USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 857 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.132 K(o=-0.13,f=-2.2!) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -85:sc= 1.29 USER MOD Single : A 31 TYR OH : rot 93:sc= -0.79 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= -0.468 USER MOD Single : A 46 SER OG : rot -30:sc= 0.122 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.015) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.497 USER MOD Single : A 72 ASN : amide:sc= -6.96! C(o=-7!,f=-6.4!) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot -120:sc= -2.32! USER MOD Single : A 79 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0276) USER MOD Single : A 82 ASN : amide:sc= -0.751 K(o=-0.75,f=-2.6) USER MOD Single : A 87 TYR OH : rot 180:sc= -0.0942 USER MOD Single : A 89 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0263) USER MOD Single : A 99 SER OG : rot -11:sc= 0.139! USER MOD Single : A 100 ASN : amide:sc= -0.113 K(o=-0.11,f=-2.1!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.0588 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot -51:sc= 1.02 USER MOD Single : A 109 ASN : amide:sc= -1.38 K(o=-1.4,f=-0.4) USER MOD Single : A 110 SER OG : rot 180:sc= -0.114 USER MOD Single : A 114 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.385 10.715 2.096 1.00 32.44 N ATOM 2 CA GLY A 1 -1.585 10.343 0.944 1.00 3.32 C ATOM 3 C GLY A 1 -0.837 9.041 1.153 1.00 55.12 C ATOM 4 O GLY A 1 -1.437 8.021 1.491 1.00 32.24 O ATOM 0 H1 GLY A 1 -2.876 11.611 1.903 1.00 32.44 H new ATOM 0 H2 GLY A 1 -3.086 9.971 2.287 1.00 32.44 H new ATOM 0 H3 GLY A 1 -1.768 10.830 2.925 1.00 32.44 H new ATOM 0 HA2 GLY A 1 -2.231 10.251 0.071 1.00 3.32 H new ATOM 0 HA3 GLY A 1 -0.871 11.138 0.729 1.00 3.32 H new ATOM 8 N SER A 2 0.476 9.075 0.949 1.00 75.33 N ATOM 9 CA SER A 2 1.305 7.887 1.111 1.00 20.51 C ATOM 10 C SER A 2 2.147 7.981 2.380 1.00 71.01 C ATOM 11 O SER A 2 2.860 8.961 2.593 1.00 11.11 O ATOM 12 CB SER A 2 2.214 7.703 -0.105 1.00 45.45 C ATOM 13 OG SER A 2 2.685 6.370 -0.195 1.00 33.45 O ATOM 0 H SER A 2 0.988 9.912 0.671 1.00 75.33 H new ATOM 0 HA SER A 2 0.646 7.023 1.196 1.00 20.51 H new ATOM 0 HB2 SER A 2 1.668 7.961 -1.013 1.00 45.45 H new ATOM 0 HB3 SER A 2 3.060 8.387 -0.037 1.00 45.45 H new ATOM 0 HG SER A 2 3.262 6.279 -0.982 1.00 33.45 H new ATOM 19 N MET A 3 2.058 6.954 3.219 1.00 0.42 N ATOM 20 CA MET A 3 2.812 6.920 4.467 1.00 42.31 C ATOM 21 C MET A 3 3.843 5.796 4.448 1.00 4.54 C ATOM 22 O MET A 3 4.860 5.863 5.139 1.00 21.22 O ATOM 23 CB MET A 3 1.866 6.740 5.655 1.00 15.12 C ATOM 24 CG MET A 3 2.451 7.212 6.976 1.00 43.41 C ATOM 25 SD MET A 3 1.188 7.769 8.136 1.00 4.23 S ATOM 26 CE MET A 3 1.909 9.306 8.709 1.00 73.20 C ATOM 0 H MET A 3 1.472 6.135 3.058 1.00 0.42 H new ATOM 0 HA MET A 3 3.337 7.870 4.571 1.00 42.31 H new ATOM 0 HB2 MET A 3 0.943 7.287 5.460 1.00 15.12 H new ATOM 0 HB3 MET A 3 1.600 5.686 5.741 1.00 15.12 H new ATOM 0 HG2 MET A 3 3.020 6.400 7.428 1.00 43.41 H new ATOM 0 HG3 MET A 3 3.151 8.026 6.789 1.00 43.41 H new ATOM 0 HE1 MET A 3 1.243 9.772 9.435 1.00 73.20 H new ATOM 0 HE2 MET A 3 2.872 9.104 9.177 1.00 73.20 H new ATOM 0 HE3 MET A 3 2.051 9.979 7.863 1.00 73.20 H new ATOM 36 N SER A 4 3.574 4.765 3.654 1.00 43.40 N ATOM 37 CA SER A 4 4.477 3.625 3.549 1.00 2.20 C ATOM 38 C SER A 4 5.899 4.085 3.243 1.00 64.24 C ATOM 39 O SER A 4 6.848 3.704 3.927 1.00 60.52 O ATOM 40 CB SER A 4 3.994 2.664 2.461 1.00 24.34 C ATOM 41 OG SER A 4 2.618 2.366 2.618 1.00 13.31 O ATOM 0 H SER A 4 2.738 4.696 3.074 1.00 43.40 H new ATOM 0 HA SER A 4 4.480 3.106 4.507 1.00 2.20 H new ATOM 0 HB2 SER A 4 4.164 3.106 1.479 1.00 24.34 H new ATOM 0 HB3 SER A 4 4.576 1.743 2.501 1.00 24.34 H new ATOM 0 HG SER A 4 2.333 1.752 1.910 1.00 13.31 H new ATOM 47 N GLY A 5 6.039 4.908 2.207 1.00 33.35 N ATOM 48 CA GLY A 5 7.347 5.406 1.827 1.00 4.52 C ATOM 49 C GLY A 5 7.989 4.575 0.734 1.00 3.51 C ATOM 50 O GLY A 5 8.446 3.460 0.981 1.00 34.24 O ATOM 0 H GLY A 5 5.269 5.238 1.625 1.00 33.35 H new ATOM 0 HA2 GLY A 5 7.255 6.438 1.488 1.00 4.52 H new ATOM 0 HA3 GLY A 5 7.997 5.415 2.702 1.00 4.52 H new ATOM 54 N GLU A 6 8.023 5.120 -0.478 1.00 62.34 N ATOM 55 CA GLU A 6 8.612 4.419 -1.613 1.00 71.34 C ATOM 56 C GLU A 6 9.052 5.404 -2.692 1.00 60.15 C ATOM 57 O GLU A 6 8.472 5.477 -3.776 1.00 14.12 O ATOM 58 CB GLU A 6 7.612 3.418 -2.198 1.00 3.43 C ATOM 59 CG GLU A 6 8.267 2.280 -2.963 1.00 13.41 C ATOM 60 CD GLU A 6 8.987 2.754 -4.210 1.00 40.42 C ATOM 61 OE1 GLU A 6 8.328 2.885 -5.263 1.00 2.32 O ATOM 62 OE2 GLU A 6 10.210 2.995 -4.133 1.00 62.50 O ATOM 0 H GLU A 6 7.650 6.043 -0.699 1.00 62.34 H new ATOM 0 HA GLU A 6 9.490 3.879 -1.258 1.00 71.34 H new ATOM 0 HB2 GLU A 6 7.011 3.002 -1.389 1.00 3.43 H new ATOM 0 HB3 GLU A 6 6.929 3.946 -2.863 1.00 3.43 H new ATOM 0 HG2 GLU A 6 8.976 1.769 -2.311 1.00 13.41 H new ATOM 0 HG3 GLU A 6 7.507 1.550 -3.242 1.00 13.41 H new ATOM 69 N PRO A 7 10.103 6.181 -2.391 1.00 32.14 N ATOM 70 CA PRO A 7 10.645 7.176 -3.321 1.00 33.12 C ATOM 71 C PRO A 7 11.339 6.534 -4.517 1.00 73.41 C ATOM 72 O PRO A 7 11.574 5.326 -4.536 1.00 52.21 O ATOM 73 CB PRO A 7 11.655 7.946 -2.467 1.00 52.50 C ATOM 74 CG PRO A 7 12.058 6.988 -1.400 1.00 13.43 C ATOM 75 CD PRO A 7 10.843 6.147 -1.118 1.00 43.52 C ATOM 0 HA PRO A 7 9.863 7.802 -3.749 1.00 33.12 H new ATOM 0 HB2 PRO A 7 12.514 8.263 -3.059 1.00 52.50 H new ATOM 0 HB3 PRO A 7 11.210 8.846 -2.043 1.00 52.50 H new ATOM 0 HG2 PRO A 7 12.894 6.369 -1.727 1.00 13.43 H new ATOM 0 HG3 PRO A 7 12.384 7.516 -0.504 1.00 13.43 H new ATOM 0 HD2 PRO A 7 11.115 5.129 -0.838 1.00 43.52 H new ATOM 0 HD3 PRO A 7 10.252 6.556 -0.298 1.00 43.52 H new ATOM 83 N GLY A 8 11.665 7.350 -5.515 1.00 32.21 N ATOM 84 CA GLY A 8 12.329 6.843 -6.701 1.00 61.42 C ATOM 85 C GLY A 8 13.760 7.330 -6.818 1.00 14.30 C ATOM 86 O GLY A 8 14.169 8.248 -6.107 1.00 34.42 O ATOM 0 H GLY A 8 11.481 8.353 -5.523 1.00 32.21 H new ATOM 0 HA2 GLY A 8 12.320 5.753 -6.681 1.00 61.42 H new ATOM 0 HA3 GLY A 8 11.771 7.150 -7.585 1.00 61.42 H new ATOM 90 N GLN A 9 14.522 6.714 -7.716 1.00 13.50 N ATOM 91 CA GLN A 9 15.916 7.090 -7.921 1.00 15.52 C ATOM 92 C GLN A 9 16.301 6.973 -9.392 1.00 34.42 C ATOM 93 O GLN A 9 16.489 5.871 -9.910 1.00 14.14 O ATOM 94 CB GLN A 9 16.833 6.212 -7.069 1.00 63.21 C ATOM 95 CG GLN A 9 18.194 6.835 -6.800 1.00 34.43 C ATOM 96 CD GLN A 9 18.845 6.293 -5.543 1.00 31.35 C ATOM 97 OE1 GLN A 9 18.188 5.668 -4.709 1.00 0.31 O ATOM 98 NE2 GLN A 9 20.144 6.529 -5.399 1.00 73.04 N ATOM 0 H GLN A 9 14.198 5.953 -8.313 1.00 13.50 H new ATOM 0 HA GLN A 9 16.035 8.130 -7.616 1.00 15.52 H new ATOM 0 HB2 GLN A 9 16.343 6.005 -6.118 1.00 63.21 H new ATOM 0 HB3 GLN A 9 16.974 5.254 -7.570 1.00 63.21 H new ATOM 0 HG2 GLN A 9 18.848 6.651 -7.652 1.00 34.43 H new ATOM 0 HG3 GLN A 9 18.084 7.916 -6.711 1.00 34.43 H new ATOM 0 HE21 GLN A 9 20.650 7.051 -6.114 1.00 73.04 H new ATOM 0 HE22 GLN A 9 20.636 6.188 -4.573 1.00 73.04 H new ATOM 107 N THR A 10 16.416 8.115 -10.062 1.00 5.13 N ATOM 108 CA THR A 10 16.778 8.140 -11.473 1.00 55.24 C ATOM 109 C THR A 10 18.278 7.951 -11.661 1.00 25.15 C ATOM 110 O THR A 10 19.027 7.850 -10.688 1.00 40.45 O ATOM 111 CB THR A 10 16.351 9.462 -12.139 1.00 4.41 C ATOM 112 OG1 THR A 10 17.017 10.564 -11.511 1.00 34.24 O ATOM 113 CG2 THR A 10 14.845 9.654 -12.047 1.00 20.33 C ATOM 0 H THR A 10 16.263 9.035 -9.650 1.00 5.13 H new ATOM 0 HA THR A 10 16.249 7.314 -11.949 1.00 55.24 H new ATOM 0 HB THR A 10 16.631 9.420 -13.191 1.00 4.41 H new ATOM 0 HG1 THR A 10 16.742 11.401 -11.941 1.00 34.24 H new ATOM 0 HG21 THR A 10 14.568 10.594 -12.524 1.00 20.33 H new ATOM 0 HG22 THR A 10 14.342 8.829 -12.551 1.00 20.33 H new ATOM 0 HG23 THR A 10 14.544 9.676 -11.000 1.00 20.33 H new ATOM 121 N SER A 11 18.712 7.904 -12.916 1.00 64.10 N ATOM 122 CA SER A 11 20.125 7.724 -13.230 1.00 71.53 C ATOM 123 C SER A 11 20.731 9.017 -13.766 1.00 65.35 C ATOM 124 O SER A 11 20.019 9.979 -14.051 1.00 13.31 O ATOM 125 CB SER A 11 20.302 6.601 -14.254 1.00 71.15 C ATOM 126 OG SER A 11 20.016 7.057 -15.565 1.00 74.44 O ATOM 0 H SER A 11 18.106 7.988 -13.732 1.00 64.10 H new ATOM 0 HA SER A 11 20.645 7.453 -12.311 1.00 71.53 H new ATOM 0 HB2 SER A 11 21.324 6.224 -14.212 1.00 71.15 H new ATOM 0 HB3 SER A 11 19.644 5.769 -14.003 1.00 71.15 H new ATOM 0 HG SER A 11 20.138 6.322 -16.201 1.00 74.44 H new ATOM 132 N VAL A 12 22.054 9.031 -13.902 1.00 12.11 N ATOM 133 CA VAL A 12 22.758 10.205 -14.405 1.00 21.53 C ATOM 134 C VAL A 12 22.668 10.290 -15.924 1.00 40.41 C ATOM 135 O VAL A 12 22.369 9.303 -16.595 1.00 54.20 O ATOM 136 CB VAL A 12 24.241 10.190 -13.989 1.00 62.33 C ATOM 137 CG1 VAL A 12 24.374 10.307 -12.479 1.00 20.24 C ATOM 138 CG2 VAL A 12 24.924 8.928 -14.497 1.00 15.24 C ATOM 0 H VAL A 12 22.659 8.243 -13.671 1.00 12.11 H new ATOM 0 HA VAL A 12 22.274 11.078 -13.966 1.00 21.53 H new ATOM 0 HB VAL A 12 24.735 11.050 -14.440 1.00 62.33 H new ATOM 0 HG11 VAL A 12 25.429 10.295 -12.205 1.00 20.24 H new ATOM 0 HG12 VAL A 12 23.923 11.242 -12.145 1.00 20.24 H new ATOM 0 HG13 VAL A 12 23.865 9.469 -12.003 1.00 20.24 H new ATOM 0 HG21 VAL A 12 25.971 8.934 -14.194 1.00 15.24 H new ATOM 0 HG22 VAL A 12 24.430 8.052 -14.077 1.00 15.24 H new ATOM 0 HG23 VAL A 12 24.861 8.893 -15.585 1.00 15.24 H new ATOM 148 N ALA A 13 22.930 11.478 -16.461 1.00 33.33 N ATOM 149 CA ALA A 13 22.881 11.692 -17.902 1.00 12.34 C ATOM 150 C ALA A 13 23.265 13.125 -18.257 1.00 20.33 C ATOM 151 O ALA A 13 23.223 14.029 -17.422 1.00 43.14 O ATOM 152 CB ALA A 13 21.494 11.368 -18.437 1.00 30.32 C ATOM 0 H ALA A 13 23.178 12.306 -15.920 1.00 33.33 H new ATOM 0 HA ALA A 13 23.604 11.023 -18.369 1.00 12.34 H new ATOM 0 HB1 ALA A 13 21.472 11.532 -19.514 1.00 30.32 H new ATOM 0 HB2 ALA A 13 21.256 10.326 -18.224 1.00 30.32 H new ATOM 0 HB3 ALA A 13 20.759 12.013 -17.956 1.00 30.32 H new ATOM 158 N PRO A 14 23.649 13.338 -19.524 1.00 3.32 N ATOM 159 CA PRO A 14 24.049 14.659 -20.018 1.00 12.41 C ATOM 160 C PRO A 14 22.872 15.625 -20.109 1.00 33.51 C ATOM 161 O PRO A 14 21.964 15.459 -20.924 1.00 34.14 O ATOM 162 CB PRO A 14 24.606 14.363 -21.412 1.00 62.13 C ATOM 163 CG PRO A 14 23.930 13.103 -21.831 1.00 0.14 C ATOM 164 CD PRO A 14 23.723 12.307 -20.572 1.00 71.31 C ATOM 0 HA PRO A 14 24.764 15.143 -19.352 1.00 12.41 H new ATOM 0 HB2 PRO A 14 24.391 15.177 -22.105 1.00 62.13 H new ATOM 0 HB3 PRO A 14 25.689 14.242 -21.388 1.00 62.13 H new ATOM 0 HG2 PRO A 14 22.979 13.314 -22.320 1.00 0.14 H new ATOM 0 HG3 PRO A 14 24.541 12.551 -22.546 1.00 0.14 H new ATOM 0 HD2 PRO A 14 22.810 11.714 -20.617 1.00 71.31 H new ATOM 0 HD3 PRO A 14 24.545 11.613 -20.396 1.00 71.31 H new ATOM 172 N PRO A 15 22.885 16.658 -19.254 1.00 24.11 N ATOM 173 CA PRO A 15 21.826 17.671 -19.219 1.00 62.24 C ATOM 174 C PRO A 15 21.839 18.565 -20.454 1.00 41.42 C ATOM 175 O PRO A 15 22.787 18.566 -21.240 1.00 10.31 O ATOM 176 CB PRO A 15 22.155 18.485 -17.966 1.00 12.14 C ATOM 177 CG PRO A 15 23.621 18.306 -17.771 1.00 32.31 C ATOM 178 CD PRO A 15 23.936 16.918 -18.256 1.00 22.45 C ATOM 0 HA PRO A 15 20.833 17.222 -19.203 1.00 62.24 H new ATOM 0 HB2 PRO A 15 21.899 19.536 -18.098 1.00 12.14 H new ATOM 0 HB3 PRO A 15 21.594 18.127 -17.103 1.00 12.14 H new ATOM 0 HG2 PRO A 15 24.183 19.053 -18.332 1.00 32.31 H new ATOM 0 HG3 PRO A 15 23.893 18.424 -16.722 1.00 32.31 H new ATOM 0 HD2 PRO A 15 24.931 16.863 -18.697 1.00 22.45 H new ATOM 0 HD3 PRO A 15 23.907 16.192 -17.443 1.00 22.45 H new ATOM 186 N PRO A 16 20.763 19.346 -20.631 1.00 40.34 N ATOM 187 CA PRO A 16 20.628 20.261 -21.769 1.00 15.12 C ATOM 188 C PRO A 16 21.591 21.440 -21.682 1.00 53.14 C ATOM 189 O PRO A 16 22.487 21.460 -20.839 1.00 55.22 O ATOM 190 CB PRO A 16 19.179 20.745 -21.664 1.00 41.11 C ATOM 191 CG PRO A 16 18.834 20.598 -20.222 1.00 73.35 C ATOM 192 CD PRO A 16 19.596 19.397 -19.735 1.00 21.13 C ATOM 0 HA PRO A 16 20.862 19.773 -22.715 1.00 15.12 H new ATOM 0 HB2 PRO A 16 19.083 21.781 -21.990 1.00 41.11 H new ATOM 0 HB3 PRO A 16 18.516 20.150 -22.292 1.00 41.11 H new ATOM 0 HG2 PRO A 16 19.112 21.490 -19.661 1.00 73.35 H new ATOM 0 HG3 PRO A 16 17.761 20.460 -20.089 1.00 73.35 H new ATOM 0 HD2 PRO A 16 19.895 19.506 -18.692 1.00 21.13 H new ATOM 0 HD3 PRO A 16 18.998 18.488 -19.802 1.00 21.13 H new ATOM 200 N GLU A 17 21.399 22.420 -22.560 1.00 2.43 N ATOM 201 CA GLU A 17 22.252 23.603 -22.581 1.00 64.34 C ATOM 202 C GLU A 17 22.251 24.300 -21.224 1.00 32.31 C ATOM 203 O GLU A 17 21.575 23.864 -20.292 1.00 50.24 O ATOM 204 CB GLU A 17 21.787 24.575 -23.667 1.00 14.31 C ATOM 205 CG GLU A 17 20.288 24.828 -23.655 1.00 44.51 C ATOM 206 CD GLU A 17 19.876 25.936 -24.605 1.00 44.12 C ATOM 207 OE1 GLU A 17 20.435 27.048 -24.497 1.00 14.13 O ATOM 208 OE2 GLU A 17 18.996 25.692 -25.457 1.00 24.45 O ATOM 0 H GLU A 17 20.662 22.418 -23.265 1.00 2.43 H new ATOM 0 HA GLU A 17 23.270 23.281 -22.803 1.00 64.34 H new ATOM 0 HB2 GLU A 17 22.308 25.524 -23.541 1.00 14.31 H new ATOM 0 HB3 GLU A 17 22.073 24.181 -24.642 1.00 14.31 H new ATOM 0 HG2 GLU A 17 19.766 23.910 -23.925 1.00 44.51 H new ATOM 0 HG3 GLU A 17 19.975 25.087 -22.643 1.00 44.51 H new ATOM 215 N GLU A 18 23.013 25.384 -21.121 1.00 21.00 N ATOM 216 CA GLU A 18 23.101 26.140 -19.877 1.00 54.23 C ATOM 217 C GLU A 18 22.178 27.355 -19.913 1.00 41.23 C ATOM 218 O GLU A 18 22.535 28.404 -20.451 1.00 34.21 O ATOM 219 CB GLU A 18 24.542 26.588 -19.627 1.00 62.00 C ATOM 220 CG GLU A 18 25.182 27.276 -20.821 1.00 71.13 C ATOM 221 CD GLU A 18 26.148 26.374 -21.565 1.00 52.45 C ATOM 222 OE1 GLU A 18 27.190 26.012 -20.981 1.00 30.43 O ATOM 223 OE2 GLU A 18 25.862 26.032 -22.732 1.00 1.22 O ATOM 0 H GLU A 18 23.578 25.758 -21.883 1.00 21.00 H new ATOM 0 HA GLU A 18 22.785 25.488 -19.063 1.00 54.23 H new ATOM 0 HB2 GLU A 18 24.560 27.267 -18.775 1.00 62.00 H new ATOM 0 HB3 GLU A 18 25.141 25.719 -19.355 1.00 62.00 H new ATOM 0 HG2 GLU A 18 24.402 27.609 -21.505 1.00 71.13 H new ATOM 0 HG3 GLU A 18 25.710 28.167 -20.482 1.00 71.13 H new ATOM 230 N VAL A 19 20.989 27.206 -19.337 1.00 64.33 N ATOM 231 CA VAL A 19 20.015 28.290 -19.302 1.00 60.34 C ATOM 232 C VAL A 19 19.286 28.331 -17.964 1.00 22.40 C ATOM 233 O VAL A 19 19.105 27.302 -17.313 1.00 64.15 O ATOM 234 CB VAL A 19 18.980 28.150 -20.434 1.00 53.42 C ATOM 235 CG1 VAL A 19 18.100 29.389 -20.509 1.00 1.10 C ATOM 236 CG2 VAL A 19 19.675 27.899 -21.764 1.00 10.13 C ATOM 0 H VAL A 19 20.677 26.345 -18.888 1.00 64.33 H new ATOM 0 HA VAL A 19 20.569 29.219 -19.439 1.00 60.34 H new ATOM 0 HB VAL A 19 18.343 27.293 -20.216 1.00 53.42 H new ATOM 0 HG11 VAL A 19 17.375 29.272 -21.314 1.00 1.10 H new ATOM 0 HG12 VAL A 19 17.574 29.519 -19.563 1.00 1.10 H new ATOM 0 HG13 VAL A 19 18.720 30.264 -20.703 1.00 1.10 H new ATOM 0 HG21 VAL A 19 18.928 27.803 -22.552 1.00 10.13 H new ATOM 0 HG22 VAL A 19 20.337 28.734 -21.992 1.00 10.13 H new ATOM 0 HG23 VAL A 19 20.258 26.980 -21.702 1.00 10.13 H new ATOM 246 N GLU A 20 18.870 29.526 -17.559 1.00 55.45 N ATOM 247 CA GLU A 20 18.160 29.701 -16.297 1.00 61.25 C ATOM 248 C GLU A 20 16.734 30.188 -16.538 1.00 20.12 C ATOM 249 O GLU A 20 16.388 31.336 -16.259 1.00 0.11 O ATOM 250 CB GLU A 20 18.905 30.692 -15.401 1.00 30.02 C ATOM 251 CG GLU A 20 19.270 31.990 -16.101 1.00 3.22 C ATOM 252 CD GLU A 20 20.552 31.879 -16.904 1.00 11.54 C ATOM 253 OE1 GLU A 20 21.639 31.870 -16.289 1.00 72.31 O ATOM 254 OE2 GLU A 20 20.467 31.802 -18.147 1.00 42.33 O ATOM 0 H GLU A 20 19.012 30.388 -18.086 1.00 55.45 H new ATOM 0 HA GLU A 20 18.115 28.733 -15.797 1.00 61.25 H new ATOM 0 HB2 GLU A 20 18.287 30.919 -14.532 1.00 30.02 H new ATOM 0 HB3 GLU A 20 19.815 30.221 -15.030 1.00 30.02 H new ATOM 0 HG2 GLU A 20 18.455 32.283 -16.763 1.00 3.22 H new ATOM 0 HG3 GLU A 20 19.378 32.781 -15.359 1.00 3.22 H new ATOM 261 N PRO A 21 15.886 29.295 -17.069 1.00 32.34 N ATOM 262 CA PRO A 21 14.484 29.610 -17.359 1.00 32.24 C ATOM 263 C PRO A 21 13.656 29.789 -16.091 1.00 12.32 C ATOM 264 O PRO A 21 12.675 30.532 -16.078 1.00 60.12 O ATOM 265 CB PRO A 21 14.001 28.388 -18.144 1.00 52.01 C ATOM 266 CG PRO A 21 14.893 27.279 -17.705 1.00 62.45 C ATOM 267 CD PRO A 21 16.230 27.908 -17.426 1.00 12.20 C ATOM 0 HA PRO A 21 14.381 30.550 -17.901 1.00 32.24 H new ATOM 0 HB2 PRO A 21 12.956 28.165 -17.927 1.00 52.01 H new ATOM 0 HB3 PRO A 21 14.075 28.553 -19.219 1.00 52.01 H new ATOM 0 HG2 PRO A 21 14.498 26.790 -16.814 1.00 62.45 H new ATOM 0 HG3 PRO A 21 14.975 26.515 -18.478 1.00 62.45 H new ATOM 0 HD2 PRO A 21 16.751 27.401 -16.614 1.00 12.20 H new ATOM 0 HD3 PRO A 21 16.883 27.867 -18.298 1.00 12.20 H new ATOM 275 N GLY A 22 14.058 29.104 -15.025 1.00 11.15 N ATOM 276 CA GLY A 22 13.342 29.202 -13.766 1.00 53.42 C ATOM 277 C GLY A 22 13.620 30.504 -13.041 1.00 12.01 C ATOM 278 O GLY A 22 12.981 30.811 -12.035 1.00 34.44 O ATOM 0 H GLY A 22 14.867 28.483 -15.011 1.00 11.15 H new ATOM 0 HA2 GLY A 22 12.272 29.115 -13.953 1.00 53.42 H new ATOM 0 HA3 GLY A 22 13.623 28.366 -13.126 1.00 53.42 H new ATOM 282 N SER A 23 14.578 31.271 -13.552 1.00 15.35 N ATOM 283 CA SER A 23 14.943 32.545 -12.942 1.00 71.24 C ATOM 284 C SER A 23 13.716 33.434 -12.764 1.00 72.32 C ATOM 285 O SER A 23 12.985 33.700 -13.717 1.00 53.31 O ATOM 286 CB SER A 23 15.987 33.263 -13.799 1.00 50.34 C ATOM 287 OG SER A 23 15.475 33.556 -15.088 1.00 62.10 O ATOM 0 H SER A 23 15.115 31.033 -14.386 1.00 15.35 H new ATOM 0 HA SER A 23 15.367 32.341 -11.959 1.00 71.24 H new ATOM 0 HB2 SER A 23 16.293 34.186 -13.307 1.00 50.34 H new ATOM 0 HB3 SER A 23 16.877 32.641 -13.891 1.00 50.34 H new ATOM 0 HG SER A 23 15.597 32.779 -15.673 1.00 62.10 H new ATOM 293 N GLY A 24 13.497 33.890 -11.535 1.00 35.25 N ATOM 294 CA GLY A 24 12.358 34.744 -11.252 1.00 75.41 C ATOM 295 C GLY A 24 11.623 34.333 -9.991 1.00 65.42 C ATOM 296 O GLY A 24 10.402 34.459 -9.906 1.00 52.01 O ATOM 0 H GLY A 24 14.088 33.683 -10.730 1.00 35.25 H new ATOM 0 HA2 GLY A 24 12.697 35.775 -11.151 1.00 75.41 H new ATOM 0 HA3 GLY A 24 11.669 34.716 -12.096 1.00 75.41 H new ATOM 300 N VAL A 25 12.369 33.837 -9.009 1.00 4.43 N ATOM 301 CA VAL A 25 11.782 33.406 -7.746 1.00 60.40 C ATOM 302 C VAL A 25 12.757 33.603 -6.591 1.00 31.54 C ATOM 303 O VAL A 25 13.972 33.524 -6.770 1.00 63.13 O ATOM 304 CB VAL A 25 11.360 31.925 -7.800 1.00 51.35 C ATOM 305 CG1 VAL A 25 10.691 31.512 -6.498 1.00 51.43 C ATOM 306 CG2 VAL A 25 10.438 31.678 -8.985 1.00 20.10 C ATOM 0 H VAL A 25 13.381 33.724 -9.064 1.00 4.43 H new ATOM 0 HA VAL A 25 10.898 34.023 -7.581 1.00 60.40 H new ATOM 0 HB VAL A 25 12.254 31.315 -7.930 1.00 51.35 H new ATOM 0 HG11 VAL A 25 10.400 30.463 -6.555 1.00 51.43 H new ATOM 0 HG12 VAL A 25 11.387 31.651 -5.671 1.00 51.43 H new ATOM 0 HG13 VAL A 25 9.805 32.126 -6.333 1.00 51.43 H new ATOM 0 HG21 VAL A 25 10.149 30.627 -9.009 1.00 20.10 H new ATOM 0 HG22 VAL A 25 9.546 32.297 -8.887 1.00 20.10 H new ATOM 0 HG23 VAL A 25 10.957 31.932 -9.909 1.00 20.10 H new ATOM 316 N ARG A 26 12.216 33.858 -5.404 1.00 53.41 N ATOM 317 CA ARG A 26 13.038 34.067 -4.218 1.00 51.44 C ATOM 318 C ARG A 26 12.636 33.108 -3.102 1.00 61.21 C ATOM 319 O ARG A 26 11.810 33.441 -2.252 1.00 23.34 O ATOM 320 CB ARG A 26 12.912 35.513 -3.733 1.00 23.31 C ATOM 321 CG ARG A 26 13.548 35.756 -2.374 1.00 45.11 C ATOM 322 CD ARG A 26 14.405 37.013 -2.377 1.00 33.20 C ATOM 323 NE ARG A 26 13.688 38.165 -1.837 1.00 31.11 N ATOM 324 CZ ARG A 26 14.291 39.248 -1.359 1.00 31.41 C ATOM 325 NH1 ARG A 26 15.614 39.326 -1.355 1.00 24.15 N ATOM 326 NH2 ARG A 26 13.570 40.255 -0.884 1.00 54.34 N ATOM 0 H ARG A 26 11.212 33.925 -5.238 1.00 53.41 H new ATOM 0 HA ARG A 26 14.076 33.870 -4.486 1.00 51.44 H new ATOM 0 HB2 ARG A 26 13.375 36.175 -4.465 1.00 23.31 H new ATOM 0 HB3 ARG A 26 11.856 35.780 -3.684 1.00 23.31 H new ATOM 0 HG2 ARG A 26 12.769 35.847 -1.617 1.00 45.11 H new ATOM 0 HG3 ARG A 26 14.160 34.897 -2.099 1.00 45.11 H new ATOM 0 HD2 ARG A 26 15.306 36.839 -1.789 1.00 33.20 H new ATOM 0 HD3 ARG A 26 14.726 37.231 -3.396 1.00 33.20 H new ATOM 0 HE ARG A 26 12.668 38.137 -1.826 1.00 31.11 H new ATOM 0 HH11 ARG A 26 16.172 38.554 -1.719 1.00 24.15 H new ATOM 0 HH12 ARG A 26 16.075 40.159 -0.988 1.00 24.15 H new ATOM 0 HH21 ARG A 26 12.552 40.198 -0.885 1.00 54.34 H new ATOM 0 HH22 ARG A 26 14.034 41.086 -0.517 1.00 54.34 H new ATOM 340 N ILE A 27 13.225 31.917 -3.112 1.00 61.24 N ATOM 341 CA ILE A 27 12.929 30.910 -2.101 1.00 32.11 C ATOM 342 C ILE A 27 13.646 31.219 -0.791 1.00 71.11 C ATOM 343 O ILE A 27 14.762 31.739 -0.789 1.00 71.53 O ATOM 344 CB ILE A 27 13.332 29.501 -2.574 1.00 63.11 C ATOM 345 CG1 ILE A 27 12.777 29.231 -3.974 1.00 35.53 C ATOM 346 CG2 ILE A 27 12.839 28.450 -1.590 1.00 41.43 C ATOM 347 CD1 ILE A 27 13.755 29.545 -5.084 1.00 0.04 C ATOM 0 H ILE A 27 13.910 31.626 -3.809 1.00 61.24 H new ATOM 0 HA ILE A 27 11.852 30.935 -1.938 1.00 32.11 H new ATOM 0 HB ILE A 27 14.420 29.446 -2.618 1.00 63.11 H new ATOM 0 HG12 ILE A 27 12.485 28.183 -4.044 1.00 35.53 H new ATOM 0 HG13 ILE A 27 11.874 29.824 -4.118 1.00 35.53 H new ATOM 0 HG21 ILE A 27 13.132 27.460 -1.938 1.00 41.43 H new ATOM 0 HG22 ILE A 27 13.279 28.634 -0.610 1.00 41.43 H new ATOM 0 HG23 ILE A 27 11.753 28.502 -1.516 1.00 41.43 H new ATOM 0 HD11 ILE A 27 13.293 29.329 -6.048 1.00 0.04 H new ATOM 0 HD12 ILE A 27 14.029 30.599 -5.040 1.00 0.04 H new ATOM 0 HD13 ILE A 27 14.649 28.933 -4.965 1.00 0.04 H new ATOM 359 N VAL A 28 12.998 30.894 0.323 1.00 33.11 N ATOM 360 CA VAL A 28 13.574 31.134 1.641 1.00 63.24 C ATOM 361 C VAL A 28 13.104 30.087 2.645 1.00 43.52 C ATOM 362 O VAL A 28 12.134 30.301 3.372 1.00 21.10 O ATOM 363 CB VAL A 28 13.209 32.535 2.166 1.00 21.35 C ATOM 364 CG1 VAL A 28 13.764 32.741 3.568 1.00 61.53 C ATOM 365 CG2 VAL A 28 13.720 33.609 1.219 1.00 42.05 C ATOM 0 H VAL A 28 12.073 30.464 0.339 1.00 33.11 H new ATOM 0 HA VAL A 28 14.656 31.067 1.531 1.00 63.24 H new ATOM 0 HB VAL A 28 12.123 32.614 2.215 1.00 21.35 H new ATOM 0 HG11 VAL A 28 13.496 33.736 3.923 1.00 61.53 H new ATOM 0 HG12 VAL A 28 13.344 31.992 4.239 1.00 61.53 H new ATOM 0 HG13 VAL A 28 14.849 32.643 3.548 1.00 61.53 H new ATOM 0 HG21 VAL A 28 13.453 34.592 1.606 1.00 42.05 H new ATOM 0 HG22 VAL A 28 14.804 33.534 1.135 1.00 42.05 H new ATOM 0 HG23 VAL A 28 13.270 33.471 0.236 1.00 42.05 H new ATOM 375 N VAL A 29 13.799 28.955 2.680 1.00 23.12 N ATOM 376 CA VAL A 29 13.455 27.875 3.597 1.00 75.32 C ATOM 377 C VAL A 29 13.646 28.303 5.047 1.00 31.34 C ATOM 378 O VAL A 29 14.766 28.563 5.485 1.00 62.01 O ATOM 379 CB VAL A 29 14.303 26.618 3.328 1.00 62.14 C ATOM 380 CG1 VAL A 29 13.798 25.445 4.154 1.00 75.15 C ATOM 381 CG2 VAL A 29 14.297 26.279 1.845 1.00 73.43 C ATOM 0 H VAL A 29 14.604 28.762 2.084 1.00 23.12 H new ATOM 0 HA VAL A 29 12.405 27.638 3.427 1.00 75.32 H new ATOM 0 HB VAL A 29 15.331 26.824 3.626 1.00 62.14 H new ATOM 0 HG11 VAL A 29 14.410 24.566 3.950 1.00 75.15 H new ATOM 0 HG12 VAL A 29 13.860 25.693 5.214 1.00 75.15 H new ATOM 0 HG13 VAL A 29 12.761 25.234 3.891 1.00 75.15 H new ATOM 0 HG21 VAL A 29 14.901 25.388 1.673 1.00 73.43 H new ATOM 0 HG22 VAL A 29 13.274 26.092 1.519 1.00 73.43 H new ATOM 0 HG23 VAL A 29 14.712 27.113 1.279 1.00 73.43 H new ATOM 391 N GLU A 30 12.544 28.373 5.788 1.00 24.24 N ATOM 392 CA GLU A 30 12.592 28.770 7.191 1.00 72.24 C ATOM 393 C GLU A 30 12.489 27.552 8.105 1.00 54.23 C ATOM 394 O GLU A 30 11.445 26.902 8.175 1.00 64.10 O ATOM 395 CB GLU A 30 11.462 29.753 7.504 1.00 42.43 C ATOM 396 CG GLU A 30 11.721 30.605 8.735 1.00 14.02 C ATOM 397 CD GLU A 30 10.832 31.833 8.792 1.00 25.23 C ATOM 398 OE1 GLU A 30 11.193 32.854 8.170 1.00 12.35 O ATOM 399 OE2 GLU A 30 9.778 31.773 9.458 1.00 20.43 O ATOM 0 H GLU A 30 11.609 28.160 5.441 1.00 24.24 H new ATOM 0 HA GLU A 30 13.550 29.258 7.372 1.00 72.24 H new ATOM 0 HB2 GLU A 30 11.312 30.407 6.645 1.00 42.43 H new ATOM 0 HB3 GLU A 30 10.536 29.196 7.646 1.00 42.43 H new ATOM 0 HG2 GLU A 30 11.560 30.003 9.629 1.00 14.02 H new ATOM 0 HG3 GLU A 30 12.766 30.916 8.744 1.00 14.02 H new ATOM 406 N TYR A 31 13.578 27.250 8.802 1.00 33.23 N ATOM 407 CA TYR A 31 13.612 26.109 9.710 1.00 52.03 C ATOM 408 C TYR A 31 14.445 26.423 10.949 1.00 51.14 C ATOM 409 O TYR A 31 15.184 27.408 10.981 1.00 31.45 O ATOM 410 CB TYR A 31 14.180 24.881 8.997 1.00 23.32 C ATOM 411 CG TYR A 31 15.639 25.019 8.623 1.00 72.31 C ATOM 412 CD1 TYR A 31 16.015 25.562 7.401 1.00 55.41 C ATOM 413 CD2 TYR A 31 16.641 24.606 9.492 1.00 2.23 C ATOM 414 CE1 TYR A 31 17.346 25.690 7.055 1.00 72.53 C ATOM 415 CE2 TYR A 31 17.975 24.731 9.155 1.00 21.12 C ATOM 416 CZ TYR A 31 18.322 25.273 7.935 1.00 23.42 C ATOM 417 OH TYR A 31 19.650 25.399 7.595 1.00 75.13 O ATOM 0 H TYR A 31 14.449 27.779 8.756 1.00 33.23 H new ATOM 0 HA TYR A 31 12.590 25.897 10.026 1.00 52.03 H new ATOM 0 HB2 TYR A 31 14.059 24.009 9.640 1.00 23.32 H new ATOM 0 HB3 TYR A 31 13.598 24.694 8.094 1.00 23.32 H new ATOM 0 HD1 TYR A 31 15.253 25.890 6.709 1.00 55.41 H new ATOM 0 HD2 TYR A 31 16.373 24.180 10.447 1.00 2.23 H new ATOM 0 HE1 TYR A 31 17.621 26.114 6.101 1.00 72.53 H new ATOM 0 HE2 TYR A 31 18.742 24.406 9.843 1.00 21.12 H new ATOM 0 HH TYR A 31 19.994 26.254 7.929 1.00 75.13 H new ATOM 427 N CYS A 32 14.321 25.578 11.967 1.00 55.42 N ATOM 428 CA CYS A 32 15.061 25.763 13.209 1.00 13.21 C ATOM 429 C CYS A 32 16.521 25.353 13.039 1.00 74.33 C ATOM 430 O CYS A 32 16.844 24.166 13.026 1.00 31.44 O ATOM 431 CB CYS A 32 14.419 24.950 14.335 1.00 1.33 C ATOM 432 SG CYS A 32 15.364 24.963 15.893 1.00 55.30 S ATOM 0 H CYS A 32 13.715 24.758 11.956 1.00 55.42 H new ATOM 0 HA CYS A 32 15.027 26.821 13.469 1.00 13.21 H new ATOM 0 HB2 CYS A 32 13.419 25.340 14.526 1.00 1.33 H new ATOM 0 HB3 CYS A 32 14.301 23.919 14.003 1.00 1.33 H new ATOM 437 N GLU A 33 17.397 26.344 12.908 1.00 71.10 N ATOM 438 CA GLU A 33 18.822 26.085 12.738 1.00 52.32 C ATOM 439 C GLU A 33 19.359 25.226 13.879 1.00 72.44 C ATOM 440 O GLU A 33 19.836 24.109 13.676 1.00 21.14 O ATOM 441 CB GLU A 33 19.597 27.403 12.669 1.00 61.43 C ATOM 442 CG GLU A 33 20.045 27.772 11.265 1.00 52.45 C ATOM 443 CD GLU A 33 18.880 27.970 10.314 1.00 40.10 C ATOM 444 OE1 GLU A 33 17.738 28.116 10.797 1.00 73.24 O ATOM 445 OE2 GLU A 33 19.112 27.979 9.087 1.00 53.33 O ATOM 0 H GLU A 33 17.145 27.332 12.916 1.00 71.10 H new ATOM 0 HA GLU A 33 18.958 25.542 11.803 1.00 52.32 H new ATOM 0 HB2 GLU A 33 18.972 28.204 13.064 1.00 61.43 H new ATOM 0 HB3 GLU A 33 20.473 27.334 13.315 1.00 61.43 H new ATOM 0 HG2 GLU A 33 20.636 28.687 11.305 1.00 52.45 H new ATOM 0 HG3 GLU A 33 20.696 26.988 10.878 1.00 52.45 H new ATOM 452 N PRO A 34 19.280 25.758 15.107 1.00 22.33 N ATOM 453 CA PRO A 34 19.753 25.057 16.305 1.00 1.00 C ATOM 454 C PRO A 34 18.877 23.861 16.661 1.00 61.45 C ATOM 455 O PRO A 34 18.340 23.778 17.765 1.00 31.14 O ATOM 456 CB PRO A 34 19.668 26.126 17.398 1.00 60.52 C ATOM 457 CG PRO A 34 18.620 27.071 16.922 1.00 14.13 C ATOM 458 CD PRO A 34 18.723 27.084 15.422 1.00 22.12 C ATOM 0 HA PRO A 34 20.753 24.646 16.168 1.00 1.00 H new ATOM 0 HB2 PRO A 34 19.400 25.689 18.360 1.00 60.52 H new ATOM 0 HB3 PRO A 34 20.624 26.631 17.533 1.00 60.52 H new ATOM 0 HG2 PRO A 34 17.629 26.748 17.242 1.00 14.13 H new ATOM 0 HG3 PRO A 34 18.778 28.068 17.333 1.00 14.13 H new ATOM 0 HD2 PRO A 34 17.750 27.233 14.954 1.00 22.12 H new ATOM 0 HD3 PRO A 34 19.372 27.886 15.071 1.00 22.12 H new ATOM 466 N CYS A 35 18.737 22.935 15.718 1.00 62.33 N ATOM 467 CA CYS A 35 17.926 21.742 15.931 1.00 44.02 C ATOM 468 C CYS A 35 18.495 20.553 15.162 1.00 43.02 C ATOM 469 O CYS A 35 18.570 19.441 15.683 1.00 4.34 O ATOM 470 CB CYS A 35 16.481 21.998 15.499 1.00 2.41 C ATOM 471 SG CYS A 35 15.527 23.021 16.666 1.00 32.12 S ATOM 0 H CYS A 35 19.175 22.988 14.798 1.00 62.33 H new ATOM 0 HA CYS A 35 17.944 21.507 16.995 1.00 44.02 H new ATOM 0 HB2 CYS A 35 16.485 22.486 14.524 1.00 2.41 H new ATOM 0 HB3 CYS A 35 15.975 21.041 15.374 1.00 2.41 H new ATOM 476 N GLY A 36 18.895 20.797 13.917 1.00 22.43 N ATOM 477 CA GLY A 36 19.452 19.737 13.096 1.00 2.44 C ATOM 478 C GLY A 36 18.624 19.469 11.855 1.00 1.54 C ATOM 479 O GLY A 36 18.667 18.373 11.296 1.00 2.51 O ATOM 0 H GLY A 36 18.843 21.709 13.463 1.00 22.43 H new ATOM 0 HA2 GLY A 36 20.467 20.005 12.801 1.00 2.44 H new ATOM 0 HA3 GLY A 36 19.522 18.823 13.686 1.00 2.44 H new ATOM 483 N PHE A 37 17.866 20.472 11.424 1.00 41.11 N ATOM 484 CA PHE A 37 17.022 20.339 10.242 1.00 31.33 C ATOM 485 C PHE A 37 17.698 20.951 9.019 1.00 13.10 C ATOM 486 O PHE A 37 17.064 21.154 7.984 1.00 30.20 O ATOM 487 CB PHE A 37 15.667 21.009 10.479 1.00 31.44 C ATOM 488 CG PHE A 37 14.937 20.477 11.680 1.00 70.14 C ATOM 489 CD1 PHE A 37 14.668 19.123 11.799 1.00 31.05 C ATOM 490 CD2 PHE A 37 14.520 21.331 12.688 1.00 25.21 C ATOM 491 CE1 PHE A 37 13.996 18.631 12.903 1.00 52.45 C ATOM 492 CE2 PHE A 37 13.848 20.845 13.794 1.00 62.23 C ATOM 493 CZ PHE A 37 13.587 19.493 13.901 1.00 15.14 C ATOM 0 H PHE A 37 17.819 21.385 11.875 1.00 41.11 H new ATOM 0 HA PHE A 37 16.866 19.276 10.055 1.00 31.33 H new ATOM 0 HB2 PHE A 37 15.817 22.082 10.601 1.00 31.44 H new ATOM 0 HB3 PHE A 37 15.044 20.873 9.595 1.00 31.44 H new ATOM 0 HD1 PHE A 37 14.987 18.445 11.021 1.00 31.05 H new ATOM 0 HD2 PHE A 37 14.722 22.389 12.609 1.00 25.21 H new ATOM 0 HE1 PHE A 37 13.791 17.574 12.984 1.00 52.45 H new ATOM 0 HE2 PHE A 37 13.528 21.521 14.573 1.00 62.23 H new ATOM 0 HZ PHE A 37 13.063 19.110 14.765 1.00 15.14 H new ATOM 503 N GLU A 38 18.988 21.244 9.148 1.00 61.24 N ATOM 504 CA GLU A 38 19.750 21.834 8.053 1.00 15.53 C ATOM 505 C GLU A 38 20.308 20.753 7.133 1.00 72.20 C ATOM 506 O GLU A 38 20.810 21.045 6.048 1.00 24.43 O ATOM 507 CB GLU A 38 20.892 22.692 8.602 1.00 53.22 C ATOM 508 CG GLU A 38 21.714 23.374 7.521 1.00 24.53 C ATOM 509 CD GLU A 38 22.524 24.540 8.053 1.00 24.11 C ATOM 510 OE1 GLU A 38 22.877 24.519 9.251 1.00 43.00 O ATOM 511 OE2 GLU A 38 22.805 25.473 7.272 1.00 1.04 O ATOM 0 H GLU A 38 19.527 21.083 9.999 1.00 61.24 H new ATOM 0 HA GLU A 38 19.076 22.466 7.474 1.00 15.53 H new ATOM 0 HB2 GLU A 38 20.478 23.451 9.266 1.00 53.22 H new ATOM 0 HB3 GLU A 38 21.549 22.065 9.205 1.00 53.22 H new ATOM 0 HG2 GLU A 38 22.387 22.646 7.068 1.00 24.53 H new ATOM 0 HG3 GLU A 38 21.049 23.728 6.733 1.00 24.53 H new ATOM 518 N ALA A 39 20.216 19.503 7.575 1.00 70.20 N ATOM 519 CA ALA A 39 20.710 18.377 6.792 1.00 40.34 C ATOM 520 C ALA A 39 19.787 18.081 5.614 1.00 24.22 C ATOM 521 O ALA A 39 20.203 17.484 4.620 1.00 2.14 O ATOM 522 CB ALA A 39 20.857 17.145 7.672 1.00 3.44 C ATOM 0 H ALA A 39 19.804 19.245 8.471 1.00 70.20 H new ATOM 0 HA ALA A 39 21.689 18.645 6.395 1.00 40.34 H new ATOM 0 HB1 ALA A 39 21.227 16.312 7.074 1.00 3.44 H new ATOM 0 HB2 ALA A 39 21.562 17.355 8.477 1.00 3.44 H new ATOM 0 HB3 ALA A 39 19.888 16.884 8.097 1.00 3.44 H new ATOM 528 N THR A 40 18.531 18.501 5.732 1.00 65.20 N ATOM 529 CA THR A 40 17.549 18.279 4.678 1.00 23.44 C ATOM 530 C THR A 40 17.501 19.458 3.714 1.00 42.10 C ATOM 531 O THR A 40 17.104 19.311 2.558 1.00 43.33 O ATOM 532 CB THR A 40 16.142 18.049 5.261 1.00 2.04 C ATOM 533 OG1 THR A 40 16.179 16.996 6.231 1.00 64.33 O ATOM 534 CG2 THR A 40 15.151 17.698 4.162 1.00 44.33 C ATOM 0 H THR A 40 18.170 18.997 6.547 1.00 65.20 H new ATOM 0 HA THR A 40 17.861 17.385 4.138 1.00 23.44 H new ATOM 0 HB THR A 40 15.817 18.972 5.740 1.00 2.04 H new ATOM 0 HG1 THR A 40 15.281 16.857 6.598 1.00 64.33 H new ATOM 0 HG21 THR A 40 14.165 17.540 4.598 1.00 44.33 H new ATOM 0 HG22 THR A 40 15.103 18.514 3.441 1.00 44.33 H new ATOM 0 HG23 THR A 40 15.474 16.787 3.658 1.00 44.33 H new ATOM 542 N TYR A 41 17.908 20.627 4.196 1.00 50.20 N ATOM 543 CA TYR A 41 17.909 21.833 3.376 1.00 5.03 C ATOM 544 C TYR A 41 19.067 21.815 2.383 1.00 5.32 C ATOM 545 O TYR A 41 18.961 22.347 1.277 1.00 32.31 O ATOM 546 CB TYR A 41 18.001 23.077 4.262 1.00 65.21 C ATOM 547 CG TYR A 41 18.246 24.353 3.489 1.00 13.44 C ATOM 548 CD1 TYR A 41 17.407 24.729 2.447 1.00 63.32 C ATOM 549 CD2 TYR A 41 19.315 25.184 3.801 1.00 21.32 C ATOM 550 CE1 TYR A 41 17.627 25.894 1.738 1.00 72.24 C ATOM 551 CE2 TYR A 41 19.541 26.351 3.098 1.00 4.35 C ATOM 552 CZ TYR A 41 18.695 26.702 2.068 1.00 72.14 C ATOM 553 OH TYR A 41 18.918 27.864 1.364 1.00 33.53 O ATOM 0 H TYR A 41 18.241 20.765 5.150 1.00 50.20 H new ATOM 0 HA TYR A 41 16.974 21.862 2.816 1.00 5.03 H new ATOM 0 HB2 TYR A 41 17.076 23.178 4.830 1.00 65.21 H new ATOM 0 HB3 TYR A 41 18.805 22.940 4.985 1.00 65.21 H new ATOM 0 HD1 TYR A 41 16.569 24.100 2.187 1.00 63.32 H new ATOM 0 HD2 TYR A 41 19.981 24.913 4.607 1.00 21.32 H new ATOM 0 HE1 TYR A 41 16.966 26.171 0.930 1.00 72.24 H new ATOM 0 HE2 TYR A 41 20.377 26.986 3.354 1.00 4.35 H new ATOM 0 HH TYR A 41 19.709 28.317 1.723 1.00 33.53 H new ATOM 563 N LEU A 42 20.174 21.200 2.786 1.00 72.13 N ATOM 564 CA LEU A 42 21.353 21.111 1.932 1.00 25.22 C ATOM 565 C LEU A 42 21.223 19.958 0.941 1.00 0.44 C ATOM 566 O LEU A 42 21.828 19.978 -0.130 1.00 73.31 O ATOM 567 CB LEU A 42 22.611 20.926 2.784 1.00 53.32 C ATOM 568 CG LEU A 42 23.503 22.158 2.939 1.00 40.30 C ATOM 569 CD1 LEU A 42 22.702 23.333 3.479 1.00 22.23 C ATOM 570 CD2 LEU A 42 24.683 21.851 3.850 1.00 71.14 C ATOM 0 H LEU A 42 20.279 20.756 3.698 1.00 72.13 H new ATOM 0 HA LEU A 42 21.435 22.041 1.370 1.00 25.22 H new ATOM 0 HB2 LEU A 42 22.308 20.594 3.777 1.00 53.32 H new ATOM 0 HB3 LEU A 42 23.206 20.124 2.348 1.00 53.32 H new ATOM 0 HG LEU A 42 23.889 22.429 1.956 1.00 40.30 H new ATOM 0 HD11 LEU A 42 23.354 24.201 3.583 1.00 22.23 H new ATOM 0 HD12 LEU A 42 21.891 23.568 2.789 1.00 22.23 H new ATOM 0 HD13 LEU A 42 22.286 23.073 4.453 1.00 22.23 H new ATOM 0 HD21 LEU A 42 25.307 22.739 3.949 1.00 71.14 H new ATOM 0 HD22 LEU A 42 24.316 21.554 4.833 1.00 71.14 H new ATOM 0 HD23 LEU A 42 25.272 21.040 3.422 1.00 71.14 H new ATOM 582 N GLU A 43 20.428 18.958 1.307 1.00 61.51 N ATOM 583 CA GLU A 43 20.218 17.798 0.449 1.00 74.43 C ATOM 584 C GLU A 43 19.374 18.167 -0.768 1.00 31.10 C ATOM 585 O GLU A 43 19.397 17.475 -1.787 1.00 42.41 O ATOM 586 CB GLU A 43 19.538 16.672 1.232 1.00 50.51 C ATOM 587 CG GLU A 43 20.508 15.802 2.013 1.00 63.04 C ATOM 588 CD GLU A 43 19.819 14.971 3.077 1.00 24.34 C ATOM 589 OE1 GLU A 43 18.622 15.211 3.336 1.00 74.13 O ATOM 590 OE2 GLU A 43 20.479 14.079 3.652 1.00 10.42 O ATOM 0 H GLU A 43 19.919 18.928 2.191 1.00 61.51 H new ATOM 0 HA GLU A 43 21.193 17.453 0.103 1.00 74.43 H new ATOM 0 HB2 GLU A 43 18.815 17.106 1.923 1.00 50.51 H new ATOM 0 HB3 GLU A 43 18.978 16.045 0.538 1.00 50.51 H new ATOM 0 HG2 GLU A 43 21.033 15.140 1.324 1.00 63.04 H new ATOM 0 HG3 GLU A 43 21.261 16.435 2.483 1.00 63.04 H new ATOM 597 N LEU A 44 18.629 19.261 -0.654 1.00 31.23 N ATOM 598 CA LEU A 44 17.776 19.723 -1.743 1.00 44.24 C ATOM 599 C LEU A 44 18.360 20.970 -2.400 1.00 65.45 C ATOM 600 O LEU A 44 18.248 21.155 -3.612 1.00 2.32 O ATOM 601 CB LEU A 44 16.368 20.018 -1.225 1.00 52.42 C ATOM 602 CG LEU A 44 16.232 21.230 -0.302 1.00 44.14 C ATOM 603 CD1 LEU A 44 15.950 22.487 -1.110 1.00 44.42 C ATOM 604 CD2 LEU A 44 15.135 20.997 0.726 1.00 41.40 C ATOM 0 H LEU A 44 18.598 19.845 0.182 1.00 31.23 H new ATOM 0 HA LEU A 44 17.723 18.931 -2.490 1.00 44.24 H new ATOM 0 HB2 LEU A 44 15.710 20.164 -2.082 1.00 52.42 H new ATOM 0 HB3 LEU A 44 16.007 19.138 -0.692 1.00 52.42 H new ATOM 0 HG LEU A 44 17.175 21.367 0.227 1.00 44.14 H new ATOM 0 HD11 LEU A 44 15.856 23.339 -0.437 1.00 44.42 H new ATOM 0 HD12 LEU A 44 16.770 22.663 -1.806 1.00 44.42 H new ATOM 0 HD13 LEU A 44 15.022 22.361 -1.667 1.00 44.42 H new ATOM 0 HD21 LEU A 44 15.052 21.870 1.374 1.00 41.40 H new ATOM 0 HD22 LEU A 44 14.186 20.833 0.215 1.00 41.40 H new ATOM 0 HD23 LEU A 44 15.379 20.121 1.327 1.00 41.40 H new ATOM 616 N ALA A 45 18.986 21.820 -1.593 1.00 61.10 N ATOM 617 CA ALA A 45 19.592 23.046 -2.097 1.00 12.45 C ATOM 618 C ALA A 45 20.791 22.741 -2.988 1.00 31.24 C ATOM 619 O ALA A 45 21.237 23.591 -3.758 1.00 12.43 O ATOM 620 CB ALA A 45 20.006 23.944 -0.940 1.00 23.32 C ATOM 0 H ALA A 45 19.087 21.682 -0.587 1.00 61.10 H new ATOM 0 HA ALA A 45 18.849 23.568 -2.700 1.00 12.45 H new ATOM 0 HB1 ALA A 45 20.457 24.856 -1.331 1.00 23.32 H new ATOM 0 HB2 ALA A 45 19.129 24.199 -0.345 1.00 23.32 H new ATOM 0 HB3 ALA A 45 20.729 23.421 -0.314 1.00 23.32 H new ATOM 626 N SER A 46 21.309 21.522 -2.877 1.00 62.10 N ATOM 627 CA SER A 46 22.460 21.106 -3.670 1.00 22.22 C ATOM 628 C SER A 46 22.021 20.592 -5.037 1.00 74.33 C ATOM 629 O SER A 46 22.845 20.367 -5.923 1.00 3.43 O ATOM 630 CB SER A 46 23.248 20.021 -2.933 1.00 71.54 C ATOM 631 OG SER A 46 24.486 19.766 -3.574 1.00 3.24 O ATOM 0 H SER A 46 20.950 20.805 -2.246 1.00 62.10 H new ATOM 0 HA SER A 46 23.102 21.975 -3.817 1.00 22.22 H new ATOM 0 HB2 SER A 46 23.425 20.332 -1.903 1.00 71.54 H new ATOM 0 HB3 SER A 46 22.660 19.104 -2.893 1.00 71.54 H new ATOM 0 HG SER A 46 24.397 19.932 -4.536 1.00 3.24 H new ATOM 637 N ALA A 47 20.715 20.407 -5.201 1.00 53.23 N ATOM 638 CA ALA A 47 20.164 19.922 -6.460 1.00 70.45 C ATOM 639 C ALA A 47 19.390 21.020 -7.181 1.00 13.20 C ATOM 640 O ALA A 47 19.317 21.039 -8.410 1.00 34.53 O ATOM 641 CB ALA A 47 19.269 18.716 -6.215 1.00 14.20 C ATOM 0 H ALA A 47 20.019 20.586 -4.477 1.00 53.23 H new ATOM 0 HA ALA A 47 20.994 19.621 -7.099 1.00 70.45 H new ATOM 0 HB1 ALA A 47 18.864 18.364 -7.164 1.00 14.20 H new ATOM 0 HB2 ALA A 47 19.851 17.919 -5.751 1.00 14.20 H new ATOM 0 HB3 ALA A 47 18.450 18.999 -5.554 1.00 14.20 H new ATOM 647 N VAL A 48 18.812 21.935 -6.408 1.00 60.25 N ATOM 648 CA VAL A 48 18.043 23.037 -6.973 1.00 41.33 C ATOM 649 C VAL A 48 18.952 24.197 -7.366 1.00 31.23 C ATOM 650 O VAL A 48 18.669 24.929 -8.315 1.00 21.44 O ATOM 651 CB VAL A 48 16.980 23.546 -5.982 1.00 34.21 C ATOM 652 CG1 VAL A 48 16.215 24.720 -6.574 1.00 71.44 C ATOM 653 CG2 VAL A 48 16.031 22.421 -5.596 1.00 11.11 C ATOM 0 H VAL A 48 18.862 21.934 -5.389 1.00 60.25 H new ATOM 0 HA VAL A 48 17.545 22.652 -7.863 1.00 41.33 H new ATOM 0 HB VAL A 48 17.485 23.891 -5.080 1.00 34.21 H new ATOM 0 HG11 VAL A 48 15.468 25.066 -5.859 1.00 71.44 H new ATOM 0 HG12 VAL A 48 16.908 25.531 -6.796 1.00 71.44 H new ATOM 0 HG13 VAL A 48 15.719 24.405 -7.492 1.00 71.44 H new ATOM 0 HG21 VAL A 48 15.286 22.798 -4.895 1.00 11.11 H new ATOM 0 HG22 VAL A 48 15.532 22.044 -6.488 1.00 11.11 H new ATOM 0 HG23 VAL A 48 16.595 21.614 -5.127 1.00 11.11 H new ATOM 663 N LYS A 49 20.046 24.359 -6.629 1.00 40.05 N ATOM 664 CA LYS A 49 20.999 25.428 -6.900 1.00 44.52 C ATOM 665 C LYS A 49 21.783 25.148 -8.179 1.00 10.15 C ATOM 666 O LYS A 49 22.303 26.066 -8.812 1.00 12.11 O ATOM 667 CB LYS A 49 21.964 25.590 -5.723 1.00 70.12 C ATOM 668 CG LYS A 49 22.841 26.826 -5.821 1.00 1.04 C ATOM 669 CD LYS A 49 22.171 28.036 -5.192 1.00 40.30 C ATOM 670 CE LYS A 49 21.218 28.713 -6.165 1.00 14.34 C ATOM 671 NZ LYS A 49 21.144 30.183 -5.937 1.00 12.15 N ATOM 0 H LYS A 49 20.294 23.763 -5.839 1.00 40.05 H new ATOM 0 HA LYS A 49 20.439 26.354 -7.033 1.00 44.52 H new ATOM 0 HB2 LYS A 49 21.390 25.634 -4.797 1.00 70.12 H new ATOM 0 HB3 LYS A 49 22.600 24.707 -5.662 1.00 70.12 H new ATOM 0 HG2 LYS A 49 23.793 26.638 -5.325 1.00 1.04 H new ATOM 0 HG3 LYS A 49 23.062 27.034 -6.868 1.00 1.04 H new ATOM 0 HD2 LYS A 49 21.625 27.728 -4.300 1.00 40.30 H new ATOM 0 HD3 LYS A 49 22.931 28.748 -4.870 1.00 40.30 H new ATOM 0 HE2 LYS A 49 21.545 28.520 -7.187 1.00 14.34 H new ATOM 0 HE3 LYS A 49 20.224 28.279 -6.061 1.00 14.34 H new ATOM 0 HZ1 LYS A 49 20.484 30.607 -6.620 1.00 12.15 H new ATOM 0 HZ2 LYS A 49 20.808 30.368 -4.970 1.00 12.15 H new ATOM 0 HZ3 LYS A 49 22.088 30.602 -6.061 1.00 12.15 H new ATOM 685 N GLU A 50 21.862 23.875 -8.552 1.00 32.32 N ATOM 686 CA GLU A 50 22.582 23.475 -9.755 1.00 53.34 C ATOM 687 C GLU A 50 21.637 23.387 -10.950 1.00 52.15 C ATOM 688 O GLU A 50 22.058 23.082 -12.066 1.00 2.22 O ATOM 689 CB GLU A 50 23.275 22.128 -9.539 1.00 13.43 C ATOM 690 CG GLU A 50 24.456 21.896 -10.466 1.00 31.44 C ATOM 691 CD GLU A 50 25.368 20.786 -9.981 1.00 22.25 C ATOM 692 OE1 GLU A 50 24.888 19.908 -9.233 1.00 10.22 O ATOM 693 OE2 GLU A 50 26.562 20.795 -10.348 1.00 34.31 O ATOM 0 H GLU A 50 21.436 23.103 -8.039 1.00 32.32 H new ATOM 0 HA GLU A 50 23.336 24.233 -9.964 1.00 53.34 H new ATOM 0 HB2 GLU A 50 23.617 22.066 -8.506 1.00 13.43 H new ATOM 0 HB3 GLU A 50 22.549 21.328 -9.682 1.00 13.43 H new ATOM 0 HG2 GLU A 50 24.088 21.650 -11.462 1.00 31.44 H new ATOM 0 HG3 GLU A 50 25.029 22.819 -10.556 1.00 31.44 H new ATOM 700 N GLN A 51 20.358 23.656 -10.707 1.00 60.43 N ATOM 701 CA GLN A 51 19.353 23.605 -11.763 1.00 3.22 C ATOM 702 C GLN A 51 18.883 25.008 -12.134 1.00 64.35 C ATOM 703 O GLN A 51 18.781 25.347 -13.314 1.00 33.34 O ATOM 704 CB GLN A 51 18.161 22.755 -11.321 1.00 12.32 C ATOM 705 CG GLN A 51 17.320 22.238 -12.477 1.00 42.41 C ATOM 706 CD GLN A 51 17.581 20.776 -12.780 1.00 41.13 C ATOM 707 OE1 GLN A 51 17.958 20.419 -13.897 1.00 54.30 O ATOM 708 NE2 GLN A 51 17.382 19.920 -11.785 1.00 2.23 N ATOM 0 H GLN A 51 19.993 23.911 -9.789 1.00 60.43 H new ATOM 0 HA GLN A 51 19.808 23.149 -12.642 1.00 3.22 H new ATOM 0 HB2 GLN A 51 18.525 21.908 -10.740 1.00 12.32 H new ATOM 0 HB3 GLN A 51 17.529 23.347 -10.659 1.00 12.32 H new ATOM 0 HG2 GLN A 51 16.264 22.374 -12.242 1.00 42.41 H new ATOM 0 HG3 GLN A 51 17.528 22.832 -13.367 1.00 42.41 H new ATOM 0 HE21 GLN A 51 17.069 20.259 -10.875 1.00 2.23 H new ATOM 0 HE22 GLN A 51 17.542 18.923 -11.930 1.00 2.23 H new ATOM 717 N TYR A 52 18.599 25.819 -11.122 1.00 20.45 N ATOM 718 CA TYR A 52 18.137 27.184 -11.342 1.00 21.21 C ATOM 719 C TYR A 52 19.101 28.192 -10.723 1.00 60.33 C ATOM 720 O TYR A 52 18.860 28.741 -9.648 1.00 50.12 O ATOM 721 CB TYR A 52 16.738 27.372 -10.753 1.00 52.35 C ATOM 722 CG TYR A 52 15.654 26.653 -11.525 1.00 45.33 C ATOM 723 CD1 TYR A 52 15.625 26.686 -12.914 1.00 15.41 C ATOM 724 CD2 TYR A 52 14.661 25.940 -10.866 1.00 22.15 C ATOM 725 CE1 TYR A 52 14.636 26.032 -13.623 1.00 22.41 C ATOM 726 CE2 TYR A 52 13.670 25.281 -11.566 1.00 72.34 C ATOM 727 CZ TYR A 52 13.661 25.330 -12.945 1.00 3.02 C ATOM 728 OH TYR A 52 12.676 24.675 -13.647 1.00 51.24 O ATOM 0 H TYR A 52 18.681 25.555 -10.140 1.00 20.45 H new ATOM 0 HA TYR A 52 18.098 27.359 -12.417 1.00 21.21 H new ATOM 0 HB2 TYR A 52 16.736 27.016 -9.723 1.00 52.35 H new ATOM 0 HB3 TYR A 52 16.506 28.437 -10.723 1.00 52.35 H new ATOM 0 HD1 TYR A 52 16.388 27.232 -13.448 1.00 15.41 H new ATOM 0 HD2 TYR A 52 14.664 25.900 -9.787 1.00 22.15 H new ATOM 0 HE1 TYR A 52 14.626 26.070 -14.702 1.00 22.41 H new ATOM 0 HE2 TYR A 52 12.906 24.730 -11.037 1.00 72.34 H new ATOM 0 HH TYR A 52 12.069 24.229 -13.020 1.00 51.24 H new ATOM 738 N PRO A 53 20.221 28.442 -11.419 1.00 35.44 N ATOM 739 CA PRO A 53 21.244 29.385 -10.959 1.00 31.03 C ATOM 740 C PRO A 53 20.767 30.832 -11.018 1.00 40.13 C ATOM 741 O PRO A 53 21.441 31.739 -10.531 1.00 63.35 O ATOM 742 CB PRO A 53 22.398 29.162 -11.939 1.00 23.31 C ATOM 743 CG PRO A 53 21.751 28.634 -13.172 1.00 70.45 C ATOM 744 CD PRO A 53 20.573 27.823 -12.707 1.00 61.24 C ATOM 0 HA PRO A 53 21.514 29.217 -9.916 1.00 31.03 H new ATOM 0 HB2 PRO A 53 22.933 30.091 -12.139 1.00 23.31 H new ATOM 0 HB3 PRO A 53 23.125 28.455 -11.540 1.00 23.31 H new ATOM 0 HG2 PRO A 53 21.432 29.447 -13.824 1.00 70.45 H new ATOM 0 HG3 PRO A 53 22.446 28.020 -13.745 1.00 70.45 H new ATOM 0 HD2 PRO A 53 19.746 27.872 -13.416 1.00 61.24 H new ATOM 0 HD3 PRO A 53 20.831 26.770 -12.590 1.00 61.24 H new ATOM 752 N GLY A 54 19.599 31.041 -11.618 1.00 40.53 N ATOM 753 CA GLY A 54 19.052 32.381 -11.730 1.00 11.02 C ATOM 754 C GLY A 54 18.269 32.792 -10.498 1.00 43.05 C ATOM 755 O GLY A 54 18.380 33.928 -10.036 1.00 35.35 O ATOM 0 H GLY A 54 19.022 30.307 -12.028 1.00 40.53 H new ATOM 0 HA2 GLY A 54 19.864 33.089 -11.894 1.00 11.02 H new ATOM 0 HA3 GLY A 54 18.403 32.433 -12.604 1.00 11.02 H new ATOM 759 N ILE A 55 17.476 31.868 -9.968 1.00 31.31 N ATOM 760 CA ILE A 55 16.672 32.141 -8.783 1.00 75.34 C ATOM 761 C ILE A 55 17.548 32.563 -7.609 1.00 30.50 C ATOM 762 O ILE A 55 18.759 32.723 -7.753 1.00 25.33 O ATOM 763 CB ILE A 55 15.839 30.912 -8.373 1.00 30.23 C ATOM 764 CG1 ILE A 55 16.759 29.754 -7.980 1.00 34.30 C ATOM 765 CG2 ILE A 55 14.911 30.498 -9.505 1.00 43.03 C ATOM 766 CD1 ILE A 55 16.569 29.288 -6.553 1.00 54.43 C ATOM 0 H ILE A 55 17.373 30.924 -10.340 1.00 31.31 H new ATOM 0 HA ILE A 55 15.997 32.957 -9.041 1.00 75.34 H new ATOM 0 HB ILE A 55 15.229 31.177 -7.509 1.00 30.23 H new ATOM 0 HG12 ILE A 55 16.582 28.916 -8.654 1.00 34.30 H new ATOM 0 HG13 ILE A 55 17.796 30.061 -8.118 1.00 34.30 H new ATOM 0 HG21 ILE A 55 14.330 29.628 -9.199 1.00 43.03 H new ATOM 0 HG22 ILE A 55 14.236 31.321 -9.742 1.00 43.03 H new ATOM 0 HG23 ILE A 55 15.501 30.248 -10.386 1.00 43.03 H new ATOM 0 HD11 ILE A 55 17.253 28.466 -6.345 1.00 54.43 H new ATOM 0 HD12 ILE A 55 16.774 30.113 -5.871 1.00 54.43 H new ATOM 0 HD13 ILE A 55 15.542 28.949 -6.414 1.00 54.43 H new ATOM 778 N GLU A 56 16.926 32.739 -6.447 1.00 65.01 N ATOM 779 CA GLU A 56 17.651 33.141 -5.247 1.00 41.24 C ATOM 780 C GLU A 56 17.098 32.432 -4.014 1.00 42.04 C ATOM 781 O GLU A 56 16.030 32.782 -3.511 1.00 63.11 O ATOM 782 CB GLU A 56 17.567 34.657 -5.058 1.00 12.21 C ATOM 783 CG GLU A 56 18.770 35.407 -5.605 1.00 73.24 C ATOM 784 CD GLU A 56 19.893 35.526 -4.593 1.00 53.35 C ATOM 785 OE1 GLU A 56 19.972 34.666 -3.692 1.00 32.23 O ATOM 786 OE2 GLU A 56 20.692 36.479 -4.703 1.00 12.52 O ATOM 0 H GLU A 56 15.923 32.610 -6.311 1.00 65.01 H new ATOM 0 HA GLU A 56 18.695 32.855 -5.371 1.00 41.24 H new ATOM 0 HB2 GLU A 56 16.666 35.026 -5.548 1.00 12.21 H new ATOM 0 HB3 GLU A 56 17.465 34.877 -3.995 1.00 12.21 H new ATOM 0 HG2 GLU A 56 19.139 34.895 -6.493 1.00 73.24 H new ATOM 0 HG3 GLU A 56 18.460 36.404 -5.917 1.00 73.24 H new ATOM 793 N ILE A 57 17.832 31.434 -3.534 1.00 44.13 N ATOM 794 CA ILE A 57 17.416 30.676 -2.361 1.00 4.11 C ATOM 795 C ILE A 57 18.342 30.941 -1.178 1.00 41.45 C ATOM 796 O ILE A 57 19.554 31.072 -1.344 1.00 63.43 O ATOM 797 CB ILE A 57 17.390 29.163 -2.648 1.00 52.32 C ATOM 798 CG1 ILE A 57 17.233 28.377 -1.345 1.00 15.21 C ATOM 799 CG2 ILE A 57 18.656 28.741 -3.379 1.00 34.54 C ATOM 800 CD1 ILE A 57 15.934 28.659 -0.622 1.00 50.21 C ATOM 0 H ILE A 57 18.718 31.132 -3.939 1.00 44.13 H new ATOM 0 HA ILE A 57 16.408 31.008 -2.113 1.00 4.11 H new ATOM 0 HB ILE A 57 16.535 28.944 -3.287 1.00 52.32 H new ATOM 0 HG12 ILE A 57 17.294 27.311 -1.564 1.00 15.21 H new ATOM 0 HG13 ILE A 57 18.066 28.615 -0.684 1.00 15.21 H new ATOM 0 HG21 ILE A 57 18.623 27.669 -3.575 1.00 34.54 H new ATOM 0 HG22 ILE A 57 18.728 29.280 -4.323 1.00 34.54 H new ATOM 0 HG23 ILE A 57 19.525 28.971 -2.763 1.00 34.54 H new ATOM 0 HD11 ILE A 57 15.891 28.068 0.293 1.00 50.21 H new ATOM 0 HD12 ILE A 57 15.879 29.719 -0.372 1.00 50.21 H new ATOM 0 HD13 ILE A 57 15.095 28.394 -1.265 1.00 50.21 H new ATOM 812 N GLU A 58 17.762 31.018 0.015 1.00 54.50 N ATOM 813 CA GLU A 58 18.536 31.267 1.226 1.00 54.25 C ATOM 814 C GLU A 58 17.857 30.645 2.443 1.00 40.14 C ATOM 815 O GLU A 58 16.727 30.165 2.359 1.00 73.25 O ATOM 816 CB GLU A 58 18.716 32.771 1.442 1.00 44.11 C ATOM 817 CG GLU A 58 19.560 33.443 0.371 1.00 14.13 C ATOM 818 CD GLU A 58 19.676 34.941 0.575 1.00 1.14 C ATOM 819 OE1 GLU A 58 20.096 35.360 1.674 1.00 64.10 O ATOM 820 OE2 GLU A 58 19.347 35.695 -0.365 1.00 31.43 O ATOM 0 H GLU A 58 16.759 30.912 0.169 1.00 54.50 H new ATOM 0 HA GLU A 58 19.515 30.805 1.102 1.00 54.25 H new ATOM 0 HB2 GLU A 58 17.735 33.245 1.471 1.00 44.11 H new ATOM 0 HB3 GLU A 58 19.179 32.937 2.415 1.00 44.11 H new ATOM 0 HG2 GLU A 58 20.557 33.002 0.369 1.00 14.13 H new ATOM 0 HG3 GLU A 58 19.123 33.246 -0.608 1.00 14.13 H new ATOM 827 N SER A 59 18.556 30.657 3.573 1.00 11.31 N ATOM 828 CA SER A 59 18.024 30.091 4.807 1.00 72.21 C ATOM 829 C SER A 59 17.616 31.193 5.780 1.00 44.34 C ATOM 830 O SER A 59 18.022 32.346 5.633 1.00 1.41 O ATOM 831 CB SER A 59 19.060 29.175 5.461 1.00 3.22 C ATOM 832 OG SER A 59 19.990 29.922 6.227 1.00 54.41 O ATOM 0 H SER A 59 19.492 31.052 3.660 1.00 11.31 H new ATOM 0 HA SER A 59 17.139 29.506 4.557 1.00 72.21 H new ATOM 0 HB2 SER A 59 18.557 28.450 6.100 1.00 3.22 H new ATOM 0 HB3 SER A 59 19.588 28.610 4.692 1.00 3.22 H new ATOM 0 HG SER A 59 20.640 29.314 6.636 1.00 54.41 H new ATOM 838 N ARG A 60 16.811 30.830 6.773 1.00 65.23 N ATOM 839 CA ARG A 60 16.347 31.787 7.769 1.00 3.33 C ATOM 840 C ARG A 60 15.861 31.071 9.026 1.00 51.31 C ATOM 841 O ARG A 60 15.709 29.849 9.038 1.00 64.13 O ATOM 842 CB ARG A 60 15.223 32.650 7.194 1.00 41.43 C ATOM 843 CG ARG A 60 15.291 34.106 7.625 1.00 0.22 C ATOM 844 CD ARG A 60 16.242 34.904 6.747 1.00 64.31 C ATOM 845 NE ARG A 60 15.577 35.434 5.560 1.00 11.21 N ATOM 846 CZ ARG A 60 14.654 36.389 5.600 1.00 71.31 C ATOM 847 NH1 ARG A 60 14.289 36.915 6.761 1.00 64.11 N ATOM 848 NH2 ARG A 60 14.094 36.819 4.477 1.00 51.05 N ATOM 0 H ARG A 60 16.467 29.880 6.909 1.00 65.23 H new ATOM 0 HA ARG A 60 17.186 32.428 8.038 1.00 3.33 H new ATOM 0 HB2 ARG A 60 15.259 32.600 6.106 1.00 41.43 H new ATOM 0 HB3 ARG A 60 14.264 32.234 7.501 1.00 41.43 H new ATOM 0 HG2 ARG A 60 14.295 34.547 7.579 1.00 0.22 H new ATOM 0 HG3 ARG A 60 15.618 34.164 8.663 1.00 0.22 H new ATOM 0 HD2 ARG A 60 16.664 35.727 7.324 1.00 64.31 H new ATOM 0 HD3 ARG A 60 17.074 34.269 6.443 1.00 64.31 H new ATOM 0 HE ARG A 60 15.835 35.050 4.651 1.00 11.21 H new ATOM 0 HH11 ARG A 60 14.717 36.587 7.627 1.00 64.11 H new ATOM 0 HH12 ARG A 60 13.580 37.648 6.788 1.00 64.11 H new ATOM 0 HH21 ARG A 60 14.372 36.416 3.582 1.00 51.05 H new ATOM 0 HH22 ARG A 60 13.386 37.552 4.509 1.00 51.05 H new ATOM 862 N LEU A 61 15.618 31.840 10.082 1.00 63.21 N ATOM 863 CA LEU A 61 15.149 31.279 11.345 1.00 43.45 C ATOM 864 C LEU A 61 13.627 31.322 11.427 1.00 72.10 C ATOM 865 O LEU A 61 12.984 32.162 10.799 1.00 1.43 O ATOM 866 CB LEU A 61 15.757 32.045 12.522 1.00 73.53 C ATOM 867 CG LEU A 61 17.276 31.955 12.668 1.00 21.44 C ATOM 868 CD1 LEU A 61 17.724 32.585 13.978 1.00 42.02 C ATOM 869 CD2 LEU A 61 17.735 30.506 12.587 1.00 31.13 C ATOM 0 H LEU A 61 15.738 32.853 10.089 1.00 63.21 H new ATOM 0 HA LEU A 61 15.468 30.238 11.393 1.00 43.45 H new ATOM 0 HB2 LEU A 61 15.483 33.096 12.426 1.00 73.53 H new ATOM 0 HB3 LEU A 61 15.301 31.679 13.442 1.00 73.53 H new ATOM 0 HG LEU A 61 17.734 32.507 11.847 1.00 21.44 H new ATOM 0 HD11 LEU A 61 18.808 32.512 14.065 1.00 42.02 H new ATOM 0 HD12 LEU A 61 17.428 33.634 13.997 1.00 42.02 H new ATOM 0 HD13 LEU A 61 17.257 32.061 14.812 1.00 42.02 H new ATOM 0 HD21 LEU A 61 18.819 30.461 12.693 1.00 31.13 H new ATOM 0 HD22 LEU A 61 17.268 29.931 13.387 1.00 31.13 H new ATOM 0 HD23 LEU A 61 17.447 30.086 11.623 1.00 31.13 H new ATOM 881 N GLY A 62 13.056 30.410 12.208 1.00 33.20 N ATOM 882 CA GLY A 62 11.613 30.362 12.360 1.00 23.31 C ATOM 883 C GLY A 62 11.174 30.577 13.795 1.00 62.41 C ATOM 884 O GLY A 62 10.430 31.511 14.090 1.00 32.55 O ATOM 0 H GLY A 62 13.567 29.704 12.738 1.00 33.20 H new ATOM 0 HA2 GLY A 62 11.158 31.123 11.726 1.00 23.31 H new ATOM 0 HA3 GLY A 62 11.246 29.397 12.012 1.00 23.31 H new ATOM 888 N GLY A 63 11.635 29.708 14.690 1.00 62.01 N ATOM 889 CA GLY A 63 11.273 29.823 16.091 1.00 42.45 C ATOM 890 C GLY A 63 11.693 28.612 16.900 1.00 52.24 C ATOM 891 O GLY A 63 12.488 28.724 17.833 1.00 4.10 O ATOM 0 H GLY A 63 12.253 28.927 14.470 1.00 62.01 H new ATOM 0 HA2 GLY A 63 11.737 30.715 16.511 1.00 42.45 H new ATOM 0 HA3 GLY A 63 10.194 29.956 16.175 1.00 42.45 H new ATOM 895 N THR A 64 11.156 27.449 16.543 1.00 11.43 N ATOM 896 CA THR A 64 11.477 26.213 17.244 1.00 32.43 C ATOM 897 C THR A 64 10.766 25.022 16.612 1.00 71.32 C ATOM 898 O THR A 64 9.538 24.946 16.615 1.00 20.33 O ATOM 899 CB THR A 64 11.091 26.295 18.733 1.00 21.54 C ATOM 900 OG1 THR A 64 10.236 27.421 18.957 1.00 53.04 O ATOM 901 CG2 THR A 64 12.330 26.411 19.608 1.00 44.32 C ATOM 0 H THR A 64 10.497 27.338 15.772 1.00 11.43 H new ATOM 0 HA THR A 64 12.555 26.075 17.163 1.00 32.43 H new ATOM 0 HB THR A 64 10.562 25.380 18.999 1.00 21.54 H new ATOM 0 HG1 THR A 64 9.994 27.465 19.906 1.00 53.04 H new ATOM 0 HG21 THR A 64 12.032 26.467 20.655 1.00 44.32 H new ATOM 0 HG22 THR A 64 12.965 25.538 19.458 1.00 44.32 H new ATOM 0 HG23 THR A 64 12.882 27.311 19.339 1.00 44.32 H new ATOM 909 N GLY A 65 11.547 24.092 16.069 1.00 14.02 N ATOM 910 CA GLY A 65 10.973 22.916 15.441 1.00 41.33 C ATOM 911 C GLY A 65 9.938 23.267 14.391 1.00 52.04 C ATOM 912 O GLY A 65 8.748 23.008 14.571 1.00 4.33 O ATOM 0 H GLY A 65 12.566 24.132 16.053 1.00 14.02 H new ATOM 0 HA2 GLY A 65 11.768 22.329 14.981 1.00 41.33 H new ATOM 0 HA3 GLY A 65 10.513 22.288 16.204 1.00 41.33 H new ATOM 916 N ALA A 66 10.390 23.859 13.290 1.00 4.22 N ATOM 917 CA ALA A 66 9.495 24.246 12.207 1.00 32.32 C ATOM 918 C ALA A 66 10.188 24.131 10.854 1.00 43.01 C ATOM 919 O ALA A 66 11.417 24.112 10.774 1.00 32.53 O ATOM 920 CB ALA A 66 8.986 25.663 12.423 1.00 2.33 C ATOM 0 H ALA A 66 11.372 24.081 13.125 1.00 4.22 H new ATOM 0 HA ALA A 66 8.646 23.563 12.210 1.00 32.32 H new ATOM 0 HB1 ALA A 66 8.319 25.938 11.606 1.00 2.33 H new ATOM 0 HB2 ALA A 66 8.444 25.715 13.367 1.00 2.33 H new ATOM 0 HB3 ALA A 66 9.830 26.353 12.450 1.00 2.33 H new ATOM 926 N PHE A 67 9.394 24.055 9.792 1.00 74.34 N ATOM 927 CA PHE A 67 9.932 23.940 8.441 1.00 14.10 C ATOM 928 C PHE A 67 9.128 24.790 7.462 1.00 41.55 C ATOM 929 O PHE A 67 8.785 24.339 6.370 1.00 54.35 O ATOM 930 CB PHE A 67 9.925 22.478 7.989 1.00 3.31 C ATOM 931 CG PHE A 67 10.791 22.218 6.790 1.00 64.21 C ATOM 932 CD1 PHE A 67 12.170 22.316 6.880 1.00 25.03 C ATOM 933 CD2 PHE A 67 10.226 21.875 5.572 1.00 43.40 C ATOM 934 CE1 PHE A 67 12.970 22.077 5.779 1.00 64.42 C ATOM 935 CE2 PHE A 67 11.021 21.635 4.467 1.00 21.53 C ATOM 936 CZ PHE A 67 12.395 21.736 4.570 1.00 13.54 C ATOM 0 H PHE A 67 8.375 24.071 9.840 1.00 74.34 H new ATOM 0 HA PHE A 67 10.959 24.304 8.453 1.00 14.10 H new ATOM 0 HB2 PHE A 67 10.261 21.849 8.814 1.00 3.31 H new ATOM 0 HB3 PHE A 67 8.901 22.182 7.759 1.00 3.31 H new ATOM 0 HD1 PHE A 67 12.625 22.582 7.822 1.00 25.03 H new ATOM 0 HD2 PHE A 67 9.153 21.794 5.485 1.00 43.40 H new ATOM 0 HE1 PHE A 67 14.044 22.157 5.864 1.00 64.42 H new ATOM 0 HE2 PHE A 67 10.568 21.369 3.523 1.00 21.53 H new ATOM 0 HZ PHE A 67 13.018 21.549 3.708 1.00 13.54 H new ATOM 946 N GLU A 68 8.832 26.023 7.862 1.00 50.11 N ATOM 947 CA GLU A 68 8.068 26.936 7.020 1.00 13.01 C ATOM 948 C GLU A 68 8.852 27.303 5.764 1.00 41.33 C ATOM 949 O GLU A 68 9.836 28.042 5.827 1.00 35.31 O ATOM 950 CB GLU A 68 7.708 28.203 7.799 1.00 43.22 C ATOM 951 CG GLU A 68 7.036 27.927 9.133 1.00 55.40 C ATOM 952 CD GLU A 68 6.960 29.159 10.014 1.00 55.53 C ATOM 953 OE1 GLU A 68 7.451 30.225 9.588 1.00 43.22 O ATOM 954 OE2 GLU A 68 6.408 29.057 11.129 1.00 14.24 O ATOM 0 H GLU A 68 9.109 26.412 8.763 1.00 50.11 H new ATOM 0 HA GLU A 68 7.150 26.430 6.719 1.00 13.01 H new ATOM 0 HB2 GLU A 68 8.615 28.783 7.972 1.00 43.22 H new ATOM 0 HB3 GLU A 68 7.047 28.819 7.189 1.00 43.22 H new ATOM 0 HG2 GLU A 68 6.029 27.548 8.957 1.00 55.40 H new ATOM 0 HG3 GLU A 68 7.584 27.144 9.657 1.00 55.40 H new ATOM 961 N ILE A 69 8.410 26.782 4.624 1.00 2.21 N ATOM 962 CA ILE A 69 9.070 27.055 3.353 1.00 11.24 C ATOM 963 C ILE A 69 8.463 28.276 2.670 1.00 21.01 C ATOM 964 O ILE A 69 7.291 28.271 2.297 1.00 15.21 O ATOM 965 CB ILE A 69 8.978 25.849 2.401 1.00 73.25 C ATOM 966 CG1 ILE A 69 9.562 24.601 3.065 1.00 62.41 C ATOM 967 CG2 ILE A 69 9.700 26.148 1.095 1.00 11.24 C ATOM 968 CD1 ILE A 69 9.143 23.309 2.399 1.00 60.14 C ATOM 0 H ILE A 69 7.598 26.169 4.555 1.00 2.21 H new ATOM 0 HA ILE A 69 10.119 27.251 3.577 1.00 11.24 H new ATOM 0 HB ILE A 69 7.928 25.661 2.178 1.00 73.25 H new ATOM 0 HG12 ILE A 69 10.650 24.669 3.055 1.00 62.41 H new ATOM 0 HG13 ILE A 69 9.254 24.578 4.110 1.00 62.41 H new ATOM 0 HG21 ILE A 69 9.626 25.286 0.433 1.00 11.24 H new ATOM 0 HG22 ILE A 69 9.242 27.014 0.616 1.00 11.24 H new ATOM 0 HG23 ILE A 69 10.750 26.359 1.300 1.00 11.24 H new ATOM 0 HD11 ILE A 69 9.594 22.467 2.923 1.00 60.14 H new ATOM 0 HD12 ILE A 69 8.057 23.218 2.433 1.00 60.14 H new ATOM 0 HD13 ILE A 69 9.475 23.311 1.361 1.00 60.14 H new ATOM 980 N GLU A 70 9.271 29.319 2.508 1.00 12.41 N ATOM 981 CA GLU A 70 8.813 30.547 1.868 1.00 13.02 C ATOM 982 C GLU A 70 9.358 30.656 0.447 1.00 30.02 C ATOM 983 O GLU A 70 10.345 31.350 0.202 1.00 62.35 O ATOM 984 CB GLU A 70 9.243 31.766 2.686 1.00 5.24 C ATOM 985 CG GLU A 70 8.541 31.877 4.029 1.00 10.31 C ATOM 986 CD GLU A 70 9.476 31.637 5.198 1.00 1.14 C ATOM 987 OE1 GLU A 70 10.643 32.076 5.124 1.00 51.21 O ATOM 988 OE2 GLU A 70 9.042 31.010 6.187 1.00 12.21 O ATOM 0 H GLU A 70 10.245 29.338 2.811 1.00 12.41 H new ATOM 0 HA GLU A 70 7.724 30.517 1.820 1.00 13.02 H new ATOM 0 HB2 GLU A 70 10.319 31.721 2.851 1.00 5.24 H new ATOM 0 HB3 GLU A 70 9.047 32.669 2.107 1.00 5.24 H new ATOM 0 HG2 GLU A 70 8.097 32.868 4.122 1.00 10.31 H new ATOM 0 HG3 GLU A 70 7.724 31.156 4.068 1.00 10.31 H new ATOM 995 N ILE A 71 8.708 29.966 -0.484 1.00 24.41 N ATOM 996 CA ILE A 71 9.127 29.985 -1.880 1.00 22.11 C ATOM 997 C ILE A 71 9.103 31.402 -2.441 1.00 41.55 C ATOM 998 O ILE A 71 9.987 31.794 -3.202 1.00 54.54 O ATOM 999 CB ILE A 71 8.230 29.085 -2.750 1.00 34.05 C ATOM 1000 CG1 ILE A 71 8.736 29.065 -4.193 1.00 53.33 C ATOM 1001 CG2 ILE A 71 6.787 29.565 -2.695 1.00 32.43 C ATOM 1002 CD1 ILE A 71 9.520 27.820 -4.542 1.00 30.32 C ATOM 0 H ILE A 71 7.889 29.387 -0.297 1.00 24.41 H new ATOM 0 HA ILE A 71 10.147 29.602 -1.908 1.00 22.11 H new ATOM 0 HB ILE A 71 8.270 28.069 -2.358 1.00 34.05 H new ATOM 0 HG12 ILE A 71 7.885 29.150 -4.869 1.00 53.33 H new ATOM 0 HG13 ILE A 71 9.365 29.939 -4.361 1.00 53.33 H new ATOM 0 HG21 ILE A 71 6.165 28.919 -3.315 1.00 32.43 H new ATOM 0 HG22 ILE A 71 6.431 29.532 -1.665 1.00 32.43 H new ATOM 0 HG23 ILE A 71 6.730 30.588 -3.066 1.00 32.43 H new ATOM 0 HD11 ILE A 71 9.847 27.875 -5.580 1.00 30.32 H new ATOM 0 HD12 ILE A 71 10.391 27.744 -3.891 1.00 30.32 H new ATOM 0 HD13 ILE A 71 8.888 26.942 -4.407 1.00 30.32 H new ATOM 1014 N ASN A 72 8.086 32.167 -2.059 1.00 13.40 N ATOM 1015 CA ASN A 72 7.947 33.543 -2.523 1.00 72.13 C ATOM 1016 C ASN A 72 7.669 34.486 -1.356 1.00 72.44 C ATOM 1017 O ASN A 72 6.847 35.395 -1.461 1.00 75.43 O ATOM 1018 CB ASN A 72 6.821 33.644 -3.554 1.00 72.24 C ATOM 1019 CG ASN A 72 6.851 32.506 -4.557 1.00 0.13 C ATOM 1020 OD1 ASN A 72 5.819 31.912 -4.870 1.00 1.24 O ATOM 1021 ND2 ASN A 72 8.038 32.197 -5.065 1.00 43.11 N ATOM 0 H ASN A 72 7.346 31.858 -1.429 1.00 13.40 H new ATOM 0 HA ASN A 72 8.886 33.839 -2.990 1.00 72.13 H new ATOM 0 HB2 ASN A 72 5.860 33.646 -3.039 1.00 72.24 H new ATOM 0 HB3 ASN A 72 6.901 34.593 -4.083 1.00 72.24 H new ATOM 0 HD21 ASN A 72 8.121 31.440 -5.744 1.00 43.11 H new ATOM 0 HD22 ASN A 72 8.867 32.716 -4.777 1.00 43.11 H new ATOM 1028 N GLY A 73 8.362 34.262 -0.244 1.00 32.12 N ATOM 1029 CA GLY A 73 8.176 35.099 0.927 1.00 40.32 C ATOM 1030 C GLY A 73 6.982 34.676 1.759 1.00 71.10 C ATOM 1031 O GLY A 73 6.780 35.176 2.865 1.00 25.12 O ATOM 0 H GLY A 73 9.049 33.516 -0.133 1.00 32.12 H new ATOM 0 HA2 GLY A 73 9.075 35.062 1.542 1.00 40.32 H new ATOM 0 HA3 GLY A 73 8.047 36.135 0.613 1.00 40.32 H new ATOM 1035 N GLN A 74 6.188 33.753 1.225 1.00 12.42 N ATOM 1036 CA GLN A 74 5.006 33.265 1.926 1.00 11.40 C ATOM 1037 C GLN A 74 5.088 31.759 2.148 1.00 23.24 C ATOM 1038 O GLN A 74 5.656 31.030 1.333 1.00 13.31 O ATOM 1039 CB GLN A 74 3.741 33.608 1.137 1.00 63.03 C ATOM 1040 CG GLN A 74 3.340 35.071 1.235 1.00 21.03 C ATOM 1041 CD GLN A 74 2.204 35.429 0.297 1.00 5.32 C ATOM 1042 OE1 GLN A 74 1.128 34.834 0.351 1.00 62.52 O ATOM 1043 NE2 GLN A 74 2.439 36.408 -0.570 1.00 34.44 N ATOM 0 H GLN A 74 6.342 33.329 0.310 1.00 12.42 H new ATOM 0 HA GLN A 74 4.963 33.755 2.899 1.00 11.40 H new ATOM 0 HB2 GLN A 74 3.896 33.352 0.089 1.00 63.03 H new ATOM 0 HB3 GLN A 74 2.919 32.990 1.498 1.00 63.03 H new ATOM 0 HG2 GLN A 74 3.044 35.295 2.260 1.00 21.03 H new ATOM 0 HG3 GLN A 74 4.204 35.696 1.009 1.00 21.03 H new ATOM 0 HE21 GLN A 74 3.346 36.874 -0.579 1.00 34.44 H new ATOM 0 HE22 GLN A 74 1.712 36.694 -1.226 1.00 34.44 H new ATOM 1052 N LEU A 75 4.519 31.298 3.257 1.00 63.54 N ATOM 1053 CA LEU A 75 4.528 29.877 3.587 1.00 64.40 C ATOM 1054 C LEU A 75 3.691 29.081 2.591 1.00 34.34 C ATOM 1055 O LEU A 75 2.489 29.311 2.451 1.00 24.31 O ATOM 1056 CB LEU A 75 3.998 29.659 5.005 1.00 5.34 C ATOM 1057 CG LEU A 75 4.713 28.589 5.832 1.00 13.41 C ATOM 1058 CD1 LEU A 75 4.419 28.775 7.313 1.00 71.43 C ATOM 1059 CD2 LEU A 75 4.300 27.198 5.375 1.00 40.05 C ATOM 0 H LEU A 75 4.046 31.887 3.942 1.00 63.54 H new ATOM 0 HA LEU A 75 5.558 29.523 3.532 1.00 64.40 H new ATOM 0 HB2 LEU A 75 4.057 30.605 5.543 1.00 5.34 H new ATOM 0 HB3 LEU A 75 2.943 29.395 4.940 1.00 5.34 H new ATOM 0 HG LEU A 75 5.787 28.696 5.679 1.00 13.41 H new ATOM 0 HD11 LEU A 75 4.936 28.005 7.886 1.00 71.43 H new ATOM 0 HD12 LEU A 75 4.765 29.758 7.632 1.00 71.43 H new ATOM 0 HD13 LEU A 75 3.345 28.695 7.484 1.00 71.43 H new ATOM 0 HD21 LEU A 75 4.818 26.449 5.974 1.00 40.05 H new ATOM 0 HD22 LEU A 75 3.223 27.079 5.498 1.00 40.05 H new ATOM 0 HD23 LEU A 75 4.562 27.067 4.325 1.00 40.05 H new ATOM 1071 N VAL A 76 4.332 28.142 1.903 1.00 23.21 N ATOM 1072 CA VAL A 76 3.646 27.309 0.923 1.00 70.12 C ATOM 1073 C VAL A 76 3.819 25.828 1.243 1.00 54.35 C ATOM 1074 O VAL A 76 3.250 24.967 0.571 1.00 22.23 O ATOM 1075 CB VAL A 76 4.163 27.579 -0.503 1.00 33.41 C ATOM 1076 CG1 VAL A 76 3.247 26.936 -1.533 1.00 61.34 C ATOM 1077 CG2 VAL A 76 4.289 29.074 -0.749 1.00 51.53 C ATOM 0 H VAL A 76 5.326 27.939 2.006 1.00 23.21 H new ATOM 0 HA VAL A 76 2.588 27.567 0.973 1.00 70.12 H new ATOM 0 HB VAL A 76 5.153 27.133 -0.603 1.00 33.41 H new ATOM 0 HG11 VAL A 76 3.628 27.137 -2.534 1.00 61.34 H new ATOM 0 HG12 VAL A 76 3.212 25.859 -1.367 1.00 61.34 H new ATOM 0 HG13 VAL A 76 2.243 27.350 -1.436 1.00 61.34 H new ATOM 0 HG21 VAL A 76 4.655 29.247 -1.761 1.00 51.53 H new ATOM 0 HG22 VAL A 76 3.313 29.546 -0.631 1.00 51.53 H new ATOM 0 HG23 VAL A 76 4.989 29.503 -0.032 1.00 51.53 H new ATOM 1087 N PHE A 77 4.607 25.539 2.273 1.00 54.13 N ATOM 1088 CA PHE A 77 4.855 24.162 2.682 1.00 21.31 C ATOM 1089 C PHE A 77 5.505 24.113 4.062 1.00 50.21 C ATOM 1090 O PHE A 77 6.709 24.326 4.200 1.00 4.34 O ATOM 1091 CB PHE A 77 5.749 23.457 1.660 1.00 61.22 C ATOM 1092 CG PHE A 77 4.983 22.660 0.643 1.00 65.42 C ATOM 1093 CD1 PHE A 77 4.231 21.562 1.028 1.00 71.45 C ATOM 1094 CD2 PHE A 77 5.016 23.008 -0.698 1.00 12.43 C ATOM 1095 CE1 PHE A 77 3.526 20.826 0.094 1.00 62.05 C ATOM 1096 CE2 PHE A 77 4.313 22.277 -1.636 1.00 73.22 C ATOM 1097 CZ PHE A 77 3.566 21.185 -1.240 1.00 21.33 C ATOM 0 H PHE A 77 5.085 26.240 2.840 1.00 54.13 H new ATOM 0 HA PHE A 77 3.896 23.646 2.733 1.00 21.31 H new ATOM 0 HB2 PHE A 77 6.355 24.202 1.145 1.00 61.22 H new ATOM 0 HB3 PHE A 77 6.437 22.795 2.186 1.00 61.22 H new ATOM 0 HD1 PHE A 77 4.195 21.278 2.069 1.00 71.45 H new ATOM 0 HD2 PHE A 77 5.598 23.861 -1.014 1.00 12.43 H new ATOM 0 HE1 PHE A 77 2.944 19.971 0.406 1.00 62.05 H new ATOM 0 HE2 PHE A 77 4.348 22.559 -2.678 1.00 73.22 H new ATOM 0 HZ PHE A 77 3.014 20.613 -1.971 1.00 21.33 H new ATOM 1107 N SER A 78 4.698 23.832 5.080 1.00 50.01 N ATOM 1108 CA SER A 78 5.192 23.760 6.450 1.00 64.31 C ATOM 1109 C SER A 78 5.136 22.328 6.973 1.00 61.42 C ATOM 1110 O SER A 78 4.156 21.614 6.759 1.00 62.43 O ATOM 1111 CB SER A 78 4.374 24.679 7.359 1.00 44.11 C ATOM 1112 OG SER A 78 5.191 25.684 7.935 1.00 15.11 O ATOM 0 H SER A 78 3.699 23.650 4.982 1.00 50.01 H new ATOM 0 HA SER A 78 6.231 24.089 6.453 1.00 64.31 H new ATOM 0 HB2 SER A 78 3.571 25.143 6.786 1.00 44.11 H new ATOM 0 HB3 SER A 78 3.904 24.091 8.148 1.00 44.11 H new ATOM 0 HG SER A 78 5.163 25.608 8.912 1.00 15.11 H new ATOM 1118 N LYS A 79 6.195 21.914 7.660 1.00 21.52 N ATOM 1119 CA LYS A 79 6.269 20.568 8.216 1.00 34.42 C ATOM 1120 C LYS A 79 5.293 20.405 9.378 1.00 64.33 C ATOM 1121 O LYS A 79 4.966 19.286 9.775 1.00 62.54 O ATOM 1122 CB LYS A 79 7.693 20.265 8.686 1.00 22.21 C ATOM 1123 CG LYS A 79 7.785 19.068 9.617 1.00 63.25 C ATOM 1124 CD LYS A 79 7.364 17.785 8.919 1.00 53.52 C ATOM 1125 CE LYS A 79 7.542 16.575 9.822 1.00 31.12 C ATOM 1126 NZ LYS A 79 8.977 16.218 9.994 1.00 23.41 N ATOM 0 H LYS A 79 7.015 22.492 7.845 1.00 21.52 H new ATOM 0 HA LYS A 79 5.994 19.863 7.432 1.00 34.42 H new ATOM 0 HB2 LYS A 79 8.324 20.087 7.815 1.00 22.21 H new ATOM 0 HB3 LYS A 79 8.093 21.142 9.195 1.00 22.21 H new ATOM 0 HG2 LYS A 79 8.807 18.967 9.981 1.00 63.25 H new ATOM 0 HG3 LYS A 79 7.152 19.234 10.488 1.00 63.25 H new ATOM 0 HD2 LYS A 79 6.321 17.862 8.613 1.00 53.52 H new ATOM 0 HD3 LYS A 79 7.953 17.653 8.012 1.00 53.52 H new ATOM 0 HE2 LYS A 79 7.100 16.781 10.797 1.00 31.12 H new ATOM 0 HE3 LYS A 79 7.004 15.725 9.401 1.00 31.12 H new ATOM 0 HZ1 LYS A 79 9.052 15.322 10.517 1.00 23.41 H new ATOM 0 HZ2 LYS A 79 9.423 16.113 9.060 1.00 23.41 H new ATOM 0 HZ3 LYS A 79 9.460 16.970 10.526 1.00 23.41 H new ATOM 1140 N LEU A 80 4.831 21.527 9.918 1.00 63.11 N ATOM 1141 CA LEU A 80 3.892 21.509 11.033 1.00 35.45 C ATOM 1142 C LEU A 80 2.453 21.420 10.533 1.00 45.13 C ATOM 1143 O LEU A 80 1.621 20.735 11.126 1.00 1.20 O ATOM 1144 CB LEU A 80 4.068 22.760 11.895 1.00 54.31 C ATOM 1145 CG LEU A 80 5.492 23.055 12.367 1.00 53.41 C ATOM 1146 CD1 LEU A 80 6.207 21.767 12.745 1.00 55.42 C ATOM 1147 CD2 LEU A 80 6.267 23.801 11.290 1.00 15.55 C ATOM 0 H LEU A 80 5.092 22.461 9.601 1.00 63.11 H new ATOM 0 HA LEU A 80 4.102 20.627 11.637 1.00 35.45 H new ATOM 0 HB2 LEU A 80 3.709 23.620 11.330 1.00 54.31 H new ATOM 0 HB3 LEU A 80 3.428 22.665 12.772 1.00 54.31 H new ATOM 0 HG LEU A 80 5.437 23.689 13.252 1.00 53.41 H new ATOM 0 HD11 LEU A 80 7.219 21.997 13.078 1.00 55.42 H new ATOM 0 HD12 LEU A 80 5.664 21.272 13.550 1.00 55.42 H new ATOM 0 HD13 LEU A 80 6.252 21.108 11.878 1.00 55.42 H new ATOM 0 HD21 LEU A 80 7.278 24.003 11.643 1.00 15.55 H new ATOM 0 HD22 LEU A 80 6.313 23.192 10.387 1.00 15.55 H new ATOM 0 HD23 LEU A 80 5.766 24.743 11.068 1.00 15.55 H new ATOM 1159 N GLU A 81 2.170 22.116 9.436 1.00 2.20 N ATOM 1160 CA GLU A 81 0.833 22.114 8.855 1.00 13.42 C ATOM 1161 C GLU A 81 0.699 21.019 7.801 1.00 12.11 C ATOM 1162 O GLU A 81 -0.097 20.093 7.951 1.00 50.11 O ATOM 1163 CB GLU A 81 0.521 23.477 8.233 1.00 40.10 C ATOM 1164 CG GLU A 81 0.906 24.652 9.116 1.00 24.12 C ATOM 1165 CD GLU A 81 -0.115 25.772 9.076 1.00 72.21 C ATOM 1166 OE1 GLU A 81 -0.655 26.042 7.983 1.00 50.54 O ATOM 1167 OE2 GLU A 81 -0.375 26.377 10.137 1.00 43.44 O ATOM 0 H GLU A 81 2.848 22.688 8.933 1.00 2.20 H new ATOM 0 HA GLU A 81 0.118 21.915 9.653 1.00 13.42 H new ATOM 0 HB2 GLU A 81 1.046 23.561 7.281 1.00 40.10 H new ATOM 0 HB3 GLU A 81 -0.546 23.532 8.015 1.00 40.10 H new ATOM 0 HG2 GLU A 81 1.021 24.307 10.144 1.00 24.12 H new ATOM 0 HG3 GLU A 81 1.875 25.038 8.799 1.00 24.12 H new ATOM 1174 N ASN A 82 1.483 21.133 6.734 1.00 5.54 N ATOM 1175 CA ASN A 82 1.452 20.154 5.654 1.00 3.22 C ATOM 1176 C ASN A 82 1.593 18.737 6.201 1.00 61.24 C ATOM 1177 O ASN A 82 0.651 17.947 6.158 1.00 53.22 O ATOM 1178 CB ASN A 82 2.569 20.438 4.648 1.00 44.20 C ATOM 1179 CG ASN A 82 2.368 19.701 3.338 1.00 45.42 C ATOM 1180 OD1 ASN A 82 1.812 20.247 2.385 1.00 44.33 O ATOM 1181 ND2 ASN A 82 2.821 18.454 3.285 1.00 5.22 N ATOM 0 H ASN A 82 2.148 21.894 6.594 1.00 5.54 H new ATOM 0 HA ASN A 82 0.489 20.236 5.150 1.00 3.22 H new ATOM 0 HB2 ASN A 82 2.617 21.510 4.455 1.00 44.20 H new ATOM 0 HB3 ASN A 82 3.527 20.149 5.081 1.00 44.20 H new ATOM 0 HD21 ASN A 82 2.714 17.909 2.430 1.00 5.22 H new ATOM 0 HD22 ASN A 82 3.276 18.042 4.100 1.00 5.22 H new ATOM 1188 N GLY A 83 2.778 18.422 6.715 1.00 20.52 N ATOM 1189 CA GLY A 83 3.021 17.100 7.263 1.00 32.13 C ATOM 1190 C GLY A 83 4.306 16.484 6.745 1.00 14.52 C ATOM 1191 O GLY A 83 4.392 15.271 6.564 1.00 73.21 O ATOM 0 H GLY A 83 3.574 19.058 6.762 1.00 20.52 H new ATOM 0 HA2 GLY A 83 3.065 17.163 8.350 1.00 32.13 H new ATOM 0 HA3 GLY A 83 2.184 16.448 7.015 1.00 32.13 H new ATOM 1195 N GLY A 84 5.308 17.325 6.504 1.00 34.34 N ATOM 1196 CA GLY A 84 6.580 16.838 6.004 1.00 20.24 C ATOM 1197 C GLY A 84 6.433 16.040 4.724 1.00 51.00 C ATOM 1198 O GLY A 84 5.492 16.249 3.958 1.00 11.42 O ATOM 0 H GLY A 84 5.261 18.334 6.646 1.00 34.34 H new ATOM 0 HA2 GLY A 84 7.245 17.683 5.827 1.00 20.24 H new ATOM 0 HA3 GLY A 84 7.051 16.215 6.764 1.00 20.24 H new ATOM 1202 N PHE A 85 7.366 15.123 4.489 1.00 10.42 N ATOM 1203 CA PHE A 85 7.338 14.293 3.291 1.00 54.02 C ATOM 1204 C PHE A 85 7.468 15.148 2.034 1.00 74.14 C ATOM 1205 O PHE A 85 6.593 15.161 1.168 1.00 74.54 O ATOM 1206 CB PHE A 85 6.042 13.482 3.238 1.00 75.54 C ATOM 1207 CG PHE A 85 6.199 12.143 2.574 1.00 1.22 C ATOM 1208 CD1 PHE A 85 7.156 11.244 3.017 1.00 40.21 C ATOM 1209 CD2 PHE A 85 5.390 11.784 1.508 1.00 30.14 C ATOM 1210 CE1 PHE A 85 7.303 10.012 2.408 1.00 45.53 C ATOM 1211 CE2 PHE A 85 5.533 10.553 0.895 1.00 15.25 C ATOM 1212 CZ PHE A 85 6.490 9.666 1.347 1.00 40.05 C ATOM 0 H PHE A 85 8.151 14.936 5.113 1.00 10.42 H new ATOM 0 HA PHE A 85 8.186 13.609 3.333 1.00 54.02 H new ATOM 0 HB2 PHE A 85 5.674 13.334 4.253 1.00 75.54 H new ATOM 0 HB3 PHE A 85 5.285 14.057 2.705 1.00 75.54 H new ATOM 0 HD1 PHE A 85 7.794 11.509 3.847 1.00 40.21 H new ATOM 0 HD2 PHE A 85 4.639 12.474 1.152 1.00 30.14 H new ATOM 0 HE1 PHE A 85 8.053 9.320 2.762 1.00 45.53 H new ATOM 0 HE2 PHE A 85 4.897 10.286 0.064 1.00 15.25 H new ATOM 0 HZ PHE A 85 6.602 8.703 0.871 1.00 40.05 H new ATOM 1222 N PRO A 86 8.586 15.881 1.930 1.00 22.22 N ATOM 1223 CA PRO A 86 8.858 16.752 0.783 1.00 3.55 C ATOM 1224 C PRO A 86 9.141 15.963 -0.490 1.00 53.34 C ATOM 1225 O PRO A 86 9.194 14.733 -0.471 1.00 42.42 O ATOM 1226 CB PRO A 86 10.103 17.531 1.217 1.00 31.01 C ATOM 1227 CG PRO A 86 10.774 16.649 2.212 1.00 30.44 C ATOM 1228 CD PRO A 86 9.672 15.915 2.925 1.00 73.43 C ATOM 0 HA PRO A 86 8.005 17.385 0.541 1.00 3.55 H new ATOM 0 HB2 PRO A 86 10.755 17.739 0.369 1.00 31.01 H new ATOM 0 HB3 PRO A 86 9.835 18.492 1.657 1.00 31.01 H new ATOM 0 HG2 PRO A 86 11.453 15.952 1.720 1.00 30.44 H new ATOM 0 HG3 PRO A 86 11.370 17.234 2.912 1.00 30.44 H new ATOM 0 HD2 PRO A 86 9.981 14.911 3.217 1.00 73.43 H new ATOM 0 HD3 PRO A 86 9.368 16.432 3.835 1.00 73.43 H new ATOM 1236 N TYR A 87 9.321 16.678 -1.596 1.00 20.15 N ATOM 1237 CA TYR A 87 9.596 16.044 -2.879 1.00 61.33 C ATOM 1238 C TYR A 87 10.578 16.876 -3.699 1.00 33.22 C ATOM 1239 O TYR A 87 10.395 18.081 -3.868 1.00 63.12 O ATOM 1240 CB TYR A 87 8.298 15.848 -3.664 1.00 34.54 C ATOM 1241 CG TYR A 87 7.152 15.337 -2.820 1.00 14.14 C ATOM 1242 CD1 TYR A 87 7.126 14.023 -2.369 1.00 0.10 C ATOM 1243 CD2 TYR A 87 6.095 16.169 -2.472 1.00 53.50 C ATOM 1244 CE1 TYR A 87 6.081 13.552 -1.598 1.00 54.54 C ATOM 1245 CE2 TYR A 87 5.046 15.708 -1.700 1.00 72.25 C ATOM 1246 CZ TYR A 87 5.043 14.399 -1.267 1.00 20.44 C ATOM 1247 OH TYR A 87 4.001 13.934 -0.498 1.00 35.11 O ATOM 0 H TYR A 87 9.281 17.697 -1.629 1.00 20.15 H new ATOM 0 HA TYR A 87 10.046 15.070 -2.685 1.00 61.33 H new ATOM 0 HB2 TYR A 87 8.010 16.797 -4.117 1.00 34.54 H new ATOM 0 HB3 TYR A 87 8.478 15.148 -4.479 1.00 34.54 H new ATOM 0 HD1 TYR A 87 7.937 13.358 -2.626 1.00 0.10 H new ATOM 0 HD2 TYR A 87 6.093 17.194 -2.811 1.00 53.50 H new ATOM 0 HE1 TYR A 87 6.076 12.527 -1.256 1.00 54.54 H new ATOM 0 HE2 TYR A 87 4.233 16.369 -1.437 1.00 72.25 H new ATOM 0 HH TYR A 87 3.353 14.655 -0.354 1.00 35.11 H new ATOM 1257 N GLU A 88 11.619 16.222 -4.205 1.00 54.23 N ATOM 1258 CA GLU A 88 12.630 16.901 -5.007 1.00 54.42 C ATOM 1259 C GLU A 88 11.991 17.621 -6.192 1.00 23.01 C ATOM 1260 O GLU A 88 12.562 18.564 -6.742 1.00 33.55 O ATOM 1261 CB GLU A 88 13.673 15.900 -5.507 1.00 4.34 C ATOM 1262 CG GLU A 88 13.165 14.993 -6.614 1.00 63.23 C ATOM 1263 CD GLU A 88 14.006 13.741 -6.775 1.00 2.22 C ATOM 1264 OE1 GLU A 88 14.352 13.124 -5.746 1.00 30.42 O ATOM 1265 OE2 GLU A 88 14.319 13.379 -7.928 1.00 54.53 O ATOM 0 H GLU A 88 11.784 15.224 -4.074 1.00 54.23 H new ATOM 0 HA GLU A 88 13.121 17.641 -4.376 1.00 54.42 H new ATOM 0 HB2 GLU A 88 14.545 16.446 -5.868 1.00 4.34 H new ATOM 0 HB3 GLU A 88 14.006 15.286 -4.670 1.00 4.34 H new ATOM 0 HG2 GLU A 88 12.134 14.709 -6.402 1.00 63.23 H new ATOM 0 HG3 GLU A 88 13.156 15.544 -7.555 1.00 63.23 H new ATOM 1272 N LYS A 89 10.804 17.169 -6.581 1.00 13.32 N ATOM 1273 CA LYS A 89 10.086 17.769 -7.699 1.00 75.53 C ATOM 1274 C LYS A 89 9.147 18.870 -7.216 1.00 71.51 C ATOM 1275 O LYS A 89 8.809 19.784 -7.968 1.00 10.34 O ATOM 1276 CB LYS A 89 9.290 16.700 -8.453 1.00 22.13 C ATOM 1277 CG LYS A 89 8.231 16.019 -7.604 1.00 31.33 C ATOM 1278 CD LYS A 89 7.424 15.018 -8.415 1.00 5.42 C ATOM 1279 CE LYS A 89 6.922 13.874 -7.548 1.00 12.20 C ATOM 1280 NZ LYS A 89 8.006 12.906 -7.224 1.00 11.11 N ATOM 0 H LYS A 89 10.319 16.389 -6.138 1.00 13.32 H new ATOM 0 HA LYS A 89 10.819 18.211 -8.373 1.00 75.53 H new ATOM 0 HB2 LYS A 89 8.811 17.158 -9.318 1.00 22.13 H new ATOM 0 HB3 LYS A 89 9.979 15.946 -8.833 1.00 22.13 H new ATOM 0 HG2 LYS A 89 8.707 15.510 -6.766 1.00 31.33 H new ATOM 0 HG3 LYS A 89 7.563 16.770 -7.183 1.00 31.33 H new ATOM 0 HD2 LYS A 89 6.577 15.523 -8.879 1.00 5.42 H new ATOM 0 HD3 LYS A 89 8.040 14.621 -9.222 1.00 5.42 H new ATOM 0 HE2 LYS A 89 6.505 14.275 -6.624 1.00 12.20 H new ATOM 0 HE3 LYS A 89 6.114 13.355 -8.064 1.00 12.20 H new ATOM 0 HZ1 LYS A 89 7.599 12.075 -6.749 1.00 11.11 H new ATOM 0 HZ2 LYS A 89 8.478 12.607 -8.101 1.00 11.11 H new ATOM 0 HZ3 LYS A 89 8.699 13.359 -6.595 1.00 11.11 H new ATOM 1294 N ASP A 90 8.731 18.776 -5.958 1.00 73.30 N ATOM 1295 CA ASP A 90 7.833 19.765 -5.374 1.00 1.52 C ATOM 1296 C ASP A 90 8.579 21.060 -5.065 1.00 33.14 C ATOM 1297 O ASP A 90 7.980 22.134 -5.001 1.00 55.23 O ATOM 1298 CB ASP A 90 7.192 19.215 -4.099 1.00 62.51 C ATOM 1299 CG ASP A 90 6.437 20.277 -3.325 1.00 2.02 C ATOM 1300 OD1 ASP A 90 5.520 20.894 -3.905 1.00 51.12 O ATOM 1301 OD2 ASP A 90 6.764 20.492 -2.139 1.00 2.23 O ATOM 0 H ASP A 90 9.001 18.025 -5.323 1.00 73.30 H new ATOM 0 HA ASP A 90 7.050 19.981 -6.100 1.00 1.52 H new ATOM 0 HB2 ASP A 90 6.510 18.406 -4.359 1.00 62.51 H new ATOM 0 HB3 ASP A 90 7.966 18.787 -3.462 1.00 62.51 H new ATOM 1306 N LEU A 91 9.888 20.950 -4.872 1.00 5.42 N ATOM 1307 CA LEU A 91 10.717 22.112 -4.568 1.00 11.11 C ATOM 1308 C LEU A 91 11.260 22.743 -5.846 1.00 20.00 C ATOM 1309 O LEU A 91 11.708 23.890 -5.842 1.00 31.03 O ATOM 1310 CB LEU A 91 11.874 21.712 -3.651 1.00 43.12 C ATOM 1311 CG LEU A 91 11.516 21.467 -2.185 1.00 54.11 C ATOM 1312 CD1 LEU A 91 12.506 20.506 -1.547 1.00 21.23 C ATOM 1313 CD2 LEU A 91 11.476 22.781 -1.419 1.00 52.41 C ATOM 0 H LEU A 91 10.399 20.069 -4.920 1.00 5.42 H new ATOM 0 HA LEU A 91 10.095 22.848 -4.058 1.00 11.11 H new ATOM 0 HB2 LEU A 91 12.330 20.805 -4.049 1.00 43.12 H new ATOM 0 HB3 LEU A 91 12.632 22.495 -3.693 1.00 43.12 H new ATOM 0 HG LEU A 91 10.525 21.015 -2.144 1.00 54.11 H new ATOM 0 HD11 LEU A 91 12.235 20.344 -0.504 1.00 21.23 H new ATOM 0 HD12 LEU A 91 12.485 19.555 -2.079 1.00 21.23 H new ATOM 0 HD13 LEU A 91 13.509 20.929 -1.600 1.00 21.23 H new ATOM 0 HD21 LEU A 91 11.220 22.587 -0.377 1.00 52.41 H new ATOM 0 HD22 LEU A 91 12.453 23.261 -1.469 1.00 52.41 H new ATOM 0 HD23 LEU A 91 10.726 23.437 -1.861 1.00 52.41 H new ATOM 1325 N ILE A 92 11.215 21.987 -6.938 1.00 1.31 N ATOM 1326 CA ILE A 92 11.700 22.474 -8.224 1.00 14.04 C ATOM 1327 C ILE A 92 10.544 22.912 -9.116 1.00 53.45 C ATOM 1328 O ILE A 92 10.709 23.765 -9.988 1.00 2.21 O ATOM 1329 CB ILE A 92 12.522 21.399 -8.959 1.00 3.44 C ATOM 1330 CG1 ILE A 92 13.477 22.053 -9.960 1.00 53.02 C ATOM 1331 CG2 ILE A 92 11.600 20.415 -9.662 1.00 52.44 C ATOM 1332 CD1 ILE A 92 14.937 21.814 -9.647 1.00 42.43 C ATOM 0 H ILE A 92 10.848 21.036 -6.958 1.00 1.31 H new ATOM 0 HA ILE A 92 12.341 23.331 -8.016 1.00 14.04 H new ATOM 0 HB ILE A 92 13.114 20.850 -8.226 1.00 3.44 H new ATOM 0 HG12 ILE A 92 13.261 21.672 -10.958 1.00 53.02 H new ATOM 0 HG13 ILE A 92 13.289 23.127 -9.981 1.00 53.02 H new ATOM 0 HG21 ILE A 92 12.196 19.662 -10.177 1.00 52.44 H new ATOM 0 HG22 ILE A 92 10.958 19.930 -8.927 1.00 52.44 H new ATOM 0 HG23 ILE A 92 10.984 20.948 -10.387 1.00 52.44 H new ATOM 0 HD11 ILE A 92 15.555 22.306 -10.398 1.00 42.43 H new ATOM 0 HD12 ILE A 92 15.169 22.220 -8.662 1.00 42.43 H new ATOM 0 HD13 ILE A 92 15.140 20.743 -9.655 1.00 42.43 H new ATOM 1344 N GLU A 93 9.373 22.324 -8.891 1.00 61.04 N ATOM 1345 CA GLU A 93 8.189 22.655 -9.676 1.00 2.25 C ATOM 1346 C GLU A 93 7.475 23.873 -9.095 1.00 61.50 C ATOM 1347 O GLU A 93 6.576 24.435 -9.720 1.00 24.30 O ATOM 1348 CB GLU A 93 7.231 21.463 -9.723 1.00 24.13 C ATOM 1349 CG GLU A 93 6.399 21.301 -8.462 1.00 72.20 C ATOM 1350 CD GLU A 93 5.746 19.936 -8.366 1.00 32.44 C ATOM 1351 OE1 GLU A 93 6.055 19.070 -9.211 1.00 23.32 O ATOM 1352 OE2 GLU A 93 4.926 19.733 -7.446 1.00 11.10 O ATOM 0 H GLU A 93 9.219 21.617 -8.172 1.00 61.04 H new ATOM 0 HA GLU A 93 8.511 22.893 -10.690 1.00 2.25 H new ATOM 0 HB2 GLU A 93 6.563 21.578 -10.577 1.00 24.13 H new ATOM 0 HB3 GLU A 93 7.806 20.552 -9.888 1.00 24.13 H new ATOM 0 HG2 GLU A 93 7.033 21.458 -7.590 1.00 72.20 H new ATOM 0 HG3 GLU A 93 5.628 22.071 -8.438 1.00 72.20 H new ATOM 1359 N ALA A 94 7.882 24.273 -7.895 1.00 0.30 N ATOM 1360 CA ALA A 94 7.283 25.424 -7.230 1.00 62.12 C ATOM 1361 C ALA A 94 7.629 26.719 -7.957 1.00 55.12 C ATOM 1362 O ALA A 94 6.741 27.472 -8.359 1.00 73.21 O ATOM 1363 CB ALA A 94 7.740 25.492 -5.780 1.00 54.33 C ATOM 0 H ALA A 94 8.624 23.817 -7.363 1.00 0.30 H new ATOM 0 HA ALA A 94 6.200 25.303 -7.253 1.00 62.12 H new ATOM 0 HB1 ALA A 94 7.285 26.356 -5.295 1.00 54.33 H new ATOM 0 HB2 ALA A 94 7.437 24.583 -5.260 1.00 54.33 H new ATOM 0 HB3 ALA A 94 8.825 25.586 -5.745 1.00 54.33 H new ATOM 1369 N ILE A 95 8.922 26.973 -8.122 1.00 23.21 N ATOM 1370 CA ILE A 95 9.384 28.177 -8.801 1.00 13.21 C ATOM 1371 C ILE A 95 8.813 28.266 -10.212 1.00 71.52 C ATOM 1372 O ILE A 95 8.669 29.355 -10.767 1.00 62.25 O ATOM 1373 CB ILE A 95 10.921 28.227 -8.877 1.00 62.40 C ATOM 1374 CG1 ILE A 95 11.437 27.193 -9.880 1.00 24.31 C ATOM 1375 CG2 ILE A 95 11.528 27.988 -7.502 1.00 75.23 C ATOM 1376 CD1 ILE A 95 11.702 27.764 -11.255 1.00 52.41 C ATOM 0 H ILE A 95 9.669 26.361 -7.795 1.00 23.21 H new ATOM 0 HA ILE A 95 9.030 29.025 -8.214 1.00 13.21 H new ATOM 0 HB ILE A 95 11.221 29.218 -9.218 1.00 62.40 H new ATOM 0 HG12 ILE A 95 12.357 26.753 -9.495 1.00 24.31 H new ATOM 0 HG13 ILE A 95 10.709 26.386 -9.965 1.00 24.31 H new ATOM 0 HG21 ILE A 95 12.615 28.026 -7.572 1.00 75.23 H new ATOM 0 HG22 ILE A 95 11.182 28.758 -6.813 1.00 75.23 H new ATOM 0 HG23 ILE A 95 11.223 27.008 -7.135 1.00 75.23 H new ATOM 0 HD11 ILE A 95 12.065 26.975 -11.913 1.00 52.41 H new ATOM 0 HD12 ILE A 95 10.779 28.179 -11.661 1.00 52.41 H new ATOM 0 HD13 ILE A 95 12.453 28.551 -11.184 1.00 52.41 H new ATOM 1388 N ARG A 96 8.488 27.112 -10.786 1.00 73.12 N ATOM 1389 CA ARG A 96 7.932 27.059 -12.133 1.00 35.31 C ATOM 1390 C ARG A 96 6.552 27.710 -12.178 1.00 5.33 C ATOM 1391 O ARG A 96 6.211 28.398 -13.140 1.00 71.21 O ATOM 1392 CB ARG A 96 7.838 25.609 -12.612 1.00 61.11 C ATOM 1393 CG ARG A 96 7.395 25.473 -14.060 1.00 4.32 C ATOM 1394 CD ARG A 96 7.218 24.015 -14.454 1.00 3.30 C ATOM 1395 NE ARG A 96 8.434 23.237 -14.234 1.00 3.15 N ATOM 1396 CZ ARG A 96 8.603 21.996 -14.676 1.00 40.13 C ATOM 1397 NH1 ARG A 96 7.639 21.396 -15.360 1.00 73.12 N ATOM 1398 NH2 ARG A 96 9.739 21.353 -14.436 1.00 15.24 N ATOM 0 H ARG A 96 8.600 26.202 -10.340 1.00 73.12 H new ATOM 0 HA ARG A 96 8.598 27.612 -12.796 1.00 35.31 H new ATOM 0 HB2 ARG A 96 8.811 25.132 -12.492 1.00 61.11 H new ATOM 0 HB3 ARG A 96 7.138 25.069 -11.974 1.00 61.11 H new ATOM 0 HG2 ARG A 96 6.456 26.007 -14.206 1.00 4.32 H new ATOM 0 HG3 ARG A 96 8.132 25.940 -14.713 1.00 4.32 H new ATOM 0 HD2 ARG A 96 6.401 23.581 -13.878 1.00 3.30 H new ATOM 0 HD3 ARG A 96 6.935 23.955 -15.505 1.00 3.30 H new ATOM 0 HE ARG A 96 9.196 23.671 -13.712 1.00 3.15 H new ATOM 0 HH11 ARG A 96 6.765 21.887 -15.548 1.00 73.12 H new ATOM 0 HH12 ARG A 96 7.771 20.443 -15.698 1.00 73.12 H new ATOM 0 HH21 ARG A 96 10.484 21.812 -13.911 1.00 15.24 H new ATOM 0 HH22 ARG A 96 9.867 20.400 -14.776 1.00 15.24 H new ATOM 1412 N ARG A 97 5.765 27.489 -11.131 1.00 33.44 N ATOM 1413 CA ARG A 97 4.423 28.053 -11.051 1.00 74.53 C ATOM 1414 C ARG A 97 4.439 29.394 -10.324 1.00 74.03 C ATOM 1415 O ARG A 97 3.561 30.232 -10.529 1.00 4.52 O ATOM 1416 CB ARG A 97 3.481 27.083 -10.335 1.00 14.23 C ATOM 1417 CG ARG A 97 2.915 26.002 -11.241 1.00 13.11 C ATOM 1418 CD ARG A 97 3.938 24.911 -11.513 1.00 24.12 C ATOM 1419 NE ARG A 97 3.442 23.919 -12.462 1.00 74.32 N ATOM 1420 CZ ARG A 97 2.637 22.917 -12.125 1.00 12.11 C ATOM 1421 NH1 ARG A 97 2.240 22.776 -10.868 1.00 13.02 N ATOM 1422 NH2 ARG A 97 2.227 22.054 -13.046 1.00 42.41 N ATOM 0 H ARG A 97 6.033 26.923 -10.326 1.00 33.44 H new ATOM 0 HA ARG A 97 4.063 28.215 -12.067 1.00 74.53 H new ATOM 0 HB2 ARG A 97 4.017 26.611 -9.512 1.00 14.23 H new ATOM 0 HB3 ARG A 97 2.657 27.647 -9.898 1.00 14.23 H new ATOM 0 HG2 ARG A 97 2.030 25.565 -10.779 1.00 13.11 H new ATOM 0 HG3 ARG A 97 2.596 26.446 -12.184 1.00 13.11 H new ATOM 0 HD2 ARG A 97 4.852 25.360 -11.903 1.00 24.12 H new ATOM 0 HD3 ARG A 97 4.199 24.418 -10.577 1.00 24.12 H new ATOM 0 HE ARG A 97 3.729 23.999 -13.437 1.00 74.32 H new ATOM 0 HH11 ARG A 97 2.552 23.437 -10.157 1.00 13.02 H new ATOM 0 HH12 ARG A 97 1.622 22.006 -10.612 1.00 13.02 H new ATOM 0 HH21 ARG A 97 2.530 22.159 -14.014 1.00 42.41 H new ATOM 0 HH22 ARG A 97 1.609 21.285 -12.786 1.00 42.41 H new ATOM 1436 N ALA A 98 5.442 29.589 -9.475 1.00 33.24 N ATOM 1437 CA ALA A 98 5.573 30.828 -8.719 1.00 12.14 C ATOM 1438 C ALA A 98 5.907 31.999 -9.637 1.00 20.40 C ATOM 1439 O ALA A 98 5.249 33.038 -9.598 1.00 75.14 O ATOM 1440 CB ALA A 98 6.637 30.679 -7.641 1.00 50.24 C ATOM 0 H ALA A 98 6.176 28.904 -9.293 1.00 33.24 H new ATOM 0 HA ALA A 98 4.615 31.036 -8.242 1.00 12.14 H new ATOM 0 HB1 ALA A 98 6.724 31.612 -7.084 1.00 50.24 H new ATOM 0 HB2 ALA A 98 6.356 29.875 -6.961 1.00 50.24 H new ATOM 0 HB3 ALA A 98 7.595 30.443 -8.105 1.00 50.24 H new ATOM 1446 N SER A 99 6.935 31.823 -10.462 1.00 13.24 N ATOM 1447 CA SER A 99 7.359 32.867 -11.387 1.00 2.22 C ATOM 1448 C SER A 99 6.361 33.018 -12.531 1.00 11.24 C ATOM 1449 O SER A 99 6.397 33.997 -13.275 1.00 72.11 O ATOM 1450 CB SER A 99 8.748 32.550 -11.945 1.00 74.53 C ATOM 1451 OG SER A 99 9.037 33.350 -13.079 1.00 32.44 O ATOM 0 H SER A 99 7.489 30.968 -10.508 1.00 13.24 H new ATOM 0 HA SER A 99 7.401 33.808 -10.839 1.00 2.22 H new ATOM 0 HB2 SER A 99 9.500 32.720 -11.175 1.00 74.53 H new ATOM 0 HB3 SER A 99 8.802 31.496 -12.216 1.00 74.53 H new ATOM 0 HG SER A 99 8.221 33.806 -13.374 1.00 32.44 H new ATOM 1457 N ASN A 100 5.470 32.041 -12.663 1.00 62.42 N ATOM 1458 CA ASN A 100 4.461 32.063 -13.716 1.00 45.32 C ATOM 1459 C ASN A 100 3.415 33.140 -13.444 1.00 60.40 C ATOM 1460 O ASN A 100 2.868 33.737 -14.370 1.00 62.01 O ATOM 1461 CB ASN A 100 3.785 30.696 -13.833 1.00 12.05 C ATOM 1462 CG ASN A 100 3.255 30.430 -15.228 1.00 63.24 C ATOM 1463 OD1 ASN A 100 3.538 31.178 -16.165 1.00 34.14 O ATOM 1464 ND2 ASN A 100 2.483 29.360 -15.374 1.00 33.42 N ATOM 0 H ASN A 100 5.426 31.224 -12.054 1.00 62.42 H new ATOM 0 HA ASN A 100 4.959 32.295 -14.657 1.00 45.32 H new ATOM 0 HB2 ASN A 100 4.498 29.917 -13.564 1.00 12.05 H new ATOM 0 HB3 ASN A 100 2.964 30.637 -13.118 1.00 12.05 H new ATOM 0 HD21 ASN A 100 2.098 29.130 -16.290 1.00 33.42 H new ATOM 0 HD22 ASN A 100 2.274 28.768 -14.570 1.00 33.42 H new ATOM 1471 N GLY A 101 3.142 33.382 -12.165 1.00 73.05 N ATOM 1472 CA GLY A 101 2.162 34.386 -11.794 1.00 3.33 C ATOM 1473 C GLY A 101 0.847 33.777 -11.350 1.00 50.24 C ATOM 1474 O GLY A 101 -0.167 34.469 -11.268 1.00 34.22 O ATOM 0 H GLY A 101 3.582 32.901 -11.380 1.00 73.05 H new ATOM 0 HA2 GLY A 101 2.564 35.001 -10.989 1.00 3.33 H new ATOM 0 HA3 GLY A 101 1.985 35.047 -12.642 1.00 3.33 H new ATOM 1478 N GLU A 102 0.864 32.479 -11.066 1.00 72.41 N ATOM 1479 CA GLU A 102 -0.338 31.777 -10.632 1.00 33.15 C ATOM 1480 C GLU A 102 -0.133 31.146 -9.257 1.00 70.24 C ATOM 1481 O GLU A 102 0.906 30.543 -8.987 1.00 22.14 O ATOM 1482 CB GLU A 102 -0.722 30.699 -11.648 1.00 10.23 C ATOM 1483 CG GLU A 102 0.258 29.539 -11.704 1.00 13.21 C ATOM 1484 CD GLU A 102 -0.032 28.586 -12.847 1.00 62.11 C ATOM 1485 OE1 GLU A 102 -0.631 29.026 -13.850 1.00 51.11 O ATOM 1486 OE2 GLU A 102 0.342 27.399 -12.738 1.00 53.11 O ATOM 0 H GLU A 102 1.696 31.892 -11.129 1.00 72.41 H new ATOM 0 HA GLU A 102 -1.147 32.504 -10.562 1.00 33.15 H new ATOM 0 HB2 GLU A 102 -1.712 30.316 -11.402 1.00 10.23 H new ATOM 0 HB3 GLU A 102 -0.793 31.152 -12.637 1.00 10.23 H new ATOM 0 HG2 GLU A 102 1.271 29.928 -11.808 1.00 13.21 H new ATOM 0 HG3 GLU A 102 0.222 28.992 -10.762 1.00 13.21 H new ATOM 1493 N THR A 103 -1.132 31.289 -8.392 1.00 4.35 N ATOM 1494 CA THR A 103 -1.061 30.736 -7.045 1.00 73.22 C ATOM 1495 C THR A 103 -0.765 29.241 -7.080 1.00 73.20 C ATOM 1496 O THR A 103 -1.015 28.571 -8.083 1.00 41.34 O ATOM 1497 CB THR A 103 -2.373 30.970 -6.272 1.00 40.03 C ATOM 1498 OG1 THR A 103 -3.018 32.156 -6.749 1.00 44.24 O ATOM 1499 CG2 THR A 103 -2.106 31.097 -4.780 1.00 35.11 C ATOM 0 H THR A 103 -2.000 31.783 -8.600 1.00 4.35 H new ATOM 0 HA THR A 103 -0.249 31.253 -6.533 1.00 73.22 H new ATOM 0 HB THR A 103 -3.024 30.112 -6.437 1.00 40.03 H new ATOM 0 HG1 THR A 103 -3.852 32.297 -6.254 1.00 44.24 H new ATOM 0 HG21 THR A 103 -3.047 31.262 -4.255 1.00 35.11 H new ATOM 0 HG22 THR A 103 -1.642 30.181 -4.414 1.00 35.11 H new ATOM 0 HG23 THR A 103 -1.438 31.939 -4.600 1.00 35.11 H new ATOM 1507 N LEU A 104 -0.233 28.722 -5.979 1.00 42.20 N ATOM 1508 CA LEU A 104 0.097 27.304 -5.883 1.00 53.32 C ATOM 1509 C LEU A 104 -0.897 26.574 -4.986 1.00 75.44 C ATOM 1510 O LEU A 104 -1.293 27.083 -3.938 1.00 44.14 O ATOM 1511 CB LEU A 104 1.516 27.126 -5.342 1.00 22.12 C ATOM 1512 CG LEU A 104 2.558 28.123 -5.849 1.00 3.30 C ATOM 1513 CD1 LEU A 104 3.932 27.793 -5.286 1.00 12.03 C ATOM 1514 CD2 LEU A 104 2.592 28.132 -7.370 1.00 52.33 C ATOM 0 H LEU A 104 -0.021 29.262 -5.140 1.00 42.20 H new ATOM 0 HA LEU A 104 0.040 26.874 -6.883 1.00 53.32 H new ATOM 0 HB2 LEU A 104 1.479 27.191 -4.255 1.00 22.12 H new ATOM 0 HB3 LEU A 104 1.854 26.120 -5.590 1.00 22.12 H new ATOM 0 HG LEU A 104 2.277 29.118 -5.505 1.00 3.30 H new ATOM 0 HD11 LEU A 104 4.660 28.514 -5.658 1.00 12.03 H new ATOM 0 HD12 LEU A 104 3.900 27.839 -4.197 1.00 12.03 H new ATOM 0 HD13 LEU A 104 4.222 26.790 -5.598 1.00 12.03 H new ATOM 0 HD21 LEU A 104 3.339 28.847 -7.713 1.00 52.33 H new ATOM 0 HD22 LEU A 104 2.848 27.137 -7.734 1.00 52.33 H new ATOM 0 HD23 LEU A 104 1.613 28.418 -7.754 1.00 52.33 H new ATOM 1526 N GLU A 105 -1.295 25.376 -5.405 1.00 55.31 N ATOM 1527 CA GLU A 105 -2.242 24.575 -4.638 1.00 54.42 C ATOM 1528 C GLU A 105 -2.023 23.086 -4.888 1.00 52.13 C ATOM 1529 O GLU A 105 -2.069 22.623 -6.028 1.00 34.51 O ATOM 1530 CB GLU A 105 -3.679 24.959 -5.000 1.00 61.51 C ATOM 1531 CG GLU A 105 -4.024 26.402 -4.675 1.00 51.11 C ATOM 1532 CD GLU A 105 -5.509 26.688 -4.794 1.00 24.24 C ATOM 1533 OE1 GLU A 105 -6.259 26.319 -3.866 1.00 30.41 O ATOM 1534 OE2 GLU A 105 -5.920 27.280 -5.813 1.00 60.21 O ATOM 0 H GLU A 105 -0.977 24.940 -6.270 1.00 55.31 H new ATOM 0 HA GLU A 105 -2.075 24.776 -3.580 1.00 54.42 H new ATOM 0 HB2 GLU A 105 -3.834 24.788 -6.065 1.00 61.51 H new ATOM 0 HB3 GLU A 105 -4.367 24.301 -4.468 1.00 61.51 H new ATOM 0 HG2 GLU A 105 -3.694 26.631 -3.662 1.00 51.11 H new ATOM 0 HG3 GLU A 105 -3.476 27.063 -5.346 1.00 51.11 H new ATOM 1541 N LYS A 106 -1.784 22.341 -3.815 1.00 24.04 N ATOM 1542 CA LYS A 106 -1.557 20.904 -3.915 1.00 15.12 C ATOM 1543 C LYS A 106 -2.832 20.129 -3.596 1.00 51.20 C ATOM 1544 O LYS A 106 -3.668 20.586 -2.816 1.00 54.02 O ATOM 1545 CB LYS A 106 -0.437 20.476 -2.965 1.00 24.21 C ATOM 1546 CG LYS A 106 -0.024 19.023 -3.127 1.00 32.04 C ATOM 1547 CD LYS A 106 0.546 18.756 -4.510 1.00 32.34 C ATOM 1548 CE LYS A 106 0.936 17.295 -4.679 1.00 52.40 C ATOM 1549 NZ LYS A 106 2.221 16.981 -3.995 1.00 14.43 N ATOM 0 H LYS A 106 -1.742 22.709 -2.865 1.00 24.04 H new ATOM 0 HA LYS A 106 -1.262 20.679 -4.940 1.00 15.12 H new ATOM 0 HB2 LYS A 106 0.432 21.113 -3.131 1.00 24.21 H new ATOM 0 HB3 LYS A 106 -0.761 20.641 -1.937 1.00 24.21 H new ATOM 0 HG2 LYS A 106 0.719 18.769 -2.371 1.00 32.04 H new ATOM 0 HG3 LYS A 106 -0.886 18.378 -2.957 1.00 32.04 H new ATOM 0 HD2 LYS A 106 -0.190 19.027 -5.267 1.00 32.34 H new ATOM 0 HD3 LYS A 106 1.419 19.388 -4.673 1.00 32.34 H new ATOM 0 HE2 LYS A 106 0.146 16.660 -4.278 1.00 52.40 H new ATOM 0 HE3 LYS A 106 1.023 17.063 -5.740 1.00 52.40 H new ATOM 0 HZ1 LYS A 106 2.452 15.976 -4.134 1.00 14.43 H new ATOM 0 HZ2 LYS A 106 2.980 17.569 -4.395 1.00 14.43 H new ATOM 0 HZ3 LYS A 106 2.130 17.178 -2.978 1.00 14.43 H new ATOM 1563 N ILE A 107 -2.973 18.955 -4.202 1.00 43.35 N ATOM 1564 CA ILE A 107 -4.144 18.117 -3.980 1.00 72.15 C ATOM 1565 C ILE A 107 -3.752 16.774 -3.373 1.00 50.14 C ATOM 1566 O ILE A 107 -2.901 16.063 -3.908 1.00 62.41 O ATOM 1567 CB ILE A 107 -4.916 17.870 -5.290 1.00 61.31 C ATOM 1568 CG1 ILE A 107 -5.148 19.190 -6.028 1.00 22.20 C ATOM 1569 CG2 ILE A 107 -6.240 17.178 -5.002 1.00 60.11 C ATOM 1570 CD1 ILE A 107 -5.900 20.216 -5.209 1.00 63.32 C ATOM 0 H ILE A 107 -2.290 18.563 -4.851 1.00 43.35 H new ATOM 0 HA ILE A 107 -4.788 18.653 -3.284 1.00 72.15 H new ATOM 0 HB ILE A 107 -4.319 17.219 -5.929 1.00 61.31 H new ATOM 0 HG12 ILE A 107 -4.185 19.607 -6.322 1.00 22.20 H new ATOM 0 HG13 ILE A 107 -5.703 18.992 -6.945 1.00 22.20 H new ATOM 0 HG21 ILE A 107 -6.774 17.010 -5.937 1.00 60.11 H new ATOM 0 HG22 ILE A 107 -6.052 16.221 -4.515 1.00 60.11 H new ATOM 0 HG23 ILE A 107 -6.844 17.806 -4.347 1.00 60.11 H new ATOM 0 HD11 ILE A 107 -6.028 21.126 -5.795 1.00 63.32 H new ATOM 0 HD12 ILE A 107 -6.878 19.819 -4.937 1.00 63.32 H new ATOM 0 HD13 ILE A 107 -5.336 20.443 -4.304 1.00 63.32 H new ATOM 1582 N THR A 108 -4.380 16.431 -2.253 1.00 1.42 N ATOM 1583 CA THR A 108 -4.098 15.174 -1.573 1.00 22.34 C ATOM 1584 C THR A 108 -5.152 14.122 -1.901 1.00 2.50 C ATOM 1585 O THR A 108 -5.383 13.198 -1.123 1.00 65.55 O ATOM 1586 CB THR A 108 -4.036 15.363 -0.045 1.00 71.31 C ATOM 1587 OG1 THR A 108 -3.645 14.138 0.585 1.00 63.43 O ATOM 1588 CG2 THR A 108 -5.384 15.811 0.500 1.00 61.34 C ATOM 0 H THR A 108 -5.088 17.007 -1.798 1.00 1.42 H new ATOM 0 HA THR A 108 -3.126 14.834 -1.930 1.00 22.34 H new ATOM 0 HB THR A 108 -3.298 16.135 0.173 1.00 71.31 H new ATOM 0 HG1 THR A 108 -4.216 13.409 0.264 1.00 63.43 H new ATOM 0 HG21 THR A 108 -5.316 15.938 1.580 1.00 61.34 H new ATOM 0 HG22 THR A 108 -5.666 16.758 0.041 1.00 61.34 H new ATOM 0 HG23 THR A 108 -6.138 15.058 0.270 1.00 61.34 H new ATOM 1596 N ASN A 109 -5.788 14.271 -3.058 1.00 73.22 N ATOM 1597 CA ASN A 109 -6.819 13.333 -3.490 1.00 4.05 C ATOM 1598 C ASN A 109 -6.692 13.034 -4.980 1.00 55.13 C ATOM 1599 O ASN A 109 -7.081 13.845 -5.821 1.00 70.54 O ATOM 1600 CB ASN A 109 -8.209 13.896 -3.187 1.00 22.44 C ATOM 1601 CG ASN A 109 -8.261 14.623 -1.857 1.00 41.41 C ATOM 1602 OD1 ASN A 109 -8.493 15.831 -1.807 1.00 3.42 O ATOM 1603 ND2 ASN A 109 -8.045 13.889 -0.772 1.00 45.10 N ATOM 0 H ASN A 109 -5.608 15.032 -3.713 1.00 73.22 H new ATOM 0 HA ASN A 109 -6.683 12.403 -2.938 1.00 4.05 H new ATOM 0 HB2 ASN A 109 -8.503 14.580 -3.983 1.00 22.44 H new ATOM 0 HB3 ASN A 109 -8.934 13.082 -3.182 1.00 22.44 H new ATOM 0 HD21 ASN A 109 -8.068 14.324 0.151 1.00 45.10 H new ATOM 0 HD22 ASN A 109 -7.856 12.891 -0.861 1.00 45.10 H new ATOM 1610 N SER A 110 -6.147 11.865 -5.300 1.00 32.32 N ATOM 1611 CA SER A 110 -5.967 11.459 -6.689 1.00 3.52 C ATOM 1612 C SER A 110 -6.086 9.945 -6.833 1.00 11.31 C ATOM 1613 O SER A 110 -5.455 9.189 -6.095 1.00 24.11 O ATOM 1614 CB SER A 110 -4.605 11.927 -7.206 1.00 24.54 C ATOM 1615 OG SER A 110 -4.209 13.136 -6.581 1.00 74.41 O ATOM 0 H SER A 110 -5.822 11.182 -4.616 1.00 32.32 H new ATOM 0 HA SER A 110 -6.753 11.925 -7.283 1.00 3.52 H new ATOM 0 HB2 SER A 110 -3.857 11.156 -7.020 1.00 24.54 H new ATOM 0 HB3 SER A 110 -4.652 12.071 -8.285 1.00 24.54 H new ATOM 0 HG SER A 110 -3.335 13.413 -6.928 1.00 74.41 H new ATOM 1621 N ARG A 111 -6.901 9.511 -7.789 1.00 22.33 N ATOM 1622 CA ARG A 111 -7.105 8.087 -8.030 1.00 1.42 C ATOM 1623 C ARG A 111 -7.317 7.813 -9.516 1.00 32.44 C ATOM 1624 O ARG A 111 -8.407 7.445 -9.955 1.00 31.24 O ATOM 1625 CB ARG A 111 -8.306 7.580 -7.230 1.00 10.03 C ATOM 1626 CG ARG A 111 -8.082 7.583 -5.726 1.00 43.34 C ATOM 1627 CD ARG A 111 -6.968 6.628 -5.327 1.00 41.02 C ATOM 1628 NE ARG A 111 -7.203 5.275 -5.824 1.00 34.25 N ATOM 1629 CZ ARG A 111 -6.353 4.269 -5.648 1.00 51.42 C ATOM 1630 NH1 ARG A 111 -5.218 4.464 -4.992 1.00 24.11 N ATOM 1631 NH2 ARG A 111 -6.638 3.066 -6.130 1.00 11.24 N ATOM 0 H ARG A 111 -7.430 10.124 -8.409 1.00 22.33 H new ATOM 0 HA ARG A 111 -6.210 7.556 -7.704 1.00 1.42 H new ATOM 0 HB2 ARG A 111 -9.173 8.199 -7.461 1.00 10.03 H new ATOM 0 HB3 ARG A 111 -8.544 6.566 -7.551 1.00 10.03 H new ATOM 0 HG2 ARG A 111 -7.834 8.592 -5.396 1.00 43.34 H new ATOM 0 HG3 ARG A 111 -9.004 7.300 -5.219 1.00 43.34 H new ATOM 0 HD2 ARG A 111 -6.018 6.997 -5.715 1.00 41.02 H new ATOM 0 HD3 ARG A 111 -6.882 6.605 -4.241 1.00 41.02 H new ATOM 0 HE ARG A 111 -8.067 5.092 -6.334 1.00 34.25 H new ATOM 0 HH11 ARG A 111 -4.996 5.388 -4.621 1.00 24.11 H new ATOM 0 HH12 ARG A 111 -4.567 3.690 -4.858 1.00 24.11 H new ATOM 0 HH21 ARG A 111 -7.510 2.913 -6.636 1.00 11.24 H new ATOM 0 HH22 ARG A 111 -5.985 2.294 -5.994 1.00 11.24 H new ATOM 1645 N PRO A 112 -6.252 7.995 -10.310 1.00 3.34 N ATOM 1646 CA PRO A 112 -6.296 7.773 -11.758 1.00 32.22 C ATOM 1647 C PRO A 112 -6.431 6.296 -12.114 1.00 10.23 C ATOM 1648 O PRO A 112 -6.269 5.413 -11.272 1.00 34.34 O ATOM 1649 CB PRO A 112 -4.951 8.319 -12.242 1.00 63.11 C ATOM 1650 CG PRO A 112 -4.050 8.211 -11.060 1.00 73.51 C ATOM 1651 CD PRO A 112 -4.921 8.433 -9.855 1.00 32.55 C ATOM 0 HA PRO A 112 -7.158 8.256 -12.218 1.00 32.22 H new ATOM 0 HB2 PRO A 112 -4.570 7.742 -13.084 1.00 63.11 H new ATOM 0 HB3 PRO A 112 -5.041 9.352 -12.578 1.00 63.11 H new ATOM 0 HG2 PRO A 112 -3.572 7.232 -11.021 1.00 73.51 H new ATOM 0 HG3 PRO A 112 -3.253 8.953 -11.108 1.00 73.51 H new ATOM 0 HD2 PRO A 112 -4.578 7.852 -8.999 1.00 32.55 H new ATOM 0 HD3 PRO A 112 -4.925 9.479 -9.549 1.00 32.55 H new ATOM 1659 N PRO A 113 -6.734 6.020 -13.391 1.00 22.33 N ATOM 1660 CA PRO A 113 -6.896 4.650 -13.887 1.00 61.11 C ATOM 1661 C PRO A 113 -5.575 3.890 -13.933 1.00 63.12 C ATOM 1662 O PRO A 113 -4.503 4.493 -13.993 1.00 44.04 O ATOM 1663 CB PRO A 113 -7.449 4.848 -15.301 1.00 25.02 C ATOM 1664 CG PRO A 113 -6.974 6.200 -15.707 1.00 42.40 C ATOM 1665 CD PRO A 113 -6.941 7.023 -14.449 1.00 24.14 C ATOM 0 HA PRO A 113 -7.543 4.056 -13.241 1.00 61.11 H new ATOM 0 HB2 PRO A 113 -7.082 4.079 -15.981 1.00 25.02 H new ATOM 0 HB3 PRO A 113 -8.537 4.791 -15.312 1.00 25.02 H new ATOM 0 HG2 PRO A 113 -5.986 6.145 -16.164 1.00 42.40 H new ATOM 0 HG3 PRO A 113 -7.642 6.643 -16.446 1.00 42.40 H new ATOM 0 HD2 PRO A 113 -6.136 7.757 -14.470 1.00 24.14 H new ATOM 0 HD3 PRO A 113 -7.870 7.574 -14.304 1.00 24.14 H new ATOM 1673 N CYS A 114 -5.659 2.565 -13.905 1.00 61.51 N ATOM 1674 CA CYS A 114 -4.469 1.722 -13.943 1.00 61.15 C ATOM 1675 C CYS A 114 -3.626 2.027 -15.178 1.00 34.32 C ATOM 1676 O CYS A 114 -3.961 1.614 -16.288 1.00 61.43 O ATOM 1677 CB CYS A 114 -4.864 0.245 -13.933 1.00 32.51 C ATOM 1678 SG CYS A 114 -3.470 -0.891 -13.746 1.00 21.42 S ATOM 0 H CYS A 114 -6.539 2.051 -13.856 1.00 61.51 H new ATOM 0 HA CYS A 114 -3.873 1.937 -13.056 1.00 61.15 H new ATOM 0 HB2 CYS A 114 -5.570 0.074 -13.120 1.00 32.51 H new ATOM 0 HB3 CYS A 114 -5.386 0.013 -14.862 1.00 32.51 H new ATOM 0 HG CYS A 114 -3.905 -2.116 -13.747 1.00 21.42 H new ATOM 1684 N VAL A 115 -2.532 2.754 -14.976 1.00 71.23 N ATOM 1685 CA VAL A 115 -1.641 3.115 -16.073 1.00 15.03 C ATOM 1686 C VAL A 115 -0.233 2.583 -15.834 1.00 43.24 C ATOM 1687 O VAL A 115 0.531 3.149 -15.051 1.00 51.14 O ATOM 1688 CB VAL A 115 -1.577 4.642 -16.263 1.00 45.03 C ATOM 1689 CG1 VAL A 115 -0.621 4.999 -17.391 1.00 43.43 C ATOM 1690 CG2 VAL A 115 -2.964 5.205 -16.531 1.00 73.41 C ATOM 0 H VAL A 115 -2.241 3.105 -14.063 1.00 71.23 H new ATOM 0 HA VAL A 115 -2.049 2.661 -16.976 1.00 15.03 H new ATOM 0 HB VAL A 115 -1.201 5.090 -15.343 1.00 45.03 H new ATOM 0 HG11 VAL A 115 -0.588 6.082 -17.511 1.00 43.43 H new ATOM 0 HG12 VAL A 115 0.377 4.630 -17.153 1.00 43.43 H new ATOM 0 HG13 VAL A 115 -0.965 4.541 -18.318 1.00 43.43 H new ATOM 0 HG21 VAL A 115 -2.899 6.285 -16.663 1.00 73.41 H new ATOM 0 HG22 VAL A 115 -3.372 4.753 -17.435 1.00 73.41 H new ATOM 0 HG23 VAL A 115 -3.617 4.981 -15.687 1.00 73.41 H new ATOM 1700 N ILE A 116 0.105 1.493 -16.515 1.00 1.04 N ATOM 1701 CA ILE A 116 1.423 0.886 -16.378 1.00 21.20 C ATOM 1702 C ILE A 116 2.114 0.760 -17.732 1.00 14.22 C ATOM 1703 O ILE A 116 1.827 -0.155 -18.505 1.00 22.23 O ATOM 1704 CB ILE A 116 1.336 -0.507 -15.727 1.00 63.43 C ATOM 1705 CG1 ILE A 116 0.224 -1.331 -16.380 1.00 10.30 C ATOM 1706 CG2 ILE A 116 1.099 -0.379 -14.230 1.00 52.11 C ATOM 1707 CD1 ILE A 116 0.587 -2.785 -16.581 1.00 64.23 C ATOM 0 H ILE A 116 -0.515 1.013 -17.167 1.00 1.04 H new ATOM 0 HA ILE A 116 2.008 1.543 -15.734 1.00 21.20 H new ATOM 0 HB ILE A 116 2.283 -1.023 -15.882 1.00 63.43 H new ATOM 0 HG12 ILE A 116 -0.672 -1.271 -15.762 1.00 10.30 H new ATOM 0 HG13 ILE A 116 -0.024 -0.890 -17.345 1.00 10.30 H new ATOM 0 HG21 ILE A 116 1.040 -1.372 -13.785 1.00 52.11 H new ATOM 0 HG22 ILE A 116 1.922 0.173 -13.777 1.00 52.11 H new ATOM 0 HG23 ILE A 116 0.165 0.154 -14.054 1.00 52.11 H new ATOM 0 HD11 ILE A 116 -0.248 -3.307 -17.048 1.00 64.23 H new ATOM 0 HD12 ILE A 116 1.464 -2.855 -17.224 1.00 64.23 H new ATOM 0 HD13 ILE A 116 0.807 -3.242 -15.616 1.00 64.23 H new ATOM 1719 N LEU A 117 3.026 1.684 -18.012 1.00 53.34 N ATOM 1720 CA LEU A 117 3.760 1.677 -19.273 1.00 31.40 C ATOM 1721 C LEU A 117 5.111 0.988 -19.112 1.00 23.02 C ATOM 1722 O LEU A 117 5.822 1.215 -18.133 1.00 44.01 O ATOM 1723 CB LEU A 117 3.960 3.107 -19.778 1.00 24.42 C ATOM 1724 CG LEU A 117 4.950 3.965 -18.989 1.00 30.54 C ATOM 1725 CD1 LEU A 117 6.351 3.830 -19.565 1.00 52.42 C ATOM 1726 CD2 LEU A 117 4.509 5.421 -18.986 1.00 45.12 C ATOM 0 H LEU A 117 3.275 2.448 -17.383 1.00 53.34 H new ATOM 0 HA LEU A 117 3.173 1.120 -20.004 1.00 31.40 H new ATOM 0 HB2 LEU A 117 4.295 3.062 -20.814 1.00 24.42 H new ATOM 0 HB3 LEU A 117 2.993 3.610 -19.777 1.00 24.42 H new ATOM 0 HG LEU A 117 4.968 3.610 -17.958 1.00 30.54 H new ATOM 0 HD11 LEU A 117 7.042 4.448 -18.991 1.00 52.42 H new ATOM 0 HD12 LEU A 117 6.667 2.788 -19.513 1.00 52.42 H new ATOM 0 HD13 LEU A 117 6.350 4.157 -20.605 1.00 52.42 H new ATOM 0 HD21 LEU A 117 5.225 6.017 -18.420 1.00 45.12 H new ATOM 0 HD22 LEU A 117 4.461 5.789 -20.011 1.00 45.12 H new ATOM 0 HD23 LEU A 117 3.525 5.502 -18.525 1.00 45.12 H new TER 1738 LEU A 117