USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 753 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 71 ASN : amide:sc= -0.344 K(o=-0.74,f=-4.1!) USER MOD Set 1.2: A 98 GLN : amide:sc= -0.396 K(o=-0.74,f=-2) USER MOD Set 2.1: A 19 SER OG : rot -2:sc= 0.274 USER MOD Set 2.2: A 93 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 85 GLN : amide:sc= 0.236 K(o=0.98,f=-1.7) USER MOD Set 3.2: A 88 SER OG : rot -130:sc= 0.743 USER MOD Set 4.1: A 9 TYR OH : rot -124:sc= 0.79 USER MOD Set 4.2: A 40 LYS NZ :NH3+ 178:sc= 1.23 (180deg=1.18) USER MOD Single : A 1 GLY N :NH3+ -133:sc= 0.0766 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= -0.0912 X(o=-0.091,f=-0.091) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot -116:sc= 0.108 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= -0.113 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 HIS : no HD1:sc= -0.126 X(o=-0.13,f=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 54:sc= 0.00917 USER MOD Single : A 39 TYR OH : rot -79:sc= 0.218 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot -160:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.162 K(o=-0.16,f=-1.1) USER MOD Single : A 45 SER OG : rot 180:sc= -0.0198 USER MOD Single : A 46 THR OG1 : rot 40:sc= 0.00642 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= 0.172 K(o=0.17,f=-1.3) USER MOD Single : A 54 SER OG : rot 66:sc= 0.316 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0.002) USER MOD Single : A 64 SER OG : rot 180:sc= 0.026 USER MOD Single : A 65 SER OG : rot 180:sc= 0.0081 USER MOD Single : A 67 SER OG : rot -24:sc= 0.159 USER MOD Single : A 68 TYR OH : rot -123:sc= 0.283 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.181 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.095) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.0311 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -39.360 2.639 -16.915 1.00 0.00 N ATOM 2 CA GLY A 1 -39.357 1.259 -16.406 1.00 0.00 C ATOM 3 C GLY A 1 -38.566 1.268 -15.120 1.00 0.00 C ATOM 4 O GLY A 1 -38.756 2.191 -14.334 1.00 0.00 O ATOM 0 H1 GLY A 1 -40.327 2.905 -17.192 1.00 0.00 H new ATOM 0 H2 GLY A 1 -39.023 3.284 -16.172 1.00 0.00 H new ATOM 0 H3 GLY A 1 -38.733 2.705 -17.742 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -40.375 0.910 -16.231 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -38.907 0.581 -17.131 1.00 0.00 H new ATOM 8 N HIS A 2 -37.636 0.328 -14.944 1.00 0.00 N ATOM 9 CA HIS A 2 -36.520 0.555 -14.033 1.00 0.00 C ATOM 10 C HIS A 2 -35.709 1.758 -14.539 1.00 0.00 C ATOM 11 O HIS A 2 -35.852 2.155 -15.701 1.00 0.00 O ATOM 12 CB HIS A 2 -35.635 -0.702 -13.959 1.00 0.00 C ATOM 13 CG HIS A 2 -36.397 -1.991 -13.753 1.00 0.00 C ATOM 14 ND1 HIS A 2 -36.166 -3.182 -14.411 1.00 0.00 N ATOM 15 CD2 HIS A 2 -37.465 -2.179 -12.915 1.00 0.00 C ATOM 16 CE1 HIS A 2 -37.086 -4.065 -13.982 1.00 0.00 C ATOM 17 NE2 HIS A 2 -37.905 -3.491 -13.089 1.00 0.00 N ATOM 0 H HIS A 2 -37.634 -0.579 -15.411 1.00 0.00 H new ATOM 0 HA HIS A 2 -36.894 0.765 -13.031 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -35.057 -0.779 -14.880 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -34.922 -0.582 -13.144 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -37.888 -1.446 -12.244 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -37.155 -5.091 -14.311 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -38.700 -3.931 -12.625 1.00 0.00 H new ATOM 25 N MET A 3 -34.843 2.288 -13.680 1.00 0.00 N ATOM 26 CA MET A 3 -33.713 3.160 -13.978 1.00 0.00 C ATOM 27 C MET A 3 -32.629 2.794 -12.958 1.00 0.00 C ATOM 28 O MET A 3 -32.916 2.086 -11.989 1.00 0.00 O ATOM 29 CB MET A 3 -34.101 4.647 -13.845 1.00 0.00 C ATOM 30 CG MET A 3 -34.883 5.188 -15.046 1.00 0.00 C ATOM 31 SD MET A 3 -33.975 5.110 -16.616 1.00 0.00 S ATOM 32 CE MET A 3 -35.156 5.929 -17.717 1.00 0.00 C ATOM 0 H MET A 3 -34.920 2.104 -12.680 1.00 0.00 H new ATOM 0 HA MET A 3 -33.370 3.024 -15.004 1.00 0.00 H new ATOM 0 HB2 MET A 3 -34.700 4.778 -12.944 1.00 0.00 H new ATOM 0 HB3 MET A 3 -33.195 5.240 -13.715 1.00 0.00 H new ATOM 0 HG2 MET A 3 -35.810 4.624 -15.146 1.00 0.00 H new ATOM 0 HG3 MET A 3 -35.160 6.224 -14.849 1.00 0.00 H new ATOM 0 HE1 MET A 3 -34.748 5.964 -18.727 1.00 0.00 H new ATOM 0 HE2 MET A 3 -36.094 5.373 -17.723 1.00 0.00 H new ATOM 0 HE3 MET A 3 -35.338 6.944 -17.364 1.00 0.00 H new ATOM 42 N GLY A 4 -31.400 3.269 -13.145 1.00 0.00 N ATOM 43 CA GLY A 4 -30.303 3.013 -12.228 1.00 0.00 C ATOM 44 C GLY A 4 -28.973 3.315 -12.901 1.00 0.00 C ATOM 45 O GLY A 4 -28.933 3.676 -14.079 1.00 0.00 O ATOM 0 H GLY A 4 -31.140 3.846 -13.945 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.415 3.628 -11.335 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -30.326 1.973 -11.903 1.00 0.00 H new ATOM 49 N SER A 5 -27.887 3.159 -12.153 1.00 0.00 N ATOM 50 CA SER A 5 -26.523 3.352 -12.618 1.00 0.00 C ATOM 51 C SER A 5 -25.639 2.316 -11.906 1.00 0.00 C ATOM 52 O SER A 5 -25.979 1.899 -10.789 1.00 0.00 O ATOM 53 CB SER A 5 -26.093 4.809 -12.368 1.00 0.00 C ATOM 54 OG SER A 5 -26.612 5.332 -11.149 1.00 0.00 O ATOM 0 H SER A 5 -27.936 2.885 -11.172 1.00 0.00 H new ATOM 0 HA SER A 5 -26.428 3.194 -13.692 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.005 4.864 -12.349 1.00 0.00 H new ATOM 0 HB3 SER A 5 -26.429 5.431 -13.198 1.00 0.00 H new ATOM 0 HG SER A 5 -26.310 6.257 -11.035 1.00 0.00 H new ATOM 60 N PRO A 6 -24.540 1.860 -12.529 1.00 0.00 N ATOM 61 CA PRO A 6 -23.673 0.847 -11.950 1.00 0.00 C ATOM 62 C PRO A 6 -22.880 1.422 -10.776 1.00 0.00 C ATOM 63 O PRO A 6 -22.870 2.631 -10.517 1.00 0.00 O ATOM 64 CB PRO A 6 -22.766 0.378 -13.091 1.00 0.00 C ATOM 65 CG PRO A 6 -22.669 1.620 -13.965 1.00 0.00 C ATOM 66 CD PRO A 6 -24.053 2.246 -13.842 1.00 0.00 C ATOM 0 HA PRO A 6 -24.236 0.009 -11.539 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -21.789 0.060 -12.728 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -23.196 -0.466 -13.631 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -21.889 2.297 -13.616 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -22.433 1.367 -14.999 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -24.003 3.331 -13.938 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -24.717 1.887 -14.628 1.00 0.00 H new ATOM 74 N VAL A 7 -22.212 0.531 -10.056 1.00 0.00 N ATOM 75 CA VAL A 7 -21.473 0.848 -8.852 1.00 0.00 C ATOM 76 C VAL A 7 -20.230 1.654 -9.229 1.00 0.00 C ATOM 77 O VAL A 7 -19.319 1.110 -9.857 1.00 0.00 O ATOM 78 CB VAL A 7 -21.116 -0.454 -8.113 1.00 0.00 C ATOM 79 CG1 VAL A 7 -20.585 -0.110 -6.719 1.00 0.00 C ATOM 80 CG2 VAL A 7 -22.313 -1.415 -8.008 1.00 0.00 C ATOM 0 H VAL A 7 -22.171 -0.458 -10.304 1.00 0.00 H new ATOM 0 HA VAL A 7 -22.076 1.455 -8.177 1.00 0.00 H new ATOM 0 HB VAL A 7 -20.349 -0.970 -8.690 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -20.330 -1.028 -6.190 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -19.696 0.514 -6.812 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -21.350 0.430 -6.161 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -22.009 -2.318 -7.479 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -23.123 -0.930 -7.463 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -22.656 -1.679 -9.008 1.00 0.00 H new ATOM 90 N SER A 8 -20.173 2.931 -8.849 1.00 0.00 N ATOM 91 CA SER A 8 -18.964 3.716 -9.043 1.00 0.00 C ATOM 92 C SER A 8 -17.994 3.391 -7.910 1.00 0.00 C ATOM 93 O SER A 8 -18.409 3.244 -6.758 1.00 0.00 O ATOM 94 CB SER A 8 -19.293 5.210 -9.099 1.00 0.00 C ATOM 95 OG SER A 8 -18.178 5.997 -9.489 1.00 0.00 O ATOM 0 H SER A 8 -20.943 3.435 -8.410 1.00 0.00 H new ATOM 0 HA SER A 8 -18.498 3.463 -9.995 1.00 0.00 H new ATOM 0 HB2 SER A 8 -20.112 5.373 -9.800 1.00 0.00 H new ATOM 0 HB3 SER A 8 -19.642 5.539 -8.120 1.00 0.00 H new ATOM 0 HG SER A 8 -17.921 6.589 -8.751 1.00 0.00 H new ATOM 101 N TYR A 9 -16.705 3.281 -8.223 1.00 0.00 N ATOM 102 CA TYR A 9 -15.623 3.030 -7.283 1.00 0.00 C ATOM 103 C TYR A 9 -14.690 4.230 -7.262 1.00 0.00 C ATOM 104 O TYR A 9 -13.897 4.439 -8.181 1.00 0.00 O ATOM 105 CB TYR A 9 -14.890 1.739 -7.643 1.00 0.00 C ATOM 106 CG TYR A 9 -15.453 0.530 -6.933 1.00 0.00 C ATOM 107 CD1 TYR A 9 -16.778 0.112 -7.141 1.00 0.00 C ATOM 108 CD2 TYR A 9 -14.656 -0.144 -5.999 1.00 0.00 C ATOM 109 CE1 TYR A 9 -17.246 -1.069 -6.538 1.00 0.00 C ATOM 110 CE2 TYR A 9 -15.142 -1.280 -5.340 1.00 0.00 C ATOM 111 CZ TYR A 9 -16.423 -1.783 -5.648 1.00 0.00 C ATOM 112 OH TYR A 9 -16.910 -2.918 -5.084 1.00 0.00 O ATOM 0 H TYR A 9 -16.375 3.369 -9.184 1.00 0.00 H new ATOM 0 HA TYR A 9 -16.028 2.895 -6.280 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -14.948 1.582 -8.720 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -13.834 1.844 -7.392 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -17.437 0.698 -7.764 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -13.660 0.215 -5.786 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -18.240 -1.429 -6.759 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -14.535 -1.772 -4.595 1.00 0.00 H new ATOM 0 HH TYR A 9 -16.861 -2.845 -4.108 1.00 0.00 H new ATOM 122 N TYR A 10 -14.800 5.012 -6.197 1.00 0.00 N ATOM 123 CA TYR A 10 -14.013 6.204 -5.950 1.00 0.00 C ATOM 124 C TYR A 10 -12.719 5.752 -5.287 1.00 0.00 C ATOM 125 O TYR A 10 -12.753 5.177 -4.193 1.00 0.00 O ATOM 126 CB TYR A 10 -14.783 7.172 -5.044 1.00 0.00 C ATOM 127 CG TYR A 10 -16.065 7.717 -5.641 1.00 0.00 C ATOM 128 CD1 TYR A 10 -17.194 6.886 -5.770 1.00 0.00 C ATOM 129 CD2 TYR A 10 -16.135 9.061 -6.054 1.00 0.00 C ATOM 130 CE1 TYR A 10 -18.375 7.381 -6.339 1.00 0.00 C ATOM 131 CE2 TYR A 10 -17.327 9.572 -6.601 1.00 0.00 C ATOM 132 CZ TYR A 10 -18.449 8.728 -6.758 1.00 0.00 C ATOM 133 OH TYR A 10 -19.592 9.214 -7.317 1.00 0.00 O ATOM 0 H TYR A 10 -15.470 4.822 -5.452 1.00 0.00 H new ATOM 0 HA TYR A 10 -13.801 6.733 -6.879 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -15.021 6.662 -4.111 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -14.131 8.009 -4.793 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -17.150 5.862 -5.429 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -15.272 9.702 -5.951 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -19.230 6.732 -6.457 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -17.384 10.608 -6.900 1.00 0.00 H new ATOM 0 HH TYR A 10 -19.468 10.159 -7.546 1.00 0.00 H new ATOM 143 N PHE A 11 -11.584 5.934 -5.956 1.00 0.00 N ATOM 144 CA PHE A 11 -10.287 5.602 -5.388 1.00 0.00 C ATOM 145 C PHE A 11 -9.237 6.565 -5.928 1.00 0.00 C ATOM 146 O PHE A 11 -8.501 6.205 -6.850 1.00 0.00 O ATOM 147 CB PHE A 11 -9.920 4.136 -5.670 1.00 0.00 C ATOM 148 CG PHE A 11 -8.654 3.641 -4.991 1.00 0.00 C ATOM 149 CD1 PHE A 11 -8.037 4.349 -3.936 1.00 0.00 C ATOM 150 CD2 PHE A 11 -8.114 2.408 -5.394 1.00 0.00 C ATOM 151 CE1 PHE A 11 -6.920 3.809 -3.290 1.00 0.00 C ATOM 152 CE2 PHE A 11 -7.007 1.863 -4.726 1.00 0.00 C ATOM 153 CZ PHE A 11 -6.426 2.552 -3.653 1.00 0.00 C ATOM 0 H PHE A 11 -11.540 6.314 -6.902 1.00 0.00 H new ATOM 0 HA PHE A 11 -10.329 5.711 -4.304 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -10.751 3.504 -5.357 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -9.809 4.007 -6.747 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -8.428 5.308 -3.628 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -8.554 1.876 -6.224 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -6.435 4.368 -2.504 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -6.602 0.912 -5.039 1.00 0.00 H new ATOM 0 HZ PHE A 11 -5.601 2.115 -3.109 1.00 0.00 H new ATOM 163 N SER A 12 -9.201 7.789 -5.409 1.00 0.00 N ATOM 164 CA SER A 12 -8.293 8.841 -5.855 1.00 0.00 C ATOM 165 C SER A 12 -8.025 9.788 -4.677 1.00 0.00 C ATOM 166 O SER A 12 -8.718 9.706 -3.662 1.00 0.00 O ATOM 167 CB SER A 12 -8.938 9.596 -7.030 1.00 0.00 C ATOM 168 OG SER A 12 -9.496 8.712 -7.996 1.00 0.00 O ATOM 0 H SER A 12 -9.816 8.083 -4.650 1.00 0.00 H new ATOM 0 HA SER A 12 -7.347 8.419 -6.193 1.00 0.00 H new ATOM 0 HB2 SER A 12 -9.718 10.256 -6.651 1.00 0.00 H new ATOM 0 HB3 SER A 12 -8.190 10.228 -7.508 1.00 0.00 H new ATOM 0 HG SER A 12 -9.896 9.233 -8.723 1.00 0.00 H new ATOM 174 N TYR A 13 -7.057 10.695 -4.800 1.00 0.00 N ATOM 175 CA TYR A 13 -6.920 11.838 -3.903 1.00 0.00 C ATOM 176 C TYR A 13 -8.087 12.813 -4.128 1.00 0.00 C ATOM 177 O TYR A 13 -8.821 12.722 -5.122 1.00 0.00 O ATOM 178 CB TYR A 13 -5.572 12.546 -4.142 1.00 0.00 C ATOM 179 CG TYR A 13 -4.347 11.753 -3.724 1.00 0.00 C ATOM 180 CD1 TYR A 13 -3.776 10.809 -4.598 1.00 0.00 C ATOM 181 CD2 TYR A 13 -3.779 11.956 -2.451 1.00 0.00 C ATOM 182 CE1 TYR A 13 -2.683 10.033 -4.183 1.00 0.00 C ATOM 183 CE2 TYR A 13 -2.700 11.162 -2.022 1.00 0.00 C ATOM 184 CZ TYR A 13 -2.170 10.173 -2.880 1.00 0.00 C ATOM 185 OH TYR A 13 -1.135 9.375 -2.504 1.00 0.00 O ATOM 0 H TYR A 13 -6.344 10.656 -5.528 1.00 0.00 H new ATOM 0 HA TYR A 13 -6.944 11.488 -2.871 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -5.487 12.785 -5.202 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -5.575 13.493 -3.601 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -4.180 10.681 -5.591 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -4.173 12.724 -1.802 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -2.234 9.326 -4.865 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.278 11.308 -1.039 1.00 0.00 H new ATOM 0 HH TYR A 13 -0.882 9.581 -1.580 1.00 0.00 H new ATOM 195 N ALA A 14 -8.212 13.797 -3.240 1.00 0.00 N ATOM 196 CA ALA A 14 -9.031 14.987 -3.456 1.00 0.00 C ATOM 197 C ALA A 14 -8.210 16.130 -4.063 1.00 0.00 C ATOM 198 O ALA A 14 -8.788 17.093 -4.562 1.00 0.00 O ATOM 199 CB ALA A 14 -9.644 15.441 -2.126 1.00 0.00 C ATOM 0 H ALA A 14 -7.740 13.789 -2.336 1.00 0.00 H new ATOM 0 HA ALA A 14 -9.822 14.729 -4.160 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -10.254 16.329 -2.291 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -10.266 14.643 -1.721 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -8.848 15.674 -1.419 1.00 0.00 H new ATOM 205 N ASP A 15 -6.878 16.042 -4.045 1.00 0.00 N ATOM 206 CA ASP A 15 -5.986 17.189 -4.234 1.00 0.00 C ATOM 207 C ASP A 15 -5.305 17.227 -5.604 1.00 0.00 C ATOM 208 O ASP A 15 -4.660 18.225 -5.941 1.00 0.00 O ATOM 209 CB ASP A 15 -4.959 17.261 -3.091 1.00 0.00 C ATOM 210 CG ASP A 15 -3.935 16.119 -3.018 1.00 0.00 C ATOM 211 OD1 ASP A 15 -3.647 15.457 -4.038 1.00 0.00 O ATOM 212 OD2 ASP A 15 -3.414 15.899 -1.898 1.00 0.00 O ATOM 0 H ASP A 15 -6.383 15.163 -3.897 1.00 0.00 H new ATOM 0 HA ASP A 15 -6.616 18.078 -4.205 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -4.415 18.202 -3.179 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -5.502 17.294 -2.146 1.00 0.00 H new ATOM 217 N GLY A 16 -5.496 16.198 -6.432 1.00 0.00 N ATOM 218 CA GLY A 16 -4.877 16.153 -7.742 1.00 0.00 C ATOM 219 C GLY A 16 -5.380 14.993 -8.584 1.00 0.00 C ATOM 220 O GLY A 16 -5.879 15.212 -9.691 1.00 0.00 O ATOM 0 H GLY A 16 -6.076 15.388 -6.211 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -5.073 17.089 -8.265 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -3.796 16.072 -7.627 1.00 0.00 H new ATOM 224 N GLY A 17 -5.271 13.753 -8.101 1.00 0.00 N ATOM 225 CA GLY A 17 -5.514 12.614 -8.977 1.00 0.00 C ATOM 226 C GLY A 17 -5.185 11.296 -8.309 1.00 0.00 C ATOM 227 O GLY A 17 -5.844 10.925 -7.341 1.00 0.00 O ATOM 0 H GLY A 17 -5.024 13.520 -7.139 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -6.560 12.612 -9.285 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -4.915 12.720 -9.882 1.00 0.00 H new ATOM 231 N THR A 18 -4.185 10.578 -8.818 1.00 0.00 N ATOM 232 CA THR A 18 -3.890 9.203 -8.418 1.00 0.00 C ATOM 233 C THR A 18 -2.418 9.026 -7.993 1.00 0.00 C ATOM 234 O THR A 18 -1.895 7.908 -7.953 1.00 0.00 O ATOM 235 CB THR A 18 -4.438 8.218 -9.480 1.00 0.00 C ATOM 236 OG1 THR A 18 -3.999 8.457 -10.807 1.00 0.00 O ATOM 237 CG2 THR A 18 -5.970 8.293 -9.549 1.00 0.00 C ATOM 0 H THR A 18 -3.549 10.939 -9.529 1.00 0.00 H new ATOM 0 HA THR A 18 -4.424 8.949 -7.502 1.00 0.00 H new ATOM 0 HB THR A 18 -4.060 7.252 -9.146 1.00 0.00 H new ATOM 0 HG1 THR A 18 -4.392 7.789 -11.407 1.00 0.00 H new ATOM 0 HG21 THR A 18 -6.335 7.593 -10.301 1.00 0.00 H new ATOM 0 HG22 THR A 18 -6.391 8.034 -8.578 1.00 0.00 H new ATOM 0 HG23 THR A 18 -6.273 9.305 -9.818 1.00 0.00 H new ATOM 245 N SER A 19 -1.718 10.112 -7.649 1.00 0.00 N ATOM 246 CA SER A 19 -0.419 10.093 -6.986 1.00 0.00 C ATOM 247 C SER A 19 -0.247 11.333 -6.106 1.00 0.00 C ATOM 248 O SER A 19 -0.839 12.374 -6.398 1.00 0.00 O ATOM 249 CB SER A 19 0.674 10.105 -8.050 1.00 0.00 C ATOM 250 OG SER A 19 0.564 8.984 -8.905 1.00 0.00 O ATOM 0 H SER A 19 -2.055 11.057 -7.832 1.00 0.00 H new ATOM 0 HA SER A 19 -0.353 9.199 -6.366 1.00 0.00 H new ATOM 0 HB2 SER A 19 0.605 11.021 -8.636 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.653 10.106 -7.570 1.00 0.00 H new ATOM 0 HG SER A 19 -0.175 8.415 -8.605 1.00 0.00 H new ATOM 256 N HIS A 20 0.637 11.246 -5.111 1.00 0.00 N ATOM 257 CA HIS A 20 1.154 12.384 -4.361 1.00 0.00 C ATOM 258 C HIS A 20 2.676 12.356 -4.468 1.00 0.00 C ATOM 259 O HIS A 20 3.270 11.281 -4.617 1.00 0.00 O ATOM 260 CB HIS A 20 0.703 12.282 -2.898 1.00 0.00 C ATOM 261 CG HIS A 20 0.602 13.594 -2.173 1.00 0.00 C ATOM 262 ND1 HIS A 20 -0.487 14.445 -2.194 1.00 0.00 N ATOM 263 CD2 HIS A 20 1.519 14.103 -1.292 1.00 0.00 C ATOM 264 CE1 HIS A 20 -0.222 15.446 -1.340 1.00 0.00 C ATOM 265 NE2 HIS A 20 0.986 15.282 -0.771 1.00 0.00 N ATOM 0 H HIS A 20 1.022 10.355 -4.798 1.00 0.00 H new ATOM 0 HA HIS A 20 0.775 13.324 -4.762 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -0.269 11.791 -2.866 1.00 0.00 H new ATOM 0 HB3 HIS A 20 1.402 11.640 -2.362 1.00 0.00 H new ATOM 0 HD2 HIS A 20 2.478 13.671 -1.046 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -0.888 16.271 -1.137 1.00 0.00 H new ATOM 0 HE2 HIS A 20 1.427 15.900 -0.090 1.00 0.00 H new ATOM 273 N THR A 21 3.325 13.512 -4.370 1.00 0.00 N ATOM 274 CA THR A 21 4.773 13.624 -4.347 1.00 0.00 C ATOM 275 C THR A 21 5.108 14.757 -3.383 1.00 0.00 C ATOM 276 O THR A 21 4.480 15.813 -3.455 1.00 0.00 O ATOM 277 CB THR A 21 5.315 13.868 -5.767 1.00 0.00 C ATOM 278 OG1 THR A 21 4.903 12.821 -6.637 1.00 0.00 O ATOM 279 CG2 THR A 21 6.846 13.941 -5.774 1.00 0.00 C ATOM 0 H THR A 21 2.848 14.411 -4.303 1.00 0.00 H new ATOM 0 HA THR A 21 5.247 12.704 -4.005 1.00 0.00 H new ATOM 0 HB THR A 21 4.913 14.821 -6.111 1.00 0.00 H new ATOM 0 HG1 THR A 21 5.252 12.988 -7.537 1.00 0.00 H new ATOM 0 HG21 THR A 21 7.197 14.114 -6.791 1.00 0.00 H new ATOM 0 HG22 THR A 21 7.174 14.759 -5.133 1.00 0.00 H new ATOM 0 HG23 THR A 21 7.257 13.002 -5.403 1.00 0.00 H new ATOM 287 N GLU A 22 6.072 14.535 -2.492 1.00 0.00 N ATOM 288 CA GLU A 22 6.501 15.486 -1.474 1.00 0.00 C ATOM 289 C GLU A 22 8.018 15.688 -1.616 1.00 0.00 C ATOM 290 O GLU A 22 8.721 14.831 -2.169 1.00 0.00 O ATOM 291 CB GLU A 22 6.080 14.962 -0.082 1.00 0.00 C ATOM 292 CG GLU A 22 5.466 16.042 0.823 1.00 0.00 C ATOM 293 CD GLU A 22 6.472 17.139 1.171 1.00 0.00 C ATOM 294 OE1 GLU A 22 6.588 18.099 0.372 1.00 0.00 O ATOM 295 OE2 GLU A 22 7.219 16.964 2.155 1.00 0.00 O ATOM 0 H GLU A 22 6.592 13.658 -2.459 1.00 0.00 H new ATOM 0 HA GLU A 22 6.025 16.459 -1.598 1.00 0.00 H new ATOM 0 HB2 GLU A 22 5.359 14.154 -0.210 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.951 14.536 0.415 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.604 16.486 0.324 1.00 0.00 H new ATOM 0 HG3 GLU A 22 5.101 15.581 1.741 1.00 0.00 H new ATOM 302 N TYR A 23 8.518 16.825 -1.137 1.00 0.00 N ATOM 303 CA TYR A 23 9.853 17.353 -1.367 1.00 0.00 C ATOM 304 C TYR A 23 10.429 18.000 -0.092 1.00 0.00 C ATOM 305 O TYR A 23 10.867 19.153 -0.163 1.00 0.00 O ATOM 306 CB TYR A 23 9.744 18.412 -2.479 1.00 0.00 C ATOM 307 CG TYR A 23 9.321 17.894 -3.830 1.00 0.00 C ATOM 308 CD1 TYR A 23 10.313 17.457 -4.716 1.00 0.00 C ATOM 309 CD2 TYR A 23 7.965 17.845 -4.204 1.00 0.00 C ATOM 310 CE1 TYR A 23 9.969 16.942 -5.969 1.00 0.00 C ATOM 311 CE2 TYR A 23 7.613 17.386 -5.484 1.00 0.00 C ATOM 312 CZ TYR A 23 8.614 16.921 -6.367 1.00 0.00 C ATOM 313 OH TYR A 23 8.260 16.418 -7.579 1.00 0.00 O ATOM 0 H TYR A 23 7.963 17.438 -0.540 1.00 0.00 H new ATOM 0 HA TYR A 23 10.523 16.542 -1.653 1.00 0.00 H new ATOM 0 HB2 TYR A 23 9.032 19.174 -2.162 1.00 0.00 H new ATOM 0 HB3 TYR A 23 10.711 18.904 -2.584 1.00 0.00 H new ATOM 0 HD1 TYR A 23 11.352 17.518 -4.429 1.00 0.00 H new ATOM 0 HD2 TYR A 23 7.199 18.159 -3.510 1.00 0.00 H new ATOM 0 HE1 TYR A 23 10.735 16.562 -6.629 1.00 0.00 H new ATOM 0 HE2 TYR A 23 6.578 17.388 -5.793 1.00 0.00 H new ATOM 0 HH TYR A 23 7.288 16.481 -7.688 1.00 0.00 H new ATOM 323 N PRO A 24 10.498 17.313 1.059 1.00 0.00 N ATOM 324 CA PRO A 24 10.964 17.955 2.280 1.00 0.00 C ATOM 325 C PRO A 24 12.463 18.237 2.208 1.00 0.00 C ATOM 326 O PRO A 24 13.183 17.704 1.351 1.00 0.00 O ATOM 327 CB PRO A 24 10.628 16.987 3.402 1.00 0.00 C ATOM 328 CG PRO A 24 10.740 15.636 2.707 1.00 0.00 C ATOM 329 CD PRO A 24 10.226 15.903 1.293 1.00 0.00 C ATOM 0 HA PRO A 24 10.487 18.922 2.439 1.00 0.00 H new ATOM 0 HB2 PRO A 24 11.324 17.074 4.237 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.628 17.158 3.801 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.769 15.277 2.696 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.143 14.877 3.212 1.00 0.00 H new ATOM 0 HD2 PRO A 24 10.735 15.275 0.562 1.00 0.00 H new ATOM 0 HD3 PRO A 24 9.161 15.687 1.212 1.00 0.00 H new ATOM 337 N ASP A 25 12.944 19.076 3.119 1.00 0.00 N ATOM 338 CA ASP A 25 14.325 19.515 3.166 1.00 0.00 C ATOM 339 C ASP A 25 14.652 20.031 4.562 1.00 0.00 C ATOM 340 O ASP A 25 13.755 20.357 5.341 1.00 0.00 O ATOM 341 CB ASP A 25 14.605 20.586 2.091 1.00 0.00 C ATOM 342 CG ASP A 25 14.287 22.020 2.529 1.00 0.00 C ATOM 343 OD1 ASP A 25 13.111 22.447 2.482 1.00 0.00 O ATOM 344 OD2 ASP A 25 15.248 22.761 2.829 1.00 0.00 O ATOM 0 H ASP A 25 12.368 19.476 3.860 1.00 0.00 H new ATOM 0 HA ASP A 25 14.973 18.666 2.948 1.00 0.00 H new ATOM 0 HB2 ASP A 25 15.655 20.531 1.805 1.00 0.00 H new ATOM 0 HB3 ASP A 25 14.020 20.352 1.202 1.00 0.00 H new ATOM 349 N ASP A 26 15.951 20.121 4.848 1.00 0.00 N ATOM 350 CA ASP A 26 16.544 20.442 6.146 1.00 0.00 C ATOM 351 C ASP A 26 16.274 19.317 7.147 1.00 0.00 C ATOM 352 O ASP A 26 17.178 18.518 7.393 1.00 0.00 O ATOM 353 CB ASP A 26 16.148 21.839 6.648 1.00 0.00 C ATOM 354 CG ASP A 26 16.817 22.150 7.979 1.00 0.00 C ATOM 355 OD1 ASP A 26 17.995 22.572 7.997 1.00 0.00 O ATOM 356 OD2 ASP A 26 16.146 22.075 9.031 1.00 0.00 O ATOM 0 H ASP A 26 16.662 19.962 4.134 1.00 0.00 H new ATOM 0 HA ASP A 26 17.626 20.501 6.025 1.00 0.00 H new ATOM 0 HB2 ASP A 26 16.433 22.589 5.910 1.00 0.00 H new ATOM 0 HB3 ASP A 26 15.065 21.896 6.759 1.00 0.00 H new ATOM 361 N SER A 27 15.056 19.217 7.683 1.00 0.00 N ATOM 362 CA SER A 27 14.609 18.124 8.528 1.00 0.00 C ATOM 363 C SER A 27 13.072 18.143 8.561 1.00 0.00 C ATOM 364 O SER A 27 12.501 18.809 9.427 1.00 0.00 O ATOM 365 CB SER A 27 15.254 18.287 9.922 1.00 0.00 C ATOM 366 OG SER A 27 14.964 17.208 10.793 1.00 0.00 O ATOM 0 H SER A 27 14.334 19.922 7.532 1.00 0.00 H new ATOM 0 HA SER A 27 14.916 17.150 8.146 1.00 0.00 H new ATOM 0 HB2 SER A 27 16.334 18.376 9.809 1.00 0.00 H new ATOM 0 HB3 SER A 27 14.903 19.216 10.373 1.00 0.00 H new ATOM 0 HG SER A 27 15.397 17.361 11.659 1.00 0.00 H new ATOM 372 N SER A 28 12.381 17.450 7.644 1.00 0.00 N ATOM 373 CA SER A 28 10.929 17.263 7.703 1.00 0.00 C ATOM 374 C SER A 28 10.511 15.830 7.310 1.00 0.00 C ATOM 375 O SER A 28 10.411 15.513 6.121 1.00 0.00 O ATOM 376 CB SER A 28 10.200 18.311 6.843 1.00 0.00 C ATOM 377 OG SER A 28 11.021 19.290 6.225 1.00 0.00 O ATOM 0 H SER A 28 12.818 17.003 6.838 1.00 0.00 H new ATOM 0 HA SER A 28 10.629 17.409 8.741 1.00 0.00 H new ATOM 0 HB2 SER A 28 9.643 17.789 6.065 1.00 0.00 H new ATOM 0 HB3 SER A 28 9.469 18.822 7.470 1.00 0.00 H new ATOM 0 HG SER A 28 10.462 19.903 5.703 1.00 0.00 H new ATOM 383 N ALA A 29 10.263 14.949 8.282 1.00 0.00 N ATOM 384 CA ALA A 29 9.613 13.653 8.069 1.00 0.00 C ATOM 385 C ALA A 29 8.718 13.330 9.275 1.00 0.00 C ATOM 386 O ALA A 29 8.832 13.986 10.318 1.00 0.00 O ATOM 387 CB ALA A 29 10.680 12.565 7.872 1.00 0.00 C ATOM 0 H ALA A 29 10.513 15.119 9.256 1.00 0.00 H new ATOM 0 HA ALA A 29 8.993 13.691 7.173 1.00 0.00 H new ATOM 0 HB1 ALA A 29 10.193 11.603 7.714 1.00 0.00 H new ATOM 0 HB2 ALA A 29 11.292 12.809 7.004 1.00 0.00 H new ATOM 0 HB3 ALA A 29 11.312 12.511 8.758 1.00 0.00 H new ATOM 393 N GLY A 30 7.855 12.314 9.194 1.00 0.00 N ATOM 394 CA GLY A 30 7.152 11.759 10.341 1.00 0.00 C ATOM 395 C GLY A 30 5.872 11.088 9.875 1.00 0.00 C ATOM 396 O GLY A 30 5.712 10.826 8.680 1.00 0.00 O ATOM 0 H GLY A 30 7.625 11.851 8.315 1.00 0.00 H new ATOM 0 HA2 GLY A 30 7.787 11.038 10.856 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.922 12.548 11.056 1.00 0.00 H new ATOM 400 N SER A 31 4.971 10.786 10.810 1.00 0.00 N ATOM 401 CA SER A 31 3.630 10.351 10.466 1.00 0.00 C ATOM 402 C SER A 31 2.756 11.567 10.167 1.00 0.00 C ATOM 403 O SER A 31 2.741 12.534 10.932 1.00 0.00 O ATOM 404 CB SER A 31 3.042 9.429 11.548 1.00 0.00 C ATOM 405 OG SER A 31 2.854 10.010 12.824 1.00 0.00 O ATOM 0 H SER A 31 5.153 10.837 11.812 1.00 0.00 H new ATOM 0 HA SER A 31 3.667 9.746 9.560 1.00 0.00 H new ATOM 0 HB2 SER A 31 2.080 9.056 11.196 1.00 0.00 H new ATOM 0 HB3 SER A 31 3.698 8.566 11.657 1.00 0.00 H new ATOM 0 HG SER A 31 2.476 9.343 13.435 1.00 0.00 H new ATOM 411 N PHE A 32 2.019 11.518 9.060 1.00 0.00 N ATOM 412 CA PHE A 32 0.952 12.461 8.728 1.00 0.00 C ATOM 413 C PHE A 32 -0.176 11.727 7.992 1.00 0.00 C ATOM 414 O PHE A 32 -0.137 10.506 7.833 1.00 0.00 O ATOM 415 CB PHE A 32 1.513 13.658 7.936 1.00 0.00 C ATOM 416 CG PHE A 32 2.193 13.334 6.617 1.00 0.00 C ATOM 417 CD1 PHE A 32 3.489 12.782 6.616 1.00 0.00 C ATOM 418 CD2 PHE A 32 1.566 13.633 5.390 1.00 0.00 C ATOM 419 CE1 PHE A 32 4.147 12.515 5.405 1.00 0.00 C ATOM 420 CE2 PHE A 32 2.243 13.401 4.182 1.00 0.00 C ATOM 421 CZ PHE A 32 3.529 12.842 4.186 1.00 0.00 C ATOM 0 H PHE A 32 2.151 10.800 8.348 1.00 0.00 H new ATOM 0 HA PHE A 32 0.525 12.874 9.642 1.00 0.00 H new ATOM 0 HB2 PHE A 32 0.695 14.351 7.738 1.00 0.00 H new ATOM 0 HB3 PHE A 32 2.228 14.182 8.570 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.980 12.563 7.553 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.566 14.040 5.379 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.126 12.059 5.410 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.771 13.655 3.244 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.044 12.663 3.254 1.00 0.00 H new ATOM 431 N ILE A 33 -1.213 12.448 7.569 1.00 0.00 N ATOM 432 CA ILE A 33 -2.376 11.913 6.867 1.00 0.00 C ATOM 433 C ILE A 33 -2.572 12.770 5.601 1.00 0.00 C ATOM 434 O ILE A 33 -2.065 13.896 5.513 1.00 0.00 O ATOM 435 CB ILE A 33 -3.592 11.862 7.836 1.00 0.00 C ATOM 436 CG1 ILE A 33 -3.228 11.170 9.181 1.00 0.00 C ATOM 437 CG2 ILE A 33 -4.759 11.087 7.198 1.00 0.00 C ATOM 438 CD1 ILE A 33 -4.297 11.198 10.280 1.00 0.00 C ATOM 0 H ILE A 33 -1.267 13.457 7.711 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.246 10.881 6.540 1.00 0.00 H new ATOM 0 HB ILE A 33 -3.882 12.894 8.031 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -2.981 10.129 8.972 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.325 11.639 9.572 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -5.601 11.062 7.890 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -5.063 11.581 6.275 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -4.441 10.068 6.976 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -3.922 10.684 11.165 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -4.532 12.232 10.533 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -5.198 10.698 9.924 1.00 0.00 H new ATOM 450 N LEU A 34 -3.252 12.214 4.593 1.00 0.00 N ATOM 451 CA LEU A 34 -3.544 12.824 3.299 1.00 0.00 C ATOM 452 C LEU A 34 -4.998 12.521 2.958 1.00 0.00 C ATOM 453 O LEU A 34 -5.478 11.434 3.285 1.00 0.00 O ATOM 454 CB LEU A 34 -2.638 12.202 2.222 1.00 0.00 C ATOM 455 CG LEU A 34 -1.155 12.587 2.353 1.00 0.00 C ATOM 456 CD1 LEU A 34 -0.303 11.652 1.493 1.00 0.00 C ATOM 457 CD2 LEU A 34 -0.938 14.036 1.913 1.00 0.00 C ATOM 0 H LEU A 34 -3.634 11.271 4.666 1.00 0.00 H new ATOM 0 HA LEU A 34 -3.370 13.899 3.338 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -2.727 11.117 2.270 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.997 12.508 1.239 1.00 0.00 H new ATOM 0 HG LEU A 34 -0.858 12.491 3.397 1.00 0.00 H new ATOM 0 HD11 LEU A 34 0.747 11.927 1.588 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -0.440 10.624 1.828 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -0.608 11.738 0.450 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.117 14.292 2.012 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.243 14.150 0.873 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.533 14.700 2.540 1.00 0.00 H new ATOM 469 N ASP A 35 -5.676 13.433 2.259 1.00 0.00 N ATOM 470 CA ASP A 35 -7.099 13.306 1.949 1.00 0.00 C ATOM 471 C ASP A 35 -7.275 12.393 0.739 1.00 0.00 C ATOM 472 O ASP A 35 -7.234 12.841 -0.414 1.00 0.00 O ATOM 473 CB ASP A 35 -7.765 14.680 1.730 1.00 0.00 C ATOM 474 CG ASP A 35 -8.412 15.223 3.002 1.00 0.00 C ATOM 475 OD1 ASP A 35 -9.137 14.469 3.686 1.00 0.00 O ATOM 476 OD2 ASP A 35 -8.228 16.425 3.312 1.00 0.00 O ATOM 0 H ASP A 35 -5.251 14.284 1.891 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.604 12.857 2.805 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -7.018 15.390 1.374 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -8.521 14.594 0.949 1.00 0.00 H new ATOM 481 N ILE A 36 -7.490 11.101 0.994 1.00 0.00 N ATOM 482 CA ILE A 36 -7.598 10.059 -0.024 1.00 0.00 C ATOM 483 C ILE A 36 -8.976 9.418 0.086 1.00 0.00 C ATOM 484 O ILE A 36 -9.436 9.079 1.180 1.00 0.00 O ATOM 485 CB ILE A 36 -6.448 9.041 0.118 1.00 0.00 C ATOM 486 CG1 ILE A 36 -5.096 9.780 0.000 1.00 0.00 C ATOM 487 CG2 ILE A 36 -6.564 7.947 -0.959 1.00 0.00 C ATOM 488 CD1 ILE A 36 -3.860 8.898 0.158 1.00 0.00 C ATOM 0 H ILE A 36 -7.597 10.742 1.943 1.00 0.00 H new ATOM 0 HA ILE A 36 -7.500 10.485 -1.023 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.509 8.560 1.094 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -5.051 10.270 -0.972 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -5.062 10.565 0.755 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -5.745 7.236 -0.845 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.515 7.426 -0.847 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -6.514 8.403 -1.948 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.962 9.508 0.059 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.872 8.427 1.141 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.862 8.128 -0.613 1.00 0.00 H new ATOM 500 N THR A 37 -9.654 9.288 -1.047 1.00 0.00 N ATOM 501 CA THR A 37 -10.982 8.717 -1.169 1.00 0.00 C ATOM 502 C THR A 37 -10.852 7.213 -1.435 1.00 0.00 C ATOM 503 O THR A 37 -10.026 6.796 -2.251 1.00 0.00 O ATOM 504 CB THR A 37 -11.698 9.425 -2.328 1.00 0.00 C ATOM 505 OG1 THR A 37 -11.770 10.826 -2.157 1.00 0.00 O ATOM 506 CG2 THR A 37 -13.145 8.962 -2.411 1.00 0.00 C ATOM 0 H THR A 37 -9.273 9.592 -1.943 1.00 0.00 H new ATOM 0 HA THR A 37 -11.560 8.854 -0.255 1.00 0.00 H new ATOM 0 HB THR A 37 -11.118 9.180 -3.218 1.00 0.00 H new ATOM 0 HG1 THR A 37 -12.233 11.226 -2.923 1.00 0.00 H new ATOM 0 HG21 THR A 37 -13.643 9.471 -3.236 1.00 0.00 H new ATOM 0 HG22 THR A 37 -13.173 7.885 -2.578 1.00 0.00 H new ATOM 0 HG23 THR A 37 -13.657 9.198 -1.478 1.00 0.00 H new ATOM 514 N SER A 38 -11.696 6.391 -0.805 1.00 0.00 N ATOM 515 CA SER A 38 -11.582 4.936 -0.871 1.00 0.00 C ATOM 516 C SER A 38 -12.937 4.276 -0.595 1.00 0.00 C ATOM 517 O SER A 38 -13.161 3.760 0.501 1.00 0.00 O ATOM 518 CB SER A 38 -10.489 4.475 0.114 1.00 0.00 C ATOM 519 OG SER A 38 -10.627 5.078 1.392 1.00 0.00 O ATOM 0 H SER A 38 -12.477 6.718 -0.236 1.00 0.00 H new ATOM 0 HA SER A 38 -11.288 4.627 -1.874 1.00 0.00 H new ATOM 0 HB2 SER A 38 -10.532 3.391 0.220 1.00 0.00 H new ATOM 0 HB3 SER A 38 -9.508 4.717 -0.296 1.00 0.00 H new ATOM 0 HG SER A 38 -11.534 4.924 1.730 1.00 0.00 H new ATOM 525 N TYR A 39 -13.874 4.306 -1.550 1.00 0.00 N ATOM 526 CA TYR A 39 -15.202 3.716 -1.339 1.00 0.00 C ATOM 527 C TYR A 39 -15.893 3.319 -2.647 1.00 0.00 C ATOM 528 O TYR A 39 -15.417 3.642 -3.739 1.00 0.00 O ATOM 529 CB TYR A 39 -16.093 4.707 -0.541 1.00 0.00 C ATOM 530 CG TYR A 39 -16.501 6.001 -1.233 1.00 0.00 C ATOM 531 CD1 TYR A 39 -17.624 6.038 -2.085 1.00 0.00 C ATOM 532 CD2 TYR A 39 -15.824 7.200 -0.940 1.00 0.00 C ATOM 533 CE1 TYR A 39 -18.033 7.251 -2.671 1.00 0.00 C ATOM 534 CE2 TYR A 39 -16.231 8.413 -1.525 1.00 0.00 C ATOM 535 CZ TYR A 39 -17.315 8.437 -2.426 1.00 0.00 C ATOM 536 OH TYR A 39 -17.720 9.589 -3.020 1.00 0.00 O ATOM 0 H TYR A 39 -13.740 4.728 -2.469 1.00 0.00 H new ATOM 0 HA TYR A 39 -15.060 2.797 -0.770 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -17.002 4.181 -0.248 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -15.566 4.968 0.377 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -18.173 5.131 -2.289 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -14.985 7.189 -0.260 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -18.902 7.272 -3.312 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -15.712 9.328 -1.283 1.00 0.00 H new ATOM 0 HH TYR A 39 -17.412 9.603 -3.950 1.00 0.00 H new ATOM 546 N LYS A 40 -17.038 2.636 -2.557 1.00 0.00 N ATOM 547 CA LYS A 40 -17.903 2.308 -3.692 1.00 0.00 C ATOM 548 C LYS A 40 -19.317 2.807 -3.426 1.00 0.00 C ATOM 549 O LYS A 40 -19.805 2.656 -2.308 1.00 0.00 O ATOM 550 CB LYS A 40 -17.837 0.807 -3.996 1.00 0.00 C ATOM 551 CG LYS A 40 -18.278 -0.154 -2.871 1.00 0.00 C ATOM 552 CD LYS A 40 -19.680 -0.744 -3.076 1.00 0.00 C ATOM 553 CE LYS A 40 -19.683 -2.074 -3.839 1.00 0.00 C ATOM 554 NZ LYS A 40 -19.237 -3.221 -3.019 1.00 0.00 N ATOM 0 H LYS A 40 -17.398 2.287 -1.669 1.00 0.00 H new ATOM 0 HA LYS A 40 -17.551 2.818 -4.589 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -18.456 0.611 -4.872 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -16.811 0.561 -4.269 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -17.558 -0.969 -2.799 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -18.253 0.379 -1.920 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -20.148 -0.892 -2.103 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -20.292 -0.023 -3.618 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -20.689 -2.270 -4.209 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -19.035 -1.986 -4.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -19.294 -4.093 -3.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -18.254 -3.069 -2.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -19.849 -3.308 -2.182 1.00 0.00 H new ATOM 568 N LYS A 41 -19.957 3.435 -4.418 1.00 0.00 N ATOM 569 CA LYS A 41 -21.243 4.118 -4.296 1.00 0.00 C ATOM 570 C LYS A 41 -22.277 3.393 -5.125 1.00 0.00 C ATOM 571 O LYS A 41 -22.032 3.121 -6.302 1.00 0.00 O ATOM 572 CB LYS A 41 -21.074 5.549 -4.805 1.00 0.00 C ATOM 573 CG LYS A 41 -22.232 6.495 -4.476 1.00 0.00 C ATOM 574 CD LYS A 41 -21.833 7.935 -4.835 1.00 0.00 C ATOM 575 CE LYS A 41 -22.894 8.906 -4.323 1.00 0.00 C ATOM 576 NZ LYS A 41 -22.571 10.312 -4.640 1.00 0.00 N ATOM 0 H LYS A 41 -19.576 3.481 -5.363 1.00 0.00 H new ATOM 0 HA LYS A 41 -21.573 4.130 -3.257 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -20.157 5.962 -4.385 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -20.944 5.521 -5.887 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -23.123 6.204 -5.032 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -22.481 6.428 -3.417 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -20.865 8.175 -4.396 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -21.726 8.034 -5.915 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -23.859 8.650 -4.761 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -22.995 8.794 -3.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -23.321 10.932 -4.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -21.664 10.567 -4.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -22.501 10.428 -5.671 1.00 0.00 H new ATOM 590 N THR A 42 -23.413 3.073 -4.516 1.00 0.00 N ATOM 591 CA THR A 42 -24.500 2.358 -5.169 1.00 0.00 C ATOM 592 C THR A 42 -25.734 2.370 -4.265 1.00 0.00 C ATOM 593 O THR A 42 -25.630 2.558 -3.049 1.00 0.00 O ATOM 594 CB THR A 42 -24.035 0.940 -5.578 1.00 0.00 C ATOM 595 OG1 THR A 42 -25.072 0.166 -6.151 1.00 0.00 O ATOM 596 CG2 THR A 42 -23.357 0.160 -4.439 1.00 0.00 C ATOM 0 H THR A 42 -23.606 3.307 -3.542 1.00 0.00 H new ATOM 0 HA THR A 42 -24.787 2.857 -6.095 1.00 0.00 H new ATOM 0 HB THR A 42 -23.279 1.116 -6.343 1.00 0.00 H new ATOM 0 HG1 THR A 42 -24.838 -0.784 -6.099 1.00 0.00 H new ATOM 0 HG21 THR A 42 -23.058 -0.824 -4.800 1.00 0.00 H new ATOM 0 HG22 THR A 42 -22.476 0.705 -4.099 1.00 0.00 H new ATOM 0 HG23 THR A 42 -24.056 0.046 -3.610 1.00 0.00 H new ATOM 604 N GLY A 43 -26.908 2.150 -4.863 1.00 0.00 N ATOM 605 CA GLY A 43 -28.195 2.112 -4.189 1.00 0.00 C ATOM 606 C GLY A 43 -28.490 3.456 -3.541 1.00 0.00 C ATOM 607 O GLY A 43 -29.023 4.352 -4.195 1.00 0.00 O ATOM 0 H GLY A 43 -26.984 1.988 -5.867 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -28.980 1.865 -4.903 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -28.194 1.328 -3.432 1.00 0.00 H new ATOM 611 N ASN A 44 -28.135 3.597 -2.265 1.00 0.00 N ATOM 612 CA ASN A 44 -28.216 4.836 -1.500 1.00 0.00 C ATOM 613 C ASN A 44 -27.172 4.812 -0.372 1.00 0.00 C ATOM 614 O ASN A 44 -27.464 5.213 0.758 1.00 0.00 O ATOM 615 CB ASN A 44 -29.640 4.993 -0.939 1.00 0.00 C ATOM 616 CG ASN A 44 -29.917 6.372 -0.375 1.00 0.00 C ATOM 617 OD1 ASN A 44 -29.311 7.365 -0.768 1.00 0.00 O ATOM 618 ND2 ASN A 44 -30.901 6.458 0.494 1.00 0.00 N ATOM 0 H ASN A 44 -27.769 2.819 -1.716 1.00 0.00 H new ATOM 0 HA ASN A 44 -28.002 5.690 -2.142 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -30.359 4.781 -1.730 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -29.798 4.250 -0.157 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -31.180 7.368 0.860 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -31.385 5.614 0.801 1.00 0.00 H new ATOM 625 N SER A 45 -25.992 4.233 -0.611 1.00 0.00 N ATOM 626 CA SER A 45 -24.940 4.093 0.389 1.00 0.00 C ATOM 627 C SER A 45 -23.558 4.126 -0.259 1.00 0.00 C ATOM 628 O SER A 45 -23.390 3.911 -1.465 1.00 0.00 O ATOM 629 CB SER A 45 -25.174 2.790 1.169 1.00 0.00 C ATOM 630 OG SER A 45 -24.215 2.536 2.185 1.00 0.00 O ATOM 0 H SER A 45 -25.741 3.844 -1.520 1.00 0.00 H new ATOM 0 HA SER A 45 -24.976 4.933 1.082 1.00 0.00 H new ATOM 0 HB2 SER A 45 -26.165 2.824 1.622 1.00 0.00 H new ATOM 0 HB3 SER A 45 -25.173 1.955 0.468 1.00 0.00 H new ATOM 0 HG SER A 45 -24.432 1.693 2.636 1.00 0.00 H new ATOM 636 N THR A 46 -22.557 4.321 0.594 1.00 0.00 N ATOM 637 CA THR A 46 -21.150 4.192 0.289 1.00 0.00 C ATOM 638 C THR A 46 -20.512 3.320 1.370 1.00 0.00 C ATOM 639 O THR A 46 -20.495 3.691 2.546 1.00 0.00 O ATOM 640 CB THR A 46 -20.500 5.580 0.149 1.00 0.00 C ATOM 641 OG1 THR A 46 -20.858 6.456 1.194 1.00 0.00 O ATOM 642 CG2 THR A 46 -20.938 6.253 -1.150 1.00 0.00 C ATOM 0 H THR A 46 -22.722 4.587 1.565 1.00 0.00 H new ATOM 0 HA THR A 46 -20.995 3.703 -0.673 1.00 0.00 H new ATOM 0 HB THR A 46 -19.425 5.401 0.170 1.00 0.00 H new ATOM 0 HG1 THR A 46 -20.878 5.964 2.041 1.00 0.00 H new ATOM 0 HG21 THR A 46 -20.467 7.233 -1.229 1.00 0.00 H new ATOM 0 HG22 THR A 46 -20.638 5.637 -1.998 1.00 0.00 H new ATOM 0 HG23 THR A 46 -22.022 6.370 -1.152 1.00 0.00 H new ATOM 650 N LYS A 47 -20.031 2.130 1.003 1.00 0.00 N ATOM 651 CA LYS A 47 -19.108 1.377 1.851 1.00 0.00 C ATOM 652 C LYS A 47 -17.709 1.832 1.480 1.00 0.00 C ATOM 653 O LYS A 47 -17.389 1.847 0.286 1.00 0.00 O ATOM 654 CB LYS A 47 -19.247 -0.142 1.636 1.00 0.00 C ATOM 655 CG LYS A 47 -20.136 -0.750 2.728 1.00 0.00 C ATOM 656 CD LYS A 47 -20.440 -2.241 2.531 1.00 0.00 C ATOM 657 CE LYS A 47 -19.163 -3.084 2.607 1.00 0.00 C ATOM 658 NZ LYS A 47 -19.447 -4.526 2.726 1.00 0.00 N ATOM 0 H LYS A 47 -20.266 1.668 0.124 1.00 0.00 H new ATOM 0 HA LYS A 47 -19.327 1.564 2.902 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -19.677 -0.340 0.654 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -18.263 -0.611 1.654 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -19.650 -0.614 3.694 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -21.076 -0.200 2.764 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -21.144 -2.575 3.293 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -20.921 -2.392 1.565 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -18.561 -2.908 1.716 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -18.569 -2.762 3.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -18.552 -5.053 2.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -19.999 -4.701 3.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -19.991 -4.842 1.898 1.00 0.00 H new ATOM 672 N ALA A 48 -16.897 2.189 2.473 1.00 0.00 N ATOM 673 CA ALA A 48 -15.477 2.359 2.247 1.00 0.00 C ATOM 674 C ALA A 48 -14.851 0.995 1.987 1.00 0.00 C ATOM 675 O ALA A 48 -15.428 -0.055 2.295 1.00 0.00 O ATOM 676 CB ALA A 48 -14.791 3.021 3.441 1.00 0.00 C ATOM 0 H ALA A 48 -17.201 2.363 3.431 1.00 0.00 H new ATOM 0 HA ALA A 48 -15.341 3.011 1.384 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -13.727 3.132 3.234 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -15.231 4.003 3.615 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -14.926 2.401 4.328 1.00 0.00 H new ATOM 682 N LEU A 49 -13.635 1.026 1.465 1.00 0.00 N ATOM 683 CA LEU A 49 -12.791 -0.123 1.265 1.00 0.00 C ATOM 684 C LEU A 49 -11.441 0.154 1.905 1.00 0.00 C ATOM 685 O LEU A 49 -10.829 1.180 1.595 1.00 0.00 O ATOM 686 CB LEU A 49 -12.592 -0.314 -0.234 1.00 0.00 C ATOM 687 CG LEU A 49 -13.697 -0.954 -1.062 1.00 0.00 C ATOM 688 CD1 LEU A 49 -14.324 -2.146 -0.351 1.00 0.00 C ATOM 689 CD2 LEU A 49 -14.767 0.017 -1.559 1.00 0.00 C ATOM 0 H LEU A 49 -13.198 1.895 1.158 1.00 0.00 H new ATOM 0 HA LEU A 49 -13.241 -1.013 1.705 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -12.388 0.667 -0.664 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -11.693 -0.915 -0.370 1.00 0.00 H new ATOM 0 HG LEU A 49 -13.192 -1.312 -1.959 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -15.108 -2.572 -0.977 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -13.560 -2.900 -0.162 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -14.754 -1.820 0.596 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -15.512 -0.528 -2.139 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -15.249 0.495 -0.706 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -14.304 0.778 -2.187 1.00 0.00 H new ATOM 701 N SER A 50 -10.963 -0.753 2.754 1.00 0.00 N ATOM 702 CA SER A 50 -9.583 -0.702 3.217 1.00 0.00 C ATOM 703 C SER A 50 -8.650 -1.150 2.091 1.00 0.00 C ATOM 704 O SER A 50 -9.070 -1.779 1.112 1.00 0.00 O ATOM 705 CB SER A 50 -9.378 -1.575 4.455 1.00 0.00 C ATOM 706 OG SER A 50 -10.150 -1.115 5.552 1.00 0.00 O ATOM 0 H SER A 50 -11.509 -1.527 3.132 1.00 0.00 H new ATOM 0 HA SER A 50 -9.351 0.326 3.496 1.00 0.00 H new ATOM 0 HB2 SER A 50 -9.651 -2.605 4.224 1.00 0.00 H new ATOM 0 HB3 SER A 50 -8.323 -1.578 4.728 1.00 0.00 H new ATOM 0 HG SER A 50 -9.997 -1.696 6.326 1.00 0.00 H new ATOM 712 N TRP A 51 -7.373 -0.828 2.254 1.00 0.00 N ATOM 713 CA TRP A 51 -6.293 -1.069 1.323 1.00 0.00 C ATOM 714 C TRP A 51 -5.057 -1.518 2.083 1.00 0.00 C ATOM 715 O TRP A 51 -5.013 -1.440 3.313 1.00 0.00 O ATOM 716 CB TRP A 51 -6.011 0.235 0.553 1.00 0.00 C ATOM 717 CG TRP A 51 -5.401 1.369 1.320 1.00 0.00 C ATOM 718 CD1 TRP A 51 -4.073 1.577 1.465 1.00 0.00 C ATOM 719 CD2 TRP A 51 -6.054 2.510 1.958 1.00 0.00 C ATOM 720 NE1 TRP A 51 -3.858 2.777 2.110 1.00 0.00 N ATOM 721 CE2 TRP A 51 -5.042 3.424 2.370 1.00 0.00 C ATOM 722 CE3 TRP A 51 -7.392 2.897 2.197 1.00 0.00 C ATOM 723 CZ2 TRP A 51 -5.336 4.695 2.876 1.00 0.00 C ATOM 724 CZ3 TRP A 51 -7.693 4.153 2.760 1.00 0.00 C ATOM 725 CH2 TRP A 51 -6.673 5.070 3.061 1.00 0.00 C ATOM 0 H TRP A 51 -7.049 -0.360 3.100 1.00 0.00 H new ATOM 0 HA TRP A 51 -6.567 -1.854 0.618 1.00 0.00 H new ATOM 0 HB2 TRP A 51 -5.350 -0.002 -0.281 1.00 0.00 H new ATOM 0 HB3 TRP A 51 -6.951 0.584 0.126 1.00 0.00 H new ATOM 0 HD1 TRP A 51 -3.298 0.905 1.127 1.00 0.00 H new ATOM 0 HE1 TRP A 51 -2.938 3.138 2.362 1.00 0.00 H new ATOM 0 HE3 TRP A 51 -8.195 2.220 1.945 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 -4.539 5.381 3.122 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 -8.721 4.414 2.963 1.00 0.00 H new ATOM 0 HH2 TRP A 51 -6.917 6.055 3.431 1.00 0.00 H new ATOM 736 N ASN A 52 -4.022 -1.926 1.352 1.00 0.00 N ATOM 737 CA ASN A 52 -2.706 -2.119 1.935 1.00 0.00 C ATOM 738 C ASN A 52 -1.623 -1.704 0.945 1.00 0.00 C ATOM 739 O ASN A 52 -1.886 -1.580 -0.254 1.00 0.00 O ATOM 740 CB ASN A 52 -2.549 -3.568 2.413 1.00 0.00 C ATOM 741 CG ASN A 52 -1.705 -3.564 3.669 1.00 0.00 C ATOM 742 OD1 ASN A 52 -0.484 -3.515 3.584 1.00 0.00 O ATOM 743 ND2 ASN A 52 -2.328 -3.512 4.830 1.00 0.00 N ATOM 0 H ASN A 52 -4.074 -2.128 0.354 1.00 0.00 H new ATOM 0 HA ASN A 52 -2.595 -1.480 2.811 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -3.525 -4.010 2.613 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -2.077 -4.174 1.640 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -1.791 -3.428 5.693 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -3.346 -3.555 4.865 1.00 0.00 H new ATOM 750 N ALA A 53 -0.395 -1.509 1.421 1.00 0.00 N ATOM 751 CA ALA A 53 0.735 -0.954 0.671 1.00 0.00 C ATOM 752 C ALA A 53 1.871 -1.981 0.577 1.00 0.00 C ATOM 753 O ALA A 53 1.675 -3.122 1.000 1.00 0.00 O ATOM 754 CB ALA A 53 1.179 0.340 1.351 1.00 0.00 C ATOM 0 H ALA A 53 -0.147 -1.743 2.382 1.00 0.00 H new ATOM 0 HA ALA A 53 0.438 -0.724 -0.352 1.00 0.00 H new ATOM 0 HB1 ALA A 53 2.020 0.768 0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.352 1.050 1.357 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.482 0.127 2.376 1.00 0.00 H new ATOM 760 N SER A 54 3.007 -1.599 -0.011 1.00 0.00 N ATOM 761 CA SER A 54 4.365 -2.086 0.246 1.00 0.00 C ATOM 762 C SER A 54 5.325 -1.453 -0.762 1.00 0.00 C ATOM 763 O SER A 54 5.000 -1.320 -1.950 1.00 0.00 O ATOM 764 CB SER A 54 4.494 -3.617 0.188 1.00 0.00 C ATOM 765 OG SER A 54 4.311 -4.201 1.467 1.00 0.00 O ATOM 0 H SER A 54 3.001 -0.883 -0.738 1.00 0.00 H new ATOM 0 HA SER A 54 4.616 -1.794 1.266 1.00 0.00 H new ATOM 0 HB2 SER A 54 3.756 -4.020 -0.506 1.00 0.00 H new ATOM 0 HB3 SER A 54 5.477 -3.886 -0.199 1.00 0.00 H new ATOM 0 HG SER A 54 3.389 -4.053 1.765 1.00 0.00 H new ATOM 771 N GLY A 55 6.545 -1.141 -0.325 1.00 0.00 N ATOM 772 CA GLY A 55 7.622 -0.784 -1.224 1.00 0.00 C ATOM 773 C GLY A 55 8.937 -0.673 -0.473 1.00 0.00 C ATOM 774 O GLY A 55 9.485 -1.689 -0.045 1.00 0.00 O ATOM 0 H GLY A 55 6.806 -1.131 0.661 1.00 0.00 H new ATOM 0 HA2 GLY A 55 7.709 -1.534 -2.010 1.00 0.00 H new ATOM 0 HA3 GLY A 55 7.395 0.164 -1.712 1.00 0.00 H new ATOM 778 N ASP A 56 9.447 0.545 -0.334 1.00 0.00 N ATOM 779 CA ASP A 56 10.707 0.838 0.341 1.00 0.00 C ATOM 780 C ASP A 56 10.539 0.568 1.837 1.00 0.00 C ATOM 781 O ASP A 56 9.490 0.893 2.392 1.00 0.00 O ATOM 782 CB ASP A 56 11.044 2.319 0.135 1.00 0.00 C ATOM 783 CG ASP A 56 11.724 2.624 -1.199 1.00 0.00 C ATOM 784 OD1 ASP A 56 11.007 2.716 -2.226 1.00 0.00 O ATOM 785 OD2 ASP A 56 12.970 2.747 -1.211 1.00 0.00 O ATOM 0 H ASP A 56 8.984 1.378 -0.697 1.00 0.00 H new ATOM 0 HA ASP A 56 11.505 0.214 -0.063 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.126 2.903 0.205 1.00 0.00 H new ATOM 0 HB3 ASP A 56 11.694 2.649 0.946 1.00 0.00 H new ATOM 790 N SER A 57 11.562 0.035 2.511 1.00 0.00 N ATOM 791 CA SER A 57 11.498 -0.311 3.938 1.00 0.00 C ATOM 792 C SER A 57 11.334 0.900 4.872 1.00 0.00 C ATOM 793 O SER A 57 11.156 0.710 6.074 1.00 0.00 O ATOM 794 CB SER A 57 12.767 -1.073 4.351 1.00 0.00 C ATOM 795 OG SER A 57 13.074 -2.123 3.450 1.00 0.00 O ATOM 0 H SER A 57 12.464 -0.171 2.082 1.00 0.00 H new ATOM 0 HA SER A 57 10.606 -0.927 4.049 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.607 -0.380 4.399 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.634 -1.482 5.353 1.00 0.00 H new ATOM 0 HG SER A 57 13.888 -2.581 3.747 1.00 0.00 H new ATOM 801 N TRP A 58 11.433 2.124 4.348 1.00 0.00 N ATOM 802 CA TRP A 58 11.416 3.369 5.105 1.00 0.00 C ATOM 803 C TRP A 58 10.139 4.177 4.846 1.00 0.00 C ATOM 804 O TRP A 58 10.095 5.363 5.163 1.00 0.00 O ATOM 805 CB TRP A 58 12.713 4.146 4.817 1.00 0.00 C ATOM 806 CG TRP A 58 13.010 4.407 3.368 1.00 0.00 C ATOM 807 CD1 TRP A 58 13.665 3.568 2.533 1.00 0.00 C ATOM 808 CD2 TRP A 58 12.601 5.544 2.550 1.00 0.00 C ATOM 809 NE1 TRP A 58 13.709 4.115 1.264 1.00 0.00 N ATOM 810 CE2 TRP A 58 13.075 5.335 1.223 1.00 0.00 C ATOM 811 CE3 TRP A 58 11.855 6.717 2.783 1.00 0.00 C ATOM 812 CZ2 TRP A 58 12.839 6.247 0.188 1.00 0.00 C ATOM 813 CZ3 TRP A 58 11.588 7.628 1.745 1.00 0.00 C ATOM 814 CH2 TRP A 58 12.081 7.400 0.450 1.00 0.00 C ATOM 0 H TRP A 58 11.531 2.276 3.344 1.00 0.00 H new ATOM 0 HA TRP A 58 11.390 3.153 6.173 1.00 0.00 H new ATOM 0 HB2 TRP A 58 12.664 5.103 5.337 1.00 0.00 H new ATOM 0 HB3 TRP A 58 13.549 3.593 5.246 1.00 0.00 H new ATOM 0 HD1 TRP A 58 14.089 2.616 2.815 1.00 0.00 H new ATOM 0 HE1 TRP A 58 14.154 3.671 0.461 1.00 0.00 H new ATOM 0 HE3 TRP A 58 11.482 6.920 3.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 13.235 6.066 -0.800 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 10.999 8.511 1.946 1.00 0.00 H new ATOM 0 HH2 TRP A 58 11.878 8.108 -0.340 1.00 0.00 H new ATOM 825 N ILE A 59 9.105 3.558 4.266 1.00 0.00 N ATOM 826 CA ILE A 59 7.817 4.182 3.988 1.00 0.00 C ATOM 827 C ILE A 59 6.758 3.246 4.570 1.00 0.00 C ATOM 828 O ILE A 59 6.815 2.035 4.339 1.00 0.00 O ATOM 829 CB ILE A 59 7.631 4.411 2.468 1.00 0.00 C ATOM 830 CG1 ILE A 59 8.818 5.179 1.833 1.00 0.00 C ATOM 831 CG2 ILE A 59 6.306 5.166 2.227 1.00 0.00 C ATOM 832 CD1 ILE A 59 8.737 5.314 0.303 1.00 0.00 C ATOM 0 H ILE A 59 9.147 2.583 3.971 1.00 0.00 H new ATOM 0 HA ILE A 59 7.739 5.170 4.442 1.00 0.00 H new ATOM 0 HB ILE A 59 7.599 3.435 1.983 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.868 6.175 2.272 1.00 0.00 H new ATOM 0 HG13 ILE A 59 9.746 4.670 2.093 1.00 0.00 H new ATOM 0 HG21 ILE A 59 6.170 5.330 1.158 1.00 0.00 H new ATOM 0 HG22 ILE A 59 5.475 4.575 2.612 1.00 0.00 H new ATOM 0 HG23 ILE A 59 6.336 6.127 2.741 1.00 0.00 H new ATOM 0 HD11 ILE A 59 9.605 5.864 -0.060 1.00 0.00 H new ATOM 0 HD12 ILE A 59 8.720 4.322 -0.149 1.00 0.00 H new ATOM 0 HD13 ILE A 59 7.828 5.852 0.033 1.00 0.00 H new ATOM 844 N HIS A 60 5.793 3.798 5.303 1.00 0.00 N ATOM 845 CA HIS A 60 4.784 3.054 6.040 1.00 0.00 C ATOM 846 C HIS A 60 3.405 3.614 5.719 1.00 0.00 C ATOM 847 O HIS A 60 3.251 4.824 5.531 1.00 0.00 O ATOM 848 CB HIS A 60 5.047 3.180 7.544 1.00 0.00 C ATOM 849 CG HIS A 60 6.447 2.810 7.953 1.00 0.00 C ATOM 850 ND1 HIS A 60 6.928 1.529 8.080 1.00 0.00 N ATOM 851 CD2 HIS A 60 7.476 3.676 8.216 1.00 0.00 C ATOM 852 CE1 HIS A 60 8.224 1.619 8.416 1.00 0.00 C ATOM 853 NE2 HIS A 60 8.601 2.904 8.530 1.00 0.00 N ATOM 0 H HIS A 60 5.692 4.808 5.401 1.00 0.00 H new ATOM 0 HA HIS A 60 4.828 2.004 5.752 1.00 0.00 H new ATOM 0 HB2 HIS A 60 4.849 4.206 7.853 1.00 0.00 H new ATOM 0 HB3 HIS A 60 4.343 2.544 8.080 1.00 0.00 H new ATOM 0 HD2 HIS A 60 7.428 4.755 8.187 1.00 0.00 H new ATOM 0 HE1 HIS A 60 8.876 0.773 8.574 1.00 0.00 H new ATOM 0 HE2 HIS A 60 9.524 3.249 8.793 1.00 0.00 H new ATOM 861 N VAL A 61 2.390 2.751 5.722 1.00 0.00 N ATOM 862 CA VAL A 61 1.014 3.119 5.429 1.00 0.00 C ATOM 863 C VAL A 61 0.118 2.408 6.446 1.00 0.00 C ATOM 864 O VAL A 61 -0.140 1.207 6.339 1.00 0.00 O ATOM 865 CB VAL A 61 0.691 2.781 3.958 1.00 0.00 C ATOM 866 CG1 VAL A 61 -0.720 3.251 3.598 1.00 0.00 C ATOM 867 CG2 VAL A 61 1.676 3.426 2.962 1.00 0.00 C ATOM 0 H VAL A 61 2.508 1.760 5.932 1.00 0.00 H new ATOM 0 HA VAL A 61 0.841 4.190 5.529 1.00 0.00 H new ATOM 0 HB VAL A 61 0.776 1.697 3.875 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.931 3.005 2.557 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -1.445 2.754 4.243 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -0.791 4.330 3.737 1.00 0.00 H new ATOM 0 HG21 VAL A 61 1.397 3.152 1.945 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.642 4.510 3.068 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.686 3.073 3.169 1.00 0.00 H new ATOM 877 N ASN A 62 -0.301 3.131 7.488 1.00 0.00 N ATOM 878 CA ASN A 62 -1.244 2.713 8.513 1.00 0.00 C ATOM 879 C ASN A 62 -2.671 3.070 8.076 1.00 0.00 C ATOM 880 O ASN A 62 -3.343 3.934 8.654 1.00 0.00 O ATOM 881 CB ASN A 62 -0.837 3.406 9.815 1.00 0.00 C ATOM 882 CG ASN A 62 -1.289 2.588 10.997 1.00 0.00 C ATOM 883 OD1 ASN A 62 -2.458 2.575 11.376 1.00 0.00 O ATOM 884 ND2 ASN A 62 -0.350 1.896 11.604 1.00 0.00 N ATOM 0 H ASN A 62 0.034 4.082 7.642 1.00 0.00 H new ATOM 0 HA ASN A 62 -1.227 1.634 8.667 1.00 0.00 H new ATOM 0 HB2 ASN A 62 0.245 3.536 9.845 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -1.279 4.401 9.861 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -0.582 1.325 12.417 1.00 0.00 H new ATOM 0 HD22 ASN A 62 0.610 1.930 11.262 1.00 0.00 H new ATOM 891 N GLY A 63 -3.113 2.461 6.978 1.00 0.00 N ATOM 892 CA GLY A 63 -4.252 2.942 6.217 1.00 0.00 C ATOM 893 C GLY A 63 -3.976 4.384 5.806 1.00 0.00 C ATOM 894 O GLY A 63 -2.972 4.641 5.145 1.00 0.00 O ATOM 0 H GLY A 63 -2.686 1.618 6.594 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.411 2.320 5.336 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -5.161 2.885 6.816 1.00 0.00 H new ATOM 898 N SER A 64 -4.825 5.329 6.205 1.00 0.00 N ATOM 899 CA SER A 64 -4.666 6.726 5.833 1.00 0.00 C ATOM 900 C SER A 64 -3.411 7.384 6.427 1.00 0.00 C ATOM 901 O SER A 64 -2.902 8.342 5.834 1.00 0.00 O ATOM 902 CB SER A 64 -5.959 7.487 6.158 1.00 0.00 C ATOM 903 OG SER A 64 -6.475 7.167 7.437 1.00 0.00 O ATOM 0 H SER A 64 -5.638 5.145 6.793 1.00 0.00 H new ATOM 0 HA SER A 64 -4.496 6.772 4.757 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.768 8.559 6.106 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.709 7.260 5.401 1.00 0.00 H new ATOM 0 HG SER A 64 -7.296 7.678 7.596 1.00 0.00 H new ATOM 909 N SER A 65 -2.872 6.891 7.548 1.00 0.00 N ATOM 910 CA SER A 65 -1.718 7.503 8.192 1.00 0.00 C ATOM 911 C SER A 65 -0.435 7.065 7.473 1.00 0.00 C ATOM 912 O SER A 65 0.114 5.986 7.731 1.00 0.00 O ATOM 913 CB SER A 65 -1.706 7.230 9.705 1.00 0.00 C ATOM 914 OG SER A 65 -2.924 6.695 10.203 1.00 0.00 O ATOM 0 H SER A 65 -3.225 6.062 8.027 1.00 0.00 H new ATOM 0 HA SER A 65 -1.781 8.587 8.102 1.00 0.00 H new ATOM 0 HB2 SER A 65 -0.896 6.537 9.933 1.00 0.00 H new ATOM 0 HB3 SER A 65 -1.487 8.160 10.230 1.00 0.00 H new ATOM 0 HG SER A 65 -2.845 6.545 11.168 1.00 0.00 H new ATOM 920 N VAL A 66 0.023 7.888 6.532 1.00 0.00 N ATOM 921 CA VAL A 66 1.301 7.738 5.855 1.00 0.00 C ATOM 922 C VAL A 66 2.413 8.028 6.867 1.00 0.00 C ATOM 923 O VAL A 66 2.233 8.788 7.825 1.00 0.00 O ATOM 924 CB VAL A 66 1.331 8.658 4.609 1.00 0.00 C ATOM 925 CG1 VAL A 66 0.984 10.128 4.891 1.00 0.00 C ATOM 926 CG2 VAL A 66 2.674 8.604 3.865 1.00 0.00 C ATOM 0 H VAL A 66 -0.504 8.701 6.213 1.00 0.00 H new ATOM 0 HA VAL A 66 1.454 6.724 5.486 1.00 0.00 H new ATOM 0 HB VAL A 66 0.543 8.247 3.978 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.030 10.697 3.963 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.022 10.191 5.306 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.697 10.540 5.605 1.00 0.00 H new ATOM 0 HG21 VAL A 66 2.638 9.268 3.001 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.474 8.922 4.534 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.864 7.584 3.531 1.00 0.00 H new ATOM 936 N SER A 67 3.588 7.429 6.705 1.00 0.00 N ATOM 937 CA SER A 67 4.801 7.868 7.380 1.00 0.00 C ATOM 938 C SER A 67 6.004 7.525 6.513 1.00 0.00 C ATOM 939 O SER A 67 5.932 6.615 5.685 1.00 0.00 O ATOM 940 CB SER A 67 4.926 7.205 8.762 1.00 0.00 C ATOM 941 OG SER A 67 3.687 7.238 9.456 1.00 0.00 O ATOM 0 H SER A 67 3.725 6.621 6.098 1.00 0.00 H new ATOM 0 HA SER A 67 4.758 8.947 7.532 1.00 0.00 H new ATOM 0 HB2 SER A 67 5.254 6.172 8.646 1.00 0.00 H new ATOM 0 HB3 SER A 67 5.689 7.718 9.348 1.00 0.00 H new ATOM 0 HG SER A 67 3.138 7.972 9.110 1.00 0.00 H new ATOM 947 N TYR A 68 7.114 8.216 6.734 1.00 0.00 N ATOM 948 CA TYR A 68 8.421 7.836 6.220 1.00 0.00 C ATOM 949 C TYR A 68 9.488 8.409 7.145 1.00 0.00 C ATOM 950 O TYR A 68 9.199 9.310 7.938 1.00 0.00 O ATOM 951 CB TYR A 68 8.596 8.283 4.759 1.00 0.00 C ATOM 952 CG TYR A 68 8.039 9.645 4.383 1.00 0.00 C ATOM 953 CD1 TYR A 68 8.790 10.815 4.620 1.00 0.00 C ATOM 954 CD2 TYR A 68 6.805 9.728 3.705 1.00 0.00 C ATOM 955 CE1 TYR A 68 8.319 12.062 4.168 1.00 0.00 C ATOM 956 CE2 TYR A 68 6.345 10.964 3.231 1.00 0.00 C ATOM 957 CZ TYR A 68 7.102 12.134 3.452 1.00 0.00 C ATOM 958 OH TYR A 68 6.641 13.312 2.956 1.00 0.00 O ATOM 0 H TYR A 68 7.130 9.073 7.287 1.00 0.00 H new ATOM 0 HA TYR A 68 8.520 6.751 6.208 1.00 0.00 H new ATOM 0 HB2 TYR A 68 9.661 8.277 4.528 1.00 0.00 H new ATOM 0 HB3 TYR A 68 8.127 7.537 4.118 1.00 0.00 H new ATOM 0 HD1 TYR A 68 9.729 10.754 5.150 1.00 0.00 H new ATOM 0 HD2 TYR A 68 6.214 8.838 3.551 1.00 0.00 H new ATOM 0 HE1 TYR A 68 8.885 12.960 4.367 1.00 0.00 H new ATOM 0 HE2 TYR A 68 5.409 11.021 2.695 1.00 0.00 H new ATOM 0 HH TYR A 68 5.747 13.491 3.315 1.00 0.00 H new ATOM 968 N ASP A 69 10.708 7.882 7.061 1.00 0.00 N ATOM 969 CA ASP A 69 11.887 8.401 7.756 1.00 0.00 C ATOM 970 C ASP A 69 12.866 8.913 6.709 1.00 0.00 C ATOM 971 O ASP A 69 12.868 8.437 5.572 1.00 0.00 O ATOM 972 CB ASP A 69 12.597 7.318 8.586 1.00 0.00 C ATOM 973 CG ASP A 69 11.908 6.958 9.901 1.00 0.00 C ATOM 974 OD1 ASP A 69 10.698 6.633 9.903 1.00 0.00 O ATOM 975 OD2 ASP A 69 12.599 6.862 10.940 1.00 0.00 O ATOM 0 H ASP A 69 10.910 7.060 6.492 1.00 0.00 H new ATOM 0 HA ASP A 69 11.561 9.188 8.435 1.00 0.00 H new ATOM 0 HB2 ASP A 69 12.684 6.416 7.980 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.610 7.655 8.804 1.00 0.00 H new ATOM 980 N GLU A 70 13.742 9.837 7.112 1.00 0.00 N ATOM 981 CA GLU A 70 14.848 10.286 6.281 1.00 0.00 C ATOM 982 C GLU A 70 15.818 9.128 6.062 1.00 0.00 C ATOM 983 O GLU A 70 16.121 8.358 6.978 1.00 0.00 O ATOM 984 CB GLU A 70 15.567 11.484 6.915 1.00 0.00 C ATOM 985 CG GLU A 70 15.444 12.743 6.048 1.00 0.00 C ATOM 986 CD GLU A 70 16.291 13.902 6.591 1.00 0.00 C ATOM 987 OE1 GLU A 70 17.539 13.800 6.550 1.00 0.00 O ATOM 988 OE2 GLU A 70 15.702 14.895 7.082 1.00 0.00 O ATOM 0 H GLU A 70 13.699 10.291 8.024 1.00 0.00 H new ATOM 0 HA GLU A 70 14.455 10.614 5.319 1.00 0.00 H new ATOM 0 HB2 GLU A 70 15.148 11.679 7.902 1.00 0.00 H new ATOM 0 HB3 GLU A 70 16.620 11.242 7.058 1.00 0.00 H new ATOM 0 HG2 GLU A 70 15.756 12.513 5.029 1.00 0.00 H new ATOM 0 HG3 GLU A 70 14.399 13.049 6.000 1.00 0.00 H new ATOM 995 N ASN A 71 16.350 9.037 4.849 1.00 0.00 N ATOM 996 CA ASN A 71 17.390 8.084 4.487 1.00 0.00 C ATOM 997 C ASN A 71 18.706 8.417 5.200 1.00 0.00 C ATOM 998 O ASN A 71 19.045 9.592 5.345 1.00 0.00 O ATOM 999 CB ASN A 71 17.624 8.059 2.970 1.00 0.00 C ATOM 1000 CG ASN A 71 17.731 9.451 2.370 1.00 0.00 C ATOM 1001 OD1 ASN A 71 16.713 10.110 2.223 1.00 0.00 O ATOM 1002 ND2 ASN A 71 18.891 9.931 1.974 1.00 0.00 N ATOM 0 H ASN A 71 16.064 9.636 4.075 1.00 0.00 H new ATOM 0 HA ASN A 71 17.048 7.098 4.803 1.00 0.00 H new ATOM 0 HB2 ASN A 71 18.538 7.505 2.757 1.00 0.00 H new ATOM 0 HB3 ASN A 71 16.806 7.522 2.489 1.00 0.00 H new ATOM 0 HD21 ASN A 71 18.941 10.854 1.544 1.00 0.00 H new ATOM 0 HD22 ASN A 71 19.740 9.379 2.097 1.00 0.00 H new ATOM 1009 N PRO A 72 19.491 7.391 5.578 1.00 0.00 N ATOM 1010 CA PRO A 72 20.773 7.551 6.264 1.00 0.00 C ATOM 1011 C PRO A 72 21.955 7.748 5.298 1.00 0.00 C ATOM 1012 O PRO A 72 23.101 7.890 5.733 1.00 0.00 O ATOM 1013 CB PRO A 72 20.934 6.232 7.023 1.00 0.00 C ATOM 1014 CG PRO A 72 20.311 5.211 6.080 1.00 0.00 C ATOM 1015 CD PRO A 72 19.120 5.979 5.528 1.00 0.00 C ATOM 0 HA PRO A 72 20.776 8.439 6.896 1.00 0.00 H new ATOM 0 HB2 PRO A 72 21.982 6.008 7.224 1.00 0.00 H new ATOM 0 HB3 PRO A 72 20.423 6.256 7.985 1.00 0.00 H new ATOM 0 HG2 PRO A 72 21.001 4.907 5.293 1.00 0.00 H new ATOM 0 HG3 PRO A 72 20.006 4.305 6.603 1.00 0.00 H new ATOM 0 HD2 PRO A 72 18.897 5.671 4.507 1.00 0.00 H new ATOM 0 HD3 PRO A 72 18.225 5.790 6.121 1.00 0.00 H new ATOM 1023 N ALA A 73 21.714 7.654 3.987 1.00 0.00 N ATOM 1024 CA ALA A 73 22.702 7.928 2.955 1.00 0.00 C ATOM 1025 C ALA A 73 22.704 9.426 2.647 1.00 0.00 C ATOM 1026 O ALA A 73 21.721 10.109 2.939 1.00 0.00 O ATOM 1027 CB ALA A 73 22.344 7.115 1.714 1.00 0.00 C ATOM 0 H ALA A 73 20.806 7.379 3.612 1.00 0.00 H new ATOM 0 HA ALA A 73 23.700 7.645 3.289 1.00 0.00 H new ATOM 0 HB1 ALA A 73 23.075 7.308 0.929 1.00 0.00 H new ATOM 0 HB2 ALA A 73 22.349 6.053 1.961 1.00 0.00 H new ATOM 0 HB3 ALA A 73 21.352 7.402 1.365 1.00 0.00 H new ATOM 1033 N LYS A 74 23.762 9.933 2.005 1.00 0.00 N ATOM 1034 CA LYS A 74 23.918 11.363 1.720 1.00 0.00 C ATOM 1035 C LYS A 74 23.370 11.777 0.355 1.00 0.00 C ATOM 1036 O LYS A 74 23.214 12.971 0.091 1.00 0.00 O ATOM 1037 CB LYS A 74 25.347 11.856 1.988 1.00 0.00 C ATOM 1038 CG LYS A 74 26.502 11.032 1.423 1.00 0.00 C ATOM 1039 CD LYS A 74 26.751 11.265 -0.072 1.00 0.00 C ATOM 1040 CE LYS A 74 27.961 10.436 -0.522 1.00 0.00 C ATOM 1041 NZ LYS A 74 28.370 10.769 -1.900 1.00 0.00 N ATOM 0 H LYS A 74 24.536 9.361 1.668 1.00 0.00 H new ATOM 0 HA LYS A 74 23.283 11.885 2.435 1.00 0.00 H new ATOM 0 HB2 LYS A 74 25.432 12.868 1.592 1.00 0.00 H new ATOM 0 HB3 LYS A 74 25.481 11.924 3.068 1.00 0.00 H new ATOM 0 HG2 LYS A 74 27.411 11.270 1.975 1.00 0.00 H new ATOM 0 HG3 LYS A 74 26.297 9.974 1.588 1.00 0.00 H new ATOM 0 HD2 LYS A 74 25.869 10.983 -0.647 1.00 0.00 H new ATOM 0 HD3 LYS A 74 26.930 12.323 -0.262 1.00 0.00 H new ATOM 0 HE2 LYS A 74 28.795 10.612 0.157 1.00 0.00 H new ATOM 0 HE3 LYS A 74 27.718 9.375 -0.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 29.190 10.189 -2.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 27.582 10.578 -2.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 28.626 11.776 -1.952 1.00 0.00 H new ATOM 1055 N GLU A 75 23.052 10.818 -0.512 1.00 0.00 N ATOM 1056 CA GLU A 75 22.359 11.112 -1.762 1.00 0.00 C ATOM 1057 C GLU A 75 20.887 11.419 -1.494 1.00 0.00 C ATOM 1058 O GLU A 75 20.332 10.990 -0.483 1.00 0.00 O ATOM 1059 CB GLU A 75 22.462 9.924 -2.724 1.00 0.00 C ATOM 1060 CG GLU A 75 23.914 9.651 -3.110 1.00 0.00 C ATOM 1061 CD GLU A 75 23.999 8.629 -4.233 1.00 0.00 C ATOM 1062 OE1 GLU A 75 23.736 7.431 -3.979 1.00 0.00 O ATOM 1063 OE2 GLU A 75 24.385 9.021 -5.359 1.00 0.00 O ATOM 0 H GLU A 75 23.264 9.830 -0.371 1.00 0.00 H new ATOM 0 HA GLU A 75 22.832 11.983 -2.216 1.00 0.00 H new ATOM 0 HB2 GLU A 75 22.034 9.037 -2.258 1.00 0.00 H new ATOM 0 HB3 GLU A 75 21.876 10.127 -3.621 1.00 0.00 H new ATOM 0 HG2 GLU A 75 24.391 10.580 -3.422 1.00 0.00 H new ATOM 0 HG3 GLU A 75 24.462 9.287 -2.241 1.00 0.00 H new ATOM 1070 N ARG A 76 20.239 12.096 -2.444 1.00 0.00 N ATOM 1071 CA ARG A 76 18.779 12.163 -2.520 1.00 0.00 C ATOM 1072 C ARG A 76 18.295 10.843 -3.132 1.00 0.00 C ATOM 1073 O ARG A 76 18.966 10.299 -4.017 1.00 0.00 O ATOM 1074 CB ARG A 76 18.364 13.414 -3.339 1.00 0.00 C ATOM 1075 CG ARG A 76 17.418 14.306 -2.525 1.00 0.00 C ATOM 1076 CD ARG A 76 17.181 15.716 -3.076 1.00 0.00 C ATOM 1077 NE ARG A 76 16.391 16.548 -2.138 1.00 0.00 N ATOM 1078 CZ ARG A 76 16.807 17.285 -1.092 1.00 0.00 C ATOM 1079 NH1 ARG A 76 18.099 17.442 -0.813 1.00 0.00 N ATOM 1080 NH2 ARG A 76 15.920 17.898 -0.311 1.00 0.00 N ATOM 0 H ARG A 76 20.713 12.614 -3.184 1.00 0.00 H new ATOM 0 HA ARG A 76 18.315 12.275 -1.540 1.00 0.00 H new ATOM 0 HB2 ARG A 76 19.251 13.980 -3.622 1.00 0.00 H new ATOM 0 HB3 ARG A 76 17.875 13.104 -4.263 1.00 0.00 H new ATOM 0 HG2 ARG A 76 16.455 13.802 -2.446 1.00 0.00 H new ATOM 0 HG3 ARG A 76 17.815 14.395 -1.514 1.00 0.00 H new ATOM 0 HD2 ARG A 76 18.140 16.197 -3.269 1.00 0.00 H new ATOM 0 HD3 ARG A 76 16.660 15.650 -4.031 1.00 0.00 H new ATOM 0 HE ARG A 76 15.386 16.564 -2.310 1.00 0.00 H new ATOM 0 HH11 ARG A 76 18.805 16.997 -1.400 1.00 0.00 H new ATOM 0 HH12 ARG A 76 18.383 18.007 -0.013 1.00 0.00 H new ATOM 0 HH21 ARG A 76 14.923 17.809 -0.505 1.00 0.00 H new ATOM 0 HH22 ARG A 76 16.238 18.456 0.481 1.00 0.00 H new ATOM 1094 N ARG A 77 17.185 10.276 -2.658 1.00 0.00 N ATOM 1095 CA ARG A 77 16.749 8.920 -2.994 1.00 0.00 C ATOM 1096 C ARG A 77 15.229 8.876 -2.982 1.00 0.00 C ATOM 1097 O ARG A 77 14.620 8.464 -1.996 1.00 0.00 O ATOM 1098 CB ARG A 77 17.350 7.899 -1.996 1.00 0.00 C ATOM 1099 CG ARG A 77 18.826 7.549 -2.246 1.00 0.00 C ATOM 1100 CD ARG A 77 18.965 6.709 -3.522 1.00 0.00 C ATOM 1101 NE ARG A 77 20.355 6.554 -3.965 1.00 0.00 N ATOM 1102 CZ ARG A 77 20.707 5.962 -5.112 1.00 0.00 C ATOM 1103 NH1 ARG A 77 19.798 5.359 -5.879 1.00 0.00 N ATOM 1104 NH2 ARG A 77 21.979 5.964 -5.477 1.00 0.00 N ATOM 0 H ARG A 77 16.552 10.755 -2.018 1.00 0.00 H new ATOM 0 HA ARG A 77 17.103 8.651 -3.989 1.00 0.00 H new ATOM 0 HB2 ARG A 77 17.251 8.297 -0.986 1.00 0.00 H new ATOM 0 HB3 ARG A 77 16.761 6.982 -2.036 1.00 0.00 H new ATOM 0 HG2 ARG A 77 19.413 8.463 -2.338 1.00 0.00 H new ATOM 0 HG3 ARG A 77 19.226 6.998 -1.394 1.00 0.00 H new ATOM 0 HD2 ARG A 77 18.534 5.723 -3.349 1.00 0.00 H new ATOM 0 HD3 ARG A 77 18.386 7.174 -4.320 1.00 0.00 H new ATOM 0 HE ARG A 77 21.095 6.918 -3.365 1.00 0.00 H new ATOM 0 HH11 ARG A 77 18.819 5.345 -5.594 1.00 0.00 H new ATOM 0 HH12 ARG A 77 20.082 4.912 -6.751 1.00 0.00 H new ATOM 0 HH21 ARG A 77 22.678 6.414 -4.886 1.00 0.00 H new ATOM 0 HH22 ARG A 77 22.260 5.516 -6.349 1.00 0.00 H new ATOM 1118 N THR A 78 14.607 9.296 -4.079 1.00 0.00 N ATOM 1119 CA THR A 78 13.159 9.231 -4.213 1.00 0.00 C ATOM 1120 C THR A 78 12.677 7.773 -4.176 1.00 0.00 C ATOM 1121 O THR A 78 12.843 7.049 -5.162 1.00 0.00 O ATOM 1122 CB THR A 78 12.716 9.968 -5.483 1.00 0.00 C ATOM 1123 OG1 THR A 78 13.287 11.262 -5.555 1.00 0.00 O ATOM 1124 CG2 THR A 78 11.194 10.123 -5.515 1.00 0.00 C ATOM 0 H THR A 78 15.087 9.686 -4.890 1.00 0.00 H new ATOM 0 HA THR A 78 12.693 9.735 -3.367 1.00 0.00 H new ATOM 0 HB THR A 78 13.055 9.370 -6.329 1.00 0.00 H new ATOM 0 HG1 THR A 78 12.988 11.706 -6.376 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.901 10.648 -6.424 1.00 0.00 H new ATOM 0 HG22 THR A 78 10.728 9.138 -5.499 1.00 0.00 H new ATOM 0 HG23 THR A 78 10.868 10.693 -4.645 1.00 0.00 H new ATOM 1132 N GLY A 79 12.097 7.352 -3.048 1.00 0.00 N ATOM 1133 CA GLY A 79 11.426 6.064 -2.904 1.00 0.00 C ATOM 1134 C GLY A 79 10.062 6.086 -3.586 1.00 0.00 C ATOM 1135 O GLY A 79 9.574 7.159 -3.959 1.00 0.00 O ATOM 0 H GLY A 79 12.083 7.911 -2.195 1.00 0.00 H new ATOM 0 HA2 GLY A 79 12.042 5.277 -3.338 1.00 0.00 H new ATOM 0 HA3 GLY A 79 11.305 5.828 -1.847 1.00 0.00 H new ATOM 1139 N LEU A 80 9.431 4.913 -3.721 1.00 0.00 N ATOM 1140 CA LEU A 80 8.077 4.791 -4.270 1.00 0.00 C ATOM 1141 C LEU A 80 7.459 3.468 -3.850 1.00 0.00 C ATOM 1142 O LEU A 80 8.041 2.415 -4.133 1.00 0.00 O ATOM 1143 CB LEU A 80 8.108 4.866 -5.805 1.00 0.00 C ATOM 1144 CG LEU A 80 6.709 4.883 -6.466 1.00 0.00 C ATOM 1145 CD1 LEU A 80 6.713 5.789 -7.700 1.00 0.00 C ATOM 1146 CD2 LEU A 80 6.269 3.490 -6.936 1.00 0.00 C ATOM 0 H LEU A 80 9.846 4.021 -3.452 1.00 0.00 H new ATOM 0 HA LEU A 80 7.478 5.615 -3.882 1.00 0.00 H new ATOM 0 HB2 LEU A 80 8.650 5.764 -6.103 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.669 4.013 -6.188 1.00 0.00 H new ATOM 0 HG LEU A 80 6.020 5.247 -5.704 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.722 5.790 -8.154 1.00 0.00 H new ATOM 0 HD12 LEU A 80 6.978 6.804 -7.405 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.442 5.418 -8.421 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.281 3.555 -7.393 1.00 0.00 H new ATOM 0 HD22 LEU A 80 6.983 3.111 -7.667 1.00 0.00 H new ATOM 0 HD23 LEU A 80 6.230 2.813 -6.082 1.00 0.00 H new ATOM 1158 N VAL A 81 6.279 3.490 -3.229 1.00 0.00 N ATOM 1159 CA VAL A 81 5.550 2.266 -2.890 1.00 0.00 C ATOM 1160 C VAL A 81 4.361 2.082 -3.833 1.00 0.00 C ATOM 1161 O VAL A 81 3.977 3.019 -4.541 1.00 0.00 O ATOM 1162 CB VAL A 81 5.158 2.231 -1.391 1.00 0.00 C ATOM 1163 CG1 VAL A 81 6.323 2.658 -0.493 1.00 0.00 C ATOM 1164 CG2 VAL A 81 3.934 3.084 -1.036 1.00 0.00 C ATOM 0 H VAL A 81 5.805 4.348 -2.949 1.00 0.00 H new ATOM 0 HA VAL A 81 6.208 1.410 -3.037 1.00 0.00 H new ATOM 0 HB VAL A 81 4.896 1.189 -1.209 1.00 0.00 H new ATOM 0 HG11 VAL A 81 6.011 2.621 0.551 1.00 0.00 H new ATOM 0 HG12 VAL A 81 7.165 1.983 -0.644 1.00 0.00 H new ATOM 0 HG13 VAL A 81 6.624 3.675 -0.746 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.730 3.002 0.032 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.131 4.126 -1.288 1.00 0.00 H new ATOM 0 HG23 VAL A 81 3.069 2.732 -1.599 1.00 0.00 H new ATOM 1174 N THR A 82 3.760 0.893 -3.824 1.00 0.00 N ATOM 1175 CA THR A 82 2.467 0.652 -4.453 1.00 0.00 C ATOM 1176 C THR A 82 1.449 0.426 -3.338 1.00 0.00 C ATOM 1177 O THR A 82 1.824 0.126 -2.200 1.00 0.00 O ATOM 1178 CB THR A 82 2.519 -0.547 -5.423 1.00 0.00 C ATOM 1179 OG1 THR A 82 3.800 -0.725 -6.006 1.00 0.00 O ATOM 1180 CG2 THR A 82 1.479 -0.399 -6.541 1.00 0.00 C ATOM 0 H THR A 82 4.160 0.068 -3.378 1.00 0.00 H new ATOM 0 HA THR A 82 2.180 1.513 -5.057 1.00 0.00 H new ATOM 0 HB THR A 82 2.294 -1.428 -4.821 1.00 0.00 H new ATOM 0 HG1 THR A 82 3.780 -1.497 -6.610 1.00 0.00 H new ATOM 0 HG21 THR A 82 1.539 -1.258 -7.209 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.481 -0.347 -6.105 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.677 0.513 -7.104 1.00 0.00 H new ATOM 1188 N LEU A 83 0.166 0.569 -3.668 1.00 0.00 N ATOM 1189 CA LEU A 83 -0.957 0.203 -2.828 1.00 0.00 C ATOM 1190 C LEU A 83 -1.991 -0.473 -3.720 1.00 0.00 C ATOM 1191 O LEU A 83 -2.097 -0.116 -4.900 1.00 0.00 O ATOM 1192 CB LEU A 83 -1.574 1.431 -2.123 1.00 0.00 C ATOM 1193 CG LEU A 83 -0.570 2.359 -1.415 1.00 0.00 C ATOM 1194 CD1 LEU A 83 0.036 3.421 -2.349 1.00 0.00 C ATOM 1195 CD2 LEU A 83 -1.250 3.074 -0.252 1.00 0.00 C ATOM 0 H LEU A 83 -0.123 0.959 -4.565 1.00 0.00 H new ATOM 0 HA LEU A 83 -0.619 -0.469 -2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.124 2.014 -2.861 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -2.300 1.081 -1.389 1.00 0.00 H new ATOM 0 HG LEU A 83 0.240 1.719 -1.065 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.735 4.042 -1.789 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.563 2.929 -3.166 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.760 4.046 -2.755 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.532 3.728 0.243 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -2.083 3.668 -0.627 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -1.621 2.338 0.461 1.00 0.00 H new ATOM 1207 N LYS A 84 -2.836 -1.337 -3.159 1.00 0.00 N ATOM 1208 CA LYS A 84 -4.079 -1.784 -3.787 1.00 0.00 C ATOM 1209 C LYS A 84 -5.143 -1.800 -2.697 1.00 0.00 C ATOM 1210 O LYS A 84 -4.826 -2.052 -1.532 1.00 0.00 O ATOM 1211 CB LYS A 84 -3.919 -3.177 -4.431 1.00 0.00 C ATOM 1212 CG LYS A 84 -5.057 -3.437 -5.435 1.00 0.00 C ATOM 1213 CD LYS A 84 -5.236 -4.909 -5.816 1.00 0.00 C ATOM 1214 CE LYS A 84 -6.494 -5.030 -6.689 1.00 0.00 C ATOM 1215 NZ LYS A 84 -6.586 -6.333 -7.381 1.00 0.00 N ATOM 0 H LYS A 84 -2.674 -1.752 -2.242 1.00 0.00 H new ATOM 0 HA LYS A 84 -4.362 -1.109 -4.595 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -2.956 -3.242 -4.938 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -3.925 -3.945 -3.658 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -5.991 -3.067 -5.012 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -4.866 -2.860 -6.340 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -4.362 -5.270 -6.357 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -5.334 -5.524 -4.921 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -7.378 -4.891 -6.066 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -6.496 -4.230 -7.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -7.453 -6.361 -7.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -5.758 -6.458 -7.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -6.612 -7.099 -6.678 1.00 0.00 H new ATOM 1229 N GLN A 85 -6.379 -1.494 -3.079 1.00 0.00 N ATOM 1230 CA GLN A 85 -7.540 -1.621 -2.212 1.00 0.00 C ATOM 1231 C GLN A 85 -8.078 -3.060 -2.270 1.00 0.00 C ATOM 1232 O GLN A 85 -7.655 -3.837 -3.124 1.00 0.00 O ATOM 1233 CB GLN A 85 -8.585 -0.594 -2.663 1.00 0.00 C ATOM 1234 CG GLN A 85 -9.303 0.163 -1.541 1.00 0.00 C ATOM 1235 CD GLN A 85 -9.297 1.681 -1.712 1.00 0.00 C ATOM 1236 OE1 GLN A 85 -8.518 2.403 -1.096 1.00 0.00 O ATOM 1237 NE2 GLN A 85 -10.184 2.193 -2.551 1.00 0.00 N ATOM 0 H GLN A 85 -6.603 -1.147 -4.012 1.00 0.00 H new ATOM 0 HA GLN A 85 -7.279 -1.421 -1.173 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -8.096 0.133 -3.311 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -9.334 -1.107 -3.267 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -10.336 -0.182 -1.487 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -8.833 -0.087 -0.590 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -10.824 1.578 -3.055 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -10.228 3.202 -2.694 1.00 0.00 H new ATOM 1246 N ASP A 86 -9.035 -3.374 -1.394 1.00 0.00 N ATOM 1247 CA ASP A 86 -9.753 -4.651 -1.330 1.00 0.00 C ATOM 1248 C ASP A 86 -10.526 -4.902 -2.634 1.00 0.00 C ATOM 1249 O ASP A 86 -10.089 -5.626 -3.532 1.00 0.00 O ATOM 1250 CB ASP A 86 -10.690 -4.617 -0.106 1.00 0.00 C ATOM 1251 CG ASP A 86 -11.437 -5.930 0.113 1.00 0.00 C ATOM 1252 OD1 ASP A 86 -10.778 -6.985 0.184 1.00 0.00 O ATOM 1253 OD2 ASP A 86 -12.678 -5.861 0.283 1.00 0.00 O ATOM 0 H ASP A 86 -9.345 -2.717 -0.678 1.00 0.00 H new ATOM 0 HA ASP A 86 -9.050 -5.477 -1.219 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -10.106 -4.385 0.785 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -11.413 -3.811 -0.232 1.00 0.00 H new ATOM 1258 N GLU A 87 -11.681 -4.253 -2.775 1.00 0.00 N ATOM 1259 CA GLU A 87 -12.513 -4.380 -3.960 1.00 0.00 C ATOM 1260 C GLU A 87 -12.105 -3.387 -5.054 1.00 0.00 C ATOM 1261 O GLU A 87 -12.465 -3.567 -6.217 1.00 0.00 O ATOM 1262 CB GLU A 87 -13.965 -4.107 -3.597 1.00 0.00 C ATOM 1263 CG GLU A 87 -14.616 -5.049 -2.590 1.00 0.00 C ATOM 1264 CD GLU A 87 -16.132 -4.807 -2.633 1.00 0.00 C ATOM 1265 OE1 GLU A 87 -16.566 -3.629 -2.558 1.00 0.00 O ATOM 1266 OE2 GLU A 87 -16.917 -5.754 -2.858 1.00 0.00 O ATOM 0 H GLU A 87 -12.062 -3.625 -2.067 1.00 0.00 H new ATOM 0 HA GLU A 87 -12.385 -5.395 -4.337 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -14.031 -3.093 -3.203 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -14.554 -4.132 -4.514 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.388 -6.086 -2.834 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.228 -4.865 -1.588 1.00 0.00 H new ATOM 1273 N SER A 88 -11.417 -2.297 -4.705 1.00 0.00 N ATOM 1274 CA SER A 88 -10.892 -1.335 -5.673 1.00 0.00 C ATOM 1275 C SER A 88 -9.520 -1.826 -6.168 1.00 0.00 C ATOM 1276 O SER A 88 -9.107 -2.946 -5.868 1.00 0.00 O ATOM 1277 CB SER A 88 -10.886 0.096 -5.107 1.00 0.00 C ATOM 1278 OG SER A 88 -11.784 0.270 -4.020 1.00 0.00 O ATOM 0 H SER A 88 -11.208 -2.057 -3.736 1.00 0.00 H new ATOM 0 HA SER A 88 -11.549 -1.277 -6.541 1.00 0.00 H new ATOM 0 HB2 SER A 88 -9.877 0.347 -4.780 1.00 0.00 H new ATOM 0 HB3 SER A 88 -11.147 0.795 -5.901 1.00 0.00 H new ATOM 0 HG SER A 88 -12.340 1.062 -4.178 1.00 0.00 H new ATOM 1284 N GLY A 89 -8.808 -1.056 -6.987 1.00 0.00 N ATOM 1285 CA GLY A 89 -7.616 -1.596 -7.638 1.00 0.00 C ATOM 1286 C GLY A 89 -6.875 -0.646 -8.557 1.00 0.00 C ATOM 1287 O GLY A 89 -5.952 -1.082 -9.238 1.00 0.00 O ATOM 0 H GLY A 89 -9.025 -0.085 -7.212 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.926 -1.935 -6.865 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.907 -2.475 -8.214 1.00 0.00 H new ATOM 1291 N LYS A 90 -7.203 0.650 -8.555 1.00 0.00 N ATOM 1292 CA LYS A 90 -6.196 1.613 -8.978 1.00 0.00 C ATOM 1293 C LYS A 90 -4.976 1.464 -8.071 1.00 0.00 C ATOM 1294 O LYS A 90 -5.090 1.008 -6.929 1.00 0.00 O ATOM 1295 CB LYS A 90 -6.708 3.053 -8.916 1.00 0.00 C ATOM 1296 CG LYS A 90 -7.647 3.439 -10.064 1.00 0.00 C ATOM 1297 CD LYS A 90 -7.538 4.958 -10.283 1.00 0.00 C ATOM 1298 CE LYS A 90 -8.358 5.498 -11.453 1.00 0.00 C ATOM 1299 NZ LYS A 90 -7.991 4.845 -12.720 1.00 0.00 N ATOM 0 H LYS A 90 -8.106 1.036 -8.281 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.940 1.408 -10.017 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -7.230 3.200 -7.970 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -5.854 3.730 -8.918 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -7.376 2.903 -10.974 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.674 3.162 -9.825 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.854 5.466 -9.372 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -6.491 5.213 -10.443 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -9.419 5.342 -11.257 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -8.204 6.574 -11.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -8.480 5.316 -13.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.963 4.913 -12.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -8.271 3.844 -12.688 1.00 0.00 H new ATOM 1313 N THR A 91 -3.828 1.925 -8.540 1.00 0.00 N ATOM 1314 CA THR A 91 -2.568 1.813 -7.841 1.00 0.00 C ATOM 1315 C THR A 91 -2.042 3.220 -7.590 1.00 0.00 C ATOM 1316 O THR A 91 -1.672 3.950 -8.512 1.00 0.00 O ATOM 1317 CB THR A 91 -1.636 0.855 -8.584 1.00 0.00 C ATOM 1318 OG1 THR A 91 -1.533 1.178 -9.965 1.00 0.00 O ATOM 1319 CG2 THR A 91 -2.169 -0.579 -8.461 1.00 0.00 C ATOM 0 H THR A 91 -3.750 2.398 -9.440 1.00 0.00 H new ATOM 0 HA THR A 91 -2.670 1.355 -6.857 1.00 0.00 H new ATOM 0 HB THR A 91 -0.648 0.945 -8.132 1.00 0.00 H new ATOM 0 HG1 THR A 91 -0.928 0.545 -10.405 1.00 0.00 H new ATOM 0 HG21 THR A 91 -1.504 -1.261 -8.991 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.215 -0.861 -7.409 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.167 -0.635 -8.896 1.00 0.00 H new ATOM 1327 N LEU A 92 -2.108 3.636 -6.332 1.00 0.00 N ATOM 1328 CA LEU A 92 -1.661 4.948 -5.893 1.00 0.00 C ATOM 1329 C LEU A 92 -0.137 4.944 -5.836 1.00 0.00 C ATOM 1330 O LEU A 92 0.496 3.881 -5.825 1.00 0.00 O ATOM 1331 CB LEU A 92 -2.261 5.300 -4.519 1.00 0.00 C ATOM 1332 CG LEU A 92 -3.765 5.628 -4.513 1.00 0.00 C ATOM 1333 CD1 LEU A 92 -4.179 5.910 -3.070 1.00 0.00 C ATOM 1334 CD2 LEU A 92 -4.128 6.863 -5.340 1.00 0.00 C ATOM 0 H LEU A 92 -2.480 3.060 -5.577 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.000 5.707 -6.598 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -2.087 4.464 -3.842 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.719 6.155 -4.115 1.00 0.00 H new ATOM 0 HG LEU A 92 -4.279 4.773 -4.952 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -5.243 6.146 -3.036 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -3.983 5.031 -2.457 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.608 6.755 -2.686 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -5.204 7.032 -5.289 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.605 7.733 -4.944 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.835 6.705 -6.378 1.00 0.00 H new ATOM 1346 N SER A 93 0.446 6.136 -5.768 1.00 0.00 N ATOM 1347 CA SER A 93 1.885 6.341 -5.760 1.00 0.00 C ATOM 1348 C SER A 93 2.194 7.470 -4.779 1.00 0.00 C ATOM 1349 O SER A 93 1.374 8.376 -4.583 1.00 0.00 O ATOM 1350 CB SER A 93 2.364 6.671 -7.182 1.00 0.00 C ATOM 1351 OG SER A 93 1.754 5.811 -8.133 1.00 0.00 O ATOM 0 H SER A 93 -0.084 7.006 -5.716 1.00 0.00 H new ATOM 0 HA SER A 93 2.411 5.442 -5.441 1.00 0.00 H new ATOM 0 HB2 SER A 93 2.127 7.708 -7.419 1.00 0.00 H new ATOM 0 HB3 SER A 93 3.448 6.571 -7.238 1.00 0.00 H new ATOM 0 HG SER A 93 2.072 6.039 -9.032 1.00 0.00 H new ATOM 1357 N LEU A 94 3.361 7.390 -4.148 1.00 0.00 N ATOM 1358 CA LEU A 94 3.896 8.317 -3.164 1.00 0.00 C ATOM 1359 C LEU A 94 5.372 8.407 -3.506 1.00 0.00 C ATOM 1360 O LEU A 94 6.048 7.382 -3.473 1.00 0.00 O ATOM 1361 CB LEU A 94 3.658 7.770 -1.744 1.00 0.00 C ATOM 1362 CG LEU A 94 4.516 8.387 -0.622 1.00 0.00 C ATOM 1363 CD1 LEU A 94 4.312 9.896 -0.448 1.00 0.00 C ATOM 1364 CD2 LEU A 94 4.155 7.696 0.695 1.00 0.00 C ATOM 0 H LEU A 94 4.003 6.617 -4.326 1.00 0.00 H new ATOM 0 HA LEU A 94 3.423 9.299 -3.185 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.608 7.918 -1.492 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.835 6.694 -1.758 1.00 0.00 H new ATOM 0 HG LEU A 94 5.559 8.237 -0.899 1.00 0.00 H new ATOM 0 HD11 LEU A 94 4.949 10.259 0.359 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.574 10.408 -1.374 1.00 0.00 H new ATOM 0 HD13 LEU A 94 3.269 10.096 -0.205 1.00 0.00 H new ATOM 0 HD21 LEU A 94 4.752 8.119 1.503 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.097 7.848 0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 94 4.359 6.628 0.613 1.00 0.00 H new ATOM 1376 N LYS A 95 5.857 9.590 -3.880 1.00 0.00 N ATOM 1377 CA LYS A 95 7.280 9.852 -4.081 1.00 0.00 C ATOM 1378 C LYS A 95 7.711 10.850 -3.024 1.00 0.00 C ATOM 1379 O LYS A 95 6.943 11.745 -2.672 1.00 0.00 O ATOM 1380 CB LYS A 95 7.542 10.419 -5.480 1.00 0.00 C ATOM 1381 CG LYS A 95 7.631 9.353 -6.568 1.00 0.00 C ATOM 1382 CD LYS A 95 8.003 10.006 -7.906 1.00 0.00 C ATOM 1383 CE LYS A 95 7.644 9.081 -9.074 1.00 0.00 C ATOM 1384 NZ LYS A 95 7.248 9.840 -10.275 1.00 0.00 N ATOM 0 H LYS A 95 5.265 10.402 -4.054 1.00 0.00 H new ATOM 0 HA LYS A 95 7.847 8.925 -3.995 1.00 0.00 H new ATOM 0 HB2 LYS A 95 6.746 11.119 -5.734 1.00 0.00 H new ATOM 0 HB3 LYS A 95 8.472 10.987 -5.464 1.00 0.00 H new ATOM 0 HG2 LYS A 95 8.377 8.606 -6.298 1.00 0.00 H new ATOM 0 HG3 LYS A 95 6.677 8.833 -6.659 1.00 0.00 H new ATOM 0 HD2 LYS A 95 7.478 10.956 -8.012 1.00 0.00 H new ATOM 0 HD3 LYS A 95 9.070 10.228 -7.925 1.00 0.00 H new ATOM 0 HE2 LYS A 95 8.498 8.447 -9.311 1.00 0.00 H new ATOM 0 HE3 LYS A 95 6.829 8.421 -8.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 7.013 9.178 -11.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 6.417 10.426 -10.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 8.034 10.452 -10.574 1.00 0.00 H new ATOM 1398 N ILE A 96 8.934 10.703 -2.528 1.00 0.00 N ATOM 1399 CA ILE A 96 9.449 11.454 -1.392 1.00 0.00 C ATOM 1400 C ILE A 96 10.850 11.901 -1.790 1.00 0.00 C ATOM 1401 O ILE A 96 11.784 11.101 -1.743 1.00 0.00 O ATOM 1402 CB ILE A 96 9.446 10.555 -0.135 1.00 0.00 C ATOM 1403 CG1 ILE A 96 8.037 10.041 0.237 1.00 0.00 C ATOM 1404 CG2 ILE A 96 10.060 11.285 1.068 1.00 0.00 C ATOM 1405 CD1 ILE A 96 8.138 8.700 0.958 1.00 0.00 C ATOM 0 H ILE A 96 9.609 10.043 -2.914 1.00 0.00 H new ATOM 0 HA ILE A 96 8.839 12.323 -1.145 1.00 0.00 H new ATOM 0 HB ILE A 96 10.056 9.688 -0.387 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.534 10.768 0.875 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.432 9.933 -0.663 1.00 0.00 H new ATOM 0 HG21 ILE A 96 10.045 10.629 1.938 1.00 0.00 H new ATOM 0 HG22 ILE A 96 11.089 11.561 0.839 1.00 0.00 H new ATOM 0 HG23 ILE A 96 9.482 12.184 1.282 1.00 0.00 H new ATOM 0 HD11 ILE A 96 7.139 8.349 1.215 1.00 0.00 H new ATOM 0 HD12 ILE A 96 8.622 7.972 0.307 1.00 0.00 H new ATOM 0 HD13 ILE A 96 8.725 8.820 1.868 1.00 0.00 H new ATOM 1417 N VAL A 97 11.007 13.139 -2.250 1.00 0.00 N ATOM 1418 CA VAL A 97 12.299 13.676 -2.656 1.00 0.00 C ATOM 1419 C VAL A 97 12.888 14.391 -1.428 1.00 0.00 C ATOM 1420 O VAL A 97 12.965 15.619 -1.382 1.00 0.00 O ATOM 1421 CB VAL A 97 12.149 14.535 -3.936 1.00 0.00 C ATOM 1422 CG1 VAL A 97 13.521 14.725 -4.598 1.00 0.00 C ATOM 1423 CG2 VAL A 97 11.181 13.918 -4.962 1.00 0.00 C ATOM 0 H VAL A 97 10.237 13.800 -2.351 1.00 0.00 H new ATOM 0 HA VAL A 97 13.010 12.905 -2.953 1.00 0.00 H new ATOM 0 HB VAL A 97 11.732 15.493 -3.624 1.00 0.00 H new ATOM 0 HG11 VAL A 97 13.410 15.330 -5.498 1.00 0.00 H new ATOM 0 HG12 VAL A 97 14.194 15.228 -3.903 1.00 0.00 H new ATOM 0 HG13 VAL A 97 13.935 13.752 -4.863 1.00 0.00 H new ATOM 0 HG21 VAL A 97 11.117 14.565 -5.837 1.00 0.00 H new ATOM 0 HG22 VAL A 97 11.547 12.936 -5.263 1.00 0.00 H new ATOM 0 HG23 VAL A 97 10.193 13.815 -4.514 1.00 0.00 H new ATOM 1433 N GLN A 98 13.247 13.613 -0.404 1.00 0.00 N ATOM 1434 CA GLN A 98 13.798 14.105 0.863 1.00 0.00 C ATOM 1435 C GLN A 98 15.332 14.173 0.759 1.00 0.00 C ATOM 1436 O GLN A 98 15.859 13.581 -0.181 1.00 0.00 O ATOM 1437 CB GLN A 98 13.306 13.188 1.998 1.00 0.00 C ATOM 1438 CG GLN A 98 13.809 11.742 1.937 1.00 0.00 C ATOM 1439 CD GLN A 98 13.225 10.868 3.045 1.00 0.00 C ATOM 1440 OE1 GLN A 98 12.469 11.316 3.900 1.00 0.00 O ATOM 1441 NE2 GLN A 98 13.588 9.600 3.069 1.00 0.00 N ATOM 0 H GLN A 98 13.161 12.597 -0.433 1.00 0.00 H new ATOM 0 HA GLN A 98 13.454 15.115 1.084 1.00 0.00 H new ATOM 0 HB2 GLN A 98 13.611 13.621 2.951 1.00 0.00 H new ATOM 0 HB3 GLN A 98 12.216 13.177 1.987 1.00 0.00 H new ATOM 0 HG2 GLN A 98 13.553 11.313 0.968 1.00 0.00 H new ATOM 0 HG3 GLN A 98 14.897 11.736 2.010 1.00 0.00 H new ATOM 0 HE21 GLN A 98 14.217 9.236 2.354 1.00 0.00 H new ATOM 0 HE22 GLN A 98 13.239 8.984 3.803 1.00 0.00 H new ATOM 1450 N PRO A 99 16.073 14.858 1.651 1.00 0.00 N ATOM 1451 CA PRO A 99 17.530 15.016 1.566 1.00 0.00 C ATOM 1452 C PRO A 99 18.369 13.746 1.679 1.00 0.00 C ATOM 1453 O PRO A 99 17.894 12.632 1.472 1.00 0.00 O ATOM 1454 CB PRO A 99 17.882 16.095 2.599 1.00 0.00 C ATOM 1455 CG PRO A 99 16.739 16.056 3.593 1.00 0.00 C ATOM 1456 CD PRO A 99 15.559 15.745 2.686 1.00 0.00 C ATOM 0 HA PRO A 99 17.799 15.314 0.553 1.00 0.00 H new ATOM 0 HB2 PRO A 99 18.836 15.885 3.083 1.00 0.00 H new ATOM 0 HB3 PRO A 99 17.970 17.077 2.133 1.00 0.00 H new ATOM 0 HG2 PRO A 99 16.884 15.290 4.355 1.00 0.00 H new ATOM 0 HG3 PRO A 99 16.616 17.005 4.115 1.00 0.00 H new ATOM 0 HD2 PRO A 99 14.753 15.268 3.244 1.00 0.00 H new ATOM 0 HD3 PRO A 99 15.150 16.657 2.251 1.00 0.00 H new ATOM 1464 N GLY A 100 19.676 13.935 1.876 1.00 0.00 N ATOM 1465 CA GLY A 100 20.515 12.908 2.443 1.00 0.00 C ATOM 1466 C GLY A 100 21.193 13.396 3.714 1.00 0.00 C ATOM 1467 O GLY A 100 21.464 14.592 3.866 1.00 0.00 O ATOM 0 H GLY A 100 20.167 14.799 1.646 1.00 0.00 H new ATOM 0 HA2 GLY A 100 19.916 12.024 2.663 1.00 0.00 H new ATOM 0 HA3 GLY A 100 21.270 12.608 1.716 1.00 0.00 H new ATOM 1471 N LYS A 101 21.537 12.463 4.602 1.00 0.00 N ATOM 1472 CA LYS A 101 21.894 12.721 5.993 1.00 0.00 C ATOM 1473 C LYS A 101 23.207 12.035 6.320 1.00 0.00 C ATOM 1474 O LYS A 101 23.319 10.826 6.138 1.00 0.00 O ATOM 1475 CB LYS A 101 20.769 12.160 6.872 1.00 0.00 C ATOM 1476 CG LYS A 101 20.973 12.456 8.362 1.00 0.00 C ATOM 1477 CD LYS A 101 19.997 11.710 9.279 1.00 0.00 C ATOM 1478 CE LYS A 101 18.561 12.191 9.064 1.00 0.00 C ATOM 1479 NZ LYS A 101 17.712 11.948 10.249 1.00 0.00 N ATOM 0 H LYS A 101 21.575 11.472 4.362 1.00 0.00 H new ATOM 0 HA LYS A 101 22.015 13.790 6.170 1.00 0.00 H new ATOM 0 HB2 LYS A 101 19.818 12.583 6.550 1.00 0.00 H new ATOM 0 HB3 LYS A 101 20.704 11.082 6.726 1.00 0.00 H new ATOM 0 HG2 LYS A 101 21.993 12.190 8.640 1.00 0.00 H new ATOM 0 HG3 LYS A 101 20.866 13.528 8.528 1.00 0.00 H new ATOM 0 HD2 LYS A 101 20.058 10.639 9.085 1.00 0.00 H new ATOM 0 HD3 LYS A 101 20.283 11.862 10.320 1.00 0.00 H new ATOM 0 HE2 LYS A 101 18.566 13.256 8.834 1.00 0.00 H new ATOM 0 HE3 LYS A 101 18.133 11.681 8.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 16.748 12.289 10.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 17.685 10.929 10.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 18.105 12.455 11.067 1.00 0.00 H new ATOM 1493 N THR A 102 24.176 12.786 6.835 1.00 0.00 N ATOM 1494 CA THR A 102 25.435 12.266 7.336 1.00 0.00 C ATOM 1495 C THR A 102 25.963 13.218 8.423 1.00 0.00 C ATOM 1496 O THR A 102 26.708 14.150 8.124 1.00 0.00 O ATOM 1497 CB THR A 102 26.445 12.071 6.178 1.00 0.00 C ATOM 1498 OG1 THR A 102 26.323 13.042 5.155 1.00 0.00 O ATOM 1499 CG2 THR A 102 26.354 10.700 5.490 1.00 0.00 C ATOM 0 H THR A 102 24.101 13.800 6.916 1.00 0.00 H new ATOM 0 HA THR A 102 25.287 11.283 7.782 1.00 0.00 H new ATOM 0 HB THR A 102 27.404 12.168 6.686 1.00 0.00 H new ATOM 0 HG1 THR A 102 26.987 12.866 4.456 1.00 0.00 H new ATOM 0 HG21 THR A 102 27.094 10.644 4.691 1.00 0.00 H new ATOM 0 HG22 THR A 102 26.547 9.913 6.219 1.00 0.00 H new ATOM 0 HG23 THR A 102 25.357 10.569 5.071 1.00 0.00 H new ATOM 1507 N SER A 103 25.579 13.002 9.681 1.00 0.00 N ATOM 1508 CA SER A 103 26.228 13.574 10.862 1.00 0.00 C ATOM 1509 C SER A 103 26.196 12.553 12.018 1.00 0.00 C ATOM 1510 O SER A 103 25.957 11.365 11.791 1.00 0.00 O ATOM 1511 CB SER A 103 25.607 14.937 11.215 1.00 0.00 C ATOM 1512 OG SER A 103 24.338 14.783 11.808 1.00 0.00 O ATOM 0 H SER A 103 24.784 12.407 9.914 1.00 0.00 H new ATOM 0 HA SER A 103 27.279 13.776 10.654 1.00 0.00 H new ATOM 0 HB2 SER A 103 26.267 15.474 11.897 1.00 0.00 H new ATOM 0 HB3 SER A 103 25.518 15.543 10.313 1.00 0.00 H new ATOM 0 HG SER A 103 23.968 15.665 12.023 1.00 0.00 H new ATOM 1518 N ILE A 104 26.467 13.010 13.242 1.00 0.00 N ATOM 1519 CA ILE A 104 26.574 12.214 14.468 1.00 0.00 C ATOM 1520 C ILE A 104 25.310 12.324 15.349 1.00 0.00 C ATOM 1521 O ILE A 104 25.372 12.015 16.539 1.00 0.00 O ATOM 1522 CB ILE A 104 27.860 12.626 15.231 1.00 0.00 C ATOM 1523 CG1 ILE A 104 27.818 14.106 15.690 1.00 0.00 C ATOM 1524 CG2 ILE A 104 29.107 12.348 14.367 1.00 0.00 C ATOM 1525 CD1 ILE A 104 28.939 14.478 16.668 1.00 0.00 C ATOM 0 H ILE A 104 26.627 14.002 13.415 1.00 0.00 H new ATOM 0 HA ILE A 104 26.648 11.161 14.198 1.00 0.00 H new ATOM 0 HB ILE A 104 27.917 12.018 16.134 1.00 0.00 H new ATOM 0 HG12 ILE A 104 27.883 14.751 14.814 1.00 0.00 H new ATOM 0 HG13 ILE A 104 26.855 14.304 16.161 1.00 0.00 H new ATOM 0 HG21 ILE A 104 30.002 12.642 14.915 1.00 0.00 H new ATOM 0 HG22 ILE A 104 29.158 11.285 14.133 1.00 0.00 H new ATOM 0 HG23 ILE A 104 29.044 12.921 13.442 1.00 0.00 H new ATOM 0 HD11 ILE A 104 28.846 15.528 16.946 1.00 0.00 H new ATOM 0 HD12 ILE A 104 28.863 13.858 17.562 1.00 0.00 H new ATOM 0 HD13 ILE A 104 29.906 14.312 16.193 1.00 0.00 H new ATOM 1537 N ASP A 105 24.200 12.834 14.804 1.00 0.00 N ATOM 1538 CA ASP A 105 22.971 13.125 15.552 1.00 0.00 C ATOM 1539 C ASP A 105 22.373 11.888 16.212 1.00 0.00 C ATOM 1540 O ASP A 105 21.813 12.016 17.321 1.00 0.00 O ATOM 1541 CB ASP A 105 21.932 13.776 14.633 1.00 0.00 C ATOM 1542 CG ASP A 105 20.698 14.240 15.411 1.00 0.00 C ATOM 1543 OD1 ASP A 105 20.856 14.930 16.451 1.00 0.00 O ATOM 1544 OD2 ASP A 105 19.559 14.047 14.927 1.00 0.00 O ATOM 0 H ASP A 105 24.129 13.060 13.812 1.00 0.00 H new ATOM 0 HA ASP A 105 23.246 13.815 16.350 1.00 0.00 H new ATOM 0 HB2 ASP A 105 22.381 14.628 14.122 1.00 0.00 H new ATOM 0 HB3 ASP A 105 21.631 13.065 13.864 1.00 0.00 H new TER 1549 ASP A 105