0.904 -2.224 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.995 2.870 -1.439 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.374 2.977 -3.175 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.731 2.541 -2.648 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.644 0.672 -0.372 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.367 0.252 -1.538 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.770 -0.823 -1.329 1.00 0.00 H new ATOM 639 N LEU A 50 2.913 1.726 -5.801 1.00 0.00 N ATOM 640 CA LEU A 50 3.511 2.512 -6.875 1.00 0.00 C ATOM 641 C LEU A 50 3.309 4.005 -6.634 1.00 0.00 C ATOM 642 O LEU A 50 2.181 4.472 -6.476 1.00 0.00 O ATOM 643 CB LEU A 50 2.904 2.114 -8.221 1.00 0.00 C ATOM 644 CG LEU A 50 3.673 2.567 -9.463 1.00 0.00 C ATOM 645 CD1 LEU A 50 5.090 2.017 -9.444 1.00 0.00 C ATOM 646 CD2 LEU A 50 2.947 2.132 -10.729 1.00 0.00 C ATOM 0 H LEU A 50 1.895 1.674 -5.832 1.00 0.00 H new ATOM 0 HA LEU A 50 4.581 2.307 -6.891 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.814 1.028 -8.250 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.894 2.519 -8.276 1.00 0.00 H new ATOM 0 HG LEU A 50 3.728 3.656 -9.455 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.621 2.350 -10.336 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.609 2.378 -8.556 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.057 0.928 -9.427 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.509 2.463 -11.603 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.860 1.046 -10.744 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.952 2.576 -10.748 1.00 0.00 H new ATOM 658 N THR A 51 4.410 4.749 -6.610 1.00 0.00 N ATOM 659 CA THR A 51 4.354 6.189 -6.391 1.00 0.00 C ATOM 660 C THR A 51 3.951 6.924 -7.663 1.00 0.00 C ATOM 661 O THR A 51 4.244 6.493 -8.778 1.00 0.00 O ATOM 662 CB THR A 51 5.709 6.735 -5.903 1.00 0.00 C ATOM 663 OG1 THR A 51 6.723 6.473 -6.880 1.00 0.00 O ATOM 664 CG2 THR A 51 6.102 6.104 -4.576 1.00 0.00 C ATOM 0 H THR A 51 5.351 4.378 -6.740 1.00 0.00 H new ATOM 0 HA THR A 51 3.602 6.363 -5.622 1.00 0.00 H new ATOM 0 HB THR A 51 5.611 7.811 -5.760 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.505 5.650 -7.365 1.00 0.00 H new ATOM 0 HG21 THR A 51 7.062 6.506 -4.252 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.343 6.330 -3.827 1.00 0.00 H new ATOM 0 HG23 THR A 51 6.183 5.024 -4.697 1.00 0.00 H new ATOM 672 N PRO A 52 3.262 8.063 -7.497 1.00 0.00 N ATOM 673 CA PRO A 52 2.804 8.883 -8.622 1.00 0.00 C ATOM 674 C PRO A 52 3.958 9.572 -9.344 1.00 0.00 C ATOM 675 O PRO A 52 3.746 10.316 -10.303 1.00 0.00 O ATOM 676 CB PRO A 52 1.894 9.920 -7.959 1.00 0.00 C ATOM 677 CG PRO A 52 2.386 10.013 -6.556 1.00 0.00 C ATOM 678 CD PRO A 52 2.877 8.638 -6.196 1.00 0.00 C ATOM 0 HA PRO A 52 2.306 8.285 -9.386 1.00 0.00 H new ATOM 0 HB2 PRO A 52 1.957 10.883 -8.465 1.00 0.00 H new ATOM 0 HB3 PRO A 52 0.850 9.610 -7.993 1.00 0.00 H new ATOM 0 HG2 PRO A 52 3.187 10.748 -6.471 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.589 10.331 -5.884 1.00 0.00 H new ATOM 0 HD2 PRO A 52 3.722 8.680 -5.509 1.00 0.00 H new ATOM 0 HD3 PRO A 52 2.100 8.048 -5.710 1.00 0.00 H new ATOM 686 N ASP A 53 5.176 9.319 -8.878 1.00 0.00 N ATOM 687 CA ASP A 53 6.362 9.914 -9.482 1.00 0.00 C ATOM 688 C ASP A 53 6.876 9.055 -10.632 1.00 0.00 C ATOM 689 O ASP A 53 7.519 9.553 -11.555 1.00 0.00 O ATOM 690 CB ASP A 53 7.460 10.091 -8.431 1.00 0.00 C ATOM 691 CG ASP A 53 7.385 11.435 -7.734 1.00 0.00 C ATOM 692 OD1 ASP A 53 6.925 12.407 -8.370 1.00 0.00 O ATOM 693 OD2 ASP A 53 7.784 11.514 -6.553 1.00 0.00 O ATOM 0 H ASP A 53 5.368 8.707 -8.085 1.00 0.00 H new ATOM 0 HA ASP A 53 6.087 10.891 -9.878 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.380 9.296 -7.690 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.435 9.986 -8.907 1.00 0.00 H new ATOM 698 N GLY A 54 6.589 7.757 -10.570 1.00 0.00 N ATOM 699 CA GLY A 54 7.031 6.849 -11.612 1.00 0.00 C ATOM 700 C GLY A 54 7.943 5.760 -11.083 1.00 0.00 C ATOM 701 O GLY A 54 8.660 5.115 -11.849 1.00 0.00 O ATOM 0 H GLY A 54 6.059 7.319 -9.817 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.161 6.393 -12.085 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.554 7.414 -12.384 1.00 0.00 H new ATOM 705 N THR A 55 7.921 5.557 -9.770 1.00 0.00 N ATOM 706 CA THR A 55 8.755 4.541 -9.139 1.00 0.00 C ATOM 707 C THR A 55 7.940 3.674 -8.187 1.00 0.00 C ATOM 708 O THR A 55 6.871 4.075 -7.729 1.00 0.00 O ATOM 709 CB THR A 55 9.924 5.177 -8.363 1.00 0.00 C ATOM 710 OG1 THR A 55 9.419 5.987 -7.295 1.00 0.00 O ATOM 711 CG2 THR A 55 10.788 6.025 -9.285 1.00 0.00 C ATOM 0 H THR A 55 7.334 6.083 -9.122 1.00 0.00 H new ATOM 0 HA THR A 55 9.155 3.919 -9.939 1.00 0.00 H new ATOM 0 HB THR A 55 10.538 4.375 -7.952 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.443 6.046 -7.363 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.607 6.464 -8.715 1.00 0.00 H new ATOM 0 HG22 THR A 55 11.194 5.400 -10.080 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.183 6.820 -9.721 1.00 0.00 H new ATOM 719 N GLU A 56 8.452 2.482 -7.895 1.00 0.00 N ATOM 720 CA GLU A 56 7.769 1.558 -6.996 1.00 0.00 C ATOM 721 C GLU A 56 8.528 1.418 -5.680 1.00 0.00 C ATOM 722 O GLU A 56 9.751 1.544 -5.641 1.00 0.00 O ATOM 723 CB GLU A 56 7.617 0.187 -7.659 1.00 0.00 C ATOM 724 CG GLU A 56 8.906 -0.616 -7.698 1.00 0.00 C ATOM 725 CD GLU A 56 9.766 -0.282 -8.902 1.00 0.00 C ATOM 726 OE1 GLU A 56 9.465 -0.784 -10.005 1.00 0.00 O ATOM 727 OE2 GLU A 56 10.740 0.483 -8.740 1.00 0.00 O ATOM 0 H GLU A 56 9.336 2.134 -8.267 1.00 0.00 H new ATOM 0 HA GLU A 56 6.780 1.963 -6.783 1.00 0.00 H new ATOM 0 HB2 GLU A 56 6.859 -0.384 -7.123 1.00 0.00 H new ATOM 0 HB3 GLU A 56 7.253 0.323 -8.677 1.00 0.00 H new ATOM 0 HG2 GLU A 56 9.474 -0.428 -6.787 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.667 -1.679 -7.711 1.00 0.00 H new ATOM 734 N ALA A 57 7.793 1.157 -4.605 1.00 0.00 N ATOM 735 CA ALA A 57 8.395 0.998 -3.287 1.00 0.00 C ATOM 736 C ALA A 57 8.037 -0.352 -2.679 1.00 0.00 C ATOM 737 O ALA A 57 7.169 -1.061 -3.186 1.00 0.00 O ATOM 738 CB ALA A 57 7.956 2.127 -2.367 1.00 0.00 C ATOM 0 H ALA A 57 6.779 1.051 -4.621 1.00 0.00 H new ATOM 0 HA ALA A 57 9.478 1.038 -3.402 1.00 0.00 H new ATOM 0 HB1 ALA A 57 8.413 1.996 -1.386 1.00 0.00 H new ATOM 0 HB2 ALA A 57 8.269 3.082 -2.788 1.00 0.00 H new ATOM 0 HB3 ALA A 57 6.871 2.113 -2.266 1.00 0.00 H new ATOM 744 N GLU A 58 8.713 -0.704 -1.590 1.00 0.00 N ATOM 745 CA GLU A 58 8.467 -1.972 -0.913 1.00 0.00 C ATOM 746 C GLU A 58 7.358 -1.828 0.125 1.00 0.00 C ATOM 747 O GLU A 58 7.251 -0.803 0.797 1.00 0.00 O ATOM 748 CB GLU A 58 9.746 -2.475 -0.242 1.00 0.00 C ATOM 749 CG GLU A 58 10.663 -3.243 -1.179 1.00 0.00 C ATOM 750 CD GLU A 58 10.239 -4.688 -1.358 1.00 0.00 C ATOM 751 OE1 GLU A 58 9.609 -5.240 -0.432 1.00 0.00 O ATOM 752 OE2 GLU A 58 10.535 -5.266 -2.424 1.00 0.00 O ATOM 0 H GLU A 58 9.436 -0.129 -1.157 1.00 0.00 H new ATOM 0 HA GLU A 58 8.149 -2.698 -1.661 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.290 -1.624 0.168 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.478 -3.117 0.597 1.00 0.00 H new ATOM 0 HG2 GLU A 58 10.678 -2.750 -2.151 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.681 -3.213 -0.790 1.00 0.00 H new ATOM 759 N ALA A 59 6.532 -2.863 0.248 1.00 0.00 N ATOM 760 CA ALA A 59 5.432 -2.854 1.205 1.00 0.00 C ATOM 761 C ALA A 59 5.549 -4.014 2.187 1.00 0.00 C ATOM 762 O ALA A 59 5.923 -5.125 1.809 1.00 0.00 O ATOM 763 CB ALA A 59 4.098 -2.909 0.475 1.00 0.00 C ATOM 0 H ALA A 59 6.604 -3.718 -0.303 1.00 0.00 H new ATOM 0 HA ALA A 59 5.485 -1.926 1.774 1.00 0.00 H new ATOM 0 HB1 ALA A 59 3.285 -2.902 1.201 1.00 0.00 H new ATOM 0 HB2 ALA A 59 4.006 -2.043 -0.181 1.00 0.00 H new ATOM 0 HB3 ALA A 59 4.046 -3.821 -0.119 1.00 0.00 H new ATOM 769 N ASP A 60 5.229 -3.749 3.449 1.00 0.00 N ATOM 770 CA ASP A 60 5.297 -4.773 4.486 1.00 0.00 C ATOM 771 C ASP A 60 4.114 -5.729 4.384 1.00 0.00 C ATOM 772 O ASP A 60 2.965 -5.303 4.262 1.00 0.00 O ATOM 773 CB ASP A 60 5.327 -4.124 5.870 1.00 0.00 C ATOM 774 CG ASP A 60 6.618 -3.373 6.130 1.00 0.00 C ATOM 775 OD1 ASP A 60 7.623 -4.025 6.479 1.00 0.00 O ATOM 776 OD2 ASP A 60 6.621 -2.132 5.988 1.00 0.00 O ATOM 0 H ASP A 60 4.920 -2.835 3.779 1.00 0.00 H new ATOM 0 HA ASP A 60 6.214 -5.343 4.340 1.00 0.00 H new ATOM 0 HB2 ASP A 60 4.486 -3.438 5.964 1.00 0.00 H new ATOM 0 HB3 ASP A 60 5.198 -4.893 6.632 1.00 0.00 H new ATOM 781 N VAL A 61 4.402 -7.026 4.434 1.00 0.00 N ATOM 782 CA VAL A 61 3.362 -8.044 4.347 1.00 0.00 C ATOM 783 C VAL A 61 3.464 -9.034 5.502 1.00 0.00 C ATOM 784 O VAL A 61 4.534 -9.579 5.773 1.00 0.00 O ATOM 785 CB VAL A 61 3.442 -8.816 3.016 1.00 0.00 C ATOM 786 CG1 VAL A 61 2.374 -9.898 2.962 1.00 0.00 C ATOM 787 CG2 VAL A 61 3.307 -7.863 1.839 1.00 0.00 C ATOM 0 H VAL A 61 5.347 -7.396 4.534 1.00 0.00 H new ATOM 0 HA VAL A 61 2.405 -7.524 4.401 1.00 0.00 H new ATOM 0 HB VAL A 61 4.418 -9.298 2.953 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.446 -10.433 2.015 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.522 -10.597 3.785 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.388 -9.441 3.047 1.00 0.00 H new ATOM 0 HG21 VAL A 61 3.366 -8.425 0.907 1.00 0.00 H new ATOM 0 HG22 VAL A 61 2.346 -7.351 1.894 1.00 0.00 H new ATOM 0 HG23 VAL A 61 4.112 -7.129 1.871 1.00 0.00 H new ATOM 797 N ILE A 62 2.343 -9.262 6.179 1.00 0.00 N ATOM 798 CA ILE A 62 2.306 -10.187 7.305 1.00 0.00 C ATOM 799 C ILE A 62 1.135 -11.157 7.181 1.00 0.00 C ATOM 800 O ILE A 62 -0.021 -10.743 7.127 1.00 0.00 O ATOM 801 CB ILE A 62 2.198 -9.438 8.646 1.00 0.00 C ATOM 802 CG1 ILE A 62 3.367 -8.466 8.808 1.00 0.00 C ATOM 803 CG2 ILE A 62 2.160 -10.425 9.803 1.00 0.00 C ATOM 804 CD1 ILE A 62 3.131 -7.121 8.157 1.00 0.00 C ATOM 0 H ILE A 62 1.449 -8.819 5.967 1.00 0.00 H new ATOM 0 HA ILE A 62 3.242 -10.746 7.285 1.00 0.00 H new ATOM 0 HB ILE A 62 1.270 -8.866 8.651 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.560 -8.317 9.870 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.264 -8.915 8.381 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.084 -9.880 10.744 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.297 -11.082 9.693 1.00 0.00 H new ATOM 0 HG23 ILE A 62 3.072 -11.022 9.802 1.00 0.00 H new ATOM 0 HD11 ILE A 62 4.002 -6.484 8.312 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.968 -7.258 7.088 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.253 -6.651 8.601 1.00 0.00 H new ATOM 816 N GLU A 63 1.447 -12.449 7.137 1.00 0.00 N ATOM 817 CA GLU A 63 0.420 -13.478 7.021 1.00 0.00 C ATOM 818 C GLU A 63 -0.249 -13.734 8.369 1.00 0.00 C ATOM 819 O GLU A 63 0.376 -13.595 9.419 1.00 0.00 O ATOM 820 CB GLU A 63 1.026 -14.776 6.486 1.00 0.00 C ATOM 821 CG GLU A 63 1.955 -15.465 7.470 1.00 0.00 C ATOM 822 CD GLU A 63 2.278 -16.892 7.067 1.00 0.00 C ATOM 823 OE1 GLU A 63 3.059 -17.076 6.111 1.00 0.00 O ATOM 824 OE2 GLU A 63 1.746 -17.824 7.708 1.00 0.00 O ATOM 0 H GLU A 63 2.401 -12.807 7.180 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.336 -13.123 6.321 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.220 -15.460 6.220 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.576 -14.560 5.570 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.881 -14.895 7.549 1.00 0.00 H new ATOM 0 HG3 GLU A 63 1.495 -15.466 8.458 1.00 0.00 H new ATOM 831 N ASN A 64 -1.524 -14.107 8.328 1.00 0.00 N ATOM 832 CA ASN A 64 -2.278 -14.381 9.545 1.00 0.00 C ATOM 833 C ASN A 64 -2.859 -15.792 9.519 1.00 0.00 C ATOM 834 O ASN A 64 -2.955 -16.414 8.462 1.00 0.00 O ATOM 835 CB ASN A 64 -3.403 -13.358 9.715 1.00 0.00 C ATOM 836 CG ASN A 64 -2.956 -12.130 10.484 1.00 0.00 C ATOM 837 OD1 ASN A 64 -3.331 -11.937 11.640 1.00 0.00 O ATOM 838 ND2 ASN A 64 -2.150 -11.291 9.842 1.00 0.00 N ATOM 0 H ASN A 64 -2.056 -14.226 7.466 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.595 -14.303 10.391 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -3.767 -13.056 8.733 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -4.239 -13.825 10.235 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -1.817 -10.447 10.308 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.864 -11.491 8.883 1.00 0.00 H new ATOM 845 N GLU A 65 -3.246 -16.289 10.690 1.00 0.00 N ATOM 846 CA GLU A 65 -3.817 -17.626 10.800 1.00 0.00 C ATOM 847 C GLU A 65 -5.135 -17.720 10.036 1.00 0.00 C ATOM 848 O GLU A 65 -5.497 -18.782 9.530 1.00 0.00 O ATOM 849 CB GLU A 65 -4.039 -17.990 12.270 1.00 0.00 C ATOM 850 CG GLU A 65 -2.781 -18.464 12.977 1.00 0.00 C ATOM 851 CD GLU A 65 -1.717 -17.386 13.057 1.00 0.00 C ATOM 852 OE1 GLU A 65 -1.831 -16.505 13.935 1.00 0.00 O ATOM 853 OE2 GLU A 65 -0.770 -17.425 12.243 1.00 0.00 O ATOM 0 H GLU A 65 -3.174 -15.786 11.575 1.00 0.00 H new ATOM 0 HA GLU A 65 -3.112 -18.332 10.361 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -4.435 -17.121 12.795 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -4.796 -18.771 12.332 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.037 -18.793 13.984 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -2.377 -19.330 12.452 1.00 0.00 H new ATOM 860 N ASP A 66 -5.847 -16.600 9.959 1.00 0.00 N ATOM 861 CA ASP A 66 -7.124 -16.556 9.257 1.00 0.00 C ATOM 862 C ASP A 66 -6.916 -16.331 7.762 1.00 0.00 C ATOM 863 O ASP A 66 -7.718 -15.669 7.106 1.00 0.00 O ATOM 864 CB ASP A 66 -8.008 -15.448 9.833 1.00 0.00 C ATOM 865 CG ASP A 66 -9.382 -15.411 9.193 1.00 0.00 C ATOM 866 OD1 ASP A 66 -10.182 -16.333 9.451 1.00 0.00 O ATOM 867 OD2 ASP A 66 -9.657 -14.459 8.431 1.00 0.00 O ATOM 0 H ASP A 66 -5.562 -15.713 10.373 1.00 0.00 H new ATOM 0 HA ASP A 66 -7.620 -17.517 9.396 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -8.115 -15.595 10.908 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.518 -14.485 9.690 1.00 0.00 H new ATOM 872 N GLY A 67 -5.831 -16.889 7.231 1.00 0.00 N ATOM 873 CA GLY A 67 -5.536 -16.736 5.818 1.00 0.00 C ATOM 874 C GLY A 67 -5.674 -15.302 5.348 1.00 0.00 C ATOM 875 O GLY A 67 -6.219 -15.041 4.275 1.00 0.00 O ATOM 0 H GLY A 67 -5.153 -17.443 7.753 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.521 -17.083 5.622 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -6.207 -17.371 5.239 1.00 0.00 H new ATOM 879 N THR A 68 -5.179 -14.367 6.153 1.00 0.00 N ATOM 880 CA THR A 68 -5.253 -12.951 5.816 1.00 0.00 C ATOM 881 C THR A 68 -3.867 -12.315 5.812 1.00 0.00 C ATOM 882 O THR A 68 -3.017 -12.651 6.636 1.00 0.00 O ATOM 883 CB THR A 68 -6.155 -12.184 6.801 1.00 0.00 C ATOM 884 OG1 THR A 68 -5.877 -12.597 8.144 1.00 0.00 O ATOM 885 CG2 THR A 68 -7.624 -12.420 6.486 1.00 0.00 C ATOM 0 H THR A 68 -4.722 -14.565 7.043 1.00 0.00 H new ATOM 0 HA THR A 68 -5.683 -12.886 4.817 1.00 0.00 H new ATOM 0 HB THR A 68 -5.944 -11.119 6.698 1.00 0.00 H new ATOM 0 HG1 THR A 68 -6.453 -12.103 8.764 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.241 -11.868 7.195 1.00 0.00 H new ATOM 0 HG22 THR A 68 -7.839 -12.077 5.474 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.846 -13.484 6.563 1.00 0.00 H new ATOM 893 N TYR A 69 -3.647 -11.393 4.881 1.00 0.00 N ATOM 894 CA TYR A 69 -2.364 -10.711 4.769 1.00 0.00 C ATOM 895 C TYR A 69 -2.504 -9.229 5.103 1.00 0.00 C ATOM 896 O TYR A 69 -3.362 -8.536 4.558 1.00 0.00 O ATOM 897 CB TYR A 69 -1.796 -10.875 3.357 1.00 0.00 C ATOM 898 CG TYR A 69 -1.301 -12.273 3.062 1.00 0.00 C ATOM 899 CD1 TYR A 69 -2.144 -13.370 3.185 1.00 0.00 C ATOM 900 CD2 TYR A 69 0.011 -12.496 2.663 1.00 0.00 C ATOM 901 CE1 TYR A 69 -1.696 -14.649 2.917 1.00 0.00 C ATOM 902 CE2 TYR A 69 0.467 -13.772 2.392 1.00 0.00 C ATOM 903 CZ TYR A 69 -0.389 -14.845 2.521 1.00 0.00 C ATOM 904 OH TYR A 69 0.062 -16.116 2.254 1.00 0.00 O ATOM 0 H TYR A 69 -4.341 -11.101 4.193 1.00 0.00 H new ATOM 0 HA TYR A 69 -1.678 -11.164 5.485 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -2.566 -10.611 2.632 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -0.975 -10.171 3.221 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -3.168 -13.220 3.496 1.00 0.00 H new ATOM 0 HD2 TYR A 69 0.685 -11.658 2.563 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -2.365 -15.491 3.017 1.00 0.00 H new ATOM 0 HE2 TYR A 69 1.489 -13.928 2.081 1.00 0.00 H new ATOM 0 HH TYR A 69 1.004 -16.079 1.987 1.00 0.00 H new ATOM 914 N ASP A 70 -1.652 -8.750 6.003 1.00 0.00 N ATOM 915 CA ASP A 70 -1.678 -7.351 6.412 1.00 0.00 C ATOM 916 C ASP A 70 -0.648 -6.538 5.632 1.00 0.00 C ATOM 917 O ASP A 70 0.518 -6.924 5.537 1.00 0.00 O ATOM 918 CB ASP A 70 -1.411 -7.229 7.913 1.00 0.00 C ATOM 919 CG ASP A 70 -2.100 -8.317 8.713 1.00 0.00 C ATOM 920 OD1 ASP A 70 -3.074 -8.905 8.198 1.00 0.00 O ATOM 921 OD2 ASP A 70 -1.665 -8.581 9.853 1.00 0.00 O ATOM 0 H ASP A 70 -0.935 -9.310 6.463 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.670 -6.954 6.195 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.337 -7.274 8.093 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.752 -6.254 8.262 1.00 0.00 H new ATOM 926 N ILE A 71 -1.087 -5.414 5.076 1.00 0.00 N ATOM 927 CA ILE A 71 -0.204 -4.548 4.305 1.00 0.00 C ATOM 928 C ILE A 71 -0.282 -3.106 4.795 1.00 0.00 C ATOM 929 O ILE A 71 -1.363 -2.600 5.098 1.00 0.00 O ATOM 930 CB ILE A 71 -0.545 -4.588 2.804 1.00 0.00 C ATOM 931 CG1 ILE A 71 -0.486 -6.025 2.284 1.00 0.00 C ATOM 932 CG2 ILE A 71 0.406 -3.696 2.020 1.00 0.00 C ATOM 933 CD1 ILE A 71 -1.362 -6.266 1.074 1.00 0.00 C ATOM 0 H ILE A 71 -2.049 -5.082 5.145 1.00 0.00 H new ATOM 0 HA ILE A 71 0.809 -4.923 4.449 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.559 -4.213 2.667 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.546 -6.269 2.030 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.787 -6.704 3.082 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.152 -3.735 0.961 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.319 -2.670 2.376 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.430 -4.043 2.160 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.270 -7.306 0.760 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.400 -6.054 1.329 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -1.047 -5.612 0.261 1.00 0.00 H new ATOM 945 N PHE A 72 0.871 -2.448 4.869 1.00 0.00 N ATOM 946 CA PHE A 72 0.932 -1.064 5.321 1.00 0.00 C ATOM 947 C PHE A 72 1.840 -0.236 4.416 1.00 0.00 C ATOM 948 O PHE A 72 2.817 -0.746 3.864 1.00 0.00 O ATOM 949 CB PHE A 72 1.436 -0.999 6.765 1.00 0.00 C ATOM 950 CG PHE A 72 0.793 -2.010 7.671 1.00 0.00 C ATOM 951 CD1 PHE A 72 1.129 -3.351 7.582 1.00 0.00 C ATOM 952 CD2 PHE A 72 -0.147 -1.618 8.610 1.00 0.00 C ATOM 953 CE1 PHE A 72 0.539 -4.283 8.414 1.00 0.00 C ATOM 954 CE2 PHE A 72 -0.739 -2.546 9.445 1.00 0.00 C ATOM 955 CZ PHE A 72 -0.397 -3.881 9.346 1.00 0.00 C ATOM 0 H PHE A 72 1.775 -2.851 4.622 1.00 0.00 H new ATOM 0 HA PHE A 72 -0.074 -0.648 5.275 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.515 -1.151 6.772 1.00 0.00 H new ATOM 0 HB3 PHE A 72 1.253 -0.000 7.161 1.00 0.00 H new ATOM 0 HD1 PHE A 72 1.860 -3.671 6.854 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -0.420 -0.576 8.690 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.810 -5.326 8.335 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.469 -2.228 10.175 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.861 -4.608 9.996 1.00 0.00 H new ATOM 965 N TYR A 73 1.511 1.042 4.268 1.00 0.00 N ATOM 966 CA TYR A 73 2.294 1.940 3.428 1.00 0.00 C ATOM 967 C TYR A 73 1.974 3.398 3.742 1.00 0.00 C ATOM 968 O TYR A 73 0.865 3.726 4.165 1.00 0.00 O ATOM 969 CB TYR A 73 2.023 1.655 1.949 1.00 0.00 C ATOM 970 CG TYR A 73 0.725 2.245 1.447 1.00 0.00 C ATOM 971 CD1 TYR A 73 0.647 3.578 1.064 1.00 0.00 C ATOM 972 CD2 TYR A 73 -0.423 1.468 1.353 1.00 0.00 C ATOM 973 CE1 TYR A 73 -0.537 4.121 0.605 1.00 0.00 C ATOM 974 CE2 TYR A 73 -1.611 2.002 0.893 1.00 0.00 C ATOM 975 CZ TYR A 73 -1.664 3.330 0.521 1.00 0.00 C ATOM 976 OH TYR A 73 -2.845 3.867 0.063 1.00 0.00 O ATOM 0 H TYR A 73 0.707 1.480 4.719 1.00 0.00 H new ATOM 0 HA TYR A 73 3.349 1.765 3.638 1.00 0.00 H new ATOM 0 HB2 TYR A 73 2.846 2.051 1.355 1.00 0.00 H new ATOM 0 HB3 TYR A 73 2.007 0.576 1.792 1.00 0.00 H new ATOM 0 HD1 TYR A 73 1.527 4.200 1.126 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -0.386 0.429 1.645 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.580 5.160 0.313 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -2.494 1.384 0.825 1.00 0.00 H new ATOM 0 HH TYR A 73 -3.599 3.362 0.432 1.00 0.00 H new ATOM 986 N THR A 74 2.953 4.272 3.532 1.00 0.00 N ATOM 987 CA THR A 74 2.778 5.695 3.792 1.00 0.00 C ATOM 988 C THR A 74 2.962 6.514 2.520 1.00 0.00 C ATOM 989 O THR A 74 3.650 6.090 1.592 1.00 0.00 O ATOM 990 CB THR A 74 3.770 6.197 4.860 1.00 0.00 C ATOM 991 OG1 THR A 74 3.652 5.407 6.048 1.00 0.00 O ATOM 992 CG2 THR A 74 3.514 7.660 5.190 1.00 0.00 C ATOM 0 H THR A 74 3.877 4.018 3.182 1.00 0.00 H new ATOM 0 HA THR A 74 1.761 5.826 4.161 1.00 0.00 H new ATOM 0 HB THR A 74 4.780 6.102 4.460 1.00 0.00 H new ATOM 0 HG1 THR A 74 4.287 5.731 6.721 1.00 0.00 H new ATOM 0 HG21 THR A 74 4.226 7.992 5.946 1.00 0.00 H new ATOM 0 HG22 THR A 74 3.633 8.262 4.289 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.499 7.775 5.572 1.00 0.00 H new ATOM 1000 N ALA A 75 2.341 7.689 2.484 1.00 0.00 N ATOM 1001 CA ALA A 75 2.439 8.568 1.326 1.00 0.00 C ATOM 1002 C ALA A 75 3.140 9.874 1.685 1.00 0.00 C ATOM 1003 O ALA A 75 2.535 10.777 2.262 1.00 0.00 O ATOM 1004 CB ALA A 75 1.055 8.850 0.759 1.00 0.00 C ATOM 0 H ALA A 75 1.765 8.053 3.243 1.00 0.00 H new ATOM 0 HA ALA A 75 3.036 8.062 0.567 1.00 0.00 H new ATOM 0 HB1 ALA A 75 1.143 9.508 -0.106 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.588 7.913 0.456 1.00 0.00 H new ATOM 0 HB3 ALA A 75 0.441 9.332 1.520 1.00 0.00 H new ATOM 1010 N ALA A 76 4.421 9.966 1.343 1.00 0.00 N ATOM 1011 CA ALA A 76 5.205 11.162 1.628 1.00 0.00 C ATOM 1012 C ALA A 76 4.564 12.398 1.009 1.00 0.00 C ATOM 1013 O ALA A 76 4.436 13.436 1.659 1.00 0.00 O ATOM 1014 CB ALA A 76 6.630 10.992 1.120 1.00 0.00 C ATOM 0 H ALA A 76 4.938 9.226 0.868 1.00 0.00 H new ATOM 0 HA ALA A 76 5.231 11.301 2.709 1.00 0.00 H new ATOM 0 HB1 ALA A 76 7.204 11.892 1.339 1.00 0.00 H new ATOM 0 HB2 ALA A 76 7.093 10.137 1.613 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.615 10.825 0.043 1.00 0.00 H new ATOM 1020 N LYS A 77 4.162 12.282 -0.253 1.00 0.00 N ATOM 1021 CA LYS A 77 3.534 13.391 -0.961 1.00 0.00 C ATOM 1022 C LYS A 77 2.223 12.952 -1.606 1.00 0.00 C ATOM 1023 O LYS A 77 2.021 11.779 -1.921 1.00 0.00 O ATOM 1024 CB LYS A 77 4.481 13.943 -2.029 1.00 0.00 C ATOM 1025 CG LYS A 77 4.414 13.191 -3.348 1.00 0.00 C ATOM 1026 CD LYS A 77 5.026 11.805 -3.231 1.00 0.00 C ATOM 1027 CE LYS A 77 5.443 11.262 -4.589 1.00 0.00 C ATOM 1028 NZ LYS A 77 6.520 10.240 -4.471 1.00 0.00 N ATOM 0 H LYS A 77 4.260 11.431 -0.806 1.00 0.00 H new ATOM 0 HA LYS A 77 3.317 14.176 -0.236 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.244 14.992 -2.206 1.00 0.00 H new ATOM 0 HB3 LYS A 77 5.503 13.906 -1.651 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.375 13.105 -3.667 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.938 13.757 -4.118 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.893 11.844 -2.572 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.307 11.126 -2.772 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.578 10.822 -5.085 1.00 0.00 H new ATOM 0 HE3 LYS A 77 5.788 12.083 -5.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 7.134 10.285 -5.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 7.084 10.427 -3.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.094 9.293 -4.404 1.00 0.00 H new ATOM 1042 N PRO A 78 1.311 13.913 -1.809 1.00 0.00 N ATOM 1043 CA PRO A 78 0.005 13.649 -2.420 1.00 0.00 C ATOM 1044 C PRO A 78 0.116 13.307 -3.902 1.00 0.00 C ATOM 1045 O PRO A 78 1.102 13.648 -4.555 1.00 0.00 O ATOM 1046 CB PRO A 78 -0.748 14.969 -2.231 1.00 0.00 C ATOM 1047 CG PRO A 78 0.319 16.003 -2.132 1.00 0.00 C ATOM 1048 CD PRO A 78 1.484 15.333 -1.458 1.00 0.00 C ATOM 0 HA PRO A 78 -0.491 12.790 -1.967 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -1.415 15.168 -3.070 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.364 14.948 -1.332 1.00 0.00 H new ATOM 0 HG2 PRO A 78 0.598 16.371 -3.119 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -0.023 16.863 -1.556 1.00 0.00 H new ATOM 0 HD2 PRO A 78 2.436 15.723 -1.819 1.00 0.00 H new ATOM 0 HD3 PRO A 78 1.466 15.485 -0.379 1.00 0.00 H new ATOM 1056 N GLY A 79 -0.901 12.631 -4.426 1.00 0.00 N ATOM 1057 CA GLY A 79 -0.897 12.255 -5.829 1.00 0.00 C ATOM 1058 C GLY A 79 -1.728 11.017 -6.098 1.00 0.00 C ATOM 1059 O GLY A 79 -2.633 10.686 -5.331 1.00 0.00 O ATOM 0 H GLY A 79 -1.727 12.337 -3.905 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -1.280 13.083 -6.425 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.129 12.078 -6.152 1.00 0.00 H new ATOM 1063 N THR A 80 -1.424 10.328 -7.195 1.00 0.00 N ATOM 1064 CA THR A 80 -2.151 9.121 -7.566 1.00 0.00 C ATOM 1065 C THR A 80 -1.304 7.875 -7.332 1.00 0.00 C ATOM 1066 O THR A 80 -0.346 7.618 -8.060 1.00 0.00 O ATOM 1067 CB THR A 80 -2.589 9.161 -9.042 1.00 0.00 C ATOM 1068 OG1 THR A 80 -3.243 10.403 -9.326 1.00 0.00 O ATOM 1069 CG2 THR A 80 -3.526 8.005 -9.360 1.00 0.00 C ATOM 0 H THR A 80 -0.679 10.586 -7.842 1.00 0.00 H new ATOM 0 HA THR A 80 -3.037 9.078 -6.933 1.00 0.00 H new ATOM 0 HB THR A 80 -1.699 9.069 -9.664 1.00 0.00 H new ATOM 0 HG1 THR A 80 -3.517 10.421 -10.267 1.00 0.00 H new ATOM 0 HG21 THR A 80 -3.822 8.054 -10.408 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.016 7.061 -9.171 1.00 0.00 H new ATOM 0 HG23 THR A 80 -4.412 8.071 -8.729 1.00 0.00 H new ATOM 1077 N TYR A 81 -1.665 7.103 -6.312 1.00 0.00 N ATOM 1078 CA TYR A 81 -0.937 5.884 -5.983 1.00 0.00 C ATOM 1079 C TYR A 81 -1.596 4.666 -6.622 1.00 0.00 C ATOM 1080 O TYR A 81 -2.821 4.545 -6.638 1.00 0.00 O ATOM 1081 CB TYR A 81 -0.867 5.703 -4.465 1.00 0.00 C ATOM 1082 CG TYR A 81 0.098 6.649 -3.786 1.00 0.00 C ATOM 1083 CD1 TYR A 81 -0.085 8.025 -3.855 1.00 0.00 C ATOM 1084 CD2 TYR A 81 1.191 6.167 -3.076 1.00 0.00 C ATOM 1085 CE1 TYR A 81 0.794 8.893 -3.237 1.00 0.00 C ATOM 1086 CE2 TYR A 81 2.073 7.028 -2.453 1.00 0.00 C ATOM 1087 CZ TYR A 81 1.871 8.391 -2.537 1.00 0.00 C ATOM 1088 OH TYR A 81 2.749 9.251 -1.920 1.00 0.00 O ATOM 0 H TYR A 81 -2.457 7.300 -5.700 1.00 0.00 H new ATOM 0 HA TYR A 81 0.074 5.976 -6.379 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.862 5.848 -4.044 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -0.574 4.677 -4.243 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.928 8.422 -4.401 1.00 0.00 H new ATOM 0 HD2 TYR A 81 1.353 5.101 -3.010 1.00 0.00 H new ATOM 0 HE1 TYR A 81 0.639 9.960 -3.302 1.00 0.00 H new ATOM 0 HE2 TYR A 81 2.916 6.637 -1.903 1.00 0.00 H new ATOM 0 HH TYR A 81 2.349 10.144 -1.868 1.00 0.00 H new ATOM 1098 N VAL A 82 -0.774 3.764 -7.148 1.00 0.00 N ATOM 1099 CA VAL A 82 -1.274 2.553 -7.788 1.00 0.00 C ATOM 1100 C VAL A 82 -0.762 1.305 -7.078 1.00 0.00 C ATOM 1101 O VAL A 82 0.429 0.999 -7.122 1.00 0.00 O ATOM 1102 CB VAL A 82 -0.865 2.491 -9.271 1.00 0.00 C ATOM 1103 CG1 VAL A 82 -1.329 1.186 -9.899 1.00 0.00 C ATOM 1104 CG2 VAL A 82 -1.426 3.686 -10.028 1.00 0.00 C ATOM 0 H VAL A 82 0.242 3.849 -7.144 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.361 2.586 -7.721 1.00 0.00 H new ATOM 0 HB VAL A 82 0.223 2.529 -9.332 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.031 1.160 -10.947 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.875 0.347 -9.372 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.414 1.114 -9.829 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.127 3.626 -11.075 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.514 3.682 -9.960 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.039 4.607 -9.592 1.00 0.00 H new ATOM 1114 N ILE A 83 -1.670 0.587 -6.425 1.00 0.00 N ATOM 1115 CA ILE A 83 -1.311 -0.629 -5.707 1.00 0.00 C ATOM 1116 C ILE A 83 -1.726 -1.871 -6.488 1.00 0.00 C ATOM 1117 O ILE A 83 -2.875 -1.994 -6.912 1.00 0.00 O ATOM 1118 CB ILE A 83 -1.960 -0.672 -4.311 1.00 0.00 C ATOM 1119 CG1 ILE A 83 -1.585 0.578 -3.512 1.00 0.00 C ATOM 1120 CG2 ILE A 83 -1.536 -1.930 -3.568 1.00 0.00 C ATOM 1121 CD1 ILE A 83 -2.534 0.873 -2.371 1.00 0.00 C ATOM 0 H ILE A 83 -2.660 0.827 -6.379 1.00 0.00 H new ATOM 0 HA ILE A 83 -0.227 -0.620 -5.593 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.043 -0.692 -4.430 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.578 0.456 -3.114 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -1.560 1.435 -4.184 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.003 -1.946 -2.583 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -1.849 -2.809 -4.132 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.452 -1.938 -3.456 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -2.207 1.772 -1.849 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.539 1.027 -2.764 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.541 0.033 -1.677 1.00 0.00 H new ATOM 1133 N TYR A 84 -0.785 -2.790 -6.672 1.00 0.00 N ATOM 1134 CA TYR A 84 -1.053 -4.024 -7.401 1.00 0.00 C ATOM 1135 C TYR A 84 -1.252 -5.192 -6.442 1.00 0.00 C ATOM 1136 O TYR A 84 -0.385 -5.490 -5.619 1.00 0.00 O ATOM 1137 CB TYR A 84 0.094 -4.329 -8.366 1.00 0.00 C ATOM 1138 CG TYR A 84 0.296 -3.267 -9.422 1.00 0.00 C ATOM 1139 CD1 TYR A 84 -0.755 -2.858 -10.233 1.00 0.00 C ATOM 1140 CD2 TYR A 84 1.538 -2.675 -9.610 1.00 0.00 C ATOM 1141 CE1 TYR A 84 -0.574 -1.888 -11.201 1.00 0.00 C ATOM 1142 CE2 TYR A 84 1.728 -1.704 -10.574 1.00 0.00 C ATOM 1143 CZ TYR A 84 0.668 -1.314 -11.367 1.00 0.00 C ATOM 1144 OH TYR A 84 0.854 -0.348 -12.329 1.00 0.00 O ATOM 0 H TYR A 84 0.171 -2.704 -6.326 1.00 0.00 H new ATOM 0 HA TYR A 84 -1.972 -3.887 -7.971 1.00 0.00 H new ATOM 0 HB2 TYR A 84 1.016 -4.443 -7.796 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.098 -5.284 -8.855 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.730 -3.305 -10.105 1.00 0.00 H new ATOM 0 HD2 TYR A 84 2.370 -2.979 -8.992 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -1.401 -1.582 -11.824 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.700 -1.253 -10.706 1.00 0.00 H new ATOM 0 HH TYR A 84 1.786 -0.047 -12.314 1.00 0.00 H new ATOM 1154 N VAL A 85 -2.399 -5.853 -6.553 1.00 0.00 N ATOM 1155 CA VAL A 85 -2.713 -6.991 -5.697 1.00 0.00 C ATOM 1156 C VAL A 85 -3.272 -8.153 -6.510 1.00 0.00 C ATOM 1157 O VAL A 85 -4.067 -7.955 -7.430 1.00 0.00 O ATOM 1158 CB VAL A 85 -3.729 -6.609 -4.604 1.00 0.00 C ATOM 1159 CG1 VAL A 85 -4.047 -7.810 -3.727 1.00 0.00 C ATOM 1160 CG2 VAL A 85 -3.201 -5.453 -3.768 1.00 0.00 C ATOM 0 H VAL A 85 -3.127 -5.620 -7.228 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.780 -7.297 -5.224 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.652 -6.287 -5.086 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -4.766 -7.521 -2.961 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.470 -8.606 -4.340 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.133 -8.165 -3.251 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -3.931 -5.196 -3.001 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.264 -5.745 -3.294 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.029 -4.589 -4.410 1.00 0.00 H new ATOM 1170 N ARG A 86 -2.851 -9.366 -6.166 1.00 0.00 N ATOM 1171 CA ARG A 86 -3.308 -10.561 -6.865 1.00 0.00 C ATOM 1172 C ARG A 86 -3.398 -11.748 -5.911 1.00 0.00 C ATOM 1173 O ARG A 86 -2.885 -11.699 -4.792 1.00 0.00 O ATOM 1174 CB ARG A 86 -2.366 -10.892 -8.022 1.00 0.00 C ATOM 1175 CG ARG A 86 -0.988 -11.354 -7.574 1.00 0.00 C ATOM 1176 CD ARG A 86 0.057 -11.120 -8.653 1.00 0.00 C ATOM 1177 NE ARG A 86 0.204 -9.703 -8.975 1.00 0.00 N ATOM 1178 CZ ARG A 86 1.284 -9.190 -9.553 1.00 0.00 C ATOM 1179 NH1 ARG A 86 2.305 -9.973 -9.872 1.00 0.00 N ATOM 1180 NH2 ARG A 86 1.344 -7.890 -9.813 1.00 0.00 N ATOM 0 H ARG A 86 -2.194 -9.547 -5.407 1.00 0.00 H new ATOM 0 HA ARG A 86 -4.303 -10.361 -7.262 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -2.819 -11.670 -8.636 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.257 -10.010 -8.654 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.702 -10.821 -6.667 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -1.022 -12.414 -7.323 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.016 -11.518 -8.321 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.222 -11.669 -9.552 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.564 -9.073 -8.743 1.00 0.00 H new ATOM 0 HH11 ARG A 86 2.263 -10.973 -9.674 1.00 0.00 H new ATOM 0 HH12 ARG A 86 3.133 -9.576 -10.316 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.560 -7.284 -9.569 1.00 0.00 H new ATOM 0 HH22 ARG A 86 2.174 -7.496 -10.257 1.00 0.00 H new ATOM 1194 N PHE A 87 -4.053 -12.813 -6.360 1.00 0.00 N ATOM 1195 CA PHE A 87 -4.211 -14.013 -5.546 1.00 0.00 C ATOM 1196 C PHE A 87 -3.858 -15.263 -6.346 1.00 0.00 C ATOM 1197 O PHE A 87 -4.536 -15.609 -7.313 1.00 0.00 O ATOM 1198 CB PHE A 87 -5.646 -14.117 -5.026 1.00 0.00 C ATOM 1199 CG PHE A 87 -5.914 -15.376 -4.252 1.00 0.00 C ATOM 1200 CD1 PHE A 87 -5.658 -15.437 -2.892 1.00 0.00 C ATOM 1201 CD2 PHE A 87 -6.423 -16.497 -4.886 1.00 0.00 C ATOM 1202 CE1 PHE A 87 -5.903 -16.595 -2.178 1.00 0.00 C ATOM 1203 CE2 PHE A 87 -6.671 -17.658 -4.177 1.00 0.00 C ATOM 1204 CZ PHE A 87 -6.412 -17.707 -2.822 1.00 0.00 C ATOM 0 H PHE A 87 -4.483 -12.870 -7.283 1.00 0.00 H new ATOM 0 HA PHE A 87 -3.529 -13.939 -4.699 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.856 -13.257 -4.390 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.334 -14.065 -5.870 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -5.263 -14.570 -2.384 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.629 -16.464 -5.946 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.697 -16.631 -1.118 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -7.067 -18.526 -4.683 1.00 0.00 H new ATOM 0 HZ PHE A 87 -6.607 -18.612 -2.266 1.00 0.00 H new ATOM 1214 N GLY A 88 -2.788 -15.939 -5.935 1.00 0.00 N ATOM 1215 CA GLY A 88 -2.362 -17.143 -6.623 1.00 0.00 C ATOM 1216 C GLY A 88 -2.030 -16.890 -8.081 1.00 0.00 C ATOM 1217 O GLY A 88 -2.256 -17.749 -8.934 1.00 0.00 O ATOM 0 H GLY A 88 -2.209 -15.673 -5.138 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.487 -17.555 -6.120 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -3.150 -17.893 -6.558 1.00 0.00 H new ATOM 1221 N GLY A 89 -1.494 -15.709 -8.369 1.00 0.00 N ATOM 1222 CA GLY A 89 -1.142 -15.366 -9.734 1.00 0.00 C ATOM 1223 C GLY A 89 -2.328 -14.859 -10.528 1.00 0.00 C ATOM 1224 O GLY A 89 -2.369 -14.993 -11.752 1.00 0.00 O ATOM 0 H GLY A 89 -1.297 -14.983 -7.681 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.363 -14.604 -9.724 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.725 -16.243 -10.230 1.00 0.00 H new ATOM 1228 N VAL A 90 -3.299 -14.275 -9.834 1.00 0.00 N ATOM 1229 CA VAL A 90 -4.493 -13.748 -10.483 1.00 0.00 C ATOM 1230 C VAL A 90 -4.814 -12.343 -9.984 1.00 0.00 C ATOM 1231 O VAL A 90 -5.279 -12.163 -8.858 1.00 0.00 O ATOM 1232 CB VAL A 90 -5.713 -14.656 -10.240 1.00 0.00 C ATOM 1233 CG1 VAL A 90 -6.957 -14.064 -10.885 1.00 0.00 C ATOM 1234 CG2 VAL A 90 -5.444 -16.058 -10.767 1.00 0.00 C ATOM 0 H VAL A 90 -3.282 -14.155 -8.821 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.282 -13.714 -11.552 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.888 -14.722 -9.166 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.808 -14.720 -10.703 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -7.157 -13.082 -10.456 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -6.798 -13.966 -11.959 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.316 -16.688 -10.588 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.244 -16.012 -11.837 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.580 -16.480 -10.254 1.00 0.00 H new ATOM 1244 N ASP A 91 -4.561 -11.349 -10.828 1.00 0.00 N ATOM 1245 CA ASP A 91 -4.824 -9.959 -10.475 1.00 0.00 C ATOM 1246 C ASP A 91 -6.318 -9.723 -10.274 1.00 0.00 C ATOM 1247 O ASP A 91 -7.074 -9.607 -11.239 1.00 0.00 O ATOM 1248 CB ASP A 91 -4.288 -9.024 -11.561 1.00 0.00 C ATOM 1249 CG ASP A 91 -4.408 -7.562 -11.177 1.00 0.00 C ATOM 1250 OD1 ASP A 91 -3.535 -7.070 -10.432 1.00 0.00 O ATOM 1251 OD2 ASP A 91 -5.375 -6.910 -11.621 1.00 0.00 O ATOM 0 H ASP A 91 -4.174 -11.480 -11.762 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.311 -9.745 -9.537 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.242 -9.261 -11.756 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -4.833 -9.199 -12.489 1.00 0.00 H new ATOM 1256 N ILE A 92 -6.736 -9.652 -9.014 1.00 0.00 N ATOM 1257 CA ILE A 92 -8.140 -9.430 -8.688 1.00 0.00 C ATOM 1258 C ILE A 92 -8.742 -8.341 -9.568 1.00 0.00 C ATOM 1259 O ILE A 92 -8.041 -7.484 -10.108 1.00 0.00 O ATOM 1260 CB ILE A 92 -8.317 -9.038 -7.209 1.00 0.00 C ATOM 1261 CG1 ILE A 92 -7.222 -8.058 -6.784 1.00 0.00 C ATOM 1262 CG2 ILE A 92 -8.299 -10.277 -6.327 1.00 0.00 C ATOM 1263 CD1 ILE A 92 -7.381 -7.552 -5.367 1.00 0.00 C ATOM 0 H ILE A 92 -6.124 -9.745 -8.204 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.661 -10.370 -8.871 1.00 0.00 H new ATOM 0 HB ILE A 92 -9.283 -8.547 -7.091 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -6.252 -8.546 -6.880 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -7.221 -7.208 -7.467 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.425 -9.984 -5.285 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -9.112 -10.942 -6.618 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.347 -10.794 -6.446 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.570 -6.862 -5.134 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.336 -7.036 -5.270 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.352 -8.393 -4.675 1.00 0.00 H new ATOM 1275 N PRO A 93 -10.075 -8.369 -9.715 1.00 0.00 N ATOM 1276 CA PRO A 93 -10.804 -7.390 -10.527 1.00 0.00 C ATOM 1277 C PRO A 93 -10.806 -6.001 -9.896 1.00 0.00 C ATOM 1278 O PRO A 93 -11.428 -5.075 -10.414 1.00 0.00 O ATOM 1279 CB PRO A 93 -12.224 -7.957 -10.577 1.00 0.00 C ATOM 1280 CG PRO A 93 -12.343 -8.791 -9.348 1.00 0.00 C ATOM 1281 CD PRO A 93 -10.974 -9.362 -9.101 1.00 0.00 C ATOM 0 HA PRO A 93 -10.350 -7.256 -11.509 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.968 -7.161 -10.588 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.381 -8.553 -11.476 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -12.675 -8.192 -8.500 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.078 -9.584 -9.484 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.774 -9.481 -8.036 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -10.860 -10.345 -9.558 1.00 0.00 H new ATOM 1289 N ASN A 94 -10.105 -5.864 -8.775 1.00 0.00 N ATOM 1290 CA ASN A 94 -10.027 -4.589 -8.073 1.00 0.00 C ATOM 1291 C ASN A 94 -8.706 -3.885 -8.371 1.00 0.00 C ATOM 1292 O ASN A 94 -8.574 -2.679 -8.164 1.00 0.00 O ATOM 1293 CB ASN A 94 -10.176 -4.802 -6.565 1.00 0.00 C ATOM 1294 CG ASN A 94 -11.430 -5.578 -6.213 1.00 0.00 C ATOM 1295 OD1 ASN A 94 -11.365 -6.620 -5.560 1.00 0.00 O ATOM 1296 ND2 ASN A 94 -12.580 -5.073 -6.644 1.00 0.00 N ATOM 0 H ASN A 94 -9.583 -6.621 -8.334 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.843 -3.958 -8.425 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.304 -5.336 -6.188 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -10.198 -3.834 -6.064 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.457 -5.552 -6.437 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.587 -4.207 -7.182 1.00 0.00 H new ATOM 1303 N SER A 95 -7.732 -4.646 -8.858 1.00 0.00 N ATOM 1304 CA SER A 95 -6.420 -4.097 -9.180 1.00 0.00 C ATOM 1305 C SER A 95 -6.365 -3.645 -10.637 1.00 0.00 C ATOM 1306 O SER A 95 -6.953 -4.259 -11.527 1.00 0.00 O ATOM 1307 CB SER A 95 -5.330 -5.137 -8.915 1.00 0.00 C ATOM 1308 OG SER A 95 -4.134 -4.519 -8.473 1.00 0.00 O ATOM 0 H SER A 95 -7.826 -5.645 -9.039 1.00 0.00 H new ATOM 0 HA SER A 95 -6.248 -3.231 -8.541 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.675 -5.847 -8.164 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.135 -5.705 -9.825 1.00 0.00 H new ATOM 0 HG SER A 95 -4.329 -3.938 -7.708 1.00 0.00 H new ATOM 1314 N PRO A 96 -5.640 -2.544 -10.886 1.00 0.00 N ATOM 1315 CA PRO A 96 -4.937 -1.804 -9.833 1.00 0.00 C ATOM 1316 C PRO A 96 -5.895 -1.080 -8.894 1.00 0.00 C ATOM 1317 O PRO A 96 -7.105 -1.060 -9.121 1.00 0.00 O ATOM 1318 CB PRO A 96 -4.090 -0.796 -10.614 1.00 0.00 C ATOM 1319 CG PRO A 96 -4.814 -0.610 -11.902 1.00 0.00 C ATOM 1320 CD PRO A 96 -5.453 -1.935 -12.213 1.00 0.00 C ATOM 0 HA PRO A 96 -4.355 -2.464 -9.190 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -3.996 0.146 -10.073 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.080 -1.171 -10.778 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.565 0.175 -11.817 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.129 -0.311 -12.695 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.402 -1.811 -12.735 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -4.816 -2.548 -12.850 1.00 0.00 H new ATOM 1328 N PHE A 97 -5.346 -0.487 -7.839 1.00 0.00 N ATOM 1329 CA PHE A 97 -6.153 0.237 -6.864 1.00 0.00 C ATOM 1330 C PHE A 97 -5.876 1.737 -6.936 1.00 0.00 C ATOM 1331 O PHE A 97 -4.842 2.213 -6.466 1.00 0.00 O ATOM 1332 CB PHE A 97 -5.869 -0.277 -5.452 1.00 0.00 C ATOM 1333 CG PHE A 97 -6.477 -1.622 -5.171 1.00 0.00 C ATOM 1334 CD1 PHE A 97 -5.940 -2.770 -5.734 1.00 0.00 C ATOM 1335 CD2 PHE A 97 -7.583 -1.740 -4.347 1.00 0.00 C ATOM 1336 CE1 PHE A 97 -6.495 -4.010 -5.478 1.00 0.00 C ATOM 1337 CE2 PHE A 97 -8.142 -2.977 -4.087 1.00 0.00 C ATOM 1338 CZ PHE A 97 -7.599 -4.112 -4.653 1.00 0.00 C ATOM 0 H PHE A 97 -4.346 -0.494 -7.638 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.203 0.066 -7.101 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -4.791 -0.337 -5.306 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -6.250 0.444 -4.728 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -5.078 -2.694 -6.380 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -8.014 -0.855 -3.902 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -6.067 -4.897 -5.922 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -9.004 -3.055 -3.441 1.00 0.00 H new ATOM 0 HZ PHE A 97 -8.036 -5.079 -4.452 1.00 0.00 H new ATOM 1348 N THR A 98 -6.808 2.477 -7.529 1.00 0.00 N ATOM 1349 CA THR A 98 -6.664 3.921 -7.665 1.00 0.00 C ATOM 1350 C THR A 98 -6.980 4.631 -6.354 1.00 0.00 C ATOM 1351 O THR A 98 -8.144 4.775 -5.979 1.00 0.00 O ATOM 1352 CB THR A 98 -7.583 4.475 -8.770 1.00 0.00 C ATOM 1353 OG1 THR A 98 -7.273 3.853 -10.022 1.00 0.00 O ATOM 1354 CG2 THR A 98 -7.430 5.983 -8.896 1.00 0.00 C ATOM 0 H THR A 98 -7.670 2.100 -7.923 1.00 0.00 H new ATOM 0 HA THR A 98 -5.626 4.111 -7.937 1.00 0.00 H new ATOM 0 HB THR A 98 -8.615 4.252 -8.499 1.00 0.00 H new ATOM 0 HG1 THR A 98 -7.863 4.209 -10.719 1.00 0.00 H new ATOM 0 HG21 THR A 98 -8.089 6.351 -9.683 1.00 0.00 H new ATOM 0 HG22 THR A 98 -7.695 6.456 -7.950 1.00 0.00 H new ATOM 0 HG23 THR A 98 -6.397 6.224 -9.146 1.00 0.00 H new ATOM 1362 N VAL A 99 -5.937 5.074 -5.659 1.00 0.00 N ATOM 1363 CA VAL A 99 -6.105 5.771 -4.389 1.00 0.00 C ATOM 1364 C VAL A 99 -5.613 7.211 -4.485 1.00 0.00 C ATOM 1365 O VAL A 99 -4.473 7.465 -4.872 1.00 0.00 O ATOM 1366 CB VAL A 99 -5.349 5.057 -3.254 1.00 0.00 C ATOM 1367 CG1 VAL A 99 -5.571 5.774 -1.931 1.00 0.00 C ATOM 1368 CG2 VAL A 99 -5.782 3.602 -3.159 1.00 0.00 C ATOM 0 H VAL A 99 -4.967 4.963 -5.954 1.00 0.00 H new ATOM 0 HA VAL A 99 -7.171 5.768 -4.163 1.00 0.00 H new ATOM 0 HB VAL A 99 -4.283 5.082 -3.479 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -5.029 5.255 -1.140 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -5.208 6.799 -2.007 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -6.635 5.783 -1.696 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -5.238 3.112 -2.352 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.852 3.553 -2.957 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.567 3.096 -4.100 1.00 0.00 H new ATOM 1378 N MET A 100 -6.482 8.152 -4.128 1.00 0.00 N ATOM 1379 CA MET A 100 -6.135 9.567 -4.170 1.00 0.00 C ATOM 1380 C MET A 100 -5.668 10.055 -2.803 1.00 0.00 C ATOM 1381 O MET A 100 -6.454 10.131 -1.859 1.00 0.00 O ATOM 1382 CB MET A 100 -7.336 10.394 -4.636 1.00 0.00 C ATOM 1383 CG MET A 100 -6.973 11.810 -5.055 1.00 0.00 C ATOM 1384 SD MET A 100 -5.676 11.853 -6.307 1.00 0.00 S ATOM 1385 CE MET A 100 -5.315 13.607 -6.360 1.00 0.00 C ATOM 0 H MET A 100 -7.431 7.960 -3.807 1.00 0.00 H new ATOM 0 HA MET A 100 -5.317 9.693 -4.879 1.00 0.00 H new ATOM 0 HB2 MET A 100 -7.813 9.887 -5.475 1.00 0.00 H new ATOM 0 HB3 MET A 100 -8.070 10.439 -3.832 1.00 0.00 H new ATOM 0 HG2 MET A 100 -7.862 12.310 -5.441 1.00 0.00 H new ATOM 0 HG3 MET A 100 -6.646 12.371 -4.180 1.00 0.00 H new ATOM 0 HE1 MET A 100 -4.529 13.795 -7.091 1.00 0.00 H new ATOM 0 HE2 MET A 100 -6.213 14.155 -6.644 1.00 0.00 H new ATOM 0 HE3 MET A 100 -4.983 13.940 -5.377 1.00 0.00 H new ATOM 1395 N ALA A 101 -4.384 10.384 -2.704 1.00 0.00 N ATOM 1396 CA ALA A 101 -3.813 10.865 -1.451 1.00 0.00 C ATOM 1397 C ALA A 101 -3.943 12.380 -1.336 1.00 0.00 C ATOM 1398 O ALA A 101 -3.243 13.128 -2.020 1.00 0.00 O ATOM 1399 CB ALA A 101 -2.354 10.448 -1.342 1.00 0.00 C ATOM 0 H ALA A 101 -3.720 10.326 -3.476 1.00 0.00 H new ATOM 0 HA ALA A 101 -4.370 10.415 -0.629 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.940 10.814 -0.402 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.283 9.361 -1.371 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.792 10.871 -2.175 1.00 0.00 H new ATOM 1405 N THR A 102 -4.844 12.827 -0.467 1.00 0.00 N ATOM 1406 CA THR A 102 -5.067 14.253 -0.263 1.00 0.00 C ATOM 1407 C THR A 102 -4.400 14.736 1.020 1.00 0.00 C ATOM 1408 O THR A 102 -4.376 14.024 2.024 1.00 0.00 O ATOM 1409 CB THR A 102 -6.571 14.585 -0.203 1.00 0.00 C ATOM 1410 OG1 THR A 102 -7.248 13.635 0.626 1.00 0.00 O ATOM 1411 CG2 THR A 102 -7.182 14.576 -1.596 1.00 0.00 C ATOM 0 H THR A 102 -5.431 12.222 0.107 1.00 0.00 H new ATOM 0 HA THR A 102 -4.623 14.767 -1.116 1.00 0.00 H new ATOM 0 HB THR A 102 -6.685 15.583 0.220 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.203 13.853 0.661 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.244 14.813 -1.529 1.00 0.00 H new ATOM 0 HG22 THR A 102 -6.683 15.320 -2.217 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.058 13.589 -2.041 1.00 0.00 H new ATOM 1419 N ASP A 103 -3.862 15.950 0.980 1.00 0.00 N ATOM 1420 CA ASP A 103 -3.197 16.529 2.142 1.00 0.00 C ATOM 1421 C ASP A 103 -4.132 16.558 3.346 1.00 0.00 C ATOM 1422 O ASP A 103 -3.693 16.433 4.489 1.00 0.00 O ATOM 1423 CB ASP A 103 -2.710 17.944 1.824 1.00 0.00 C ATOM 1424 CG ASP A 103 -3.686 18.710 0.954 1.00 0.00 C ATOM 1425 OD1 ASP A 103 -4.753 19.108 1.466 1.00 0.00 O ATOM 1426 OD2 ASP A 103 -3.382 18.912 -0.241 1.00 0.00 O ATOM 0 H ASP A 103 -3.873 16.552 0.157 1.00 0.00 H new ATOM 0 HA ASP A 103 -2.339 15.904 2.388 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -2.553 18.489 2.755 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -1.745 17.888 1.320 1.00 0.00 H new ATOM 1431 N GLY A 104 -5.424 16.724 3.082 1.00 0.00 N ATOM 1432 CA GLY A 104 -6.401 16.768 4.154 1.00 0.00 C ATOM 1433 C GLY A 104 -6.713 18.183 4.597 1.00 0.00 C ATOM 1434 O GLY A 104 -5.829 19.039 4.630 1.00 0.00 O ATOM 0 H GLY A 104 -5.812 16.829 2.144 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.320 16.283 3.824 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.028 16.198 5.005 1.00 0.00 H new ATOM 1438 N GLU A 105 -7.974 18.431 4.938 1.00 0.00 N ATOM 1439 CA GLU A 105 -8.400 19.754 5.379 1.00 0.00 C ATOM 1440 C GLU A 105 -7.702 20.145 6.678 1.00 0.00 C ATOM 1441 O GLU A 105 -7.870 19.490 7.707 1.00 0.00 O ATOM 1442 CB GLU A 105 -9.917 19.788 5.570 1.00 0.00 C ATOM 1443 CG GLU A 105 -10.437 18.707 6.504 1.00 0.00 C ATOM 1444 CD GLU A 105 -11.951 18.680 6.578 1.00 0.00 C ATOM 1445 OE1 GLU A 105 -12.546 19.713 6.947 1.00 0.00 O ATOM 1446 OE2 GLU A 105 -12.541 17.624 6.268 1.00 0.00 O ATOM 0 H GLU A 105 -8.718 17.733 4.917 1.00 0.00 H new ATOM 0 HA GLU A 105 -8.123 20.473 4.608 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.204 20.764 5.962 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.400 19.680 4.599 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.076 17.736 6.166 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.031 18.868 7.503 1.00 0.00 H new ATOM 1453 N VAL A 106 -6.919 21.217 6.622 1.00 0.00 N ATOM 1454 CA VAL A 106 -6.195 21.696 7.795 1.00 0.00 C ATOM 1455 C VAL A 106 -7.095 22.546 8.686 1.00 0.00 C ATOM 1456 O VAL A 106 -8.221 22.879 8.314 1.00 0.00 O ATOM 1457 CB VAL A 106 -4.960 22.524 7.392 1.00 0.00 C ATOM 1458 CG1 VAL A 106 -3.990 21.677 6.583 1.00 0.00 C ATOM 1459 CG2 VAL A 106 -5.379 23.761 6.612 1.00 0.00 C ATOM 0 H VAL A 106 -6.769 21.770 5.778 1.00 0.00 H new ATOM 0 HA VAL A 106 -5.868 20.815 8.348 1.00 0.00 H new ATOM 0 HB VAL A 106 -4.451 22.850 8.299 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -3.124 22.279 6.307 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -3.665 20.825 7.181 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -4.485 21.319 5.680 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -4.494 24.334 6.336 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -5.912 23.459 5.710 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -6.032 24.377 7.230 1.00 0.00 H new ATOM 1469 N THR A 107 -6.590 22.896 9.865 1.00 0.00 N ATOM 1470 CA THR A 107 -7.347 23.707 10.810 1.00 0.00 C ATOM 1471 C THR A 107 -6.629 25.018 11.107 1.00 0.00 C ATOM 1472 O THR A 107 -7.263 26.061 11.269 1.00 0.00 O ATOM 1473 CB THR A 107 -7.585 22.953 12.132 1.00 0.00 C ATOM 1474 OG1 THR A 107 -6.354 22.398 12.607 1.00 0.00 O ATOM 1475 CG2 THR A 107 -8.609 21.844 11.947 1.00 0.00 C ATOM 0 H THR A 107 -5.660 22.630 10.188 1.00 0.00 H new ATOM 0 HA THR A 107 -8.309 23.921 10.344 1.00 0.00 H new ATOM 0 HB THR A 107 -7.971 23.662 12.864 1.00 0.00 H new ATOM 0 HG1 THR A 107 -6.513 21.922 13.449 1.00 0.00 H new ATOM 0 HG21 THR A 107 -8.760 21.326 12.894 1.00 0.00 H new ATOM 0 HG22 THR A 107 -9.554 22.273 11.614 1.00 0.00 H new ATOM 0 HG23 THR A 107 -8.248 21.137 11.200 1.00 0.00 H new ATOM 1483 N ALA A 108 -5.304 24.959 11.178 1.00 0.00 N ATOM 1484 CA ALA A 108 -4.499 26.143 11.454 1.00 0.00 C ATOM 1485 C ALA A 108 -3.011 25.839 11.325 1.00 0.00 C ATOM 1486 O ALA A 108 -2.600 24.678 11.352 1.00 0.00 O ATOM 1487 CB ALA A 108 -4.812 26.682 12.842 1.00 0.00 C ATOM 0 H ALA A 108 -4.764 24.103 11.048 1.00 0.00 H new ATOM 0 HA ALA A 108 -4.752 26.904 10.715 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -4.204 27.566 13.035 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -5.867 26.948 12.899 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -4.589 25.919 13.588 1.00 0.00 H new ATOM 1493 N VAL A 109 -2.207 26.887 11.185 1.00 0.00 N ATOM 1494 CA VAL A 109 -0.763 26.731 11.053 1.00 0.00 C ATOM 1495 C VAL A 109 -0.185 25.952 12.229 1.00 0.00 C ATOM 1496 O VAL A 109 -0.865 25.722 13.228 1.00 0.00 O ATOM 1497 CB VAL A 109 -0.057 28.097 10.960 1.00 0.00 C ATOM 1498 CG1 VAL A 109 -0.474 28.829 9.694 1.00 0.00 C ATOM 1499 CG2 VAL A 109 -0.357 28.936 12.194 1.00 0.00 C ATOM 0 H VAL A 109 -2.531 27.854 11.160 1.00 0.00 H new ATOM 0 HA VAL A 109 -0.587 26.176 10.131 1.00 0.00 H new ATOM 0 HB VAL A 109 1.019 27.928 10.915 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.035 29.792 9.646 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.204 28.232 8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.552 28.989 9.704 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.149 29.898 12.112 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -1.432 29.098 12.272 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.003 28.414 13.083 1.00 0.00 H new ATOM 1509 N GLU A 110 1.076 25.548 12.101 1.00 0.00 N ATOM 1510 CA GLU A 110 1.746 24.793 13.154 1.00 0.00 C ATOM 1511 C GLU A 110 2.618 25.708 14.008 1.00 0.00 C ATOM 1512 O GLU A 110 3.275 26.613 13.495 1.00 0.00 O ATOM 1513 CB GLU A 110 2.599 23.677 12.548 1.00 0.00 C ATOM 1514 CG GLU A 110 1.782 22.567 11.907 1.00 0.00 C ATOM 1515 CD GLU A 110 1.136 21.653 12.929 1.00 0.00 C ATOM 1516 OE1 GLU A 110 0.318 22.145 13.733 1.00 0.00 O ATOM 1517 OE2 GLU A 110 1.449 20.444 12.925 1.00 0.00 O ATOM 0 H GLU A 110 1.653 25.731 11.280 1.00 0.00 H new ATOM 0 HA GLU A 110 0.981 24.350 13.791 1.00 0.00 H new ATOM 0 HB2 GLU A 110 3.265 24.106 11.799 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.230 23.249 13.327 1.00 0.00 H new ATOM 0 HG2 GLU A 110 1.008 23.007 11.279 1.00 0.00 H new ATOM 0 HG3 GLU A 110 2.426 21.978 11.254 1.00 0.00 H new ATOM 1524 N GLU A 111 2.619 25.465 15.315 1.00 0.00 N ATOM 1525 CA GLU A 111 3.409 26.267 16.241 1.00 0.00 C ATOM 1526 C GLU A 111 4.752 25.604 16.526 1.00 0.00 C ATOM 1527 O GLU A 111 4.869 24.378 16.502 1.00 0.00 O ATOM 1528 CB GLU A 111 2.644 26.479 17.549 1.00 0.00 C ATOM 1529 CG GLU A 111 2.371 25.191 18.309 1.00 0.00 C ATOM 1530 CD GLU A 111 2.022 25.437 19.765 1.00 0.00 C ATOM 1531 OE1 GLU A 111 2.938 25.761 20.549 1.00 0.00 O ATOM 1532 OE2 GLU A 111 0.831 25.304 20.119 1.00 0.00 O ATOM 0 H GLU A 111 2.081 24.719 15.756 1.00 0.00 H new ATOM 0 HA GLU A 111 3.593 27.235 15.776 1.00 0.00 H new ATOM 0 HB2 GLU A 111 3.213 27.154 18.188 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.696 26.970 17.330 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.552 24.656 17.828 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.249 24.547 18.253 1.00 0.00 H new ATOM 1539 N ALA A 112 5.765 26.422 16.796 1.00 0.00 N ATOM 1540 CA ALA A 112 7.099 25.914 17.088 1.00 0.00 C ATOM 1541 C ALA A 112 7.427 26.051 18.571 1.00 0.00 C ATOM 1542 O ALA A 112 8.033 27.027 19.011 1.00 0.00 O ATOM 1543 CB ALA A 112 8.136 26.645 16.248 1.00 0.00 C ATOM 0 H ALA A 112 5.686 27.439 16.818 1.00 0.00 H new ATOM 0 HA ALA A 112 7.121 24.854 16.834 1.00 0.00 H new ATOM 0 HB1 ALA A 112 9.128 26.256 16.476 1.00 0.00 H new ATOM 0 HB2 ALA A 112 7.920 26.493 15.190 1.00 0.00 H new ATOM 0 HB3 ALA A 112 8.103 27.711 16.475 1.00 0.00 H new ATOM 1549 N PRO A 113 7.017 25.048 19.363 1.00 0.00 N ATOM 1550 CA PRO A 113 7.255 25.033 20.809 1.00 0.00 C ATOM 1551 C PRO A 113 8.728 24.832 21.152 1.00 0.00 C ATOM 1552 O PRO A 113 9.098 24.761 22.324 1.00 0.00 O ATOM 1553 CB PRO A 113 6.425 23.842 21.294 1.00 0.00 C ATOM 1554 CG PRO A 113 6.319 22.946 20.107 1.00 0.00 C ATOM 1555 CD PRO A 113 6.288 23.852 18.907 1.00 0.00 C ATOM 0 HA PRO A 113 6.981 25.979 21.277 1.00 0.00 H new ATOM 0 HB2 PRO A 113 6.909 23.336 22.130 1.00 0.00 H new ATOM 0 HB3 PRO A 113 5.441 24.159 21.640 1.00 0.00 H new ATOM 0 HG2 PRO A 113 7.166 22.262 20.058 1.00 0.00 H new ATOM 0 HG3 PRO A 113 5.418 22.335 20.158 1.00 0.00 H new ATOM 0 HD2 PRO A 113 6.770 23.392 18.044 1.00 0.00 H new ATOM 0 HD3 PRO A 113 5.267 24.092 18.611 1.00 0.00 H new ATOM 1563 N VAL A 114 9.562 24.741 20.122 1.00 0.00 N ATOM 1564 CA VAL A 114 10.995 24.549 20.315 1.00 0.00 C ATOM 1565 C VAL A 114 11.483 25.270 21.566 1.00 0.00 C ATOM 1566 O VAL A 114 11.329 26.485 21.695 1.00 0.00 O ATOM 1567 CB VAL A 114 11.797 25.053 19.099 1.00 0.00 C ATOM 1568 CG1 VAL A 114 13.290 24.887 19.340 1.00 0.00 C ATOM 1569 CG2 VAL A 114 11.367 24.321 17.837 1.00 0.00 C ATOM 0 H VAL A 114 9.271 24.797 19.146 1.00 0.00 H new ATOM 0 HA VAL A 114 11.158 23.477 20.430 1.00 0.00 H new ATOM 0 HB VAL A 114 11.591 26.115 18.963 1.00 0.00 H new ATOM 0 HG11 VAL A 114 13.841 25.248 18.472 1.00 0.00 H new ATOM 0 HG12 VAL A 114 13.583 25.461 20.219 1.00 0.00 H new ATOM 0 HG13 VAL A 114 13.517 23.833 19.502 1.00 0.00 H new ATOM 0 HG21 VAL A 114 11.943 24.689 16.988 1.00 0.00 H new ATOM 0 HG22 VAL A 114 11.543 23.252 17.959 1.00 0.00 H new ATOM 0 HG23 VAL A 114 10.306 24.496 17.658 1.00 0.00 H new ATOM 1579 N ASN A 115 12.072 24.514 22.487 1.00 0.00 N ATOM 1580 CA ASN A 115 12.583 25.082 23.729 1.00 0.00 C ATOM 1581 C ASN A 115 13.937 25.748 23.507 1.00 0.00 C ATOM 1582 O ASN A 115 14.521 25.645 22.429 1.00 0.00 O ATOM 1583 CB ASN A 115 12.706 23.994 24.798 1.00 0.00 C ATOM 1584 CG ASN A 115 12.771 24.567 26.201 1.00 0.00 C ATOM 1585 OD1 ASN A 115 13.817 25.044 26.641 1.00 0.00 O ATOM 1586 ND2 ASN A 115 11.649 24.520 26.911 1.00 0.00 N ATOM 0 H ASN A 115 12.207 23.507 22.397 1.00 0.00 H new ATOM 0 HA ASN A 115 11.878 25.840 24.070 1.00 0.00 H new ATOM 0 HB2 ASN A 115 11.855 23.318 24.724 1.00 0.00 H new ATOM 0 HB3 ASN A 115 13.601 23.402 24.608 1.00 0.00 H new ATOM 0 HD21 ASN A 115 11.631 24.889 27.862 1.00 0.00 H new ATOM 0 HD22 ASN A 115 10.805 24.115 26.505 1.00 0.00 H new ATOM 1593 N ALA A 116 14.430 26.432 24.534 1.00 0.00 N ATOM 1594 CA ALA A 116 15.716 27.113 24.453 1.00 0.00 C ATOM 1595 C ALA A 116 16.318 27.318 25.838 1.00 0.00 C ATOM 1596 O ALA A 116 15.606 27.304 26.843 1.00 0.00 O ATOM 1597 CB ALA A 116 15.562 28.448 23.739 1.00 0.00 C ATOM 0 H ALA A 116 13.958 26.529 25.433 1.00 0.00 H new ATOM 0 HA ALA A 116 16.397 26.483 23.880 1.00 0.00 H new ATOM 0 HB1 ALA A 116 16.530 28.946 23.686 1.00 0.00 H new ATOM 0 HB2 ALA A 116 15.184 28.280 22.730 1.00 0.00 H new ATOM 0 HB3 ALA A 116 14.861 29.076 24.289 1.00 0.00 H new ATOM 1603 N CYS A 117 17.632 27.506 25.886 1.00 0.00 N ATOM 1604 CA CYS A 117 18.330 27.713 27.150 1.00 0.00 C ATOM 1605 C CYS A 117 19.764 28.173 26.909 1.00 0.00 C ATOM 1606 O CYS A 117 20.455 27.693 26.010 1.00 0.00 O ATOM 1607 CB CYS A 117 18.327 26.426 27.974 1.00 0.00 C ATOM 1608 SG CYS A 117 18.935 24.976 27.082 1.00 0.00 S ATOM 0 H CYS A 117 18.236 27.519 25.064 1.00 0.00 H new ATOM 0 HA CYS A 117 17.805 28.492 27.704 1.00 0.00 H new ATOM 0 HB2 CYS A 117 18.940 26.575 28.863 1.00 0.00 H new ATOM 0 HB3 CYS A 117 17.311 26.229 28.316 1.00 0.00 H new ATOM 0 HG CYS A 117 18.896 23.938 27.863 1.00 0.00 H new ATOM 1614 N PRO A 118 20.225 29.128 27.731 1.00 0.00 N ATOM 1615 CA PRO A 118 21.581 29.675 27.627 1.00 0.00 C ATOM 1616 C PRO A 118 22.646 28.667 28.043 1.00 0.00 C ATOM 1617 O PRO A 118 22.972 28.544 29.223 1.00 0.00 O ATOM 1618 CB PRO A 118 21.560 30.861 28.597 1.00 0.00 C ATOM 1619 CG PRO A 118 20.497 30.523 29.585 1.00 0.00 C ATOM 1620 CD PRO A 118 19.458 29.746 28.826 1.00 0.00 C ATOM 0 HA PRO A 118 21.833 29.948 26.602 1.00 0.00 H new ATOM 0 HB2 PRO A 118 22.526 30.991 29.084 1.00 0.00 H new ATOM 0 HB3 PRO A 118 21.336 31.793 28.078 1.00 0.00 H new ATOM 0 HG2 PRO A 118 20.902 29.933 30.407 1.00 0.00 H new ATOM 0 HG3 PRO A 118 20.068 31.425 30.021 1.00 0.00 H new ATOM 0 HD2 PRO A 118 18.979 28.995 29.455 1.00 0.00 H new ATOM 0 HD3 PRO A 118 18.668 30.395 28.447 1.00 0.00 H new ATOM 1628 N SER A 119 23.187 27.947 27.065 1.00 0.00 N ATOM 1629 CA SER A 119 24.213 26.946 27.329 1.00 0.00 C ATOM 1630 C SER A 119 25.256 26.929 26.215 1.00 0.00 C ATOM 1631 O SER A 119 24.924 26.753 25.043 1.00 0.00 O ATOM 1632 CB SER A 119 23.581 25.560 27.473 1.00 0.00 C ATOM 1633 OG SER A 119 23.314 24.988 26.204 1.00 0.00 O ATOM 0 H SER A 119 22.931 28.039 26.082 1.00 0.00 H new ATOM 0 HA SER A 119 24.709 27.209 28.263 1.00 0.00 H new ATOM 0 HB2 SER A 119 24.249 24.909 28.036 1.00 0.00 H new ATOM 0 HB3 SER A 119 22.655 25.636 28.043 1.00 0.00 H new ATOM 0 HG SER A 119 23.565 25.622 25.500 1.00 0.00 H new ATOM 1639 N GLY A 120 26.517 27.113 26.590 1.00 0.00 N ATOM 1640 CA GLY A 120 27.589 27.116 25.611 1.00 0.00 C ATOM 1641 C GLY A 120 28.896 27.631 26.184 1.00 0.00 C ATOM 1642 O GLY A 120 29.419 28.662 25.763 1.00 0.00 O ATOM 0 H GLY A 120 26.816 27.260 27.554 1.00 0.00 H new ATOM 0 HA2 GLY A 120 27.735 26.104 25.233 1.00 0.00 H new ATOM 0 HA3 GLY A 120 27.299 27.734 24.761 1.00 0.00 H new ATOM 1646 N PRO A 121 29.442 26.901 27.170 1.00 0.00 N ATOM 1647 CA PRO A 121 30.702 27.271 27.822 1.00 0.00 C ATOM 1648 C PRO A 121 31.904 27.105 26.899 1.00 0.00 C ATOM 1649 O PRO A 121 31.855 26.344 25.933 1.00 0.00 O ATOM 1650 CB PRO A 121 30.791 26.296 28.998 1.00 0.00 C ATOM 1651 CG PRO A 121 29.985 25.117 28.574 1.00 0.00 C ATOM 1652 CD PRO A 121 28.873 25.660 27.721 1.00 0.00 C ATOM 0 HA PRO A 121 30.715 28.320 28.118 1.00 0.00 H new ATOM 0 HB2 PRO A 121 31.824 26.016 29.203 1.00 0.00 H new ATOM 0 HB3 PRO A 121 30.394 26.740 29.911 1.00 0.00 H new ATOM 0 HG2 PRO A 121 30.595 24.408 28.014 1.00 0.00 H new ATOM 0 HG3 PRO A 121 29.589 24.584 29.438 1.00 0.00 H new ATOM 0 HD2 PRO A 121 28.593 24.961 26.933 1.00 0.00 H new ATOM 0 HD3 PRO A 121 27.975 25.855 28.307 1.00 0.00 H new ATOM 1660 N SER A 122 32.981 27.822 27.204 1.00 0.00 N ATOM 1661 CA SER A 122 34.195 27.756 26.398 1.00 0.00 C ATOM 1662 C SER A 122 34.450 26.331 25.916 1.00 0.00 C ATOM 1663 O SER A 122 34.582 25.406 26.718 1.00 0.00 O ATOM 1664 CB SER A 122 35.395 28.255 27.206 1.00 0.00 C ATOM 1665 OG SER A 122 35.634 27.426 28.330 1.00 0.00 O ATOM 0 H SER A 122 33.038 28.454 28.002 1.00 0.00 H new ATOM 0 HA SER A 122 34.059 28.397 25.527 1.00 0.00 H new ATOM 0 HB2 SER A 122 36.281 28.277 26.571 1.00 0.00 H new ATOM 0 HB3 SER A 122 35.215 29.278 27.537 1.00 0.00 H new ATOM 0 HG SER A 122 35.324 26.517 28.138 1.00 0.00 H new ATOM 1671 N SER A 123 34.519 26.163 24.599 1.00 0.00 N ATOM 1672 CA SER A 123 34.754 24.851 24.008 1.00 0.00 C ATOM 1673 C SER A 123 36.221 24.682 23.627 1.00 0.00 C ATOM 1674 O SER A 123 37.011 25.620 23.722 1.00 0.00 O ATOM 1675 CB SER A 123 33.870 24.658 22.774 1.00 0.00 C ATOM 1676 OG SER A 123 33.796 23.291 22.409 1.00 0.00 O ATOM 0 H SER A 123 34.416 26.919 23.922 1.00 0.00 H new ATOM 0 HA SER A 123 34.500 24.095 24.751 1.00 0.00 H new ATOM 0 HB2 SER A 123 32.869 25.038 22.977 1.00 0.00 H new ATOM 0 HB3 SER A 123 34.269 25.239 21.942 1.00 0.00 H new ATOM 0 HG SER A 123 33.224 23.194 21.619 1.00 0.00 H new ATOM 1682 N GLY A 124 36.579 23.477 23.194 1.00 0.00 N ATOM 1683 CA GLY A 124 37.951 23.205 22.805 1.00 0.00 C ATOM 1684 C GLY A 124 38.058 22.671 21.390 1.00 0.00 C ATOM 1685 O GLY A 124 39.040 22.019 21.038 1.00 0.00 O ATOM 0 H GLY A 124 35.943 22.684 23.106 1.00 0.00 H new ATOM 0 HA2 GLY A 124 38.538 24.120 22.890 1.00 0.00 H new ATOM 0 HA3 GLY A 124 38.385 22.483 23.496 1.00 0.00 H new TER 1689 GLY A 124