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 80 THR OG1 : rot -51:sc= 0.0268 USER MOD Set 1.2: A 100 MET CE :methyl 164:sc= 0 (180deg=-0.252) USER MOD Set 2.1: A 51 THR OG1 : rot -71:sc= 1.05 USER MOD Set 2.2: A 55 THR OG1 : rot 13:sc= 0.276 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0194 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 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 157:sc= -0.599! USER MOD Single : A 17 THR OG1 : rot 42:sc= 0.0759 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0193) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -140:sc= -0.801 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 145:sc= -0.323 (180deg=-1.7!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 CYS SG : rot -60:sc= -1.22 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.103 X(o=-0.1,f=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.503 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 173:sc= 0.682 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -146:sc= -0.51 (180deg=-1.69!) USER MOD Single : A 81 TYR OH : rot 26:sc= 1.2 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) USER MOD Single : A 95 SER OG : rot -88:sc= -0.529 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc=-0.00545 USER MOD Single : A 115 ASN : amide:sc= -3.28! C(o=-3.3!,f=-4!) USER MOD Single : A 117 CYS SG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.044 -27.988 -18.504 1.00 0.00 N ATOM 2 CA GLY A 1 7.239 -27.385 -17.944 1.00 0.00 C ATOM 3 C GLY A 1 7.957 -28.308 -16.979 1.00 0.00 C ATOM 4 O GLY A 1 8.725 -29.176 -17.393 1.00 0.00 O ATOM 0 H1 GLY A 1 5.590 -27.318 -19.157 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.301 -28.853 -19.020 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.383 -28.226 -17.737 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.917 -27.111 -18.752 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.970 -26.463 -17.428 1.00 0.00 H new ATOM 8 N SER A 2 7.708 -28.120 -15.687 1.00 0.00 N ATOM 9 CA SER A 2 8.339 -28.938 -14.659 1.00 0.00 C ATOM 10 C SER A 2 7.352 -29.267 -13.544 1.00 0.00 C ATOM 11 O SER A 2 6.242 -28.736 -13.506 1.00 0.00 O ATOM 12 CB SER A 2 9.557 -28.216 -14.080 1.00 0.00 C ATOM 13 OG SER A 2 10.380 -29.110 -13.350 1.00 0.00 O ATOM 0 H SER A 2 7.073 -27.407 -15.327 1.00 0.00 H new ATOM 0 HA SER A 2 8.663 -29.871 -15.120 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.133 -27.763 -14.887 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.228 -27.406 -13.429 1.00 0.00 H new ATOM 0 HG SER A 2 11.152 -28.625 -12.992 1.00 0.00 H new ATOM 19 N SER A 3 7.764 -30.149 -12.638 1.00 0.00 N ATOM 20 CA SER A 3 6.916 -30.554 -11.524 1.00 0.00 C ATOM 21 C SER A 3 7.070 -29.596 -10.347 1.00 0.00 C ATOM 22 O SER A 3 8.126 -28.990 -10.159 1.00 0.00 O ATOM 23 CB SER A 3 7.259 -31.978 -11.084 1.00 0.00 C ATOM 24 OG SER A 3 6.914 -32.919 -12.087 1.00 0.00 O ATOM 0 H SER A 3 8.680 -30.596 -12.654 1.00 0.00 H new ATOM 0 HA SER A 3 5.880 -30.525 -11.861 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.325 -32.048 -10.866 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.729 -32.214 -10.161 1.00 0.00 H new ATOM 0 HG SER A 3 7.145 -33.821 -11.782 1.00 0.00 H new ATOM 30 N GLY A 4 6.010 -29.463 -9.556 1.00 0.00 N ATOM 31 CA GLY A 4 6.048 -28.577 -8.407 1.00 0.00 C ATOM 32 C GLY A 4 4.697 -28.445 -7.731 1.00 0.00 C ATOM 33 O GLY A 4 3.661 -28.694 -8.348 1.00 0.00 O ATOM 0 H GLY A 4 5.125 -29.953 -9.690 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.776 -28.952 -7.687 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.390 -27.592 -8.723 1.00 0.00 H new ATOM 37 N SER A 5 4.708 -28.054 -6.461 1.00 0.00 N ATOM 38 CA SER A 5 3.475 -27.896 -5.700 1.00 0.00 C ATOM 39 C SER A 5 2.455 -27.072 -6.481 1.00 0.00 C ATOM 40 O SER A 5 2.772 -26.000 -6.997 1.00 0.00 O ATOM 41 CB SER A 5 3.763 -27.229 -4.354 1.00 0.00 C ATOM 42 OG SER A 5 2.567 -26.783 -3.739 1.00 0.00 O ATOM 0 H SER A 5 5.557 -27.841 -5.938 1.00 0.00 H new ATOM 0 HA SER A 5 3.057 -28.887 -5.524 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.272 -27.934 -3.697 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.437 -26.385 -4.500 1.00 0.00 H new ATOM 0 HG SER A 5 2.778 -26.362 -2.880 1.00 0.00 H new ATOM 48 N SER A 6 1.231 -27.581 -6.564 1.00 0.00 N ATOM 49 CA SER A 6 0.165 -26.895 -7.285 1.00 0.00 C ATOM 50 C SER A 6 -1.153 -26.982 -6.521 1.00 0.00 C ATOM 51 O SER A 6 -1.497 -28.028 -5.973 1.00 0.00 O ATOM 52 CB SER A 6 -0.002 -27.495 -8.683 1.00 0.00 C ATOM 53 OG SER A 6 -0.551 -28.801 -8.614 1.00 0.00 O ATOM 0 H SER A 6 0.952 -28.466 -6.141 1.00 0.00 H new ATOM 0 HA SER A 6 0.441 -25.845 -7.378 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.650 -26.855 -9.282 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.965 -27.529 -9.186 1.00 0.00 H new ATOM 0 HG SER A 6 -0.650 -29.163 -9.519 1.00 0.00 H new ATOM 59 N GLY A 7 -1.885 -25.873 -6.488 1.00 0.00 N ATOM 60 CA GLY A 7 -3.156 -25.843 -5.788 1.00 0.00 C ATOM 61 C GLY A 7 -4.230 -25.111 -6.566 1.00 0.00 C ATOM 62 O GLY A 7 -4.149 -24.992 -7.790 1.00 0.00 O ATOM 0 H GLY A 7 -1.621 -24.994 -6.934 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.485 -26.864 -5.594 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.022 -25.362 -4.819 1.00 0.00 H new ATOM 66 N THR A 8 -5.241 -24.619 -5.858 1.00 0.00 N ATOM 67 CA THR A 8 -6.339 -23.898 -6.491 1.00 0.00 C ATOM 68 C THR A 8 -6.847 -22.775 -5.594 1.00 0.00 C ATOM 69 O THR A 8 -6.543 -22.732 -4.403 1.00 0.00 O ATOM 70 CB THR A 8 -7.509 -24.840 -6.830 1.00 0.00 C ATOM 71 OG1 THR A 8 -7.847 -25.632 -5.686 1.00 0.00 O ATOM 72 CG2 THR A 8 -7.152 -25.749 -7.996 1.00 0.00 C ATOM 0 H THR A 8 -5.323 -24.706 -4.845 1.00 0.00 H new ATOM 0 HA THR A 8 -5.947 -23.472 -7.415 1.00 0.00 H new ATOM 0 HB THR A 8 -8.366 -24.231 -7.115 1.00 0.00 H new ATOM 0 HG1 THR A 8 -8.593 -26.227 -5.909 1.00 0.00 H new ATOM 0 HG21 THR A 8 -7.994 -26.405 -8.217 1.00 0.00 H new ATOM 0 HG22 THR A 8 -6.924 -25.143 -8.873 1.00 0.00 H new ATOM 0 HG23 THR A 8 -6.282 -26.351 -7.735 1.00 0.00 H new ATOM 80 N GLY A 9 -7.625 -21.866 -6.176 1.00 0.00 N ATOM 81 CA GLY A 9 -8.165 -20.755 -5.413 1.00 0.00 C ATOM 82 C GLY A 9 -8.543 -19.579 -6.292 1.00 0.00 C ATOM 83 O GLY A 9 -7.793 -19.202 -7.191 1.00 0.00 O ATOM 0 H GLY A 9 -7.890 -21.879 -7.161 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -9.043 -21.090 -4.861 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -7.430 -20.433 -4.676 1.00 0.00 H new ATOM 87 N ASP A 10 -9.710 -18.999 -6.033 1.00 0.00 N ATOM 88 CA ASP A 10 -10.187 -17.860 -6.806 1.00 0.00 C ATOM 89 C ASP A 10 -9.750 -16.546 -6.165 1.00 0.00 C ATOM 90 O ASP A 10 -9.629 -16.451 -4.944 1.00 0.00 O ATOM 91 CB ASP A 10 -11.711 -17.900 -6.929 1.00 0.00 C ATOM 92 CG ASP A 10 -12.189 -19.004 -7.850 1.00 0.00 C ATOM 93 OD1 ASP A 10 -12.043 -20.190 -7.483 1.00 0.00 O ATOM 94 OD2 ASP A 10 -12.711 -18.684 -8.938 1.00 0.00 O ATOM 0 H ASP A 10 -10.343 -19.300 -5.292 1.00 0.00 H new ATOM 0 HA ASP A 10 -9.749 -17.921 -7.802 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -12.149 -18.041 -5.941 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -12.068 -16.940 -7.302 1.00 0.00 H new ATOM 99 N ALA A 11 -9.512 -15.538 -6.997 1.00 0.00 N ATOM 100 CA ALA A 11 -9.090 -14.230 -6.511 1.00 0.00 C ATOM 101 C ALA A 11 -10.263 -13.258 -6.462 1.00 0.00 C ATOM 102 O ALA A 11 -10.344 -12.414 -5.568 1.00 0.00 O ATOM 103 CB ALA A 11 -7.979 -13.675 -7.391 1.00 0.00 C ATOM 0 H ALA A 11 -9.604 -15.602 -8.011 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.710 -14.351 -5.497 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -7.673 -12.698 -7.017 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -7.127 -14.354 -7.372 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.341 -13.575 -8.414 1.00 0.00 H new ATOM 109 N SER A 12 -11.170 -13.381 -7.426 1.00 0.00 N ATOM 110 CA SER A 12 -12.337 -12.509 -7.494 1.00 0.00 C ATOM 111 C SER A 12 -13.171 -12.618 -6.220 1.00 0.00 C ATOM 112 O SER A 12 -13.976 -11.738 -5.914 1.00 0.00 O ATOM 113 CB SER A 12 -13.194 -12.863 -8.710 1.00 0.00 C ATOM 114 OG SER A 12 -13.688 -14.188 -8.619 1.00 0.00 O ATOM 0 H SER A 12 -11.119 -14.076 -8.171 1.00 0.00 H new ATOM 0 HA SER A 12 -11.987 -11.481 -7.592 1.00 0.00 H new ATOM 0 HB2 SER A 12 -14.028 -12.165 -8.786 1.00 0.00 H new ATOM 0 HB3 SER A 12 -12.603 -12.754 -9.619 1.00 0.00 H new ATOM 0 HG SER A 12 -14.234 -14.388 -9.408 1.00 0.00 H new ATOM 120 N LYS A 13 -12.973 -13.704 -5.482 1.00 0.00 N ATOM 121 CA LYS A 13 -13.704 -13.932 -4.241 1.00 0.00 C ATOM 122 C LYS A 13 -13.046 -13.195 -3.079 1.00 0.00 C ATOM 123 O LYS A 13 -13.725 -12.717 -2.170 1.00 0.00 O ATOM 124 CB LYS A 13 -13.777 -15.428 -3.934 1.00 0.00 C ATOM 125 CG LYS A 13 -14.128 -16.280 -5.141 1.00 0.00 C ATOM 126 CD LYS A 13 -15.544 -16.008 -5.623 1.00 0.00 C ATOM 127 CE LYS A 13 -16.560 -16.863 -4.879 1.00 0.00 C ATOM 128 NZ LYS A 13 -16.744 -18.191 -5.526 1.00 0.00 N ATOM 0 H LYS A 13 -12.311 -14.442 -5.722 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.715 -13.545 -4.368 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.817 -15.756 -3.535 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.520 -15.594 -3.154 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -13.423 -16.078 -5.947 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.026 -17.335 -4.885 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.781 -14.954 -5.482 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -15.611 -16.209 -6.692 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -16.233 -17.003 -3.849 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.516 -16.341 -4.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -17.443 -18.744 -4.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -17.081 -18.058 -6.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -15.837 -18.699 -5.539 1.00 0.00 H new ATOM 142 N CYS A 14 -11.721 -13.104 -3.117 1.00 0.00 N ATOM 143 CA CYS A 14 -10.971 -12.424 -2.066 1.00 0.00 C ATOM 144 C CYS A 14 -11.578 -11.059 -1.762 1.00 0.00 C ATOM 145 O CYS A 14 -12.049 -10.361 -2.662 1.00 0.00 O ATOM 146 CB CYS A 14 -9.506 -12.265 -2.479 1.00 0.00 C ATOM 147 SG CYS A 14 -8.497 -13.737 -2.199 1.00 0.00 S ATOM 0 H CYS A 14 -11.144 -13.492 -3.863 1.00 0.00 H new ATOM 0 HA CYS A 14 -11.023 -13.033 -1.163 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -9.464 -12.005 -3.537 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -9.073 -11.430 -1.928 1.00 0.00 H new ATOM 0 HG CYS A 14 -7.466 -13.713 -2.990 1.00 0.00 H new ATOM 153 N LEU A 15 -11.566 -10.683 -0.487 1.00 0.00 N ATOM 154 CA LEU A 15 -12.118 -9.401 -0.063 1.00 0.00 C ATOM 155 C LEU A 15 -11.024 -8.496 0.495 1.00 0.00 C ATOM 156 O LEU A 15 -10.256 -8.900 1.369 1.00 0.00 O ATOM 157 CB LEU A 15 -13.204 -9.615 0.991 1.00 0.00 C ATOM 158 CG LEU A 15 -14.614 -9.876 0.457 1.00 0.00 C ATOM 159 CD1 LEU A 15 -14.974 -8.864 -0.618 1.00 0.00 C ATOM 160 CD2 LEU A 15 -14.725 -11.294 -0.083 1.00 0.00 C ATOM 0 H LEU A 15 -11.180 -11.247 0.270 1.00 0.00 H new ATOM 0 HA LEU A 15 -12.557 -8.916 -0.935 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -12.913 -10.457 1.618 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -13.237 -8.735 1.634 1.00 0.00 H new ATOM 0 HG LEU A 15 -15.320 -9.766 1.280 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -15.980 -9.066 -0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.936 -7.859 -0.199 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -14.265 -8.941 -1.442 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -15.734 -11.462 -0.459 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -14.009 -11.432 -0.893 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -14.512 -12.005 0.715 1.00 0.00 H new ATOM 172 N ALA A 16 -10.960 -7.270 -0.013 1.00 0.00 N ATOM 173 CA ALA A 16 -9.963 -6.307 0.437 1.00 0.00 C ATOM 174 C ALA A 16 -10.617 -5.153 1.192 1.00 0.00 C ATOM 175 O ALA A 16 -11.325 -4.336 0.604 1.00 0.00 O ATOM 176 CB ALA A 16 -9.165 -5.780 -0.746 1.00 0.00 C ATOM 0 H ALA A 16 -11.587 -6.920 -0.737 1.00 0.00 H new ATOM 0 HA ALA A 16 -9.284 -6.817 1.120 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.424 -5.062 -0.394 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.660 -6.609 -1.242 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.838 -5.291 -1.450 1.00 0.00 H new ATOM 182 N THR A 17 -10.374 -5.093 2.497 1.00 0.00 N ATOM 183 CA THR A 17 -10.940 -4.042 3.333 1.00 0.00 C ATOM 184 C THR A 17 -9.849 -3.299 4.096 1.00 0.00 C ATOM 185 O THR A 17 -9.044 -3.910 4.798 1.00 0.00 O ATOM 186 CB THR A 17 -11.959 -4.610 4.338 1.00 0.00 C ATOM 187 OG1 THR A 17 -11.391 -5.726 5.033 1.00 0.00 O ATOM 188 CG2 THR A 17 -13.235 -5.042 3.630 1.00 0.00 C ATOM 0 H THR A 17 -9.788 -5.761 2.998 1.00 0.00 H new ATOM 0 HA THR A 17 -11.450 -3.347 2.665 1.00 0.00 H new ATOM 0 HB THR A 17 -12.208 -3.826 5.053 1.00 0.00 H new ATOM 0 HG1 THR A 17 -10.459 -5.528 5.264 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.940 -5.440 4.360 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.680 -4.184 3.126 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.001 -5.812 2.895 1.00 0.00 H new ATOM 196 N GLY A 18 -9.829 -1.977 3.955 1.00 0.00 N ATOM 197 CA GLY A 18 -8.833 -1.174 4.638 1.00 0.00 C ATOM 198 C GLY A 18 -8.805 0.259 4.144 1.00 0.00 C ATOM 199 O GLY A 18 -9.184 0.555 3.011 1.00 0.00 O ATOM 0 H GLY A 18 -10.485 -1.448 3.380 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.036 -1.182 5.709 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.850 -1.623 4.497 1.00 0.00 H new ATOM 203 N PRO A 19 -8.349 1.179 5.007 1.00 0.00 N ATOM 204 CA PRO A 19 -8.264 2.604 4.675 1.00 0.00 C ATOM 205 C PRO A 19 -7.181 2.894 3.642 1.00 0.00 C ATOM 206 O PRO A 19 -7.203 3.930 2.979 1.00 0.00 O ATOM 207 CB PRO A 19 -7.917 3.260 6.013 1.00 0.00 C ATOM 208 CG PRO A 19 -7.237 2.190 6.795 1.00 0.00 C ATOM 209 CD PRO A 19 -7.881 0.898 6.375 1.00 0.00 C ATOM 0 HA PRO A 19 -9.187 2.975 4.230 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.266 4.123 5.874 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -8.812 3.615 6.524 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -6.167 2.177 6.590 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -7.355 2.355 7.866 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -7.172 0.070 6.395 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -8.706 0.627 7.034 1.00 0.00 H new ATOM 217 N GLY A 20 -6.232 1.972 3.511 1.00 0.00 N ATOM 218 CA GLY A 20 -5.153 2.147 2.556 1.00 0.00 C ATOM 219 C GLY A 20 -5.603 1.928 1.126 1.00 0.00 C ATOM 220 O GLY A 20 -5.138 2.610 0.210 1.00 0.00 O ATOM 0 H GLY A 20 -6.191 1.107 4.049 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.744 3.153 2.655 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.348 1.451 2.791 1.00 0.00 H new ATOM 224 N ILE A 21 -6.508 0.975 0.931 1.00 0.00 N ATOM 225 CA ILE A 21 -7.020 0.669 -0.398 1.00 0.00 C ATOM 226 C ILE A 21 -8.201 1.566 -0.754 1.00 0.00 C ATOM 227 O ILE A 21 -8.690 1.548 -1.883 1.00 0.00 O ATOM 228 CB ILE A 21 -7.458 -0.804 -0.507 1.00 0.00 C ATOM 229 CG1 ILE A 21 -8.347 -1.183 0.679 1.00 0.00 C ATOM 230 CG2 ILE A 21 -6.241 -1.715 -0.576 1.00 0.00 C ATOM 231 CD1 ILE A 21 -9.170 -2.430 0.444 1.00 0.00 C ATOM 0 H ILE A 21 -6.902 0.402 1.677 1.00 0.00 H new ATOM 0 HA ILE A 21 -6.205 0.851 -1.099 1.00 0.00 H new ATOM 0 HB ILE A 21 -8.034 -0.930 -1.424 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -7.721 -1.331 1.559 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -9.017 -0.352 0.901 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -6.567 -2.752 -0.653 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.643 -1.457 -1.450 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -5.641 -1.589 0.325 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -9.775 -2.638 1.326 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -9.822 -2.279 -0.416 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.506 -3.273 0.252 1.00 0.00 H new ATOM 243 N ALA A 22 -8.653 2.351 0.218 1.00 0.00 N ATOM 244 CA ALA A 22 -9.775 3.258 0.008 1.00 0.00 C ATOM 245 C ALA A 22 -9.506 4.202 -1.160 1.00 0.00 C ATOM 246 O ALA A 22 -8.404 4.733 -1.300 1.00 0.00 O ATOM 247 CB ALA A 22 -10.058 4.052 1.275 1.00 0.00 C ATOM 0 H ALA A 22 -8.260 2.377 1.159 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.653 2.659 -0.236 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -10.898 4.725 1.103 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -10.302 3.367 2.087 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -9.177 4.634 1.544 1.00 0.00 H new ATOM 253 N SER A 23 -10.518 4.406 -1.996 1.00 0.00 N ATOM 254 CA SER A 23 -10.389 5.282 -3.155 1.00 0.00 C ATOM 255 C SER A 23 -9.483 6.469 -2.839 1.00 0.00 C ATOM 256 O SER A 23 -8.707 6.915 -3.684 1.00 0.00 O ATOM 257 CB SER A 23 -11.765 5.780 -3.600 1.00 0.00 C ATOM 258 OG SER A 23 -11.683 6.467 -4.836 1.00 0.00 O ATOM 0 H SER A 23 -11.437 3.976 -1.893 1.00 0.00 H new ATOM 0 HA SER A 23 -9.939 4.709 -3.966 1.00 0.00 H new ATOM 0 HB2 SER A 23 -12.448 4.936 -3.694 1.00 0.00 H new ATOM 0 HB3 SER A 23 -12.179 6.442 -2.839 1.00 0.00 H new ATOM 0 HG SER A 23 -12.576 6.774 -5.099 1.00 0.00 H new ATOM 264 N THR A 24 -9.589 6.978 -1.615 1.00 0.00 N ATOM 265 CA THR A 24 -8.782 8.113 -1.187 1.00 0.00 C ATOM 266 C THR A 24 -8.159 7.859 0.181 1.00 0.00 C ATOM 267 O THR A 24 -8.742 7.177 1.023 1.00 0.00 O ATOM 268 CB THR A 24 -9.618 9.405 -1.126 1.00 0.00 C ATOM 269 OG1 THR A 24 -10.674 9.262 -0.170 1.00 0.00 O ATOM 270 CG2 THR A 24 -10.204 9.735 -2.491 1.00 0.00 C ATOM 0 H THR A 24 -10.226 6.621 -0.903 1.00 0.00 H new ATOM 0 HA THR A 24 -7.991 8.236 -1.927 1.00 0.00 H new ATOM 0 HB THR A 24 -8.962 10.221 -0.822 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.199 10.089 -0.137 1.00 0.00 H new ATOM 0 HG21 THR A 24 -10.790 10.651 -2.423 1.00 0.00 H new ATOM 0 HG22 THR A 24 -9.396 9.873 -3.210 1.00 0.00 H new ATOM 0 HG23 THR A 24 -10.846 8.917 -2.819 1.00 0.00 H new ATOM 278 N VAL A 25 -6.971 8.415 0.396 1.00 0.00 N ATOM 279 CA VAL A 25 -6.268 8.251 1.663 1.00 0.00 C ATOM 280 C VAL A 25 -5.671 9.571 2.136 1.00 0.00 C ATOM 281 O VAL A 25 -5.824 10.604 1.483 1.00 0.00 O ATOM 282 CB VAL A 25 -5.145 7.203 1.551 1.00 0.00 C ATOM 283 CG1 VAL A 25 -5.713 5.852 1.143 1.00 0.00 C ATOM 284 CG2 VAL A 25 -4.083 7.664 0.564 1.00 0.00 C ATOM 0 H VAL A 25 -6.475 8.983 -0.291 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.004 7.908 2.390 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.676 7.092 2.529 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -4.904 5.125 1.069 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.433 5.519 1.891 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.209 5.943 0.177 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.297 6.912 0.497 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.535 7.805 -0.418 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -3.655 8.607 0.904 1.00 0.00 H new ATOM 294 N LYS A 26 -4.988 9.532 3.276 1.00 0.00 N ATOM 295 CA LYS A 26 -4.365 10.724 3.837 1.00 0.00 C ATOM 296 C LYS A 26 -2.845 10.616 3.791 1.00 0.00 C ATOM 297 O LYS A 26 -2.284 9.527 3.923 1.00 0.00 O ATOM 298 CB LYS A 26 -4.829 10.936 5.279 1.00 0.00 C ATOM 299 CG LYS A 26 -6.254 11.448 5.391 1.00 0.00 C ATOM 300 CD LYS A 26 -6.684 11.589 6.842 1.00 0.00 C ATOM 301 CE LYS A 26 -6.928 10.233 7.486 1.00 0.00 C ATOM 302 NZ LYS A 26 -8.220 9.635 7.046 1.00 0.00 N ATOM 0 H LYS A 26 -4.852 8.686 3.829 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.669 11.580 3.235 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.747 9.993 5.820 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.158 11.643 5.767 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.335 12.413 4.891 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.929 10.765 4.875 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -5.916 12.125 7.400 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.593 12.188 6.896 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -6.110 9.558 7.233 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.928 10.341 8.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -8.390 8.753 7.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -8.994 10.304 7.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.179 9.430 6.027 1.00 0.00 H new ATOM 316 N THR A 27 -2.180 11.753 3.604 1.00 0.00 N ATOM 317 CA THR A 27 -0.725 11.785 3.541 1.00 0.00 C ATOM 318 C THR A 27 -0.119 11.972 4.927 1.00 0.00 C ATOM 319 O THR A 27 -0.760 12.510 5.829 1.00 0.00 O ATOM 320 CB THR A 27 -0.227 12.916 2.620 1.00 0.00 C ATOM 321 OG1 THR A 27 -0.791 14.166 3.031 1.00 0.00 O ATOM 322 CG2 THR A 27 -0.600 12.637 1.172 1.00 0.00 C ATOM 0 H THR A 27 -2.627 12.663 3.494 1.00 0.00 H new ATOM 0 HA THR A 27 -0.405 10.826 3.133 1.00 0.00 H new ATOM 0 HB THR A 27 0.859 12.966 2.696 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.468 14.880 2.442 1.00 0.00 H new ATOM 0 HG21 THR A 27 -0.238 13.448 0.540 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.145 11.699 0.853 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.684 12.563 1.083 1.00 0.00 H new ATOM 330 N GLY A 28 1.123 11.522 5.091 1.00 0.00 N ATOM 331 CA GLY A 28 1.794 11.650 6.372 1.00 0.00 C ATOM 332 C GLY A 28 1.454 10.518 7.320 1.00 0.00 C ATOM 333 O GLY A 28 2.317 10.031 8.049 1.00 0.00 O ATOM 0 H GLY A 28 1.675 11.072 4.361 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.872 11.675 6.213 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.517 12.599 6.830 1.00 0.00 H new ATOM 337 N GLU A 29 0.192 10.099 7.312 1.00 0.00 N ATOM 338 CA GLU A 29 -0.260 9.019 8.180 1.00 0.00 C ATOM 339 C GLU A 29 0.109 7.659 7.594 1.00 0.00 C ATOM 340 O GLU A 29 0.507 7.560 6.434 1.00 0.00 O ATOM 341 CB GLU A 29 -1.773 9.103 8.390 1.00 0.00 C ATOM 342 CG GLU A 29 -2.201 10.261 9.276 1.00 0.00 C ATOM 343 CD GLU A 29 -1.930 10.003 10.745 1.00 0.00 C ATOM 344 OE1 GLU A 29 -2.295 8.913 11.234 1.00 0.00 O ATOM 345 OE2 GLU A 29 -1.352 10.891 11.407 1.00 0.00 O ATOM 0 H GLU A 29 -0.535 10.492 6.714 1.00 0.00 H new ATOM 0 HA GLU A 29 0.240 9.128 9.143 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.261 9.199 7.420 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.122 8.170 8.832 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -1.675 11.164 8.967 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.265 10.448 9.134 1.00 0.00 H new ATOM 352 N GLU A 30 -0.028 6.615 8.405 1.00 0.00 N ATOM 353 CA GLU A 30 0.292 5.261 7.967 1.00 0.00 C ATOM 354 C GLU A 30 -0.967 4.402 7.891 1.00 0.00 C ATOM 355 O GLU A 30 -1.614 4.138 8.906 1.00 0.00 O ATOM 356 CB GLU A 30 1.305 4.619 8.918 1.00 0.00 C ATOM 357 CG GLU A 30 1.585 3.158 8.612 1.00 0.00 C ATOM 358 CD GLU A 30 2.968 2.723 9.058 1.00 0.00 C ATOM 359 OE1 GLU A 30 3.923 3.505 8.874 1.00 0.00 O ATOM 360 OE2 GLU A 30 3.092 1.601 9.592 1.00 0.00 O ATOM 0 H GLU A 30 -0.358 6.680 9.368 1.00 0.00 H new ATOM 0 HA GLU A 30 0.729 5.323 6.970 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.240 5.177 8.870 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.935 4.703 9.940 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.837 2.538 9.105 1.00 0.00 H new ATOM 0 HG3 GLU A 30 1.483 2.989 7.540 1.00 0.00 H new ATOM 367 N VAL A 31 -1.309 3.969 6.683 1.00 0.00 N ATOM 368 CA VAL A 31 -2.490 3.138 6.474 1.00 0.00 C ATOM 369 C VAL A 31 -2.188 1.672 6.758 1.00 0.00 C ATOM 370 O VAL A 31 -1.033 1.290 6.947 1.00 0.00 O ATOM 371 CB VAL A 31 -3.023 3.273 5.035 1.00 0.00 C ATOM 372 CG1 VAL A 31 -3.435 4.709 4.750 1.00 0.00 C ATOM 373 CG2 VAL A 31 -1.979 2.801 4.034 1.00 0.00 C ATOM 0 H VAL A 31 -0.786 4.179 5.833 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.252 3.489 7.170 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.905 2.640 4.932 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.809 4.784 3.729 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.219 5.008 5.446 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.573 5.365 4.870 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.372 2.903 3.023 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.078 3.406 4.136 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.738 1.755 4.225 1.00 0.00 H new ATOM 383 N GLY A 32 -3.234 0.852 6.785 1.00 0.00 N ATOM 384 CA GLY A 32 -3.060 -0.566 7.045 1.00 0.00 C ATOM 385 C GLY A 32 -4.265 -1.384 6.628 1.00 0.00 C ATOM 386 O GLY A 32 -5.244 -1.482 7.367 1.00 0.00 O ATOM 0 H GLY A 32 -4.199 1.144 6.631 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.179 -0.925 6.512 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.873 -0.717 8.108 1.00 0.00 H new ATOM 390 N PHE A 33 -4.195 -1.973 5.438 1.00 0.00 N ATOM 391 CA PHE A 33 -5.290 -2.786 4.922 1.00 0.00 C ATOM 392 C PHE A 33 -4.934 -4.269 4.966 1.00 0.00 C ATOM 393 O PHE A 33 -3.762 -4.639 4.900 1.00 0.00 O ATOM 394 CB PHE A 33 -5.627 -2.373 3.488 1.00 0.00 C ATOM 395 CG PHE A 33 -4.507 -2.607 2.517 1.00 0.00 C ATOM 396 CD1 PHE A 33 -3.468 -1.697 2.404 1.00 0.00 C ATOM 397 CD2 PHE A 33 -4.492 -3.738 1.716 1.00 0.00 C ATOM 398 CE1 PHE A 33 -2.433 -1.911 1.512 1.00 0.00 C ATOM 399 CE2 PHE A 33 -3.461 -3.957 0.822 1.00 0.00 C ATOM 400 CZ PHE A 33 -2.430 -3.042 0.719 1.00 0.00 C ATOM 0 H PHE A 33 -3.392 -1.902 4.814 1.00 0.00 H new ATOM 0 HA PHE A 33 -6.162 -2.621 5.555 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.506 -2.926 3.156 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -5.892 -1.316 3.476 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -3.466 -0.810 3.020 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -5.295 -4.456 1.791 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -1.628 -1.195 1.436 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.461 -4.843 0.204 1.00 0.00 H new ATOM 0 HZ PHE A 33 -1.624 -3.211 0.020 1.00 0.00 H new ATOM 410 N VAL A 34 -5.955 -5.113 5.077 1.00 0.00 N ATOM 411 CA VAL A 34 -5.751 -6.556 5.130 1.00 0.00 C ATOM 412 C VAL A 34 -6.703 -7.279 4.183 1.00 0.00 C ATOM 413 O VAL A 34 -7.885 -6.948 4.100 1.00 0.00 O ATOM 414 CB VAL A 34 -5.952 -7.100 6.556 1.00 0.00 C ATOM 415 CG1 VAL A 34 -7.365 -6.818 7.042 1.00 0.00 C ATOM 416 CG2 VAL A 34 -5.650 -8.590 6.604 1.00 0.00 C ATOM 0 H VAL A 34 -6.931 -4.823 5.132 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.723 -6.742 4.821 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.257 -6.589 7.222 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -7.488 -7.210 8.052 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.540 -5.742 7.047 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -8.082 -7.299 6.376 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.797 -8.959 7.619 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.319 -9.119 5.925 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -4.617 -8.762 6.302 1.00 0.00 H new ATOM 426 N VAL A 35 -6.179 -8.271 3.469 1.00 0.00 N ATOM 427 CA VAL A 35 -6.981 -9.044 2.529 1.00 0.00 C ATOM 428 C VAL A 35 -7.611 -10.254 3.210 1.00 0.00 C ATOM 429 O VAL A 35 -6.911 -11.164 3.653 1.00 0.00 O ATOM 430 CB VAL A 35 -6.138 -9.523 1.332 1.00 0.00 C ATOM 431 CG1 VAL A 35 -6.943 -10.473 0.458 1.00 0.00 C ATOM 432 CG2 VAL A 35 -5.639 -8.335 0.524 1.00 0.00 C ATOM 0 H VAL A 35 -5.202 -8.558 3.524 1.00 0.00 H new ATOM 0 HA VAL A 35 -7.769 -8.383 2.167 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.272 -10.064 1.712 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.331 -10.801 -0.382 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.246 -11.339 1.046 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.829 -9.960 0.084 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.045 -8.691 -0.318 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.490 -7.765 0.152 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -5.023 -7.697 1.158 1.00 0.00 H new ATOM 442 N ASP A 36 -8.937 -10.258 3.287 1.00 0.00 N ATOM 443 CA ASP A 36 -9.664 -11.358 3.912 1.00 0.00 C ATOM 444 C ASP A 36 -10.210 -12.316 2.859 1.00 0.00 C ATOM 445 O ASP A 36 -10.906 -11.904 1.932 1.00 0.00 O ATOM 446 CB ASP A 36 -10.809 -10.818 4.772 1.00 0.00 C ATOM 447 CG ASP A 36 -11.119 -11.717 5.952 1.00 0.00 C ATOM 448 OD1 ASP A 36 -11.284 -12.936 5.742 1.00 0.00 O ATOM 449 OD2 ASP A 36 -11.198 -11.201 7.087 1.00 0.00 O ATOM 0 H ASP A 36 -9.531 -9.512 2.925 1.00 0.00 H new ATOM 0 HA ASP A 36 -8.969 -11.905 4.549 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -10.549 -9.823 5.135 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.702 -10.710 4.157 1.00 0.00 H new ATOM 454 N ALA A 37 -9.889 -13.597 3.008 1.00 0.00 N ATOM 455 CA ALA A 37 -10.348 -14.614 2.071 1.00 0.00 C ATOM 456 C ALA A 37 -11.111 -15.720 2.791 1.00 0.00 C ATOM 457 O ALA A 37 -10.609 -16.316 3.745 1.00 0.00 O ATOM 458 CB ALA A 37 -9.170 -15.196 1.304 1.00 0.00 C ATOM 0 H ALA A 37 -9.312 -13.955 3.769 1.00 0.00 H new ATOM 0 HA ALA A 37 -11.029 -14.140 1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.528 -15.954 0.608 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.669 -14.402 0.750 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.468 -15.649 2.004 1.00 0.00 H new ATOM 464 N LYS A 38 -12.327 -15.992 2.330 1.00 0.00 N ATOM 465 CA LYS A 38 -13.160 -17.028 2.930 1.00 0.00 C ATOM 466 C LYS A 38 -13.368 -18.188 1.962 1.00 0.00 C ATOM 467 O LYS A 38 -12.933 -19.311 2.218 1.00 0.00 O ATOM 468 CB LYS A 38 -14.514 -16.446 3.344 1.00 0.00 C ATOM 469 CG LYS A 38 -14.433 -15.014 3.843 1.00 0.00 C ATOM 470 CD LYS A 38 -15.573 -14.691 4.796 1.00 0.00 C ATOM 471 CE LYS A 38 -15.421 -13.302 5.397 1.00 0.00 C ATOM 472 NZ LYS A 38 -16.662 -12.856 6.088 1.00 0.00 N ATOM 0 H LYS A 38 -12.758 -15.509 1.542 1.00 0.00 H new ATOM 0 HA LYS A 38 -12.647 -17.404 3.815 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -15.193 -16.487 2.493 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -14.945 -17.071 4.126 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -13.480 -14.857 4.348 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -14.461 -14.330 2.995 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -16.522 -14.757 4.265 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.602 -15.433 5.594 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -14.592 -13.302 6.104 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -15.169 -12.592 4.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -16.517 -11.905 6.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -17.448 -12.832 5.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -16.889 -13.519 6.856 1.00 0.00 H new ATOM 486 N THR A 39 -14.035 -17.908 0.846 1.00 0.00 N ATOM 487 CA THR A 39 -14.299 -18.928 -0.161 1.00 0.00 C ATOM 488 C THR A 39 -13.220 -18.932 -1.237 1.00 0.00 C ATOM 489 O THR A 39 -13.042 -19.920 -1.949 1.00 0.00 O ATOM 490 CB THR A 39 -15.671 -18.716 -0.828 1.00 0.00 C ATOM 491 OG1 THR A 39 -15.599 -17.635 -1.765 1.00 0.00 O ATOM 492 CG2 THR A 39 -16.740 -18.419 0.213 1.00 0.00 C ATOM 0 H THR A 39 -14.402 -16.984 0.617 1.00 0.00 H new ATOM 0 HA THR A 39 -14.297 -19.888 0.355 1.00 0.00 H new ATOM 0 HB THR A 39 -15.940 -19.634 -1.351 1.00 0.00 H new ATOM 0 HG1 THR A 39 -16.417 -17.098 -1.708 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.700 -18.273 -0.283 1.00 0.00 H new ATOM 0 HG22 THR A 39 -16.814 -19.256 0.908 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.473 -17.515 0.761 1.00 0.00 H new ATOM 500 N ALA A 40 -12.500 -17.820 -1.351 1.00 0.00 N ATOM 501 CA ALA A 40 -11.436 -17.697 -2.339 1.00 0.00 C ATOM 502 C ALA A 40 -10.572 -18.954 -2.375 1.00 0.00 C ATOM 503 O ALA A 40 -10.278 -19.486 -3.446 1.00 0.00 O ATOM 504 CB ALA A 40 -10.579 -16.475 -2.042 1.00 0.00 C ATOM 0 H ALA A 40 -12.635 -16.992 -0.771 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.897 -17.575 -3.319 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.788 -16.395 -2.788 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -11.199 -15.579 -2.074 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.135 -16.574 -1.051 1.00 0.00 H new ATOM 510 N GLY A 41 -10.169 -19.424 -1.199 1.00 0.00 N ATOM 511 CA GLY A 41 -9.343 -20.615 -1.120 1.00 0.00 C ATOM 512 C GLY A 41 -7.905 -20.299 -0.756 1.00 0.00 C ATOM 513 O GLY A 41 -7.634 -19.329 -0.048 1.00 0.00 O ATOM 0 H GLY A 41 -10.399 -19.002 -0.300 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.761 -21.295 -0.378 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -9.367 -21.134 -2.078 1.00 0.00 H new ATOM 517 N LYS A 42 -6.980 -21.122 -1.239 1.00 0.00 N ATOM 518 CA LYS A 42 -5.563 -20.927 -0.960 1.00 0.00 C ATOM 519 C LYS A 42 -4.915 -20.047 -2.024 1.00 0.00 C ATOM 520 O LYS A 42 -5.278 -20.106 -3.198 1.00 0.00 O ATOM 521 CB LYS A 42 -4.845 -22.278 -0.894 1.00 0.00 C ATOM 522 CG LYS A 42 -3.538 -22.234 -0.121 1.00 0.00 C ATOM 523 CD LYS A 42 -2.378 -21.817 -1.011 1.00 0.00 C ATOM 524 CE LYS A 42 -1.292 -21.110 -0.214 1.00 0.00 C ATOM 525 NZ LYS A 42 -0.526 -22.059 0.642 1.00 0.00 N ATOM 0 H LYS A 42 -7.187 -21.930 -1.826 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.473 -20.427 0.004 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -5.507 -23.010 -0.431 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.646 -22.625 -1.908 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -3.629 -21.535 0.711 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.334 -23.215 0.308 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -1.958 -22.696 -1.500 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.741 -21.157 -1.799 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.609 -20.606 -0.898 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -1.743 -20.340 0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.204 -21.539 1.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -1.173 -22.522 1.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.074 -22.779 0.043 1.00 0.00 H new ATOM 539 N GLY A 43 -3.951 -19.232 -1.606 1.00 0.00 N ATOM 540 CA GLY A 43 -3.267 -18.352 -2.536 1.00 0.00 C ATOM 541 C GLY A 43 -2.487 -17.259 -1.832 1.00 0.00 C ATOM 542 O GLY A 43 -2.847 -16.837 -0.733 1.00 0.00 O ATOM 0 H GLY A 43 -3.631 -19.165 -0.640 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.587 -18.939 -3.154 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.997 -17.899 -3.207 1.00 0.00 H new ATOM 546 N LYS A 44 -1.413 -16.800 -2.466 1.00 0.00 N ATOM 547 CA LYS A 44 -0.578 -15.750 -1.896 1.00 0.00 C ATOM 548 C LYS A 44 -1.021 -14.375 -2.387 1.00 0.00 C ATOM 549 O LYS A 44 -1.369 -14.205 -3.555 1.00 0.00 O ATOM 550 CB LYS A 44 0.890 -15.984 -2.257 1.00 0.00 C ATOM 551 CG LYS A 44 1.544 -17.096 -1.457 1.00 0.00 C ATOM 552 CD LYS A 44 2.899 -17.474 -2.031 1.00 0.00 C ATOM 553 CE LYS A 44 2.765 -18.486 -3.158 1.00 0.00 C ATOM 554 NZ LYS A 44 2.547 -17.824 -4.475 1.00 0.00 N ATOM 0 H LYS A 44 -1.101 -17.139 -3.376 1.00 0.00 H new ATOM 0 HA LYS A 44 -0.688 -15.782 -0.812 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.961 -16.222 -3.318 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.446 -15.060 -2.100 1.00 0.00 H new ATOM 0 HG2 LYS A 44 1.663 -16.779 -0.421 1.00 0.00 H new ATOM 0 HG3 LYS A 44 0.894 -17.971 -1.450 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.400 -16.580 -2.401 1.00 0.00 H new ATOM 0 HD3 LYS A 44 3.527 -17.888 -1.242 1.00 0.00 H new ATOM 0 HE2 LYS A 44 3.665 -19.099 -3.204 1.00 0.00 H new ATOM 0 HE3 LYS A 44 1.932 -19.157 -2.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 3.023 -18.370 -5.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 1.528 -17.778 -4.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.938 -16.861 -4.448 1.00 0.00 H new ATOM 568 N VAL A 45 -1.004 -13.397 -1.488 1.00 0.00 N ATOM 569 CA VAL A 45 -1.402 -12.037 -1.831 1.00 0.00 C ATOM 570 C VAL A 45 -0.203 -11.094 -1.821 1.00 0.00 C ATOM 571 O VAL A 45 0.367 -10.807 -0.767 1.00 0.00 O ATOM 572 CB VAL A 45 -2.469 -11.501 -0.859 1.00 0.00 C ATOM 573 CG1 VAL A 45 -2.847 -10.071 -1.215 1.00 0.00 C ATOM 574 CG2 VAL A 45 -3.695 -12.402 -0.866 1.00 0.00 C ATOM 0 H VAL A 45 -0.719 -13.521 -0.517 1.00 0.00 H new ATOM 0 HA VAL A 45 -1.823 -12.076 -2.836 1.00 0.00 H new ATOM 0 HB VAL A 45 -2.051 -11.501 0.148 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.602 -9.710 -0.517 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -1.964 -9.435 -1.155 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.247 -10.042 -2.229 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.439 -12.009 -0.174 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.116 -12.436 -1.871 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -3.409 -13.408 -0.559 1.00 0.00 H new ATOM 584 N THR A 46 0.177 -10.614 -3.001 1.00 0.00 N ATOM 585 CA THR A 46 1.308 -9.705 -3.129 1.00 0.00 C ATOM 586 C THR A 46 0.840 -8.275 -3.371 1.00 0.00 C ATOM 587 O THR A 46 -0.088 -8.038 -4.146 1.00 0.00 O ATOM 588 CB THR A 46 2.242 -10.128 -4.279 1.00 0.00 C ATOM 589 OG1 THR A 46 1.521 -10.143 -5.516 1.00 0.00 O ATOM 590 CG2 THR A 46 2.835 -11.505 -4.015 1.00 0.00 C ATOM 0 H THR A 46 -0.283 -10.840 -3.883 1.00 0.00 H new ATOM 0 HA THR A 46 1.857 -9.751 -2.189 1.00 0.00 H new ATOM 0 HB THR A 46 3.055 -9.405 -4.342 1.00 0.00 H new ATOM 0 HG1 THR A 46 2.122 -10.411 -6.242 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.491 -11.783 -4.840 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.408 -11.483 -3.088 1.00 0.00 H new ATOM 0 HG23 THR A 46 2.032 -12.237 -3.928 1.00 0.00 H new ATOM 598 N CYS A 47 1.485 -7.325 -2.705 1.00 0.00 N ATOM 599 CA CYS A 47 1.134 -5.916 -2.848 1.00 0.00 C ATOM 600 C CYS A 47 2.320 -5.110 -3.367 1.00 0.00 C ATOM 601 O CYS A 47 3.475 -5.419 -3.068 1.00 0.00 O ATOM 602 CB CYS A 47 0.664 -5.348 -1.507 1.00 0.00 C ATOM 603 SG CYS A 47 0.658 -3.541 -1.433 1.00 0.00 S ATOM 0 H CYS A 47 2.255 -7.504 -2.060 1.00 0.00 H new ATOM 0 HA CYS A 47 0.322 -5.841 -3.572 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -0.343 -5.713 -1.303 1.00 0.00 H new ATOM 0 HB3 CYS A 47 1.309 -5.731 -0.716 1.00 0.00 H new ATOM 0 HG CYS A 47 1.862 -3.094 -1.635 1.00 0.00 H new ATOM 609 N THR A 48 2.028 -4.075 -4.149 1.00 0.00 N ATOM 610 CA THR A 48 3.069 -3.226 -4.713 1.00 0.00 C ATOM 611 C THR A 48 2.622 -1.770 -4.768 1.00 0.00 C ATOM 612 O THR A 48 1.784 -1.398 -5.590 1.00 0.00 O ATOM 613 CB THR A 48 3.462 -3.685 -6.130 1.00 0.00 C ATOM 614 OG1 THR A 48 4.076 -4.978 -6.074 1.00 0.00 O ATOM 615 CG2 THR A 48 4.417 -2.692 -6.775 1.00 0.00 C ATOM 0 H THR A 48 1.079 -3.805 -4.406 1.00 0.00 H new ATOM 0 HA THR A 48 3.936 -3.312 -4.058 1.00 0.00 H new ATOM 0 HB THR A 48 2.557 -3.739 -6.734 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.321 -5.263 -6.979 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.680 -3.037 -7.775 1.00 0.00 H new ATOM 0 HG22 THR A 48 3.936 -1.716 -6.843 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.320 -2.610 -6.170 1.00 0.00 H new ATOM 623 N VAL A 49 3.185 -0.949 -3.888 1.00 0.00 N ATOM 624 CA VAL A 49 2.846 0.469 -3.839 1.00 0.00 C ATOM 625 C VAL A 49 3.568 1.246 -4.933 1.00 0.00 C ATOM 626 O VAL A 49 4.799 1.308 -4.956 1.00 0.00 O ATOM 627 CB VAL A 49 3.196 1.082 -2.470 1.00 0.00 C ATOM 628 CG1 VAL A 49 2.753 2.536 -2.408 1.00 0.00 C ATOM 629 CG2 VAL A 49 2.566 0.274 -1.347 1.00 0.00 C ATOM 0 H VAL A 49 3.878 -1.241 -3.199 1.00 0.00 H new ATOM 0 HA VAL A 49 1.770 0.543 -3.997 1.00 0.00 H new ATOM 0 HB VAL A 49 4.278 1.052 -2.343 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.008 2.953 -1.434 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.258 3.104 -3.189 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.675 2.594 -2.556 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.824 0.722 -0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.482 0.269 -1.466 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.939 -0.750 -1.382 1.00 0.00 H new ATOM 639 N LEU A 50 2.797 1.839 -5.838 1.00 0.00 N ATOM 640 CA LEU A 50 3.365 2.614 -6.936 1.00 0.00 C ATOM 641 C LEU A 50 3.122 4.106 -6.731 1.00 0.00 C ATOM 642 O LEU A 50 1.986 4.577 -6.796 1.00 0.00 O ATOM 643 CB LEU A 50 2.760 2.166 -8.268 1.00 0.00 C ATOM 644 CG LEU A 50 3.385 2.770 -9.526 1.00 0.00 C ATOM 645 CD1 LEU A 50 4.834 2.327 -9.667 1.00 0.00 C ATOM 646 CD2 LEU A 50 2.584 2.380 -10.759 1.00 0.00 C ATOM 0 H LEU A 50 1.778 1.798 -5.833 1.00 0.00 H new ATOM 0 HA LEU A 50 4.441 2.438 -6.955 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.838 1.081 -8.333 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.698 2.409 -8.262 1.00 0.00 H new ATOM 0 HG LEU A 50 3.366 3.856 -9.433 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.263 2.766 -10.568 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.402 2.657 -8.797 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.877 1.240 -9.738 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.043 2.819 -11.645 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.572 1.294 -10.856 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.562 2.747 -10.660 1.00 0.00 H new ATOM 658 N THR A 51 4.199 4.847 -6.484 1.00 0.00 N ATOM 659 CA THR A 51 4.103 6.286 -6.271 1.00 0.00 C ATOM 660 C THR A 51 3.979 7.031 -7.595 1.00 0.00 C ATOM 661 O THR A 51 4.483 6.594 -8.630 1.00 0.00 O ATOM 662 CB THR A 51 5.328 6.821 -5.505 1.00 0.00 C ATOM 663 OG1 THR A 51 6.530 6.480 -6.205 1.00 0.00 O ATOM 664 CG2 THR A 51 5.377 6.253 -4.095 1.00 0.00 C ATOM 0 H THR A 51 5.147 4.474 -6.427 1.00 0.00 H new ATOM 0 HA THR A 51 3.206 6.460 -5.676 1.00 0.00 H new ATOM 0 HB THR A 51 5.242 7.906 -5.438 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.688 5.515 -6.134 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.251 6.646 -3.575 1.00 0.00 H new ATOM 0 HG22 THR A 51 4.474 6.540 -3.556 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.441 5.166 -4.143 1.00 0.00 H new ATOM 672 N PRO A 52 3.294 8.184 -7.564 1.00 0.00 N ATOM 673 CA PRO A 52 3.090 9.014 -8.754 1.00 0.00 C ATOM 674 C PRO A 52 4.378 9.679 -9.226 1.00 0.00 C ATOM 675 O PRO A 52 4.389 10.391 -10.230 1.00 0.00 O ATOM 676 CB PRO A 52 2.085 10.069 -8.282 1.00 0.00 C ATOM 677 CG PRO A 52 2.286 10.150 -6.808 1.00 0.00 C ATOM 678 CD PRO A 52 2.668 8.764 -6.365 1.00 0.00 C ATOM 0 HA PRO A 52 2.746 8.427 -9.606 1.00 0.00 H new ATOM 0 HB2 PRO A 52 2.267 11.031 -8.760 1.00 0.00 H new ATOM 0 HB3 PRO A 52 1.063 9.780 -8.527 1.00 0.00 H new ATOM 0 HG2 PRO A 52 3.067 10.868 -6.560 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.376 10.483 -6.308 1.00 0.00 H new ATOM 0 HD2 PRO A 52 3.359 8.787 -5.522 1.00 0.00 H new ATOM 0 HD3 PRO A 52 1.798 8.189 -6.048 1.00 0.00 H new ATOM 686 N ASP A 53 5.462 9.443 -8.494 1.00 0.00 N ATOM 687 CA ASP A 53 6.757 10.018 -8.839 1.00 0.00 C ATOM 688 C ASP A 53 7.447 9.193 -9.922 1.00 0.00 C ATOM 689 O ASP A 53 8.264 9.710 -10.683 1.00 0.00 O ATOM 690 CB ASP A 53 7.648 10.102 -7.599 1.00 0.00 C ATOM 691 CG ASP A 53 8.641 11.245 -7.675 1.00 0.00 C ATOM 692 OD1 ASP A 53 9.019 11.628 -8.801 1.00 0.00 O ATOM 693 OD2 ASP A 53 9.039 11.757 -6.608 1.00 0.00 O ATOM 0 H ASP A 53 5.469 8.858 -7.659 1.00 0.00 H new ATOM 0 HA ASP A 53 6.589 11.023 -9.225 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.023 10.226 -6.714 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.188 9.163 -7.479 1.00 0.00 H new ATOM 698 N GLY A 54 7.114 7.908 -9.982 1.00 0.00 N ATOM 699 CA GLY A 54 7.712 7.033 -10.973 1.00 0.00 C ATOM 700 C GLY A 54 8.698 6.056 -10.365 1.00 0.00 C ATOM 701 O GLY A 54 9.629 5.604 -11.032 1.00 0.00 O ATOM 0 H GLY A 54 6.441 7.457 -9.362 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.926 6.479 -11.486 1.00 0.00 H new ATOM 0 HA3 GLY A 54 8.220 7.636 -11.726 1.00 0.00 H new ATOM 705 N THR A 55 8.496 5.729 -9.092 1.00 0.00 N ATOM 706 CA THR A 55 9.377 4.802 -8.392 1.00 0.00 C ATOM 707 C THR A 55 8.576 3.759 -7.622 1.00 0.00 C ATOM 708 O THR A 55 7.658 4.095 -6.875 1.00 0.00 O ATOM 709 CB THR A 55 10.309 5.542 -7.414 1.00 0.00 C ATOM 710 OG1 THR A 55 9.543 6.403 -6.564 1.00 0.00 O ATOM 711 CG2 THR A 55 11.347 6.359 -8.169 1.00 0.00 C ATOM 0 H THR A 55 7.730 6.092 -8.525 1.00 0.00 H new ATOM 0 HA THR A 55 9.981 4.305 -9.151 1.00 0.00 H new ATOM 0 HB THR A 55 10.826 4.799 -6.807 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.591 6.185 -6.650 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.994 6.873 -7.457 1.00 0.00 H new ATOM 0 HG22 THR A 55 11.948 5.697 -8.793 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.844 7.094 -8.798 1.00 0.00 H new ATOM 719 N GLU A 56 8.930 2.491 -7.808 1.00 0.00 N ATOM 720 CA GLU A 56 8.242 1.399 -7.130 1.00 0.00 C ATOM 721 C GLU A 56 8.756 1.236 -5.702 1.00 0.00 C ATOM 722 O GLU A 56 9.923 0.913 -5.484 1.00 0.00 O ATOM 723 CB GLU A 56 8.430 0.091 -7.902 1.00 0.00 C ATOM 724 CG GLU A 56 7.560 -0.012 -9.144 1.00 0.00 C ATOM 725 CD GLU A 56 8.174 -0.893 -10.215 1.00 0.00 C ATOM 726 OE1 GLU A 56 8.008 -2.128 -10.133 1.00 0.00 O ATOM 727 OE2 GLU A 56 8.821 -0.348 -11.134 1.00 0.00 O ATOM 0 H GLU A 56 9.689 2.195 -8.422 1.00 0.00 H new ATOM 0 HA GLU A 56 7.180 1.641 -7.091 1.00 0.00 H new ATOM 0 HB2 GLU A 56 9.476 -0.003 -8.193 1.00 0.00 H new ATOM 0 HB3 GLU A 56 8.206 -0.747 -7.241 1.00 0.00 H new ATOM 0 HG2 GLU A 56 6.584 -0.410 -8.867 1.00 0.00 H new ATOM 0 HG3 GLU A 56 7.394 0.986 -9.551 1.00 0.00 H new ATOM 734 N ALA A 57 7.874 1.463 -4.733 1.00 0.00 N ATOM 735 CA ALA A 57 8.236 1.342 -3.327 1.00 0.00 C ATOM 736 C ALA A 57 7.926 -0.055 -2.800 1.00 0.00 C ATOM 737 O ALA A 57 7.251 -0.843 -3.462 1.00 0.00 O ATOM 738 CB ALA A 57 7.509 2.392 -2.502 1.00 0.00 C ATOM 0 H ALA A 57 6.904 1.732 -4.897 1.00 0.00 H new ATOM 0 HA ALA A 57 9.310 1.506 -3.238 1.00 0.00 H new ATOM 0 HB1 ALA A 57 7.789 2.289 -1.454 1.00 0.00 H new ATOM 0 HB2 ALA A 57 7.783 3.386 -2.855 1.00 0.00 H new ATOM 0 HB3 ALA A 57 6.433 2.254 -2.605 1.00 0.00 H new ATOM 744 N GLU A 58 8.425 -0.356 -1.604 1.00 0.00 N ATOM 745 CA GLU A 58 8.201 -1.659 -0.990 1.00 0.00 C ATOM 746 C GLU A 58 7.026 -1.608 -0.018 1.00 0.00 C ATOM 747 O GLU A 58 6.784 -0.590 0.627 1.00 0.00 O ATOM 748 CB GLU A 58 9.462 -2.125 -0.258 1.00 0.00 C ATOM 749 CG GLU A 58 9.826 -1.261 0.937 1.00 0.00 C ATOM 750 CD GLU A 58 11.244 -1.500 1.420 1.00 0.00 C ATOM 751 OE1 GLU A 58 12.150 -1.610 0.566 1.00 0.00 O ATOM 752 OE2 GLU A 58 11.448 -1.579 2.649 1.00 0.00 O ATOM 0 H GLU A 58 8.986 0.285 -1.043 1.00 0.00 H new ATOM 0 HA GLU A 58 7.964 -2.370 -1.782 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.319 -3.152 0.077 1.00 0.00 H new ATOM 0 HB3 GLU A 58 10.297 -2.132 -0.959 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.709 -0.211 0.670 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.130 -1.462 1.751 1.00 0.00 H new ATOM 759 N ALA A 59 6.297 -2.715 0.079 1.00 0.00 N ATOM 760 CA ALA A 59 5.148 -2.799 0.971 1.00 0.00 C ATOM 761 C ALA A 59 5.260 -4.002 1.900 1.00 0.00 C ATOM 762 O ALA A 59 5.400 -5.138 1.446 1.00 0.00 O ATOM 763 CB ALA A 59 3.859 -2.870 0.166 1.00 0.00 C ATOM 0 H ALA A 59 6.483 -3.567 -0.450 1.00 0.00 H new ATOM 0 HA ALA A 59 5.131 -1.899 1.586 1.00 0.00 H new ATOM 0 HB1 ALA A 59 3.009 -2.932 0.845 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.766 -1.976 -0.451 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.878 -3.752 -0.474 1.00 0.00 H new ATOM 769 N ASP A 60 5.199 -3.747 3.201 1.00 0.00 N ATOM 770 CA ASP A 60 5.294 -4.810 4.196 1.00 0.00 C ATOM 771 C ASP A 60 4.045 -5.687 4.174 1.00 0.00 C ATOM 772 O ASP A 60 2.922 -5.183 4.154 1.00 0.00 O ATOM 773 CB ASP A 60 5.492 -4.217 5.591 1.00 0.00 C ATOM 774 CG ASP A 60 6.530 -3.112 5.609 1.00 0.00 C ATOM 775 OD1 ASP A 60 6.169 -1.953 5.318 1.00 0.00 O ATOM 776 OD2 ASP A 60 7.704 -3.408 5.916 1.00 0.00 O ATOM 0 H ASP A 60 5.084 -2.812 3.593 1.00 0.00 H new ATOM 0 HA ASP A 60 6.156 -5.430 3.949 1.00 0.00 H new ATOM 0 HB2 ASP A 60 4.542 -3.825 5.954 1.00 0.00 H new ATOM 0 HB3 ASP A 60 5.794 -5.007 6.279 1.00 0.00 H new ATOM 781 N VAL A 61 4.251 -7.000 4.178 1.00 0.00 N ATOM 782 CA VAL A 61 3.142 -7.946 4.159 1.00 0.00 C ATOM 783 C VAL A 61 3.274 -8.969 5.282 1.00 0.00 C ATOM 784 O VAL A 61 4.363 -9.478 5.546 1.00 0.00 O ATOM 785 CB VAL A 61 3.060 -8.688 2.811 1.00 0.00 C ATOM 786 CG1 VAL A 61 1.888 -9.657 2.806 1.00 0.00 C ATOM 787 CG2 VAL A 61 2.947 -7.695 1.664 1.00 0.00 C ATOM 0 H VAL A 61 5.175 -7.432 4.194 1.00 0.00 H new ATOM 0 HA VAL A 61 2.230 -7.367 4.303 1.00 0.00 H new ATOM 0 HB VAL A 61 3.976 -9.263 2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.846 -10.172 1.846 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.017 -10.388 3.605 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.960 -9.107 2.964 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.890 -8.235 0.719 1.00 0.00 H new ATOM 0 HG22 VAL A 61 2.048 -7.092 1.792 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.822 -7.045 1.658 1.00 0.00 H new ATOM 797 N ILE A 62 2.157 -9.266 5.938 1.00 0.00 N ATOM 798 CA ILE A 62 2.148 -10.230 7.032 1.00 0.00 C ATOM 799 C ILE A 62 1.053 -11.272 6.836 1.00 0.00 C ATOM 800 O ILE A 62 -0.136 -10.960 6.914 1.00 0.00 O ATOM 801 CB ILE A 62 1.943 -9.536 8.392 1.00 0.00 C ATOM 802 CG1 ILE A 62 3.038 -8.492 8.626 1.00 0.00 C ATOM 803 CG2 ILE A 62 1.935 -10.563 9.515 1.00 0.00 C ATOM 804 CD1 ILE A 62 2.685 -7.119 8.100 1.00 0.00 C ATOM 0 H ILE A 62 1.247 -8.853 5.731 1.00 0.00 H new ATOM 0 HA ILE A 62 3.120 -10.722 7.027 1.00 0.00 H new ATOM 0 HB ILE A 62 0.978 -9.029 8.383 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.240 -8.422 9.695 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.958 -8.829 8.149 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.789 -10.057 10.470 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.124 -11.273 9.353 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.886 -11.095 9.528 1.00 0.00 H new ATOM 0 HD11 ILE A 62 3.506 -6.430 8.300 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.512 -7.175 7.025 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.782 -6.761 8.595 1.00 0.00 H new ATOM 816 N GLU A 63 1.461 -12.512 6.585 1.00 0.00 N ATOM 817 CA GLU A 63 0.513 -13.601 6.379 1.00 0.00 C ATOM 818 C GLU A 63 -0.040 -14.099 7.711 1.00 0.00 C ATOM 819 O GLU A 63 0.635 -14.039 8.738 1.00 0.00 O ATOM 820 CB GLU A 63 1.183 -14.754 5.629 1.00 0.00 C ATOM 821 CG GLU A 63 2.322 -15.401 6.398 1.00 0.00 C ATOM 822 CD GLU A 63 3.188 -16.285 5.523 1.00 0.00 C ATOM 823 OE1 GLU A 63 2.744 -17.399 5.178 1.00 0.00 O ATOM 824 OE2 GLU A 63 4.314 -15.861 5.184 1.00 0.00 O ATOM 0 H GLU A 63 2.441 -12.787 6.519 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.315 -13.221 5.781 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.434 -15.512 5.401 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.563 -14.384 4.677 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.940 -14.624 6.847 1.00 0.00 H new ATOM 0 HG3 GLU A 63 1.913 -15.995 7.215 1.00 0.00 H new ATOM 831 N ASN A 64 -1.275 -14.591 7.685 1.00 0.00 N ATOM 832 CA ASN A 64 -1.921 -15.098 8.891 1.00 0.00 C ATOM 833 C ASN A 64 -2.326 -16.558 8.716 1.00 0.00 C ATOM 834 O ASN A 64 -2.367 -17.072 7.598 1.00 0.00 O ATOM 835 CB ASN A 64 -3.149 -14.253 9.231 1.00 0.00 C ATOM 836 CG ASN A 64 -2.818 -13.098 10.157 1.00 0.00 C ATOM 837 OD1 ASN A 64 -3.320 -13.025 11.279 1.00 0.00 O ATOM 838 ND2 ASN A 64 -1.971 -12.189 9.689 1.00 0.00 N ATOM 0 H ASN A 64 -1.848 -14.649 6.843 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.207 -15.033 9.712 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -3.585 -13.864 8.311 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -3.904 -14.885 9.699 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -1.712 -11.389 10.266 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.580 -12.291 8.753 1.00 0.00 H new ATOM 845 N GLU A 65 -2.626 -17.221 9.829 1.00 0.00 N ATOM 846 CA GLU A 65 -3.029 -18.622 9.798 1.00 0.00 C ATOM 847 C GLU A 65 -4.391 -18.783 9.129 1.00 0.00 C ATOM 848 O GLU A 65 -4.663 -19.796 8.486 1.00 0.00 O ATOM 849 CB GLU A 65 -3.075 -19.194 11.217 1.00 0.00 C ATOM 850 CG GLU A 65 -3.994 -18.428 12.153 1.00 0.00 C ATOM 851 CD GLU A 65 -4.015 -19.007 13.554 1.00 0.00 C ATOM 852 OE1 GLU A 65 -4.147 -20.242 13.684 1.00 0.00 O ATOM 853 OE2 GLU A 65 -3.900 -18.225 14.520 1.00 0.00 O ATOM 0 H GLU A 65 -2.598 -16.811 10.762 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.290 -19.172 9.215 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.402 -20.233 11.170 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -2.067 -19.195 11.632 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.674 -17.387 12.199 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.006 -18.433 11.747 1.00 0.00 H new ATOM 860 N ASP A 66 -5.243 -17.776 9.288 1.00 0.00 N ATOM 861 CA ASP A 66 -6.577 -17.804 8.700 1.00 0.00 C ATOM 862 C ASP A 66 -6.517 -17.523 7.202 1.00 0.00 C ATOM 863 O ASP A 66 -7.416 -17.900 6.452 1.00 0.00 O ATOM 864 CB ASP A 66 -7.482 -16.780 9.388 1.00 0.00 C ATOM 865 CG ASP A 66 -8.955 -17.065 9.161 1.00 0.00 C ATOM 866 OD1 ASP A 66 -9.502 -17.946 9.857 1.00 0.00 O ATOM 867 OD2 ASP A 66 -9.559 -16.407 8.289 1.00 0.00 O ATOM 0 H ASP A 66 -5.034 -16.931 9.819 1.00 0.00 H new ATOM 0 HA ASP A 66 -6.991 -18.801 8.848 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -7.276 -16.778 10.458 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.246 -15.783 9.016 1.00 0.00 H new ATOM 872 N GLY A 67 -5.450 -16.855 6.772 1.00 0.00 N ATOM 873 CA GLY A 67 -5.292 -16.534 5.366 1.00 0.00 C ATOM 874 C GLY A 67 -5.440 -15.050 5.091 1.00 0.00 C ATOM 875 O GLY A 67 -5.780 -14.648 3.977 1.00 0.00 O ATOM 0 H GLY A 67 -4.692 -16.531 7.373 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.311 -16.867 5.028 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -6.033 -17.084 4.785 1.00 0.00 H new ATOM 879 N THR A 68 -5.186 -14.233 6.108 1.00 0.00 N ATOM 880 CA THR A 68 -5.296 -12.786 5.972 1.00 0.00 C ATOM 881 C THR A 68 -3.919 -12.134 5.907 1.00 0.00 C ATOM 882 O THR A 68 -3.072 -12.364 6.770 1.00 0.00 O ATOM 883 CB THR A 68 -6.089 -12.170 7.139 1.00 0.00 C ATOM 884 OG1 THR A 68 -5.588 -12.664 8.386 1.00 0.00 O ATOM 885 CG2 THR A 68 -7.570 -12.494 7.019 1.00 0.00 C ATOM 0 H THR A 68 -4.903 -14.549 7.035 1.00 0.00 H new ATOM 0 HA THR A 68 -5.830 -12.596 5.041 1.00 0.00 H new ATOM 0 HB THR A 68 -5.966 -11.088 7.101 1.00 0.00 H new ATOM 0 HG1 THR A 68 -6.096 -12.266 9.123 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.109 -12.048 7.855 1.00 0.00 H new ATOM 0 HG22 THR A 68 -7.956 -12.092 6.082 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.708 -13.575 7.034 1.00 0.00 H new ATOM 893 N TYR A 69 -3.703 -11.319 4.880 1.00 0.00 N ATOM 894 CA TYR A 69 -2.428 -10.636 4.702 1.00 0.00 C ATOM 895 C TYR A 69 -2.551 -9.155 5.049 1.00 0.00 C ATOM 896 O TYR A 69 -3.283 -8.411 4.396 1.00 0.00 O ATOM 897 CB TYR A 69 -1.937 -10.794 3.262 1.00 0.00 C ATOM 898 CG TYR A 69 -1.558 -12.214 2.904 1.00 0.00 C ATOM 899 CD1 TYR A 69 -2.460 -13.257 3.068 1.00 0.00 C ATOM 900 CD2 TYR A 69 -0.297 -12.511 2.404 1.00 0.00 C ATOM 901 CE1 TYR A 69 -2.117 -14.555 2.744 1.00 0.00 C ATOM 902 CE2 TYR A 69 0.055 -13.806 2.075 1.00 0.00 C ATOM 903 CZ TYR A 69 -0.860 -14.824 2.247 1.00 0.00 C ATOM 904 OH TYR A 69 -0.514 -16.117 1.922 1.00 0.00 O ATOM 0 H TYR A 69 -4.395 -11.116 4.159 1.00 0.00 H new ATOM 0 HA TYR A 69 -1.704 -11.091 5.378 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -2.717 -10.452 2.581 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -1.074 -10.147 3.108 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -3.447 -13.050 3.456 1.00 0.00 H new ATOM 0 HD2 TYR A 69 0.421 -11.716 2.270 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -2.830 -15.355 2.879 1.00 0.00 H new ATOM 0 HE2 TYR A 69 1.040 -14.020 1.686 1.00 0.00 H new ATOM 0 HH TYR A 69 0.406 -16.135 1.585 1.00 0.00 H new ATOM 914 N ASP A 70 -1.829 -8.735 6.082 1.00 0.00 N ATOM 915 CA ASP A 70 -1.854 -7.343 6.516 1.00 0.00 C ATOM 916 C ASP A 70 -0.753 -6.539 5.832 1.00 0.00 C ATOM 917 O ASP A 70 0.412 -6.937 5.835 1.00 0.00 O ATOM 918 CB ASP A 70 -1.696 -7.257 8.035 1.00 0.00 C ATOM 919 CG ASP A 70 -2.825 -7.948 8.776 1.00 0.00 C ATOM 920 OD1 ASP A 70 -3.021 -9.163 8.558 1.00 0.00 O ATOM 921 OD2 ASP A 70 -3.511 -7.275 9.571 1.00 0.00 O ATOM 0 H ASP A 70 -1.219 -9.338 6.634 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.817 -6.918 6.233 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.746 -7.707 8.324 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.657 -6.210 8.334 1.00 0.00 H new ATOM 926 N ILE A 71 -1.131 -5.409 5.244 1.00 0.00 N ATOM 927 CA ILE A 71 -0.176 -4.550 4.555 1.00 0.00 C ATOM 928 C ILE A 71 -0.315 -3.100 5.006 1.00 0.00 C ATOM 929 O ILE A 71 -1.420 -2.624 5.268 1.00 0.00 O ATOM 930 CB ILE A 71 -0.354 -4.621 3.028 1.00 0.00 C ATOM 931 CG1 ILE A 71 -0.306 -6.074 2.553 1.00 0.00 C ATOM 932 CG2 ILE A 71 0.717 -3.796 2.330 1.00 0.00 C ATOM 933 CD1 ILE A 71 -1.109 -6.327 1.297 1.00 0.00 C ATOM 0 H ILE A 71 -2.092 -5.067 5.231 1.00 0.00 H new ATOM 0 HA ILE A 71 0.818 -4.914 4.813 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.329 -4.207 2.773 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.732 -6.355 2.373 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.678 -6.720 3.348 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.577 -3.857 1.251 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.640 -2.756 2.648 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.702 -4.183 2.591 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.029 -7.378 1.019 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.155 -6.078 1.477 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.723 -5.707 0.487 1.00 0.00 H new ATOM 945 N PHE A 72 0.812 -2.401 5.093 1.00 0.00 N ATOM 946 CA PHE A 72 0.816 -1.004 5.510 1.00 0.00 C ATOM 947 C PHE A 72 1.744 -0.176 4.627 1.00 0.00 C ATOM 948 O PHE A 72 2.732 -0.684 4.097 1.00 0.00 O ATOM 949 CB PHE A 72 1.247 -0.889 6.974 1.00 0.00 C ATOM 950 CG PHE A 72 0.593 -1.899 7.873 1.00 0.00 C ATOM 951 CD1 PHE A 72 0.995 -3.225 7.856 1.00 0.00 C ATOM 952 CD2 PHE A 72 -0.426 -1.523 8.735 1.00 0.00 C ATOM 953 CE1 PHE A 72 0.395 -4.156 8.683 1.00 0.00 C ATOM 954 CE2 PHE A 72 -1.028 -2.451 9.563 1.00 0.00 C ATOM 955 CZ PHE A 72 -0.618 -3.769 9.536 1.00 0.00 C ATOM 0 H PHE A 72 1.735 -2.780 4.880 1.00 0.00 H new ATOM 0 HA PHE A 72 -0.197 -0.616 5.405 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.329 -1.006 7.036 1.00 0.00 H new ATOM 0 HB3 PHE A 72 1.013 0.112 7.336 1.00 0.00 H new ATOM 0 HD1 PHE A 72 1.786 -3.535 7.189 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -0.753 -0.494 8.759 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.719 -5.186 8.661 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.819 -2.145 10.231 1.00 0.00 H new ATOM 0 HZ PHE A 72 -1.089 -4.496 10.181 1.00 0.00 H new ATOM 965 N TYR A 73 1.420 1.104 4.476 1.00 0.00 N ATOM 966 CA TYR A 73 2.222 2.003 3.656 1.00 0.00 C ATOM 967 C TYR A 73 1.911 3.461 3.982 1.00 0.00 C ATOM 968 O TYR A 73 0.816 3.787 4.443 1.00 0.00 O ATOM 969 CB TYR A 73 1.970 1.736 2.172 1.00 0.00 C ATOM 970 CG TYR A 73 0.676 2.330 1.660 1.00 0.00 C ATOM 971 CD1 TYR A 73 0.542 3.702 1.482 1.00 0.00 C ATOM 972 CD2 TYR A 73 -0.410 1.520 1.356 1.00 0.00 C ATOM 973 CE1 TYR A 73 -0.638 4.249 1.017 1.00 0.00 C ATOM 974 CE2 TYR A 73 -1.593 2.058 0.889 1.00 0.00 C ATOM 975 CZ TYR A 73 -1.703 3.423 0.721 1.00 0.00 C ATOM 976 OH TYR A 73 -2.879 3.965 0.256 1.00 0.00 O ATOM 0 H TYR A 73 0.608 1.541 4.911 1.00 0.00 H new ATOM 0 HA TYR A 73 3.273 1.816 3.878 1.00 0.00 H new ATOM 0 HB2 TYR A 73 2.800 2.141 1.593 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.958 0.659 2.002 1.00 0.00 H new ATOM 0 HD1 TYR A 73 1.374 4.351 1.711 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -0.328 0.451 1.487 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.727 5.317 0.886 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -2.428 1.414 0.656 1.00 0.00 H new ATOM 0 HH TYR A 73 -3.488 3.245 -0.011 1.00 0.00 H new ATOM 986 N THR A 74 2.883 4.335 3.740 1.00 0.00 N ATOM 987 CA THR A 74 2.715 5.758 4.007 1.00 0.00 C ATOM 988 C THR A 74 2.796 6.573 2.721 1.00 0.00 C ATOM 989 O THR A 74 3.529 6.222 1.798 1.00 0.00 O ATOM 990 CB THR A 74 3.779 6.273 4.995 1.00 0.00 C ATOM 991 OG1 THR A 74 3.652 5.595 6.249 1.00 0.00 O ATOM 992 CG2 THR A 74 3.638 7.773 5.207 1.00 0.00 C ATOM 0 H THR A 74 3.795 4.082 3.359 1.00 0.00 H new ATOM 0 HA THR A 74 1.727 5.882 4.450 1.00 0.00 H new ATOM 0 HB THR A 74 4.764 6.072 4.573 1.00 0.00 H new ATOM 0 HG1 THR A 74 4.333 5.927 6.871 1.00 0.00 H new ATOM 0 HG21 THR A 74 4.399 8.115 5.908 1.00 0.00 H new ATOM 0 HG22 THR A 74 3.764 8.288 4.255 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.649 7.992 5.610 1.00 0.00 H new ATOM 1000 N ALA A 75 2.036 7.662 2.668 1.00 0.00 N ATOM 1001 CA ALA A 75 2.024 8.528 1.495 1.00 0.00 C ATOM 1002 C ALA A 75 2.829 9.800 1.743 1.00 0.00 C ATOM 1003 O ALA A 75 2.303 10.789 2.252 1.00 0.00 O ATOM 1004 CB ALA A 75 0.593 8.874 1.109 1.00 0.00 C ATOM 0 H ALA A 75 1.421 7.965 3.423 1.00 0.00 H new ATOM 0 HA ALA A 75 2.491 7.988 0.671 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.599 9.521 0.232 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.046 7.959 0.881 1.00 0.00 H new ATOM 0 HB3 ALA A 75 0.107 9.390 1.937 1.00 0.00 H new ATOM 1010 N ALA A 76 4.107 9.765 1.381 1.00 0.00 N ATOM 1011 CA ALA A 76 4.984 10.916 1.563 1.00 0.00 C ATOM 1012 C ALA A 76 4.387 12.167 0.927 1.00 0.00 C ATOM 1013 O ALA A 76 4.346 13.232 1.544 1.00 0.00 O ATOM 1014 CB ALA A 76 6.359 10.628 0.980 1.00 0.00 C ATOM 0 H ALA A 76 4.558 8.953 0.960 1.00 0.00 H new ATOM 0 HA ALA A 76 5.087 11.099 2.633 1.00 0.00 H new ATOM 0 HB1 ALA A 76 7.004 11.495 1.123 1.00 0.00 H new ATOM 0 HB2 ALA A 76 6.795 9.765 1.484 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.266 10.417 -0.085 1.00 0.00 H new ATOM 1020 N LYS A 77 3.927 12.032 -0.313 1.00 0.00 N ATOM 1021 CA LYS A 77 3.332 13.151 -1.035 1.00 0.00 C ATOM 1022 C LYS A 77 2.031 12.731 -1.712 1.00 0.00 C ATOM 1023 O LYS A 77 1.837 11.570 -2.070 1.00 0.00 O ATOM 1024 CB LYS A 77 4.313 13.690 -2.078 1.00 0.00 C ATOM 1025 CG LYS A 77 4.601 12.712 -3.204 1.00 0.00 C ATOM 1026 CD LYS A 77 5.970 12.955 -3.817 1.00 0.00 C ATOM 1027 CE LYS A 77 7.063 12.239 -3.039 1.00 0.00 C ATOM 1028 NZ LYS A 77 7.544 13.049 -1.885 1.00 0.00 N ATOM 0 H LYS A 77 3.955 11.158 -0.839 1.00 0.00 H new ATOM 0 HA LYS A 77 3.108 13.939 -0.316 1.00 0.00 H new ATOM 0 HB2 LYS A 77 3.911 14.610 -2.501 1.00 0.00 H new ATOM 0 HB3 LYS A 77 5.250 13.949 -1.584 1.00 0.00 H new ATOM 0 HG2 LYS A 77 4.547 11.692 -2.824 1.00 0.00 H new ATOM 0 HG3 LYS A 77 3.835 12.806 -3.974 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.973 12.611 -4.851 1.00 0.00 H new ATOM 0 HD3 LYS A 77 6.177 14.025 -3.836 1.00 0.00 H new ATOM 0 HE2 LYS A 77 6.685 11.282 -2.679 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.899 12.022 -3.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 8.560 12.880 -1.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 7.385 14.058 -2.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 7.023 12.775 -1.028 1.00 0.00 H new ATOM 1042 N PRO A 78 1.119 13.699 -1.895 1.00 0.00 N ATOM 1043 CA PRO A 78 -0.177 13.453 -2.532 1.00 0.00 C ATOM 1044 C PRO A 78 -0.044 13.161 -4.023 1.00 0.00 C ATOM 1045 O PRO A 78 1.004 13.401 -4.622 1.00 0.00 O ATOM 1046 CB PRO A 78 -0.935 14.764 -2.309 1.00 0.00 C ATOM 1047 CG PRO A 78 0.129 15.797 -2.160 1.00 0.00 C ATOM 1048 CD PRO A 78 1.285 15.105 -1.494 1.00 0.00 C ATOM 0 HA PRO A 78 -0.677 12.579 -2.115 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -1.591 14.990 -3.150 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.563 14.712 -1.420 1.00 0.00 H new ATOM 0 HG2 PRO A 78 0.421 16.200 -3.130 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -0.223 16.636 -1.559 1.00 0.00 H new ATOM 0 HD2 PRO A 78 2.241 15.508 -1.828 1.00 0.00 H new ATOM 0 HD3 PRO A 78 1.252 15.220 -0.411 1.00 0.00 H new ATOM 1056 N GLY A 79 -1.114 12.642 -4.618 1.00 0.00 N ATOM 1057 CA GLY A 79 -1.096 12.327 -6.035 1.00 0.00 C ATOM 1058 C GLY A 79 -1.956 11.126 -6.372 1.00 0.00 C ATOM 1059 O GLY A 79 -3.004 10.911 -5.763 1.00 0.00 O ATOM 0 H GLY A 79 -1.993 12.434 -4.144 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -1.446 13.191 -6.601 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -0.070 12.135 -6.348 1.00 0.00 H new ATOM 1063 N THR A 80 -1.513 10.337 -7.347 1.00 0.00 N ATOM 1064 CA THR A 80 -2.250 9.152 -7.767 1.00 0.00 C ATOM 1065 C THR A 80 -1.416 7.891 -7.579 1.00 0.00 C ATOM 1066 O THR A 80 -0.564 7.569 -8.407 1.00 0.00 O ATOM 1067 CB THR A 80 -2.682 9.253 -9.242 1.00 0.00 C ATOM 1068 OG1 THR A 80 -3.316 10.515 -9.482 1.00 0.00 O ATOM 1069 CG2 THR A 80 -3.635 8.125 -9.605 1.00 0.00 C ATOM 0 H THR A 80 -0.647 10.498 -7.860 1.00 0.00 H new ATOM 0 HA THR A 80 -3.139 9.093 -7.139 1.00 0.00 H new ATOM 0 HB THR A 80 -1.791 9.170 -9.865 1.00 0.00 H new ATOM 0 HG1 THR A 80 -4.015 10.663 -8.811 1.00 0.00 H new ATOM 0 HG21 THR A 80 -3.926 8.217 -10.651 1.00 0.00 H new ATOM 0 HG22 THR A 80 -3.140 7.166 -9.449 1.00 0.00 H new ATOM 0 HG23 THR A 80 -4.523 8.182 -8.975 1.00 0.00 H new ATOM 1077 N TYR A 81 -1.666 7.180 -6.485 1.00 0.00 N ATOM 1078 CA TYR A 81 -0.937 5.953 -6.187 1.00 0.00 C ATOM 1079 C TYR A 81 -1.641 4.740 -6.790 1.00 0.00 C ATOM 1080 O TYR A 81 -2.870 4.679 -6.833 1.00 0.00 O ATOM 1081 CB TYR A 81 -0.794 5.774 -4.675 1.00 0.00 C ATOM 1082 CG TYR A 81 0.253 6.671 -4.056 1.00 0.00 C ATOM 1083 CD1 TYR A 81 0.206 8.049 -4.229 1.00 0.00 C ATOM 1084 CD2 TYR A 81 1.290 6.141 -3.299 1.00 0.00 C ATOM 1085 CE1 TYR A 81 1.160 8.874 -3.666 1.00 0.00 C ATOM 1086 CE2 TYR A 81 2.249 6.958 -2.730 1.00 0.00 C ATOM 1087 CZ TYR A 81 2.180 8.323 -2.916 1.00 0.00 C ATOM 1088 OH TYR A 81 3.133 9.140 -2.354 1.00 0.00 O ATOM 0 H TYR A 81 -2.368 7.433 -5.790 1.00 0.00 H new ATOM 0 HA TYR A 81 0.055 6.033 -6.632 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.756 5.972 -4.202 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -0.542 4.735 -4.463 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.591 8.483 -4.814 1.00 0.00 H new ATOM 0 HD2 TYR A 81 1.348 5.073 -3.152 1.00 0.00 H new ATOM 0 HE1 TYR A 81 1.108 9.943 -3.811 1.00 0.00 H new ATOM 0 HE2 TYR A 81 3.048 6.530 -2.143 1.00 0.00 H new ATOM 0 HH TYR A 81 2.756 10.033 -2.213 1.00 0.00 H new ATOM 1098 N VAL A 82 -0.852 3.776 -7.254 1.00 0.00 N ATOM 1099 CA VAL A 82 -1.398 2.564 -7.853 1.00 0.00 C ATOM 1100 C VAL A 82 -0.860 1.318 -7.157 1.00 0.00 C ATOM 1101 O VAL A 82 0.317 0.982 -7.286 1.00 0.00 O ATOM 1102 CB VAL A 82 -1.068 2.483 -9.355 1.00 0.00 C ATOM 1103 CG1 VAL A 82 -1.340 1.083 -9.886 1.00 0.00 C ATOM 1104 CG2 VAL A 82 -1.864 3.520 -10.131 1.00 0.00 C ATOM 0 H VAL A 82 0.167 3.811 -7.227 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.480 2.608 -7.729 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.008 2.697 -9.489 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.101 1.044 -10.949 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.722 0.364 -9.349 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.392 0.837 -9.741 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.619 3.449 -11.191 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.930 3.339 -9.992 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.615 4.517 -9.767 1.00 0.00 H new ATOM 1114 N ILE A 83 -1.732 0.636 -6.420 1.00 0.00 N ATOM 1115 CA ILE A 83 -1.346 -0.574 -5.706 1.00 0.00 C ATOM 1116 C ILE A 83 -1.816 -1.823 -6.445 1.00 0.00 C ATOM 1117 O ILE A 83 -3.012 -2.005 -6.677 1.00 0.00 O ATOM 1118 CB ILE A 83 -1.918 -0.591 -4.277 1.00 0.00 C ATOM 1119 CG1 ILE A 83 -1.415 0.621 -3.488 1.00 0.00 C ATOM 1120 CG2 ILE A 83 -1.539 -1.883 -3.570 1.00 0.00 C ATOM 1121 CD1 ILE A 83 -2.272 0.959 -2.289 1.00 0.00 C ATOM 0 H ILE A 83 -2.710 0.902 -6.302 1.00 0.00 H new ATOM 0 HA ILE A 83 -0.257 -0.575 -5.653 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.005 -0.537 -4.336 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.396 0.429 -3.153 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -1.375 1.485 -4.151 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -1.951 -1.880 -2.561 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -1.941 -2.732 -4.123 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.453 -1.965 -3.519 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -1.856 1.827 -1.778 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.287 1.183 -2.618 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.292 0.111 -1.605 1.00 0.00 H new ATOM 1133 N TYR A 84 -0.869 -2.680 -6.809 1.00 0.00 N ATOM 1134 CA TYR A 84 -1.186 -3.912 -7.521 1.00 0.00 C ATOM 1135 C TYR A 84 -1.410 -5.063 -6.546 1.00 0.00 C ATOM 1136 O TYR A 84 -0.617 -5.279 -5.630 1.00 0.00 O ATOM 1137 CB TYR A 84 -0.062 -4.266 -8.497 1.00 0.00 C ATOM 1138 CG TYR A 84 0.091 -3.277 -9.629 1.00 0.00 C ATOM 1139 CD1 TYR A 84 -0.893 -3.149 -10.602 1.00 0.00 C ATOM 1140 CD2 TYR A 84 1.218 -2.471 -9.729 1.00 0.00 C ATOM 1141 CE1 TYR A 84 -0.758 -2.247 -11.641 1.00 0.00 C ATOM 1142 CE2 TYR A 84 1.361 -1.566 -10.762 1.00 0.00 C ATOM 1143 CZ TYR A 84 0.370 -1.458 -11.716 1.00 0.00 C ATOM 1144 OH TYR A 84 0.510 -0.558 -12.747 1.00 0.00 O ATOM 0 H TYR A 84 0.125 -2.544 -6.623 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.107 -3.751 -8.081 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.878 -4.326 -7.949 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.252 -5.255 -8.913 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.778 -3.765 -10.546 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.997 -2.554 -8.985 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -1.532 -2.161 -12.390 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.243 -0.946 -10.823 1.00 0.00 H new ATOM 0 HH TYR A 84 1.361 -0.081 -12.651 1.00 0.00 H new ATOM 1154 N VAL A 85 -2.497 -5.800 -6.751 1.00 0.00 N ATOM 1155 CA VAL A 85 -2.827 -6.931 -5.891 1.00 0.00 C ATOM 1156 C VAL A 85 -3.093 -8.187 -6.714 1.00 0.00 C ATOM 1157 O VAL A 85 -3.819 -8.148 -7.708 1.00 0.00 O ATOM 1158 CB VAL A 85 -4.059 -6.632 -5.018 1.00 0.00 C ATOM 1159 CG1 VAL A 85 -4.183 -7.657 -3.900 1.00 0.00 C ATOM 1160 CG2 VAL A 85 -3.982 -5.221 -4.453 1.00 0.00 C ATOM 0 H VAL A 85 -3.164 -5.634 -7.505 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.966 -7.099 -5.244 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.950 -6.701 -5.642 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.060 -7.429 -3.293 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.288 -8.653 -4.330 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.291 -7.623 -3.275 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.861 -5.027 -3.838 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -3.084 -5.122 -3.843 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.946 -4.503 -5.272 1.00 0.00 H new ATOM 1170 N ARG A 86 -2.501 -9.300 -6.293 1.00 0.00 N ATOM 1171 CA ARG A 86 -2.674 -10.568 -6.992 1.00 0.00 C ATOM 1172 C ARG A 86 -2.825 -11.718 -6.001 1.00 0.00 C ATOM 1173 O ARG A 86 -2.077 -11.815 -5.027 1.00 0.00 O ATOM 1174 CB ARG A 86 -1.486 -10.831 -7.918 1.00 0.00 C ATOM 1175 CG ARG A 86 -1.203 -12.308 -8.142 1.00 0.00 C ATOM 1176 CD ARG A 86 0.058 -12.514 -8.967 1.00 0.00 C ATOM 1177 NE ARG A 86 -0.226 -12.552 -10.400 1.00 0.00 N ATOM 1178 CZ ARG A 86 0.698 -12.779 -11.326 1.00 0.00 C ATOM 1179 NH1 ARG A 86 1.958 -12.988 -10.973 1.00 0.00 N ATOM 1180 NH2 ARG A 86 0.362 -12.797 -12.610 1.00 0.00 N ATOM 0 H ARG A 86 -1.898 -9.349 -5.472 1.00 0.00 H new ATOM 0 HA ARG A 86 -3.583 -10.504 -7.589 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -1.675 -10.356 -8.881 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -0.598 -10.359 -7.498 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.096 -12.809 -7.180 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -2.050 -12.769 -8.649 1.00 0.00 H new ATOM 0 HD2 ARG A 86 0.763 -11.710 -8.758 1.00 0.00 H new ATOM 0 HD3 ARG A 86 0.539 -13.445 -8.668 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.187 -12.396 -10.705 1.00 0.00 H new ATOM 0 HH11 ARG A 86 2.220 -12.975 -9.987 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.665 -13.162 -11.687 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.607 -12.636 -12.886 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.073 -12.971 -13.321 1.00 0.00 H new ATOM 1194 N PHE A 87 -3.797 -12.589 -6.255 1.00 0.00 N ATOM 1195 CA PHE A 87 -4.046 -13.732 -5.385 1.00 0.00 C ATOM 1196 C PHE A 87 -3.787 -15.043 -6.121 1.00 0.00 C ATOM 1197 O PHE A 87 -4.445 -15.350 -7.114 1.00 0.00 O ATOM 1198 CB PHE A 87 -5.486 -13.701 -4.866 1.00 0.00 C ATOM 1199 CG PHE A 87 -5.912 -14.979 -4.202 1.00 0.00 C ATOM 1200 CD1 PHE A 87 -6.393 -16.038 -4.955 1.00 0.00 C ATOM 1201 CD2 PHE A 87 -5.832 -15.120 -2.827 1.00 0.00 C ATOM 1202 CE1 PHE A 87 -6.786 -17.216 -4.346 1.00 0.00 C ATOM 1203 CE2 PHE A 87 -6.222 -16.295 -2.214 1.00 0.00 C ATOM 1204 CZ PHE A 87 -6.701 -17.344 -2.974 1.00 0.00 C ATOM 0 H PHE A 87 -4.425 -12.524 -7.056 1.00 0.00 H new ATOM 0 HA PHE A 87 -3.361 -13.669 -4.540 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.590 -12.880 -4.157 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.159 -13.491 -5.697 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.462 -15.943 -6.029 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -5.461 -14.302 -2.227 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -7.159 -18.035 -4.943 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -6.152 -16.393 -1.141 1.00 0.00 H new ATOM 0 HZ PHE A 87 -7.008 -18.262 -2.496 1.00 0.00 H new ATOM 1214 N GLY A 88 -2.823 -15.812 -5.627 1.00 0.00 N ATOM 1215 CA GLY A 88 -2.493 -17.080 -6.250 1.00 0.00 C ATOM 1216 C GLY A 88 -2.243 -16.947 -7.739 1.00 0.00 C ATOM 1217 O GLY A 88 -2.635 -17.813 -8.521 1.00 0.00 O ATOM 0 H GLY A 88 -2.264 -15.580 -4.806 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.606 -17.496 -5.772 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -3.307 -17.786 -6.083 1.00 0.00 H new ATOM 1221 N GLY A 89 -1.590 -15.859 -8.133 1.00 0.00 N ATOM 1222 CA GLY A 89 -1.302 -15.634 -9.538 1.00 0.00 C ATOM 1223 C GLY A 89 -2.531 -15.219 -10.322 1.00 0.00 C ATOM 1224 O GLY A 89 -2.642 -15.506 -11.515 1.00 0.00 O ATOM 0 H GLY A 89 -1.255 -15.129 -7.505 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.538 -14.862 -9.630 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.889 -16.545 -9.971 1.00 0.00 H new ATOM 1228 N VAL A 90 -3.459 -14.543 -9.653 1.00 0.00 N ATOM 1229 CA VAL A 90 -4.686 -14.088 -10.294 1.00 0.00 C ATOM 1230 C VAL A 90 -5.038 -12.668 -9.865 1.00 0.00 C ATOM 1231 O VAL A 90 -5.500 -12.443 -8.746 1.00 0.00 O ATOM 1232 CB VAL A 90 -5.869 -15.019 -9.967 1.00 0.00 C ATOM 1233 CG1 VAL A 90 -7.158 -14.477 -10.567 1.00 0.00 C ATOM 1234 CG2 VAL A 90 -5.590 -16.429 -10.465 1.00 0.00 C ATOM 0 H VAL A 90 -3.384 -14.298 -8.666 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.505 -14.105 -11.369 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.990 -15.058 -8.884 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.982 -15.148 -10.325 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -7.363 -13.488 -10.156 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -7.054 -14.406 -11.650 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.436 -17.073 -10.226 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.442 -16.411 -11.545 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.692 -16.814 -9.982 1.00 0.00 H new ATOM 1244 N ASP A 91 -4.816 -11.713 -10.762 1.00 0.00 N ATOM 1245 CA ASP A 91 -5.110 -10.314 -10.477 1.00 0.00 C ATOM 1246 C ASP A 91 -6.607 -10.105 -10.264 1.00 0.00 C ATOM 1247 O ASP A 91 -7.405 -10.288 -11.184 1.00 0.00 O ATOM 1248 CB ASP A 91 -4.615 -9.424 -11.618 1.00 0.00 C ATOM 1249 CG ASP A 91 -4.717 -7.948 -11.287 1.00 0.00 C ATOM 1250 OD1 ASP A 91 -3.943 -7.478 -10.427 1.00 0.00 O ATOM 1251 OD2 ASP A 91 -5.570 -7.263 -11.890 1.00 0.00 O ATOM 0 H ASP A 91 -4.434 -11.883 -11.692 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.589 -10.039 -9.560 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.578 -9.672 -11.844 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.196 -9.633 -12.516 1.00 0.00 H new ATOM 1256 N ILE A 92 -6.979 -9.725 -9.047 1.00 0.00 N ATOM 1257 CA ILE A 92 -8.378 -9.492 -8.714 1.00 0.00 C ATOM 1258 C ILE A 92 -8.990 -8.429 -9.621 1.00 0.00 C ATOM 1259 O ILE A 92 -8.294 -7.590 -10.192 1.00 0.00 O ATOM 1260 CB ILE A 92 -8.544 -9.056 -7.246 1.00 0.00 C ATOM 1261 CG1 ILE A 92 -7.432 -8.081 -6.854 1.00 0.00 C ATOM 1262 CG2 ILE A 92 -8.540 -10.270 -6.330 1.00 0.00 C ATOM 1263 CD1 ILE A 92 -7.745 -7.276 -5.612 1.00 0.00 C ATOM 0 H ILE A 92 -6.330 -9.572 -8.275 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.899 -10.438 -8.864 1.00 0.00 H new ATOM 0 HB ILE A 92 -9.502 -8.548 -7.138 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -6.510 -8.640 -6.692 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -7.249 -7.398 -7.684 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.658 -9.946 -5.296 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -9.363 -10.932 -6.599 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.596 -10.804 -6.437 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.913 -6.606 -5.393 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.649 -6.690 -5.777 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.898 -7.951 -4.770 1.00 0.00 H new ATOM 1275 N PRO A 93 -10.324 -8.463 -9.756 1.00 0.00 N ATOM 1276 CA PRO A 93 -11.060 -7.508 -10.590 1.00 0.00 C ATOM 1277 C PRO A 93 -11.056 -6.102 -10.000 1.00 0.00 C ATOM 1278 O PRO A 93 -11.677 -5.189 -10.545 1.00 0.00 O ATOM 1279 CB PRO A 93 -12.480 -8.076 -10.611 1.00 0.00 C ATOM 1280 CG PRO A 93 -12.589 -8.872 -9.357 1.00 0.00 C ATOM 1281 CD PRO A 93 -11.217 -9.436 -9.105 1.00 0.00 C ATOM 0 HA PRO A 93 -10.615 -7.402 -11.579 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -13.224 -7.280 -10.640 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.644 -8.699 -11.490 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -12.913 -8.247 -8.525 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.325 -9.669 -9.463 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -11.008 -9.523 -8.039 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -11.107 -10.432 -9.534 1.00 0.00 H new ATOM 1289 N ASN A 94 -10.353 -5.933 -8.886 1.00 0.00 N ATOM 1290 CA ASN A 94 -10.269 -4.637 -8.223 1.00 0.00 C ATOM 1291 C ASN A 94 -8.901 -3.999 -8.445 1.00 0.00 C ATOM 1292 O ASN A 94 -8.654 -2.871 -8.021 1.00 0.00 O ATOM 1293 CB ASN A 94 -10.535 -4.789 -6.723 1.00 0.00 C ATOM 1294 CG ASN A 94 -12.016 -4.807 -6.398 1.00 0.00 C ATOM 1295 OD1 ASN A 94 -12.697 -3.786 -6.500 1.00 0.00 O ATOM 1296 ND2 ASN A 94 -12.521 -5.970 -6.003 1.00 0.00 N ATOM 0 H ASN A 94 -9.833 -6.678 -8.423 1.00 0.00 H new ATOM 0 HA ASN A 94 -11.029 -3.986 -8.656 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -10.076 -5.711 -6.367 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -10.058 -3.968 -6.187 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.511 -6.043 -5.770 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -11.919 -6.790 -5.933 1.00 0.00 H new ATOM 1303 N SER A 95 -8.015 -4.730 -9.115 1.00 0.00 N ATOM 1304 CA SER A 95 -6.671 -4.237 -9.393 1.00 0.00 C ATOM 1305 C SER A 95 -6.576 -3.687 -10.813 1.00 0.00 C ATOM 1306 O SER A 95 -7.175 -4.214 -11.751 1.00 0.00 O ATOM 1307 CB SER A 95 -5.645 -5.356 -9.197 1.00 0.00 C ATOM 1308 OG SER A 95 -4.401 -4.835 -8.764 1.00 0.00 O ATOM 0 H SER A 95 -8.204 -5.665 -9.475 1.00 0.00 H new ATOM 0 HA SER A 95 -6.455 -3.428 -8.695 1.00 0.00 H new ATOM 0 HB2 SER A 95 -6.018 -6.072 -8.465 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.510 -5.898 -10.133 1.00 0.00 H new ATOM 0 HG SER A 95 -3.858 -4.595 -9.544 1.00 0.00 H new ATOM 1314 N PRO A 96 -5.807 -2.601 -10.975 1.00 0.00 N ATOM 1315 CA PRO A 96 -5.090 -1.965 -9.865 1.00 0.00 C ATOM 1316 C PRO A 96 -6.033 -1.271 -8.889 1.00 0.00 C ATOM 1317 O PRO A 96 -7.248 -1.250 -9.091 1.00 0.00 O ATOM 1318 CB PRO A 96 -4.193 -0.940 -10.563 1.00 0.00 C ATOM 1319 CG PRO A 96 -4.890 -0.636 -11.844 1.00 0.00 C ATOM 1320 CD PRO A 96 -5.576 -1.909 -12.254 1.00 0.00 C ATOM 0 HA PRO A 96 -4.542 -2.691 -9.264 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.071 -0.043 -9.956 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.196 -1.343 -10.741 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.611 0.171 -11.714 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.182 -0.311 -12.606 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.511 -1.711 -12.778 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -4.954 -2.502 -12.925 1.00 0.00 H new ATOM 1328 N PHE A 97 -5.467 -0.703 -7.829 1.00 0.00 N ATOM 1329 CA PHE A 97 -6.258 -0.008 -6.820 1.00 0.00 C ATOM 1330 C PHE A 97 -6.019 1.499 -6.885 1.00 0.00 C ATOM 1331 O PHE A 97 -5.019 2.003 -6.375 1.00 0.00 O ATOM 1332 CB PHE A 97 -5.915 -0.530 -5.423 1.00 0.00 C ATOM 1333 CG PHE A 97 -6.573 -1.840 -5.095 1.00 0.00 C ATOM 1334 CD1 PHE A 97 -6.303 -2.973 -5.846 1.00 0.00 C ATOM 1335 CD2 PHE A 97 -7.461 -1.938 -4.037 1.00 0.00 C ATOM 1336 CE1 PHE A 97 -6.907 -4.180 -5.546 1.00 0.00 C ATOM 1337 CE2 PHE A 97 -8.068 -3.142 -3.732 1.00 0.00 C ATOM 1338 CZ PHE A 97 -7.791 -4.265 -4.489 1.00 0.00 C ATOM 0 H PHE A 97 -4.463 -0.710 -7.647 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.311 -0.201 -7.024 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -4.834 -0.645 -5.342 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -6.213 0.213 -4.683 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -5.613 -2.912 -6.675 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -7.682 -1.063 -3.443 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -6.687 -5.056 -6.138 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -8.758 -3.205 -2.903 1.00 0.00 H new ATOM 0 HZ PHE A 97 -8.265 -5.207 -4.254 1.00 0.00 H new ATOM 1348 N THR A 98 -6.946 2.212 -7.517 1.00 0.00 N ATOM 1349 CA THR A 98 -6.837 3.659 -7.651 1.00 0.00 C ATOM 1350 C THR A 98 -6.926 4.345 -6.293 1.00 0.00 C ATOM 1351 O THR A 98 -8.008 4.469 -5.719 1.00 0.00 O ATOM 1352 CB THR A 98 -7.936 4.223 -8.572 1.00 0.00 C ATOM 1353 OG1 THR A 98 -7.888 3.572 -9.847 1.00 0.00 O ATOM 1354 CG2 THR A 98 -7.771 5.724 -8.755 1.00 0.00 C ATOM 0 H THR A 98 -7.781 1.811 -7.944 1.00 0.00 H new ATOM 0 HA THR A 98 -5.862 3.863 -8.095 1.00 0.00 H new ATOM 0 HB THR A 98 -8.903 4.035 -8.105 1.00 0.00 H new ATOM 0 HG1 THR A 98 -8.591 3.935 -10.426 1.00 0.00 H new ATOM 0 HG21 THR A 98 -8.558 6.100 -9.409 1.00 0.00 H new ATOM 0 HG22 THR A 98 -7.838 6.218 -7.786 1.00 0.00 H new ATOM 0 HG23 THR A 98 -6.799 5.931 -9.202 1.00 0.00 H new ATOM 1362 N VAL A 99 -5.782 4.790 -5.783 1.00 0.00 N ATOM 1363 CA VAL A 99 -5.732 5.465 -4.493 1.00 0.00 C ATOM 1364 C VAL A 99 -5.262 6.908 -4.645 1.00 0.00 C ATOM 1365 O VAL A 99 -4.157 7.163 -5.124 1.00 0.00 O ATOM 1366 CB VAL A 99 -4.797 4.733 -3.511 1.00 0.00 C ATOM 1367 CG1 VAL A 99 -4.716 5.483 -2.190 1.00 0.00 C ATOM 1368 CG2 VAL A 99 -5.269 3.304 -3.294 1.00 0.00 C ATOM 0 H VAL A 99 -4.877 4.695 -6.244 1.00 0.00 H new ATOM 0 HA VAL A 99 -6.746 5.456 -4.093 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.797 4.700 -3.944 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -4.051 4.951 -1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -4.329 6.487 -2.365 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -5.710 5.550 -1.748 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -4.598 2.801 -2.598 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.278 3.313 -2.883 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.270 2.773 -4.246 1.00 0.00 H new ATOM 1378 N MET A 100 -6.106 7.848 -4.234 1.00 0.00 N ATOM 1379 CA MET A 100 -5.776 9.265 -4.323 1.00 0.00 C ATOM 1380 C MET A 100 -5.381 9.818 -2.958 1.00 0.00 C ATOM 1381 O MET A 100 -6.177 9.807 -2.020 1.00 0.00 O ATOM 1382 CB MET A 100 -6.962 10.053 -4.882 1.00 0.00 C ATOM 1383 CG MET A 100 -6.585 11.430 -5.406 1.00 0.00 C ATOM 1384 SD MET A 100 -6.011 11.389 -7.116 1.00 0.00 S ATOM 1385 CE MET A 100 -5.052 12.899 -7.186 1.00 0.00 C ATOM 0 H MET A 100 -7.025 7.654 -3.836 1.00 0.00 H new ATOM 0 HA MET A 100 -4.927 9.373 -4.998 1.00 0.00 H new ATOM 0 HB2 MET A 100 -7.421 9.480 -5.688 1.00 0.00 H new ATOM 0 HB3 MET A 100 -7.714 10.164 -4.101 1.00 0.00 H new ATOM 0 HG2 MET A 100 -7.448 12.091 -5.332 1.00 0.00 H new ATOM 0 HG3 MET A 100 -5.804 11.854 -4.775 1.00 0.00 H new ATOM 0 HE1 MET A 100 -4.408 12.880 -8.065 1.00 0.00 H new ATOM 0 HE2 MET A 100 -5.725 13.755 -7.247 1.00 0.00 H new ATOM 0 HE3 MET A 100 -4.439 12.983 -6.289 1.00 0.00 H new ATOM 1395 N ALA A 101 -4.147 10.301 -2.854 1.00 0.00 N ATOM 1396 CA ALA A 101 -3.648 10.859 -1.604 1.00 0.00 C ATOM 1397 C ALA A 101 -4.011 12.336 -1.479 1.00 0.00 C ATOM 1398 O ALA A 101 -3.736 13.132 -2.378 1.00 0.00 O ATOM 1399 CB ALA A 101 -2.141 10.674 -1.508 1.00 0.00 C ATOM 0 H ALA A 101 -3.475 10.317 -3.621 1.00 0.00 H new ATOM 0 HA ALA A 101 -4.122 10.324 -0.781 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.782 11.096 -0.569 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -1.902 9.611 -1.544 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.658 11.183 -2.342 1.00 0.00 H new ATOM 1405 N THR A 102 -4.630 12.696 -0.359 1.00 0.00 N ATOM 1406 CA THR A 102 -5.031 14.076 -0.118 1.00 0.00 C ATOM 1407 C THR A 102 -4.403 14.615 1.162 1.00 0.00 C ATOM 1408 O THR A 102 -4.133 13.862 2.098 1.00 0.00 O ATOM 1409 CB THR A 102 -6.563 14.206 -0.018 1.00 0.00 C ATOM 1410 OG1 THR A 102 -7.068 13.301 0.969 1.00 0.00 O ATOM 1411 CG2 THR A 102 -7.218 13.916 -1.360 1.00 0.00 C ATOM 0 H THR A 102 -4.864 12.051 0.395 1.00 0.00 H new ATOM 0 HA THR A 102 -4.678 14.661 -0.967 1.00 0.00 H new ATOM 0 HB THR A 102 -6.801 15.229 0.272 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.042 13.391 1.027 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.300 14.014 -1.266 1.00 0.00 H new ATOM 0 HG22 THR A 102 -6.853 14.625 -2.104 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.971 12.902 -1.674 1.00 0.00 H new ATOM 1419 N ASP A 103 -4.173 15.923 1.197 1.00 0.00 N ATOM 1420 CA ASP A 103 -3.578 16.564 2.364 1.00 0.00 C ATOM 1421 C ASP A 103 -4.544 16.549 3.545 1.00 0.00 C ATOM 1422 O ASP A 103 -4.131 16.652 4.699 1.00 0.00 O ATOM 1423 CB ASP A 103 -3.179 18.003 2.034 1.00 0.00 C ATOM 1424 CG ASP A 103 -2.236 18.085 0.849 1.00 0.00 C ATOM 1425 OD1 ASP A 103 -1.027 17.838 1.036 1.00 0.00 O ATOM 1426 OD2 ASP A 103 -2.709 18.397 -0.264 1.00 0.00 O ATOM 0 H ASP A 103 -4.390 16.560 0.431 1.00 0.00 H new ATOM 0 HA ASP A 103 -2.686 16.002 2.641 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -4.075 18.586 1.822 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -2.704 18.454 2.905 1.00 0.00 H new ATOM 1431 N GLY A 104 -5.834 16.421 3.246 1.00 0.00 N ATOM 1432 CA GLY A 104 -6.838 16.396 4.292 1.00 0.00 C ATOM 1433 C GLY A 104 -6.741 17.592 5.218 1.00 0.00 C ATOM 1434 O GLY A 104 -6.983 18.726 4.805 1.00 0.00 O ATOM 0 H GLY A 104 -6.200 16.334 2.298 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.829 16.371 3.839 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.730 15.480 4.874 1.00 0.00 H new ATOM 1438 N GLU A 105 -6.387 17.338 6.474 1.00 0.00 N ATOM 1439 CA GLU A 105 -6.261 18.404 7.462 1.00 0.00 C ATOM 1440 C GLU A 105 -5.173 19.394 7.057 1.00 0.00 C ATOM 1441 O GLU A 105 -4.342 19.104 6.196 1.00 0.00 O ATOM 1442 CB GLU A 105 -5.946 17.818 8.840 1.00 0.00 C ATOM 1443 CG GLU A 105 -7.107 17.056 9.456 1.00 0.00 C ATOM 1444 CD GLU A 105 -6.776 16.499 10.828 1.00 0.00 C ATOM 1445 OE1 GLU A 105 -6.000 15.524 10.901 1.00 0.00 O ATOM 1446 OE2 GLU A 105 -7.292 17.040 11.828 1.00 0.00 O ATOM 0 H GLU A 105 -6.183 16.405 6.831 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.212 18.935 7.510 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.089 17.150 8.754 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -5.655 18.626 9.511 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.970 17.717 9.535 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.392 16.238 8.795 1.00 0.00 H new ATOM 1453 N VAL A 106 -5.184 20.567 7.684 1.00 0.00 N ATOM 1454 CA VAL A 106 -4.200 21.600 7.391 1.00 0.00 C ATOM 1455 C VAL A 106 -2.812 21.188 7.869 1.00 0.00 C ATOM 1456 O VAL A 106 -2.669 20.509 8.886 1.00 0.00 O ATOM 1457 CB VAL A 106 -4.580 22.941 8.047 1.00 0.00 C ATOM 1458 CG1 VAL A 106 -4.626 22.800 9.562 1.00 0.00 C ATOM 1459 CG2 VAL A 106 -3.604 24.032 7.635 1.00 0.00 C ATOM 0 H VAL A 106 -5.865 20.824 8.399 1.00 0.00 H new ATOM 0 HA VAL A 106 -4.186 21.725 6.308 1.00 0.00 H new ATOM 0 HB VAL A 106 -5.574 23.226 7.701 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -4.896 23.757 10.008 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -5.368 22.050 9.835 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -3.647 22.492 9.929 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -3.888 24.972 8.108 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -2.597 23.757 7.950 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -3.626 24.150 6.552 1.00 0.00 H new ATOM 1469 N THR A 107 -1.789 21.604 7.128 1.00 0.00 N ATOM 1470 CA THR A 107 -0.411 21.279 7.476 1.00 0.00 C ATOM 1471 C THR A 107 0.351 22.521 7.922 1.00 0.00 C ATOM 1472 O THR A 107 0.017 23.639 7.532 1.00 0.00 O ATOM 1473 CB THR A 107 0.330 20.634 6.289 1.00 0.00 C ATOM 1474 OG1 THR A 107 1.649 20.245 6.690 1.00 0.00 O ATOM 1475 CG2 THR A 107 0.413 21.596 5.115 1.00 0.00 C ATOM 0 H THR A 107 -1.889 22.167 6.283 1.00 0.00 H new ATOM 0 HA THR A 107 -0.452 20.567 8.300 1.00 0.00 H new ATOM 0 HB THR A 107 -0.229 19.753 5.975 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.114 19.834 5.931 1.00 0.00 H new ATOM 0 HG21 THR A 107 0.940 21.118 4.289 1.00 0.00 H new ATOM 0 HG22 THR A 107 -0.593 21.867 4.795 1.00 0.00 H new ATOM 0 HG23 THR A 107 0.951 22.494 5.418 1.00 0.00 H new ATOM 1483 N ALA A 108 1.378 22.317 8.740 1.00 0.00 N ATOM 1484 CA ALA A 108 2.192 23.421 9.237 1.00 0.00 C ATOM 1485 C ALA A 108 3.678 23.093 9.147 1.00 0.00 C ATOM 1486 O ALA A 108 4.189 22.269 9.904 1.00 0.00 O ATOM 1487 CB ALA A 108 1.808 23.755 10.672 1.00 0.00 C ATOM 0 H ALA A 108 1.667 21.397 9.073 1.00 0.00 H new ATOM 0 HA ALA A 108 2.002 24.291 8.609 1.00 0.00 H new ATOM 0 HB1 ALA A 108 2.423 24.580 11.031 1.00 0.00 H new ATOM 0 HB2 ALA A 108 0.757 24.042 10.710 1.00 0.00 H new ATOM 0 HB3 ALA A 108 1.968 22.882 11.304 1.00 0.00 H new ATOM 1493 N VAL A 109 4.366 23.743 8.214 1.00 0.00 N ATOM 1494 CA VAL A 109 5.795 23.520 8.024 1.00 0.00 C ATOM 1495 C VAL A 109 6.569 24.831 8.091 1.00 0.00 C ATOM 1496 O VAL A 109 6.199 25.815 7.452 1.00 0.00 O ATOM 1497 CB VAL A 109 6.082 22.835 6.675 1.00 0.00 C ATOM 1498 CG1 VAL A 109 5.569 21.403 6.682 1.00 0.00 C ATOM 1499 CG2 VAL A 109 5.461 23.627 5.534 1.00 0.00 C ATOM 0 H VAL A 109 3.958 24.428 7.578 1.00 0.00 H new ATOM 0 HA VAL A 109 6.123 22.866 8.832 1.00 0.00 H new ATOM 0 HB VAL A 109 7.161 22.807 6.524 1.00 0.00 H new ATOM 0 HG11 VAL A 109 5.781 20.936 5.720 1.00 0.00 H new ATOM 0 HG12 VAL A 109 6.065 20.843 7.475 1.00 0.00 H new ATOM 0 HG13 VAL A 109 4.493 21.403 6.856 1.00 0.00 H new ATOM 0 HG21 VAL A 109 5.673 23.129 4.588 1.00 0.00 H new ATOM 0 HG22 VAL A 109 4.382 23.688 5.678 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.882 24.632 5.518 1.00 0.00 H new ATOM 1509 N GLU A 110 7.647 24.837 8.871 1.00 0.00 N ATOM 1510 CA GLU A 110 8.472 26.029 9.022 1.00 0.00 C ATOM 1511 C GLU A 110 9.813 25.683 9.663 1.00 0.00 C ATOM 1512 O GLU A 110 9.875 24.907 10.616 1.00 0.00 O ATOM 1513 CB GLU A 110 7.746 27.078 9.867 1.00 0.00 C ATOM 1514 CG GLU A 110 8.223 28.498 9.616 1.00 0.00 C ATOM 1515 CD GLU A 110 9.445 28.857 10.439 1.00 0.00 C ATOM 1516 OE1 GLU A 110 9.624 28.262 11.523 1.00 0.00 O ATOM 1517 OE2 GLU A 110 10.221 29.732 10.000 1.00 0.00 O ATOM 0 H GLU A 110 7.968 24.031 9.407 1.00 0.00 H new ATOM 0 HA GLU A 110 8.657 26.439 8.029 1.00 0.00 H new ATOM 0 HB2 GLU A 110 6.677 27.021 9.662 1.00 0.00 H new ATOM 0 HB3 GLU A 110 7.881 26.839 10.922 1.00 0.00 H new ATOM 0 HG2 GLU A 110 8.454 28.618 8.558 1.00 0.00 H new ATOM 0 HG3 GLU A 110 7.417 29.194 9.847 1.00 0.00 H new ATOM 1524 N GLU A 111 10.885 26.266 9.132 1.00 0.00 N ATOM 1525 CA GLU A 111 12.224 26.019 9.653 1.00 0.00 C ATOM 1526 C GLU A 111 13.127 27.227 9.426 1.00 0.00 C ATOM 1527 O GLU A 111 13.119 27.829 8.354 1.00 0.00 O ATOM 1528 CB GLU A 111 12.833 24.782 8.989 1.00 0.00 C ATOM 1529 CG GLU A 111 14.217 24.431 9.509 1.00 0.00 C ATOM 1530 CD GLU A 111 14.904 23.373 8.667 1.00 0.00 C ATOM 1531 OE1 GLU A 111 15.474 23.730 7.615 1.00 0.00 O ATOM 1532 OE2 GLU A 111 14.872 22.188 9.061 1.00 0.00 O ATOM 0 H GLU A 111 10.851 26.911 8.343 1.00 0.00 H new ATOM 0 HA GLU A 111 12.142 25.844 10.726 1.00 0.00 H new ATOM 0 HB2 GLU A 111 12.169 23.932 9.146 1.00 0.00 H new ATOM 0 HB3 GLU A 111 12.890 24.948 7.913 1.00 0.00 H new ATOM 0 HG2 GLU A 111 14.833 25.330 9.529 1.00 0.00 H new ATOM 0 HG3 GLU A 111 14.136 24.077 10.537 1.00 0.00 H new ATOM 1539 N ALA A 112 13.905 27.577 10.446 1.00 0.00 N ATOM 1540 CA ALA A 112 14.815 28.712 10.359 1.00 0.00 C ATOM 1541 C ALA A 112 16.265 28.248 10.288 1.00 0.00 C ATOM 1542 O ALA A 112 16.941 28.089 11.305 1.00 0.00 O ATOM 1543 CB ALA A 112 14.613 29.643 11.546 1.00 0.00 C ATOM 0 H ALA A 112 13.923 27.090 11.342 1.00 0.00 H new ATOM 0 HA ALA A 112 14.590 29.257 9.442 1.00 0.00 H new ATOM 0 HB1 ALA A 112 15.299 30.486 11.468 1.00 0.00 H new ATOM 0 HB2 ALA A 112 13.587 30.010 11.550 1.00 0.00 H new ATOM 0 HB3 ALA A 112 14.808 29.101 12.471 1.00 0.00 H new ATOM 1549 N PRO A 113 16.758 28.027 9.060 1.00 0.00 N ATOM 1550 CA PRO A 113 18.134 27.578 8.828 1.00 0.00 C ATOM 1551 C PRO A 113 19.158 28.661 9.150 1.00 0.00 C ATOM 1552 O PRO A 113 19.140 29.742 8.561 1.00 0.00 O ATOM 1553 CB PRO A 113 18.153 27.251 7.333 1.00 0.00 C ATOM 1554 CG PRO A 113 17.074 28.095 6.747 1.00 0.00 C ATOM 1555 CD PRO A 113 16.009 28.198 7.804 1.00 0.00 C ATOM 0 HA PRO A 113 18.401 26.735 9.466 1.00 0.00 H new ATOM 0 HB2 PRO A 113 19.121 27.482 6.889 1.00 0.00 H new ATOM 0 HB3 PRO A 113 17.967 26.192 7.157 1.00 0.00 H new ATOM 0 HG2 PRO A 113 17.453 29.081 6.477 1.00 0.00 H new ATOM 0 HG3 PRO A 113 16.678 27.645 5.836 1.00 0.00 H new ATOM 0 HD2 PRO A 113 15.499 29.161 7.768 1.00 0.00 H new ATOM 0 HD3 PRO A 113 15.247 27.429 7.683 1.00 0.00 H new ATOM 1563 N VAL A 114 20.053 28.362 10.087 1.00 0.00 N ATOM 1564 CA VAL A 114 21.087 29.310 10.486 1.00 0.00 C ATOM 1565 C VAL A 114 22.401 28.596 10.784 1.00 0.00 C ATOM 1566 O VAL A 114 22.438 27.642 11.561 1.00 0.00 O ATOM 1567 CB VAL A 114 20.660 30.116 11.727 1.00 0.00 C ATOM 1568 CG1 VAL A 114 19.673 31.208 11.341 1.00 0.00 C ATOM 1569 CG2 VAL A 114 20.065 29.196 12.781 1.00 0.00 C ATOM 0 H VAL A 114 20.083 27.471 10.583 1.00 0.00 H new ATOM 0 HA VAL A 114 21.230 29.994 9.649 1.00 0.00 H new ATOM 0 HB VAL A 114 21.544 30.592 12.151 1.00 0.00 H new ATOM 0 HG11 VAL A 114 19.383 31.767 12.231 1.00 0.00 H new ATOM 0 HG12 VAL A 114 20.140 31.884 10.624 1.00 0.00 H new ATOM 0 HG13 VAL A 114 18.789 30.757 10.891 1.00 0.00 H new ATOM 0 HG21 VAL A 114 19.769 29.783 13.651 1.00 0.00 H new ATOM 0 HG22 VAL A 114 19.192 28.689 12.371 1.00 0.00 H new ATOM 0 HG23 VAL A 114 20.807 28.455 13.079 1.00 0.00 H new ATOM 1579 N ASN A 115 23.477 29.065 10.162 1.00 0.00 N ATOM 1580 CA ASN A 115 24.794 28.472 10.361 1.00 0.00 C ATOM 1581 C ASN A 115 25.895 29.419 9.892 1.00 0.00 C ATOM 1582 O ASN A 115 25.646 30.337 9.111 1.00 0.00 O ATOM 1583 CB ASN A 115 24.896 27.142 9.610 1.00 0.00 C ATOM 1584 CG ASN A 115 24.040 26.058 10.236 1.00 0.00 C ATOM 1585 OD1 ASN A 115 22.892 25.852 9.842 1.00 0.00 O ATOM 1586 ND2 ASN A 115 24.597 25.358 11.218 1.00 0.00 N ATOM 0 H ASN A 115 23.463 29.854 9.516 1.00 0.00 H new ATOM 0 HA ASN A 115 24.926 28.291 11.428 1.00 0.00 H new ATOM 0 HB2 ASN A 115 24.591 27.289 8.574 1.00 0.00 H new ATOM 0 HB3 ASN A 115 25.936 26.816 9.594 1.00 0.00 H new ATOM 0 HD21 ASN A 115 24.070 24.615 11.678 1.00 0.00 H new ATOM 0 HD22 ASN A 115 25.552 25.563 11.512 1.00 0.00 H new ATOM 1593 N ALA A 116 27.112 29.188 10.373 1.00 0.00 N ATOM 1594 CA ALA A 116 28.250 30.019 10.001 1.00 0.00 C ATOM 1595 C ALA A 116 29.457 29.162 9.630 1.00 0.00 C ATOM 1596 O ALA A 116 29.679 28.101 10.213 1.00 0.00 O ATOM 1597 CB ALA A 116 28.604 30.968 11.136 1.00 0.00 C ATOM 0 H ALA A 116 27.335 28.432 11.021 1.00 0.00 H new ATOM 0 HA ALA A 116 27.970 30.605 9.126 1.00 0.00 H new ATOM 0 HB1 ALA A 116 29.456 31.582 10.844 1.00 0.00 H new ATOM 0 HB2 ALA A 116 27.750 31.610 11.353 1.00 0.00 H new ATOM 0 HB3 ALA A 116 28.860 30.392 12.025 1.00 0.00 H new ATOM 1603 N CYS A 117 30.229 29.629 8.656 1.00 0.00 N ATOM 1604 CA CYS A 117 31.413 28.905 8.205 1.00 0.00 C ATOM 1605 C CYS A 117 32.640 29.810 8.213 1.00 0.00 C ATOM 1606 O CYS A 117 33.003 30.413 7.203 1.00 0.00 O ATOM 1607 CB CYS A 117 31.188 28.341 6.802 1.00 0.00 C ATOM 1608 SG CYS A 117 32.521 27.271 6.213 1.00 0.00 S ATOM 0 H CYS A 117 30.057 30.505 8.163 1.00 0.00 H new ATOM 0 HA CYS A 117 31.589 28.080 8.896 1.00 0.00 H new ATOM 0 HB2 CYS A 117 30.255 27.778 6.794 1.00 0.00 H new ATOM 0 HB3 CYS A 117 31.067 29.170 6.104 1.00 0.00 H new ATOM 0 HG CYS A 117 32.238 26.842 5.019 1.00 0.00 H new ATOM 1614 N PRO A 118 33.296 29.910 9.379 1.00 0.00 N ATOM 1615 CA PRO A 118 34.491 30.741 9.546 1.00 0.00 C ATOM 1616 C PRO A 118 35.698 30.176 8.804 1.00 0.00 C ATOM 1617 O PRO A 118 35.633 29.089 8.229 1.00 0.00 O ATOM 1618 CB PRO A 118 34.733 30.715 11.057 1.00 0.00 C ATOM 1619 CG PRO A 118 34.106 29.445 11.519 1.00 0.00 C ATOM 1620 CD PRO A 118 32.919 29.219 10.624 1.00 0.00 C ATOM 0 HA PRO A 118 34.351 31.743 9.140 1.00 0.00 H new ATOM 0 HB2 PRO A 118 35.798 30.738 11.288 1.00 0.00 H new ATOM 0 HB3 PRO A 118 34.283 31.579 11.545 1.00 0.00 H new ATOM 0 HG2 PRO A 118 34.810 28.615 11.451 1.00 0.00 H new ATOM 0 HG3 PRO A 118 33.800 29.518 12.562 1.00 0.00 H new ATOM 0 HD2 PRO A 118 32.739 28.157 10.456 1.00 0.00 H new ATOM 0 HD3 PRO A 118 32.007 29.633 11.053 1.00 0.00 H new ATOM 1628 N SER A 119 36.799 30.920 8.821 1.00 0.00 N ATOM 1629 CA SER A 119 38.020 30.494 8.147 1.00 0.00 C ATOM 1630 C SER A 119 39.186 30.422 9.129 1.00 0.00 C ATOM 1631 O SER A 119 39.540 31.414 9.764 1.00 0.00 O ATOM 1632 CB SER A 119 38.359 31.456 7.005 1.00 0.00 C ATOM 1633 OG SER A 119 39.345 30.904 6.150 1.00 0.00 O ATOM 0 H SER A 119 36.871 31.821 9.294 1.00 0.00 H new ATOM 0 HA SER A 119 37.851 29.498 7.737 1.00 0.00 H new ATOM 0 HB2 SER A 119 37.459 31.677 6.432 1.00 0.00 H new ATOM 0 HB3 SER A 119 38.716 32.401 7.415 1.00 0.00 H new ATOM 0 HG SER A 119 39.543 31.536 5.428 1.00 0.00 H new ATOM 1639 N GLY A 120 39.779 29.237 9.247 1.00 0.00 N ATOM 1640 CA GLY A 120 40.898 29.055 10.152 1.00 0.00 C ATOM 1641 C GLY A 120 42.204 28.817 9.420 1.00 0.00 C ATOM 1642 O GLY A 120 42.620 27.678 9.204 1.00 0.00 O ATOM 0 H GLY A 120 39.504 28.401 8.732 1.00 0.00 H new ATOM 0 HA2 GLY A 120 40.996 29.937 10.786 1.00 0.00 H new ATOM 0 HA3 GLY A 120 40.695 28.210 10.810 1.00 0.00 H new ATOM 1646 N PRO A 121 42.872 29.910 9.022 1.00 0.00 N ATOM 1647 CA PRO A 121 44.147 29.840 8.302 1.00 0.00 C ATOM 1648 C PRO A 121 45.287 29.346 9.188 1.00 0.00 C ATOM 1649 O PRO A 121 45.069 28.956 10.334 1.00 0.00 O ATOM 1650 CB PRO A 121 44.393 31.289 7.874 1.00 0.00 C ATOM 1651 CG PRO A 121 43.642 32.109 8.866 1.00 0.00 C ATOM 1652 CD PRO A 121 42.434 31.298 9.245 1.00 0.00 C ATOM 0 HA PRO A 121 44.107 29.136 7.471 1.00 0.00 H new ATOM 0 HB2 PRO A 121 45.456 31.530 7.885 1.00 0.00 H new ATOM 0 HB3 PRO A 121 44.036 31.469 6.860 1.00 0.00 H new ATOM 0 HG2 PRO A 121 44.257 32.324 9.740 1.00 0.00 H new ATOM 0 HG3 PRO A 121 43.350 33.068 8.438 1.00 0.00 H new ATOM 0 HD2 PRO A 121 42.146 31.467 10.283 1.00 0.00 H new ATOM 0 HD3 PRO A 121 41.571 31.551 8.629 1.00 0.00 H new ATOM 1660 N SER A 122 46.500 29.365 8.647 1.00 0.00 N ATOM 1661 CA SER A 122 47.674 28.917 9.388 1.00 0.00 C ATOM 1662 C SER A 122 48.807 29.931 9.279 1.00 0.00 C ATOM 1663 O SER A 122 48.780 30.818 8.424 1.00 0.00 O ATOM 1664 CB SER A 122 48.141 27.556 8.868 1.00 0.00 C ATOM 1665 OG SER A 122 49.063 26.957 9.762 1.00 0.00 O ATOM 0 H SER A 122 46.696 29.685 7.699 1.00 0.00 H new ATOM 0 HA SER A 122 47.396 28.823 10.438 1.00 0.00 H new ATOM 0 HB2 SER A 122 47.281 26.900 8.734 1.00 0.00 H new ATOM 0 HB3 SER A 122 48.605 27.677 7.889 1.00 0.00 H new ATOM 0 HG SER A 122 49.345 26.088 9.408 1.00 0.00 H new ATOM 1671 N SER A 123 49.803 29.795 10.149 1.00 0.00 N ATOM 1672 CA SER A 123 50.944 30.701 10.153 1.00 0.00 C ATOM 1673 C SER A 123 52.240 29.945 9.877 1.00 0.00 C ATOM 1674 O SER A 123 52.261 28.715 9.854 1.00 0.00 O ATOM 1675 CB SER A 123 51.040 31.428 11.497 1.00 0.00 C ATOM 1676 OG SER A 123 50.253 32.606 11.497 1.00 0.00 O ATOM 0 H SER A 123 49.842 29.065 10.860 1.00 0.00 H new ATOM 0 HA SER A 123 50.797 31.435 9.360 1.00 0.00 H new ATOM 0 HB2 SER A 123 50.709 30.766 12.297 1.00 0.00 H new ATOM 0 HB3 SER A 123 52.080 31.682 11.703 1.00 0.00 H new ATOM 0 HG SER A 123 50.330 33.051 12.367 1.00 0.00 H new ATOM 1682 N GLY A 124 53.320 30.691 9.668 1.00 0.00 N ATOM 1683 CA GLY A 124 54.606 30.076 9.396 1.00 0.00 C ATOM 1684 C GLY A 124 54.684 29.490 8.000 1.00 0.00 C ATOM 1685 O GLY A 124 54.969 28.304 7.833 1.00 0.00 O ATOM 0 H GLY A 124 53.327 31.711 9.682 1.00 0.00 H new ATOM 0 HA2 GLY A 124 55.394 30.819 9.520 1.00 0.00 H new ATOM 0 HA3 GLY A 124 54.791 29.290 10.128 1.00 0.00 H new TER 1689 GLY A 124