USER MOD reduce.3.24.130724 H: found=0, std=0, add=851, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 852 hydrogens (5 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 NoAdj-H: A 10 CSP H2 : A 10 CSP N : A 9 PHE C :(H bumps) USER MOD NoAdj-H: A 10 CSP H : A 10 CSP N : A 9 PHE C :(H bumps) USER MOD Set 1.1: A 102 LYS NZ :NH3+ -175:sc= -0.0204 (180deg=-0.165) USER MOD Set 1.2: A 106 ASN : amide:sc= -0.657 K(o=-0.68,f=-5.7!) USER MOD Set 2.1: A 15 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 59 GLN : amide:sc= 1.6 K(o=2.4,f=-4.7!) USER MOD Set 2.3: A 84 TYR OH : rot 15:sc= 0.785 USER MOD Set 3.1: A 26 GLN : amide:sc= -2.39 K(o=-2.2,f=-3.9!) USER MOD Set 3.2: A 29 LYS NZ :NH3+ -143:sc= 0.0785 (180deg=0) USER MOD Set 3.3: A 30 TYR OH : rot 180:sc= 0.0759 USER MOD Set 4.1: A 5 HIS : no HD1:sc= 0.199 X(o=0.41,f=-0.00071) USER MOD Set 4.2: A 7 TYR OH : rot 62:sc= 0.212 USER MOD Single : A 1 MET CE :methyl 170:sc=-0.00749 (180deg=-0.0928) USER MOD Single : A 1 MET N :NH3+ 142:sc= 0.0606 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0491) USER MOD Single : A 11 SER OG : rot 180:sc= 0.0026 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot -170:sc= 0.0322 USER MOD Single : A 17 SER OG : rot -89:sc= 0.315 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0649) USER MOD Single : A 23 MET CE :methyl -166:sc= 0 (180deg=-0.193) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 LYS NZ :NH3+ -174:sc= 0.118 (180deg=0.112) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 169:sc=-0.00574 (180deg=-0.122) USER MOD Single : A 101 LYS NZ :NH3+ -159:sc= -0.0286 (180deg=-0.327) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.679 19.248 10.339 1.00 0.00 N ATOM 2 CA MET A 1 -6.239 17.894 10.224 1.00 0.00 C ATOM 3 C MET A 1 -5.116 17.008 9.682 1.00 0.00 C ATOM 4 O MET A 1 -4.472 17.436 8.725 1.00 0.00 O ATOM 5 CB MET A 1 -7.413 17.926 9.243 1.00 0.00 C ATOM 6 CG MET A 1 -8.311 16.688 9.311 1.00 0.00 C ATOM 7 SD MET A 1 -7.584 15.155 8.626 1.00 0.00 S ATOM 8 CE MET A 1 -9.020 14.106 8.698 1.00 0.00 C ATOM 0 H1 MET A 1 -6.401 19.946 10.069 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.382 19.419 11.321 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.857 19.339 9.708 1.00 0.00 H new ATOM 0 HA MET A 1 -6.602 17.516 11.180 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.016 18.812 9.442 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.024 18.026 8.230 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.578 16.510 10.353 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.237 16.901 8.777 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.822 13.180 8.158 1.00 0.00 H new ATOM 0 HE2 MET A 1 -9.252 13.877 9.738 1.00 0.00 H new ATOM 0 HE3 MET A 1 -9.868 14.618 8.242 1.00 0.00 H new ATOM 20 N GLU A 2 -4.823 15.905 10.365 1.00 0.00 N ATOM 21 CA GLU A 2 -3.709 15.022 9.993 1.00 0.00 C ATOM 22 C GLU A 2 -4.243 13.616 9.708 1.00 0.00 C ATOM 23 O GLU A 2 -4.880 13.034 10.584 1.00 0.00 O ATOM 24 CB GLU A 2 -2.736 14.970 11.173 1.00 0.00 C ATOM 25 CG GLU A 2 -1.405 14.295 10.836 1.00 0.00 C ATOM 26 CD GLU A 2 -0.466 15.234 10.076 1.00 0.00 C ATOM 27 OE1 GLU A 2 -0.601 15.316 8.836 1.00 0.00 O ATOM 28 OE2 GLU A 2 0.415 15.807 10.753 1.00 0.00 O ATOM 0 H GLU A 2 -5.343 15.595 11.186 1.00 0.00 H new ATOM 0 HA GLU A 2 -3.207 15.396 9.101 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -2.542 15.985 11.519 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -3.207 14.436 11.999 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -0.922 13.965 11.756 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -1.591 13.404 10.236 1.00 0.00 H new ATOM 35 N LYS A 3 -4.273 13.264 8.426 1.00 0.00 N ATOM 36 CA LYS A 3 -4.554 11.893 7.977 1.00 0.00 C ATOM 37 C LYS A 3 -3.833 11.660 6.649 1.00 0.00 C ATOM 38 O LYS A 3 -3.795 12.543 5.793 1.00 0.00 O ATOM 39 CB LYS A 3 -6.043 11.657 7.720 1.00 0.00 C ATOM 40 CG LYS A 3 -6.661 10.549 8.576 1.00 0.00 C ATOM 41 CD LYS A 3 -7.047 11.030 9.976 1.00 0.00 C ATOM 42 CE LYS A 3 -7.700 9.929 10.815 1.00 0.00 C ATOM 43 NZ LYS A 3 -7.997 10.451 12.156 1.00 0.00 N ATOM 0 H LYS A 3 -4.103 13.919 7.663 1.00 0.00 H new ATOM 0 HA LYS A 3 -4.219 11.218 8.765 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -6.583 12.586 7.903 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -6.183 11.409 6.668 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -7.546 10.158 8.074 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -5.953 9.724 8.662 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -6.157 11.394 10.490 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -7.733 11.873 9.891 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -8.616 9.585 10.335 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -7.035 9.068 10.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.441 9.705 12.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -7.114 10.758 12.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.646 11.260 12.078 1.00 0.00 H new ATOM 57 N LYS A 4 -3.100 10.550 6.642 1.00 0.00 N ATOM 58 CA LYS A 4 -2.361 10.097 5.455 1.00 0.00 C ATOM 59 C LYS A 4 -3.012 8.874 4.807 1.00 0.00 C ATOM 60 O LYS A 4 -3.448 7.942 5.483 1.00 0.00 O ATOM 61 CB LYS A 4 -0.900 9.784 5.782 1.00 0.00 C ATOM 62 CG LYS A 4 0.021 11.003 5.850 1.00 0.00 C ATOM 63 CD LYS A 4 -0.159 11.842 7.117 1.00 0.00 C ATOM 64 CE LYS A 4 0.780 13.048 7.160 1.00 0.00 C ATOM 65 NZ LYS A 4 0.427 14.043 6.138 1.00 0.00 N ATOM 0 H LYS A 4 -2.998 9.938 7.452 1.00 0.00 H new ATOM 0 HA LYS A 4 -2.393 10.924 4.745 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -0.861 9.264 6.739 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -0.514 9.097 5.029 1.00 0.00 H new ATOM 0 HG2 LYS A 4 1.057 10.668 5.791 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -0.160 11.633 4.979 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -1.191 12.187 7.177 1.00 0.00 H new ATOM 0 HD3 LYS A 4 0.019 11.216 7.991 1.00 0.00 H new ATOM 0 HE2 LYS A 4 0.738 13.508 8.147 1.00 0.00 H new ATOM 0 HE3 LYS A 4 1.807 12.716 7.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 1.005 14.897 6.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.605 13.648 5.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -0.580 14.289 6.226 1.00 0.00 H new ATOM 79 N HIS A 5 -3.085 8.921 3.480 1.00 0.00 N ATOM 80 CA HIS A 5 -3.733 7.906 2.638 1.00 0.00 C ATOM 81 C HIS A 5 -2.714 6.936 2.035 1.00 0.00 C ATOM 82 O HIS A 5 -1.846 7.283 1.236 1.00 0.00 O ATOM 83 CB HIS A 5 -4.591 8.568 1.558 1.00 0.00 C ATOM 84 CG HIS A 5 -5.874 9.179 2.126 1.00 0.00 C ATOM 85 ND1 HIS A 5 -7.093 8.654 2.035 1.00 0.00 N ATOM 86 CD2 HIS A 5 -5.980 10.420 2.743 1.00 0.00 C ATOM 87 CE1 HIS A 5 -7.902 9.571 2.559 1.00 0.00 C ATOM 88 NE2 HIS A 5 -7.263 10.650 3.006 1.00 0.00 N ATOM 0 H HIS A 5 -2.684 9.688 2.939 1.00 0.00 H new ATOM 0 HA HIS A 5 -4.392 7.315 3.274 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -4.010 9.346 1.062 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -4.849 7.829 0.799 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -5.160 11.085 2.970 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -8.974 9.452 2.616 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -7.669 11.473 3.452 1.00 0.00 H new ATOM 96 N ILE A 6 -2.800 5.712 2.549 1.00 0.00 N ATOM 97 CA ILE A 6 -1.933 4.580 2.193 1.00 0.00 C ATOM 98 C ILE A 6 -2.813 3.570 1.453 1.00 0.00 C ATOM 99 O ILE A 6 -3.608 2.841 2.044 1.00 0.00 O ATOM 100 CB ILE A 6 -1.289 3.985 3.446 1.00 0.00 C ATOM 101 CG1 ILE A 6 -0.488 5.042 4.208 1.00 0.00 C ATOM 102 CG2 ILE A 6 -0.409 2.790 3.076 1.00 0.00 C ATOM 103 CD1 ILE A 6 -0.120 4.651 5.640 1.00 0.00 C ATOM 0 H ILE A 6 -3.499 5.467 3.251 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.108 4.889 1.552 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.083 3.635 4.106 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.428 5.253 3.656 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -1.064 5.967 4.234 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.042 2.377 3.978 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -1.018 2.026 2.593 1.00 0.00 H new ATOM 0 HG23 ILE A 6 0.376 3.114 2.393 1.00 0.00 H new ATOM 0 HD11 ILE A 6 0.446 5.459 6.104 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -1.029 4.470 6.213 1.00 0.00 H new ATOM 0 HD13 ILE A 6 0.486 3.745 5.625 1.00 0.00 H new ATOM 115 N TYR A 7 -2.638 3.559 0.134 1.00 0.00 N ATOM 116 CA TYR A 7 -3.434 2.696 -0.752 1.00 0.00 C ATOM 117 C TYR A 7 -2.614 1.566 -1.377 1.00 0.00 C ATOM 118 O TYR A 7 -1.531 1.756 -1.930 1.00 0.00 O ATOM 119 CB TYR A 7 -4.152 3.496 -1.840 1.00 0.00 C ATOM 120 CG TYR A 7 -5.173 4.543 -1.391 1.00 0.00 C ATOM 121 CD1 TYR A 7 -5.810 4.525 -0.156 1.00 0.00 C ATOM 122 CD2 TYR A 7 -5.498 5.491 -2.354 1.00 0.00 C ATOM 123 CE1 TYR A 7 -6.782 5.477 0.128 1.00 0.00 C ATOM 124 CE2 TYR A 7 -6.466 6.449 -2.080 1.00 0.00 C ATOM 125 CZ TYR A 7 -7.103 6.418 -0.844 1.00 0.00 C ATOM 126 OH TYR A 7 -8.182 7.227 -0.669 1.00 0.00 O ATOM 0 H TYR A 7 -1.952 4.137 -0.351 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.187 2.237 -0.111 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -3.395 4.001 -2.441 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.661 2.790 -2.496 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -5.551 3.776 0.578 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -5.000 5.483 -3.312 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.279 5.486 1.087 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -6.719 7.202 -2.812 1.00 0.00 H new ATOM 0 HH TYR A 7 -8.048 7.784 0.126 1.00 0.00 H new ATOM 136 N LEU A 8 -3.153 0.367 -1.175 1.00 0.00 N ATOM 137 CA LEU A 8 -2.573 -0.903 -1.633 1.00 0.00 C ATOM 138 C LEU A 8 -3.283 -1.433 -2.881 1.00 0.00 C ATOM 139 O LEU A 8 -4.499 -1.318 -3.020 1.00 0.00 O ATOM 140 CB LEU A 8 -2.633 -1.965 -0.532 1.00 0.00 C ATOM 141 CG LEU A 8 -1.454 -1.929 0.444 1.00 0.00 C ATOM 142 CD1 LEU A 8 -1.516 -0.707 1.362 1.00 0.00 C ATOM 143 CD2 LEU A 8 -1.454 -3.194 1.304 1.00 0.00 C ATOM 0 H LEU A 8 -4.032 0.243 -0.673 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.532 -0.699 -1.883 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.558 -1.837 0.030 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.675 -2.950 -0.996 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.540 -1.871 -0.148 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.662 -0.717 2.040 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.491 0.202 0.760 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.439 -0.733 1.941 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.613 -3.163 1.997 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.386 -3.251 1.867 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.363 -4.070 0.662 1.00 0.00 H new ATOM 155 N PHE A 9 -2.462 -1.966 -3.782 1.00 0.00 N ATOM 156 CA PHE A 9 -2.909 -2.465 -5.090 1.00 0.00 C ATOM 157 C PHE A 9 -2.355 -3.845 -5.447 1.00 0.00 C ATOM 158 O PHE A 9 -1.176 -4.144 -5.261 1.00 0.00 O ATOM 159 CB PHE A 9 -2.546 -1.459 -6.185 1.00 0.00 C ATOM 160 CG PHE A 9 -3.307 -0.137 -6.068 1.00 0.00 C ATOM 161 CD1 PHE A 9 -4.524 0.023 -6.722 1.00 0.00 C ATOM 162 CD2 PHE A 9 -2.753 0.912 -5.344 1.00 0.00 C ATOM 163 CE1 PHE A 9 -5.183 1.244 -6.661 1.00 0.00 C ATOM 164 CE2 PHE A 9 -3.405 2.138 -5.288 1.00 0.00 C ATOM 165 CZ PHE A 9 -4.618 2.296 -5.949 1.00 0.00 C ATOM 0 H PHE A 9 -1.459 -2.067 -3.629 1.00 0.00 H new ATOM 0 HA PHE A 9 -3.991 -2.578 -5.020 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -1.475 -1.259 -6.144 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -2.751 -1.903 -7.159 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -4.955 -0.799 -7.275 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -1.816 0.774 -4.825 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -6.130 1.376 -7.164 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -2.974 2.960 -4.736 1.00 0.00 H new ATOM 0 HZ PHE A 9 -5.127 3.247 -5.909 1.00 0.00 H new HETATM 175 N CSP A 10 -3.310 -4.688 -5.825 1.00 0.00 N HETATM 176 CA CSP A 10 -3.115 -6.018 -6.423 1.00 0.00 C HETATM 177 CB CSP A 10 -3.039 -7.152 -5.400 1.00 0.00 C HETATM 178 SG CSP A 10 -4.627 -7.693 -4.669 1.00 0.00 S HETATM 179 C CSP A 10 -4.262 -6.249 -7.408 1.00 0.00 C HETATM 180 O CSP A 10 -5.299 -5.596 -7.296 1.00 0.00 O HETATM 181 P CSP A 10 -4.703 -9.771 -5.178 1.00 0.00 P HETATM 182 O1P CSP A 10 -5.841 -10.302 -4.395 1.00 0.00 O HETATM 183 O2P CSP A 10 -3.342 -10.349 -5.121 1.00 0.00 O HETATM 184 O3P CSP A 10 -5.150 -9.805 -6.723 1.00 0.00 O HETATM 0 HB3 CSP A 10 -2.572 -8.013 -5.878 1.00 0.00 H new HETATM 0 HB2 CSP A 10 -2.379 -6.839 -4.591 1.00 0.00 H new HETATM 0 HA CSP A 10 -2.147 -6.031 -6.924 1.00 0.00 H new ATOM 190 N SER A 11 -4.125 -7.258 -8.263 1.00 0.00 N ATOM 191 CA SER A 11 -5.021 -7.530 -9.396 1.00 0.00 C ATOM 192 C SER A 11 -6.519 -7.447 -9.098 1.00 0.00 C ATOM 193 O SER A 11 -7.290 -6.816 -9.820 1.00 0.00 O ATOM 194 CB SER A 11 -4.700 -8.917 -9.956 1.00 0.00 C ATOM 195 OG SER A 11 -3.310 -9.042 -10.268 1.00 0.00 O ATOM 0 H SER A 11 -3.365 -7.934 -8.189 1.00 0.00 H new ATOM 0 HA SER A 11 -4.830 -6.732 -10.113 1.00 0.00 H new ATOM 0 HB2 SER A 11 -4.982 -9.679 -9.229 1.00 0.00 H new ATOM 0 HB3 SER A 11 -5.294 -9.096 -10.852 1.00 0.00 H new ATOM 0 HG SER A 11 -3.134 -9.939 -10.622 1.00 0.00 H new ATOM 201 N ALA A 12 -6.942 -8.081 -8.008 1.00 0.00 N ATOM 202 CA ALA A 12 -8.345 -8.116 -7.571 1.00 0.00 C ATOM 203 C ALA A 12 -8.646 -7.292 -6.317 1.00 0.00 C ATOM 204 O ALA A 12 -9.771 -6.827 -6.148 1.00 0.00 O ATOM 205 CB ALA A 12 -8.745 -9.575 -7.342 1.00 0.00 C ATOM 0 H ALA A 12 -6.314 -8.595 -7.390 1.00 0.00 H new ATOM 0 HA ALA A 12 -8.932 -7.654 -8.365 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -9.784 -9.621 -7.017 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -8.631 -10.134 -8.271 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -8.105 -10.012 -6.575 1.00 0.00 H new ATOM 211 N GLY A 13 -7.638 -7.102 -5.471 1.00 0.00 N ATOM 212 CA GLY A 13 -7.768 -6.419 -4.176 1.00 0.00 C ATOM 213 C GLY A 13 -8.381 -7.289 -3.076 1.00 0.00 C ATOM 214 O GLY A 13 -9.101 -6.771 -2.224 1.00 0.00 O ATOM 0 H GLY A 13 -6.689 -7.422 -5.664 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.783 -6.082 -3.853 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -8.382 -5.528 -4.306 1.00 0.00 H new ATOM 218 N MET A 14 -7.998 -8.561 -3.023 1.00 0.00 N ATOM 219 CA MET A 14 -8.573 -9.511 -2.059 1.00 0.00 C ATOM 220 C MET A 14 -7.619 -9.996 -0.965 1.00 0.00 C ATOM 221 O MET A 14 -7.896 -9.761 0.210 1.00 0.00 O ATOM 222 CB MET A 14 -9.217 -10.712 -2.755 1.00 0.00 C ATOM 223 CG MET A 14 -10.430 -10.343 -3.612 1.00 0.00 C ATOM 224 SD MET A 14 -11.520 -11.760 -4.002 1.00 0.00 S ATOM 225 CE MET A 14 -10.454 -12.843 -4.929 1.00 0.00 C ATOM 0 H MET A 14 -7.290 -8.965 -3.636 1.00 0.00 H new ATOM 0 HA MET A 14 -9.337 -8.924 -1.550 1.00 0.00 H new ATOM 0 HB2 MET A 14 -8.472 -11.199 -3.384 1.00 0.00 H new ATOM 0 HB3 MET A 14 -9.522 -11.438 -2.001 1.00 0.00 H new ATOM 0 HG2 MET A 14 -11.012 -9.582 -3.092 1.00 0.00 H new ATOM 0 HG3 MET A 14 -10.082 -9.897 -4.544 1.00 0.00 H new ATOM 0 HE1 MET A 14 -11.007 -13.736 -5.219 1.00 0.00 H new ATOM 0 HE2 MET A 14 -10.101 -12.328 -5.823 1.00 0.00 H new ATOM 0 HE3 MET A 14 -9.601 -13.128 -4.313 1.00 0.00 H new ATOM 235 N SER A 15 -6.492 -10.605 -1.324 1.00 0.00 N ATOM 236 CA SER A 15 -5.531 -11.176 -0.368 1.00 0.00 C ATOM 237 C SER A 15 -4.934 -10.154 0.603 1.00 0.00 C ATOM 238 O SER A 15 -4.654 -10.461 1.760 1.00 0.00 O ATOM 239 CB SER A 15 -4.380 -11.858 -1.110 1.00 0.00 C ATOM 240 OG SER A 15 -3.674 -10.875 -1.870 1.00 0.00 O ATOM 0 H SER A 15 -6.212 -10.720 -2.298 1.00 0.00 H new ATOM 0 HA SER A 15 -6.105 -11.892 0.220 1.00 0.00 H new ATOM 0 HB2 SER A 15 -3.708 -12.341 -0.401 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.764 -12.638 -1.767 1.00 0.00 H new ATOM 0 HG SER A 15 -2.933 -11.302 -2.349 1.00 0.00 H new ATOM 246 N THR A 16 -4.834 -8.913 0.135 1.00 0.00 N ATOM 247 CA THR A 16 -4.344 -7.745 0.882 1.00 0.00 C ATOM 248 C THR A 16 -5.172 -7.392 2.118 1.00 0.00 C ATOM 249 O THR A 16 -4.616 -6.896 3.098 1.00 0.00 O ATOM 250 CB THR A 16 -4.339 -6.523 -0.040 1.00 0.00 C ATOM 251 OG1 THR A 16 -5.605 -6.484 -0.703 1.00 0.00 O ATOM 252 CG2 THR A 16 -3.166 -6.533 -1.023 1.00 0.00 C ATOM 0 H THR A 16 -5.104 -8.677 -0.820 1.00 0.00 H new ATOM 0 HA THR A 16 -3.346 -8.014 1.228 1.00 0.00 H new ATOM 0 HB THR A 16 -4.196 -5.616 0.548 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.581 -5.811 -1.415 1.00 0.00 H new ATOM 0 HG21 THR A 16 -3.211 -5.644 -1.652 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.227 -6.538 -0.469 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.223 -7.424 -1.649 1.00 0.00 H new ATOM 260 N SER A 17 -6.448 -7.766 2.139 1.00 0.00 N ATOM 261 CA SER A 17 -7.416 -7.355 3.166 1.00 0.00 C ATOM 262 C SER A 17 -7.023 -7.672 4.610 1.00 0.00 C ATOM 263 O SER A 17 -7.209 -6.847 5.504 1.00 0.00 O ATOM 264 CB SER A 17 -8.782 -7.981 2.880 1.00 0.00 C ATOM 265 OG SER A 17 -8.712 -9.396 3.067 1.00 0.00 O ATOM 0 H SER A 17 -6.852 -8.377 1.429 1.00 0.00 H new ATOM 0 HA SER A 17 -7.443 -6.268 3.095 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.535 -7.554 3.543 1.00 0.00 H new ATOM 0 HB3 SER A 17 -9.090 -7.754 1.859 1.00 0.00 H new ATOM 0 HG SER A 17 -8.446 -9.824 2.227 1.00 0.00 H new ATOM 271 N LEU A 18 -6.450 -8.852 4.831 1.00 0.00 N ATOM 272 CA LEU A 18 -5.993 -9.277 6.162 1.00 0.00 C ATOM 273 C LEU A 18 -4.808 -8.437 6.646 1.00 0.00 C ATOM 274 O LEU A 18 -4.794 -7.962 7.780 1.00 0.00 O ATOM 275 CB LEU A 18 -5.667 -10.771 6.203 1.00 0.00 C ATOM 276 CG LEU A 18 -5.121 -11.227 7.558 1.00 0.00 C ATOM 277 CD1 LEU A 18 -6.165 -11.151 8.674 1.00 0.00 C ATOM 278 CD2 LEU A 18 -4.579 -12.655 7.462 1.00 0.00 C ATOM 0 H LEU A 18 -6.287 -9.543 4.098 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.821 -9.107 6.851 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.567 -11.340 5.970 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.936 -10.999 5.427 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.316 -10.539 7.815 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.721 -11.487 9.611 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.507 -10.122 8.783 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.012 -11.790 8.424 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.194 -12.964 8.434 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.380 -13.329 7.158 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.776 -12.691 6.726 1.00 0.00 H new ATOM 290 N LEU A 19 -3.866 -8.199 5.737 1.00 0.00 N ATOM 291 CA LEU A 19 -2.725 -7.310 5.994 1.00 0.00 C ATOM 292 C LEU A 19 -3.198 -5.888 6.306 1.00 0.00 C ATOM 293 O LEU A 19 -2.831 -5.355 7.352 1.00 0.00 O ATOM 294 CB LEU A 19 -1.781 -7.333 4.790 1.00 0.00 C ATOM 295 CG LEU A 19 -0.311 -7.304 5.214 1.00 0.00 C ATOM 296 CD1 LEU A 19 0.569 -7.750 4.045 1.00 0.00 C ATOM 297 CD2 LEU A 19 0.151 -5.914 5.654 1.00 0.00 C ATOM 0 H LEU A 19 -3.867 -8.612 4.804 1.00 0.00 H new ATOM 0 HA LEU A 19 -2.183 -7.667 6.870 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.970 -8.229 4.198 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -1.990 -6.477 4.149 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.217 -7.979 6.064 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.616 -7.729 4.349 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.297 -8.764 3.751 1.00 0.00 H new ATOM 0 HD13 LEU A 19 0.422 -7.076 3.201 1.00 0.00 H new ATOM 0 HD21 LEU A 19 1.201 -5.954 5.943 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.029 -5.212 4.829 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.447 -5.584 6.503 1.00 0.00 H new ATOM 309 N VAL A 20 -4.209 -5.420 5.579 1.00 0.00 N ATOM 310 CA VAL A 20 -4.853 -4.116 5.788 1.00 0.00 C ATOM 311 C VAL A 20 -5.455 -4.048 7.193 1.00 0.00 C ATOM 312 O VAL A 20 -5.339 -3.031 7.876 1.00 0.00 O ATOM 313 CB VAL A 20 -5.934 -3.866 4.734 1.00 0.00 C ATOM 314 CG1 VAL A 20 -6.709 -2.562 4.939 1.00 0.00 C ATOM 315 CG2 VAL A 20 -5.328 -3.793 3.331 1.00 0.00 C ATOM 0 H VAL A 20 -4.617 -5.947 4.807 1.00 0.00 H new ATOM 0 HA VAL A 20 -4.096 -3.338 5.688 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.617 -4.709 4.842 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.457 -2.456 4.153 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -7.204 -2.582 5.910 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.019 -1.719 4.900 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -6.119 -3.615 2.602 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.605 -2.978 3.289 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.828 -4.734 3.101 1.00 0.00 H new ATOM 325 N SER A 21 -6.145 -5.113 7.590 1.00 0.00 N ATOM 326 CA SER A 21 -6.749 -5.228 8.926 1.00 0.00 C ATOM 327 C SER A 21 -5.724 -5.087 10.053 1.00 0.00 C ATOM 328 O SER A 21 -5.860 -4.226 10.920 1.00 0.00 O ATOM 329 CB SER A 21 -7.481 -6.566 9.052 1.00 0.00 C ATOM 330 OG SER A 21 -8.061 -6.680 10.354 1.00 0.00 O ATOM 0 H SER A 21 -6.305 -5.927 6.997 1.00 0.00 H new ATOM 0 HA SER A 21 -7.454 -4.404 9.031 1.00 0.00 H new ATOM 0 HB2 SER A 21 -8.257 -6.639 8.290 1.00 0.00 H new ATOM 0 HB3 SER A 21 -6.787 -7.388 8.880 1.00 0.00 H new ATOM 0 HG SER A 21 -8.530 -7.537 10.429 1.00 0.00 H new ATOM 336 N LYS A 22 -4.609 -5.797 9.909 1.00 0.00 N ATOM 337 CA LYS A 22 -3.472 -5.721 10.839 1.00 0.00 C ATOM 338 C LYS A 22 -2.798 -4.347 10.854 1.00 0.00 C ATOM 339 O LYS A 22 -2.381 -3.875 11.910 1.00 0.00 O ATOM 340 CB LYS A 22 -2.422 -6.784 10.512 1.00 0.00 C ATOM 341 CG LYS A 22 -2.903 -8.206 10.810 1.00 0.00 C ATOM 342 CD LYS A 22 -1.794 -9.205 10.478 1.00 0.00 C ATOM 343 CE LYS A 22 -2.140 -10.643 10.871 1.00 0.00 C ATOM 344 NZ LYS A 22 -2.154 -10.789 12.333 1.00 0.00 N ATOM 0 H LYS A 22 -4.462 -6.449 9.139 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.891 -5.900 11.829 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -2.153 -6.710 9.458 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -1.518 -6.584 11.087 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -3.182 -8.293 11.860 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -3.794 -8.429 10.224 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.588 -9.167 9.408 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.879 -8.906 10.989 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.114 -10.913 10.464 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.412 -11.329 10.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.239 -11.796 12.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -1.271 -10.408 12.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -2.963 -10.267 12.726 1.00 0.00 H new ATOM 358 N MET A 23 -2.738 -3.720 9.683 1.00 0.00 N ATOM 359 CA MET A 23 -2.241 -2.350 9.491 1.00 0.00 C ATOM 360 C MET A 23 -3.089 -1.335 10.259 1.00 0.00 C ATOM 361 O MET A 23 -2.555 -0.558 11.049 1.00 0.00 O ATOM 362 CB MET A 23 -2.264 -1.950 8.015 1.00 0.00 C ATOM 363 CG MET A 23 -1.169 -2.606 7.171 1.00 0.00 C ATOM 364 SD MET A 23 0.412 -1.686 7.225 1.00 0.00 S ATOM 365 CE MET A 23 0.126 -0.367 6.064 1.00 0.00 C ATOM 0 H MET A 23 -3.041 -4.158 8.813 1.00 0.00 H new ATOM 0 HA MET A 23 -1.217 -2.342 9.866 1.00 0.00 H new ATOM 0 HB2 MET A 23 -3.236 -2.209 7.595 1.00 0.00 H new ATOM 0 HB3 MET A 23 -2.164 -0.867 7.942 1.00 0.00 H new ATOM 0 HG2 MET A 23 -1.004 -3.624 7.525 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.507 -2.678 6.137 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.074 0.111 5.816 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.324 -0.771 5.158 1.00 0.00 H new ATOM 0 HE3 MET A 23 -0.546 0.368 6.507 1.00 0.00 H new ATOM 375 N ARG A 24 -4.406 -1.458 10.118 1.00 0.00 N ATOM 376 CA ARG A 24 -5.383 -0.607 10.814 1.00 0.00 C ATOM 377 C ARG A 24 -5.344 -0.809 12.330 1.00 0.00 C ATOM 378 O ARG A 24 -5.206 0.169 13.062 1.00 0.00 O ATOM 379 CB ARG A 24 -6.807 -0.853 10.310 1.00 0.00 C ATOM 380 CG ARG A 24 -7.086 -0.265 8.925 1.00 0.00 C ATOM 381 CD ARG A 24 -8.571 -0.402 8.584 1.00 0.00 C ATOM 382 NE ARG A 24 -8.923 0.148 7.267 1.00 0.00 N ATOM 383 CZ ARG A 24 -9.603 -0.490 6.305 1.00 0.00 C ATOM 384 NH1 ARG A 24 -9.961 -1.775 6.433 1.00 0.00 N ATOM 385 NH2 ARG A 24 -10.046 0.188 5.237 1.00 0.00 N ATOM 0 H ARG A 24 -4.836 -2.157 9.512 1.00 0.00 H new ATOM 0 HA ARG A 24 -5.099 0.422 10.592 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -6.991 -1.927 10.282 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -7.513 -0.427 11.023 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -6.795 0.785 8.902 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.484 -0.779 8.175 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.847 -1.456 8.614 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -9.160 0.104 9.349 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.622 1.102 7.067 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.716 -2.291 7.278 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -10.478 -2.237 5.685 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.865 1.189 5.157 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.564 -0.297 4.504 1.00 0.00 H new ATOM 399 N ALA A 25 -5.164 -2.057 12.755 1.00 0.00 N ATOM 400 CA ALA A 25 -5.085 -2.403 14.182 1.00 0.00 C ATOM 401 C ALA A 25 -3.826 -1.869 14.869 1.00 0.00 C ATOM 402 O ALA A 25 -3.869 -1.402 16.006 1.00 0.00 O ATOM 403 CB ALA A 25 -5.162 -3.926 14.300 1.00 0.00 C ATOM 0 H ALA A 25 -5.069 -2.856 12.129 1.00 0.00 H new ATOM 0 HA ALA A 25 -5.918 -1.926 14.697 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.106 -4.213 15.350 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -6.104 -4.276 13.878 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -4.331 -4.376 13.756 1.00 0.00 H new ATOM 409 N GLN A 26 -2.692 -1.963 14.180 1.00 0.00 N ATOM 410 CA GLN A 26 -1.427 -1.371 14.639 1.00 0.00 C ATOM 411 C GLN A 26 -1.450 0.158 14.588 1.00 0.00 C ATOM 412 O GLN A 26 -0.879 0.802 15.467 1.00 0.00 O ATOM 413 CB GLN A 26 -0.248 -1.900 13.820 1.00 0.00 C ATOM 414 CG GLN A 26 0.174 -3.334 14.145 1.00 0.00 C ATOM 415 CD GLN A 26 1.058 -3.483 15.385 1.00 0.00 C ATOM 416 OE1 GLN A 26 0.895 -2.869 16.437 1.00 0.00 O ATOM 417 NE2 GLN A 26 2.036 -4.384 15.365 1.00 0.00 N ATOM 0 H GLN A 26 -2.618 -2.451 13.287 1.00 0.00 H new ATOM 0 HA GLN A 26 -1.303 -1.668 15.681 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.506 -1.844 12.762 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.607 -1.242 13.975 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -0.723 -3.938 14.282 1.00 0.00 H new ATOM 0 HG3 GLN A 26 0.706 -3.743 13.286 1.00 0.00 H new ATOM 0 HE21 GLN A 26 2.216 -4.923 14.518 1.00 0.00 H new ATOM 0 HE22 GLN A 26 2.606 -4.536 16.197 1.00 0.00 H new ATOM 426 N ALA A 27 -2.201 0.707 13.638 1.00 0.00 N ATOM 427 CA ALA A 27 -2.448 2.152 13.538 1.00 0.00 C ATOM 428 C ALA A 27 -3.257 2.657 14.734 1.00 0.00 C ATOM 429 O ALA A 27 -2.879 3.675 15.312 1.00 0.00 O ATOM 430 CB ALA A 27 -3.189 2.480 12.241 1.00 0.00 C ATOM 0 H ALA A 27 -2.661 0.163 12.908 1.00 0.00 H new ATOM 0 HA ALA A 27 -1.481 2.654 13.536 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -3.364 3.554 12.183 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -2.588 2.164 11.389 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -4.145 1.956 12.225 1.00 0.00 H new ATOM 436 N GLU A 28 -4.246 1.882 15.172 1.00 0.00 N ATOM 437 CA GLU A 28 -5.056 2.188 16.360 1.00 0.00 C ATOM 438 C GLU A 28 -4.240 2.075 17.649 1.00 0.00 C ATOM 439 O GLU A 28 -4.238 2.986 18.476 1.00 0.00 O ATOM 440 CB GLU A 28 -6.239 1.220 16.431 1.00 0.00 C ATOM 441 CG GLU A 28 -7.323 1.525 15.394 1.00 0.00 C ATOM 442 CD GLU A 28 -8.485 0.532 15.468 1.00 0.00 C ATOM 443 OE1 GLU A 28 -9.413 0.797 16.263 1.00 0.00 O ATOM 444 OE2 GLU A 28 -8.455 -0.428 14.668 1.00 0.00 O ATOM 0 H GLU A 28 -4.515 1.013 14.711 1.00 0.00 H new ATOM 0 HA GLU A 28 -5.406 3.216 16.269 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.878 0.202 16.283 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.676 1.261 17.429 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.700 2.536 15.550 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -6.887 1.498 14.395 1.00 0.00 H new ATOM 451 N LYS A 29 -3.413 1.034 17.708 1.00 0.00 N ATOM 452 CA LYS A 29 -2.532 0.744 18.849 1.00 0.00 C ATOM 453 C LYS A 29 -1.547 1.877 19.144 1.00 0.00 C ATOM 454 O LYS A 29 -1.214 2.127 20.301 1.00 0.00 O ATOM 455 CB LYS A 29 -1.785 -0.558 18.554 1.00 0.00 C ATOM 456 CG LYS A 29 -0.939 -1.014 19.744 1.00 0.00 C ATOM 457 CD LYS A 29 -0.123 -2.262 19.402 1.00 0.00 C ATOM 458 CE LYS A 29 0.865 -2.608 20.517 1.00 0.00 C ATOM 459 NZ LYS A 29 1.706 -3.713 20.031 1.00 0.00 N ATOM 0 H LYS A 29 -3.331 0.353 16.953 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.146 0.644 19.744 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -2.502 -1.338 18.299 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.143 -0.419 17.684 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -0.268 -0.210 20.045 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -1.588 -1.223 20.595 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -0.795 -3.104 19.236 1.00 0.00 H new ATOM 0 HD3 LYS A 29 0.420 -2.099 18.471 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.477 -1.742 20.770 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.334 -2.899 21.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.910 -4.365 20.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.205 -4.225 19.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.598 -3.332 19.657 1.00 0.00 H new ATOM 473 N TYR A 30 -0.980 2.435 18.077 1.00 0.00 N ATOM 474 CA TYR A 30 0.030 3.497 18.173 1.00 0.00 C ATOM 475 C TYR A 30 -0.467 4.870 17.716 1.00 0.00 C ATOM 476 O TYR A 30 0.341 5.719 17.340 1.00 0.00 O ATOM 477 CB TYR A 30 1.255 3.078 17.356 1.00 0.00 C ATOM 478 CG TYR A 30 1.982 1.843 17.889 1.00 0.00 C ATOM 479 CD1 TYR A 30 2.634 1.871 19.116 1.00 0.00 C ATOM 480 CD2 TYR A 30 2.017 0.715 17.076 1.00 0.00 C ATOM 481 CE1 TYR A 30 3.341 0.751 19.540 1.00 0.00 C ATOM 482 CE2 TYR A 30 2.732 -0.402 17.490 1.00 0.00 C ATOM 483 CZ TYR A 30 3.373 -0.373 18.722 1.00 0.00 C ATOM 484 OH TYR A 30 3.884 -1.551 19.170 1.00 0.00 O ATOM 0 H TYR A 30 -1.205 2.167 17.119 1.00 0.00 H new ATOM 0 HA TYR A 30 0.279 3.614 19.228 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.943 2.885 16.330 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.957 3.911 17.324 1.00 0.00 H new ATOM 0 HD1 TYR A 30 2.592 2.755 19.735 1.00 0.00 H new ATOM 0 HD2 TYR A 30 1.493 0.707 16.132 1.00 0.00 H new ATOM 0 HE1 TYR A 30 3.857 0.754 20.489 1.00 0.00 H new ATOM 0 HE2 TYR A 30 2.789 -1.280 16.863 1.00 0.00 H new ATOM 0 HH TYR A 30 3.822 -2.225 18.461 1.00 0.00 H new ATOM 494 N GLU A 31 -1.777 5.082 17.810 1.00 0.00 N ATOM 495 CA GLU A 31 -2.524 6.228 17.273 1.00 0.00 C ATOM 496 C GLU A 31 -1.846 6.966 16.117 1.00 0.00 C ATOM 497 O GLU A 31 -1.379 8.103 16.174 1.00 0.00 O ATOM 498 CB GLU A 31 -3.021 7.171 18.371 1.00 0.00 C ATOM 499 CG GLU A 31 -1.928 7.751 19.272 1.00 0.00 C ATOM 500 CD GLU A 31 -2.498 8.872 20.146 1.00 0.00 C ATOM 501 OE1 GLU A 31 -2.626 10.001 19.625 1.00 0.00 O ATOM 502 OE2 GLU A 31 -2.845 8.571 21.308 1.00 0.00 O ATOM 0 H GLU A 31 -2.387 4.421 18.291 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.405 5.780 16.813 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -3.561 7.995 17.904 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.736 6.634 18.994 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.512 6.965 19.902 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.111 8.136 18.662 1.00 0.00 H new ATOM 509 N VAL A 32 -1.791 6.234 15.008 1.00 0.00 N ATOM 510 CA VAL A 32 -1.215 6.689 13.734 1.00 0.00 C ATOM 511 C VAL A 32 -2.389 7.149 12.867 1.00 0.00 C ATOM 512 O VAL A 32 -3.156 6.315 12.390 1.00 0.00 O ATOM 513 CB VAL A 32 -0.417 5.574 13.055 1.00 0.00 C ATOM 514 CG1 VAL A 32 0.317 6.087 11.815 1.00 0.00 C ATOM 515 CG2 VAL A 32 0.619 4.933 13.981 1.00 0.00 C ATOM 0 H VAL A 32 -2.154 5.282 14.963 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.510 7.505 13.893 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.157 4.823 12.778 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.874 5.269 11.357 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.407 6.478 11.100 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.008 6.880 12.103 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.153 4.150 13.443 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.327 5.691 14.315 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.116 4.501 14.846 1.00 0.00 H new ATOM 525 N PRO A 33 -2.550 8.454 12.668 1.00 0.00 N ATOM 526 CA PRO A 33 -3.692 8.997 11.917 1.00 0.00 C ATOM 527 C PRO A 33 -3.555 8.792 10.408 1.00 0.00 C ATOM 528 O PRO A 33 -3.072 9.632 9.650 1.00 0.00 O ATOM 529 CB PRO A 33 -3.761 10.467 12.335 1.00 0.00 C ATOM 530 CG PRO A 33 -2.307 10.821 12.655 1.00 0.00 C ATOM 531 CD PRO A 33 -1.738 9.532 13.249 1.00 0.00 C ATOM 0 HA PRO A 33 -4.623 8.478 12.147 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -4.159 11.092 11.536 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -4.407 10.607 13.201 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -1.763 11.123 11.760 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -2.243 11.649 13.361 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.684 9.412 12.996 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -1.806 9.535 14.337 1.00 0.00 H new ATOM 539 N VAL A 34 -4.036 7.622 9.995 1.00 0.00 N ATOM 540 CA VAL A 34 -3.965 7.126 8.614 1.00 0.00 C ATOM 541 C VAL A 34 -5.219 6.370 8.170 1.00 0.00 C ATOM 542 O VAL A 34 -5.971 5.809 8.965 1.00 0.00 O ATOM 543 CB VAL A 34 -2.734 6.249 8.373 1.00 0.00 C ATOM 544 CG1 VAL A 34 -1.448 7.077 8.387 1.00 0.00 C ATOM 545 CG2 VAL A 34 -2.597 5.098 9.371 1.00 0.00 C ATOM 0 H VAL A 34 -4.501 6.970 10.627 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.886 8.027 8.006 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.886 5.813 7.386 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.593 6.424 8.213 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.493 7.833 7.603 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.340 7.565 9.355 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.703 4.520 9.139 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.517 5.500 10.381 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -3.473 4.453 9.305 1.00 0.00 H new ATOM 555 N ILE A 35 -5.416 6.445 6.856 1.00 0.00 N ATOM 556 CA ILE A 35 -6.468 5.755 6.096 1.00 0.00 C ATOM 557 C ILE A 35 -5.765 4.730 5.205 1.00 0.00 C ATOM 558 O ILE A 35 -4.969 5.075 4.333 1.00 0.00 O ATOM 559 CB ILE A 35 -7.281 6.753 5.267 1.00 0.00 C ATOM 560 CG1 ILE A 35 -7.899 7.877 6.101 1.00 0.00 C ATOM 561 CG2 ILE A 35 -8.339 6.059 4.407 1.00 0.00 C ATOM 562 CD1 ILE A 35 -8.855 7.479 7.228 1.00 0.00 C ATOM 0 H ILE A 35 -4.819 7.016 6.258 1.00 0.00 H new ATOM 0 HA ILE A 35 -7.175 5.260 6.762 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.561 7.226 4.598 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -7.086 8.456 6.539 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -8.436 8.542 5.424 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.891 6.806 3.836 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.853 5.365 3.721 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -9.028 5.511 5.050 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.215 8.375 7.733 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.701 6.932 6.811 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.330 6.846 7.943 1.00 0.00 H new ATOM 574 N ILE A 36 -5.979 3.465 5.558 1.00 0.00 N ATOM 575 CA ILE A 36 -5.328 2.340 4.871 1.00 0.00 C ATOM 576 C ILE A 36 -6.409 1.491 4.197 1.00 0.00 C ATOM 577 O ILE A 36 -7.207 0.853 4.881 1.00 0.00 O ATOM 578 CB ILE A 36 -4.491 1.494 5.830 1.00 0.00 C ATOM 579 CG1 ILE A 36 -3.623 2.363 6.743 1.00 0.00 C ATOM 580 CG2 ILE A 36 -3.615 0.530 5.027 1.00 0.00 C ATOM 581 CD1 ILE A 36 -3.246 1.689 8.064 1.00 0.00 C ATOM 0 H ILE A 36 -6.600 3.187 6.318 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.640 2.732 4.122 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.171 0.930 6.468 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.711 2.634 6.211 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.154 3.290 6.958 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.018 -0.074 5.710 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.248 -0.122 4.426 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.954 1.098 4.372 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.631 2.367 8.656 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.152 1.443 8.618 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.686 0.776 7.860 1.00 0.00 H new ATOM 593 N GLU A 37 -6.354 1.462 2.868 1.00 0.00 N ATOM 594 CA GLU A 37 -7.381 0.851 2.014 1.00 0.00 C ATOM 595 C GLU A 37 -6.781 0.209 0.761 1.00 0.00 C ATOM 596 O GLU A 37 -5.769 0.656 0.223 1.00 0.00 O ATOM 597 CB GLU A 37 -8.377 1.945 1.625 1.00 0.00 C ATOM 598 CG GLU A 37 -9.750 1.425 1.191 1.00 0.00 C ATOM 599 CD GLU A 37 -10.762 2.553 0.987 1.00 0.00 C ATOM 600 OE1 GLU A 37 -10.794 3.461 1.845 1.00 0.00 O ATOM 601 OE2 GLU A 37 -11.549 2.440 0.022 1.00 0.00 O ATOM 0 H GLU A 37 -5.582 1.869 2.340 1.00 0.00 H new ATOM 0 HA GLU A 37 -7.875 0.052 2.566 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.508 2.618 2.472 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -7.952 2.534 0.813 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.646 0.862 0.264 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -10.128 0.733 1.943 1.00 0.00 H new ATOM 608 N ALA A 38 -7.382 -0.921 0.400 1.00 0.00 N ATOM 609 CA ALA A 38 -6.970 -1.733 -0.754 1.00 0.00 C ATOM 610 C ALA A 38 -7.925 -1.630 -1.945 1.00 0.00 C ATOM 611 O ALA A 38 -9.135 -1.496 -1.770 1.00 0.00 O ATOM 612 CB ALA A 38 -6.836 -3.195 -0.325 1.00 0.00 C ATOM 0 H ALA A 38 -8.180 -1.309 0.904 1.00 0.00 H new ATOM 0 HA ALA A 38 -6.011 -1.339 -1.091 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -6.531 -3.798 -1.180 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -6.087 -3.276 0.463 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -7.795 -3.554 0.048 1.00 0.00 H new ATOM 618 N PHE A 39 -7.337 -1.696 -3.136 1.00 0.00 N ATOM 619 CA PHE A 39 -8.029 -1.577 -4.429 1.00 0.00 C ATOM 620 C PHE A 39 -7.428 -2.476 -5.511 1.00 0.00 C ATOM 621 O PHE A 39 -6.243 -2.797 -5.435 1.00 0.00 O ATOM 622 CB PHE A 39 -7.937 -0.133 -4.930 1.00 0.00 C ATOM 623 CG PHE A 39 -8.591 0.928 -4.042 1.00 0.00 C ATOM 624 CD1 PHE A 39 -9.944 1.202 -4.205 1.00 0.00 C ATOM 625 CD2 PHE A 39 -7.815 1.667 -3.157 1.00 0.00 C ATOM 626 CE1 PHE A 39 -10.527 2.242 -3.490 1.00 0.00 C ATOM 627 CE2 PHE A 39 -8.393 2.712 -2.448 1.00 0.00 C ATOM 628 CZ PHE A 39 -9.746 2.983 -2.612 1.00 0.00 C ATOM 0 H PHE A 39 -6.332 -1.838 -3.238 1.00 0.00 H new ATOM 0 HA PHE A 39 -9.060 -1.884 -4.255 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -6.884 0.122 -5.052 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -8.393 -0.083 -5.919 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -10.540 0.610 -4.884 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -6.770 1.430 -3.022 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -11.575 2.471 -3.616 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -7.796 3.309 -1.775 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.199 3.784 -2.047 1.00 0.00 H new ATOM 638 N PRO A 40 -8.205 -2.871 -6.516 1.00 0.00 N ATOM 639 CA PRO A 40 -7.663 -3.497 -7.730 1.00 0.00 C ATOM 640 C PRO A 40 -6.844 -2.537 -8.596 1.00 0.00 C ATOM 641 O PRO A 40 -7.109 -1.337 -8.660 1.00 0.00 O ATOM 642 CB PRO A 40 -8.854 -4.068 -8.502 1.00 0.00 C ATOM 643 CG PRO A 40 -10.079 -3.384 -7.894 1.00 0.00 C ATOM 644 CD PRO A 40 -9.663 -3.046 -6.461 1.00 0.00 C ATOM 0 HA PRO A 40 -6.958 -4.280 -7.449 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.772 -3.857 -9.568 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.912 -5.151 -8.395 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -10.348 -2.486 -8.450 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -10.948 -4.041 -7.910 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -10.156 -2.139 -6.111 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -9.938 -3.844 -5.772 1.00 0.00 H new ATOM 652 N GLU A 41 -5.944 -3.141 -9.365 1.00 0.00 N ATOM 653 CA GLU A 41 -4.890 -2.472 -10.141 1.00 0.00 C ATOM 654 C GLU A 41 -5.380 -1.446 -11.165 1.00 0.00 C ATOM 655 O GLU A 41 -4.753 -0.403 -11.347 1.00 0.00 O ATOM 656 CB GLU A 41 -3.980 -3.513 -10.796 1.00 0.00 C ATOM 657 CG GLU A 41 -4.414 -4.111 -12.137 1.00 0.00 C ATOM 658 CD GLU A 41 -5.615 -5.057 -12.105 1.00 0.00 C ATOM 659 OE1 GLU A 41 -6.744 -4.559 -11.908 1.00 0.00 O ATOM 660 OE2 GLU A 41 -5.377 -6.251 -12.390 1.00 0.00 O ATOM 0 H GLU A 41 -5.923 -4.155 -9.473 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.328 -1.881 -9.418 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.000 -3.057 -10.936 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.852 -4.334 -10.091 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.643 -3.291 -12.818 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.566 -4.650 -12.561 1.00 0.00 H new ATOM 667 N THR A 42 -6.562 -1.676 -11.731 1.00 0.00 N ATOM 668 CA THR A 42 -7.204 -0.805 -12.725 1.00 0.00 C ATOM 669 C THR A 42 -7.531 0.596 -12.204 1.00 0.00 C ATOM 670 O THR A 42 -7.388 1.591 -12.912 1.00 0.00 O ATOM 671 CB THR A 42 -8.429 -1.489 -13.337 1.00 0.00 C ATOM 672 OG1 THR A 42 -9.033 -0.616 -14.296 1.00 0.00 O ATOM 673 CG2 THR A 42 -9.496 -1.920 -12.330 1.00 0.00 C ATOM 0 H THR A 42 -7.121 -2.499 -11.507 1.00 0.00 H new ATOM 0 HA THR A 42 -6.467 -0.647 -13.513 1.00 0.00 H new ATOM 0 HB THR A 42 -8.052 -2.404 -13.795 1.00 0.00 H new ATOM 0 HG1 THR A 42 -9.816 -1.054 -14.689 1.00 0.00 H new ATOM 0 HG21 THR A 42 -10.324 -2.394 -12.857 1.00 0.00 H new ATOM 0 HG22 THR A 42 -9.064 -2.627 -11.622 1.00 0.00 H new ATOM 0 HG23 THR A 42 -9.862 -1.046 -11.791 1.00 0.00 H new ATOM 681 N LEU A 43 -7.682 0.695 -10.887 1.00 0.00 N ATOM 682 CA LEU A 43 -7.983 1.957 -10.197 1.00 0.00 C ATOM 683 C LEU A 43 -6.745 2.671 -9.649 1.00 0.00 C ATOM 684 O LEU A 43 -6.847 3.654 -8.917 1.00 0.00 O ATOM 685 CB LEU A 43 -8.967 1.663 -9.063 1.00 0.00 C ATOM 686 CG LEU A 43 -10.314 1.139 -9.567 1.00 0.00 C ATOM 687 CD1 LEU A 43 -11.147 0.653 -8.380 1.00 0.00 C ATOM 688 CD2 LEU A 43 -11.107 2.201 -10.332 1.00 0.00 C ATOM 0 H LEU A 43 -7.599 -0.103 -10.257 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.415 2.638 -10.931 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.527 0.930 -8.387 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.130 2.572 -8.484 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.106 0.321 -10.256 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.107 0.280 -8.738 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.615 -0.147 -7.866 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.314 1.480 -7.690 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -12.054 1.777 -10.667 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -11.301 3.051 -9.678 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.532 2.532 -11.196 1.00 0.00 H new ATOM 700 N ALA A 44 -5.585 2.245 -10.142 1.00 0.00 N ATOM 701 CA ALA A 44 -4.278 2.811 -9.777 1.00 0.00 C ATOM 702 C ALA A 44 -4.129 4.287 -10.151 1.00 0.00 C ATOM 703 O ALA A 44 -3.737 5.074 -9.291 1.00 0.00 O ATOM 704 CB ALA A 44 -3.148 2.003 -10.418 1.00 0.00 C ATOM 0 H ALA A 44 -5.520 1.484 -10.818 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.215 2.749 -8.691 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.187 2.435 -10.138 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.197 0.971 -10.071 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.254 2.026 -11.503 1.00 0.00 H new ATOM 710 N GLY A 45 -4.590 4.656 -11.343 1.00 0.00 N ATOM 711 CA GLY A 45 -4.611 6.055 -11.791 1.00 0.00 C ATOM 712 C GLY A 45 -5.526 6.892 -10.894 1.00 0.00 C ATOM 713 O GLY A 45 -5.054 7.523 -9.950 1.00 0.00 O ATOM 0 H GLY A 45 -4.960 3.998 -12.029 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.601 6.464 -11.773 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.957 6.107 -12.823 1.00 0.00 H new ATOM 717 N GLU A 46 -6.794 6.494 -10.936 1.00 0.00 N ATOM 718 CA GLU A 46 -7.906 7.268 -10.366 1.00 0.00 C ATOM 719 C GLU A 46 -7.761 7.526 -8.864 1.00 0.00 C ATOM 720 O GLU A 46 -7.692 8.663 -8.400 1.00 0.00 O ATOM 721 CB GLU A 46 -9.204 6.509 -10.649 1.00 0.00 C ATOM 722 CG GLU A 46 -10.440 7.410 -10.620 1.00 0.00 C ATOM 723 CD GLU A 46 -10.675 8.107 -11.962 1.00 0.00 C ATOM 724 OE1 GLU A 46 -9.774 8.840 -12.421 1.00 0.00 O ATOM 725 OE2 GLU A 46 -11.775 7.862 -12.501 1.00 0.00 O ATOM 0 H GLU A 46 -7.087 5.618 -11.369 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.909 8.251 -10.836 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -9.133 6.030 -11.625 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -9.322 5.715 -9.912 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -11.316 6.815 -10.363 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.323 8.160 -9.838 1.00 0.00 H new ATOM 732 N LYS A 47 -7.588 6.441 -8.114 1.00 0.00 N ATOM 733 CA LYS A 47 -7.480 6.513 -6.649 1.00 0.00 C ATOM 734 C LYS A 47 -6.075 6.872 -6.160 1.00 0.00 C ATOM 735 O LYS A 47 -5.944 7.656 -5.221 1.00 0.00 O ATOM 736 CB LYS A 47 -7.925 5.217 -5.971 1.00 0.00 C ATOM 737 CG LYS A 47 -9.370 4.803 -6.255 1.00 0.00 C ATOM 738 CD LYS A 47 -10.403 5.853 -5.841 1.00 0.00 C ATOM 739 CE LYS A 47 -11.818 5.295 -6.002 1.00 0.00 C ATOM 740 NZ LYS A 47 -12.766 6.405 -5.828 1.00 0.00 N ATOM 0 H LYS A 47 -7.519 5.496 -8.492 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.155 7.320 -6.365 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.263 4.412 -6.289 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.799 5.326 -4.894 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.478 4.600 -7.321 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.582 3.871 -5.730 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -10.237 6.149 -4.805 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -10.286 6.749 -6.451 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -11.939 4.841 -6.986 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -12.006 4.514 -5.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.738 6.051 -5.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -12.648 6.817 -4.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -12.583 7.134 -6.547 1.00 0.00 H new ATOM 754 N GLY A 48 -5.061 6.449 -6.909 1.00 0.00 N ATOM 755 CA GLY A 48 -3.650 6.744 -6.620 1.00 0.00 C ATOM 756 C GLY A 48 -3.323 8.238 -6.665 1.00 0.00 C ATOM 757 O GLY A 48 -2.435 8.714 -5.959 1.00 0.00 O ATOM 0 H GLY A 48 -5.192 5.883 -7.747 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -3.399 6.354 -5.634 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -3.021 6.220 -7.340 1.00 0.00 H new ATOM 761 N GLN A 49 -4.142 8.983 -7.403 1.00 0.00 N ATOM 762 CA GLN A 49 -4.106 10.451 -7.476 1.00 0.00 C ATOM 763 C GLN A 49 -4.283 11.145 -6.125 1.00 0.00 C ATOM 764 O GLN A 49 -3.667 12.177 -5.864 1.00 0.00 O ATOM 765 CB GLN A 49 -5.203 10.928 -8.429 1.00 0.00 C ATOM 766 CG GLN A 49 -4.774 10.697 -9.880 1.00 0.00 C ATOM 767 CD GLN A 49 -5.954 10.784 -10.850 1.00 0.00 C ATOM 768 OE1 GLN A 49 -6.936 11.496 -10.645 1.00 0.00 O ATOM 769 NE2 GLN A 49 -5.844 10.098 -11.985 1.00 0.00 N ATOM 0 H GLN A 49 -4.873 8.575 -7.986 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.113 10.721 -7.835 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -6.130 10.393 -8.226 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -5.404 11.987 -8.265 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -4.022 11.436 -10.157 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -4.305 9.717 -9.967 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.027 9.510 -12.148 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -6.577 10.161 -12.692 1.00 0.00 H new ATOM 778 N ASN A 50 -5.012 10.477 -5.234 1.00 0.00 N ATOM 779 CA ASN A 50 -5.247 10.939 -3.858 1.00 0.00 C ATOM 780 C ASN A 50 -4.657 9.984 -2.818 1.00 0.00 C ATOM 781 O ASN A 50 -5.175 9.814 -1.717 1.00 0.00 O ATOM 782 CB ASN A 50 -6.752 11.130 -3.659 1.00 0.00 C ATOM 783 CG ASN A 50 -7.291 12.255 -4.543 1.00 0.00 C ATOM 784 OD1 ASN A 50 -6.887 13.413 -4.446 1.00 0.00 O ATOM 785 ND2 ASN A 50 -8.171 11.950 -5.493 1.00 0.00 N ATOM 0 H ASN A 50 -5.464 9.587 -5.445 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.735 11.890 -3.711 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -7.272 10.201 -3.891 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.957 11.357 -2.613 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -8.504 12.673 -6.131 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -8.513 10.993 -5.583 1.00 0.00 H new ATOM 792 N ALA A 51 -3.540 9.372 -3.201 1.00 0.00 N ATOM 793 CA ALA A 51 -2.699 8.598 -2.276 1.00 0.00 C ATOM 794 C ALA A 51 -1.389 9.334 -1.987 1.00 0.00 C ATOM 795 O ALA A 51 -0.817 9.987 -2.859 1.00 0.00 O ATOM 796 CB ALA A 51 -2.385 7.220 -2.862 1.00 0.00 C ATOM 0 H ALA A 51 -3.188 9.395 -4.158 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.253 8.477 -1.345 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.762 6.661 -2.164 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -3.315 6.677 -3.033 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.855 7.339 -3.807 1.00 0.00 H new ATOM 802 N ASP A 52 -1.039 9.313 -0.704 1.00 0.00 N ATOM 803 CA ASP A 52 0.238 9.827 -0.188 1.00 0.00 C ATOM 804 C ASP A 52 1.363 8.811 -0.392 1.00 0.00 C ATOM 805 O ASP A 52 2.522 9.206 -0.509 1.00 0.00 O ATOM 806 CB ASP A 52 0.144 10.208 1.291 1.00 0.00 C ATOM 807 CG ASP A 52 -0.806 11.382 1.535 1.00 0.00 C ATOM 808 OD1 ASP A 52 -0.328 12.534 1.436 1.00 0.00 O ATOM 809 OD2 ASP A 52 -1.972 11.096 1.881 1.00 0.00 O ATOM 0 H ASP A 52 -1.643 8.932 0.025 1.00 0.00 H new ATOM 0 HA ASP A 52 0.467 10.728 -0.756 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -0.195 9.345 1.864 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.137 10.465 1.660 1.00 0.00 H new ATOM 814 N VAL A 53 1.016 7.527 -0.382 1.00 0.00 N ATOM 815 CA VAL A 53 1.871 6.458 -0.920 1.00 0.00 C ATOM 816 C VAL A 53 0.997 5.347 -1.505 1.00 0.00 C ATOM 817 O VAL A 53 -0.080 5.020 -1.010 1.00 0.00 O ATOM 818 CB VAL A 53 2.873 5.951 0.119 1.00 0.00 C ATOM 819 CG1 VAL A 53 2.207 5.230 1.292 1.00 0.00 C ATOM 820 CG2 VAL A 53 3.941 5.072 -0.536 1.00 0.00 C ATOM 0 H VAL A 53 0.132 7.191 -0.000 1.00 0.00 H new ATOM 0 HA VAL A 53 2.479 6.862 -1.729 1.00 0.00 H new ATOM 0 HB VAL A 53 3.357 6.833 0.539 1.00 0.00 H new ATOM 0 HG11 VAL A 53 2.971 4.895 1.994 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.524 5.912 1.798 1.00 0.00 H new ATOM 0 HG13 VAL A 53 1.651 4.369 0.921 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.641 4.724 0.223 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.465 4.214 -1.011 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.478 5.651 -1.287 1.00 0.00 H new ATOM 830 N VAL A 54 1.480 4.877 -2.652 1.00 0.00 N ATOM 831 CA VAL A 54 0.929 3.730 -3.388 1.00 0.00 C ATOM 832 C VAL A 54 1.882 2.557 -3.153 1.00 0.00 C ATOM 833 O VAL A 54 3.089 2.635 -3.377 1.00 0.00 O ATOM 834 CB VAL A 54 0.839 4.074 -4.876 1.00 0.00 C ATOM 835 CG1 VAL A 54 0.336 2.900 -5.720 1.00 0.00 C ATOM 836 CG2 VAL A 54 -0.098 5.261 -5.112 1.00 0.00 C ATOM 0 H VAL A 54 2.290 5.292 -3.113 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.075 3.475 -3.048 1.00 0.00 H new ATOM 0 HB VAL A 54 1.855 4.323 -5.184 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.291 3.198 -6.768 1.00 0.00 H new ATOM 0 HG12 VAL A 54 1.017 2.056 -5.612 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -0.659 2.609 -5.382 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.143 5.483 -6.178 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.096 5.014 -4.751 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.277 6.133 -4.575 1.00 0.00 H new ATOM 846 N LEU A 55 1.290 1.507 -2.589 1.00 0.00 N ATOM 847 CA LEU A 55 1.996 0.246 -2.326 1.00 0.00 C ATOM 848 C LEU A 55 1.448 -0.900 -3.178 1.00 0.00 C ATOM 849 O LEU A 55 0.245 -1.045 -3.390 1.00 0.00 O ATOM 850 CB LEU A 55 1.914 -0.104 -0.838 1.00 0.00 C ATOM 851 CG LEU A 55 2.752 0.841 0.025 1.00 0.00 C ATOM 852 CD1 LEU A 55 2.339 0.676 1.489 1.00 0.00 C ATOM 853 CD2 LEU A 55 4.254 0.582 -0.103 1.00 0.00 C ATOM 0 H LEU A 55 0.312 1.501 -2.301 1.00 0.00 H new ATOM 0 HA LEU A 55 3.041 0.386 -2.602 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.874 -0.063 -0.514 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.255 -1.128 -0.688 1.00 0.00 H new ATOM 0 HG LEU A 55 2.566 1.856 -0.325 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.931 1.346 2.112 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.282 0.919 1.598 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.509 -0.354 1.801 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.799 1.281 0.531 1.00 0.00 H new ATOM 0 HD22 LEU A 55 4.475 -0.439 0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.560 0.719 -1.140 1.00 0.00 H new ATOM 865 N LEU A 56 2.405 -1.658 -3.706 1.00 0.00 N ATOM 866 CA LEU A 56 2.147 -2.784 -4.615 1.00 0.00 C ATOM 867 C LEU A 56 2.480 -4.138 -3.983 1.00 0.00 C ATOM 868 O LEU A 56 3.487 -4.302 -3.296 1.00 0.00 O ATOM 869 CB LEU A 56 3.008 -2.670 -5.875 1.00 0.00 C ATOM 870 CG LEU A 56 2.848 -1.349 -6.630 1.00 0.00 C ATOM 871 CD1 LEU A 56 3.934 -1.237 -7.703 1.00 0.00 C ATOM 872 CD2 LEU A 56 1.479 -1.232 -7.302 1.00 0.00 C ATOM 0 H LEU A 56 3.396 -1.510 -3.516 1.00 0.00 H new ATOM 0 HA LEU A 56 1.083 -2.735 -4.846 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.055 -2.792 -5.598 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.759 -3.491 -6.547 1.00 0.00 H new ATOM 0 HG LEU A 56 2.939 -0.544 -5.901 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.819 -0.296 -8.240 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.916 -1.268 -7.231 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.841 -2.068 -8.403 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.411 -0.278 -7.826 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.353 -2.047 -8.014 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.696 -1.287 -6.545 1.00 0.00 H new ATOM 884 N GLY A 57 1.605 -5.092 -4.288 1.00 0.00 N ATOM 885 CA GLY A 57 1.815 -6.523 -4.024 1.00 0.00 C ATOM 886 C GLY A 57 3.005 -7.039 -4.834 1.00 0.00 C ATOM 887 O GLY A 57 3.075 -6.731 -6.023 1.00 0.00 O ATOM 0 H GLY A 57 0.710 -4.894 -4.735 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.993 -6.682 -2.960 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.918 -7.084 -4.284 1.00 0.00 H new ATOM 891 N PRO A 58 3.893 -7.841 -4.253 1.00 0.00 N ATOM 892 CA PRO A 58 5.086 -8.337 -4.956 1.00 0.00 C ATOM 893 C PRO A 58 4.799 -9.100 -6.250 1.00 0.00 C ATOM 894 O PRO A 58 5.590 -9.070 -7.192 1.00 0.00 O ATOM 895 CB PRO A 58 5.857 -9.183 -3.941 1.00 0.00 C ATOM 896 CG PRO A 58 4.845 -9.495 -2.837 1.00 0.00 C ATOM 897 CD PRO A 58 3.893 -8.298 -2.856 1.00 0.00 C ATOM 0 HA PRO A 58 5.673 -7.488 -5.307 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.238 -10.097 -4.397 1.00 0.00 H new ATOM 0 HB3 PRO A 58 6.717 -8.641 -3.547 1.00 0.00 H new ATOM 0 HG2 PRO A 58 4.316 -10.428 -3.033 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.332 -9.602 -1.868 1.00 0.00 H new ATOM 0 HD2 PRO A 58 2.892 -8.584 -2.533 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.233 -7.511 -2.182 1.00 0.00 H new ATOM 905 N GLN A 59 3.600 -9.666 -6.355 1.00 0.00 N ATOM 906 CA GLN A 59 3.071 -10.335 -7.553 1.00 0.00 C ATOM 907 C GLN A 59 2.854 -9.425 -8.763 1.00 0.00 C ATOM 908 O GLN A 59 3.085 -9.844 -9.896 1.00 0.00 O ATOM 909 CB GLN A 59 1.783 -11.103 -7.256 1.00 0.00 C ATOM 910 CG GLN A 59 0.703 -10.348 -6.478 1.00 0.00 C ATOM 911 CD GLN A 59 0.843 -10.495 -4.961 1.00 0.00 C ATOM 912 OE1 GLN A 59 1.924 -10.558 -4.377 1.00 0.00 O ATOM 913 NE2 GLN A 59 -0.283 -10.456 -4.253 1.00 0.00 N ATOM 0 H GLN A 59 2.938 -9.675 -5.579 1.00 0.00 H new ATOM 0 HA GLN A 59 3.864 -11.030 -7.829 1.00 0.00 H new ATOM 0 HB2 GLN A 59 1.355 -11.431 -8.203 1.00 0.00 H new ATOM 0 HB3 GLN A 59 2.043 -12.001 -6.696 1.00 0.00 H new ATOM 0 HG2 GLN A 59 0.747 -9.291 -6.740 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.278 -10.712 -6.783 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.183 -10.404 -4.729 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -0.246 -10.478 -3.234 1.00 0.00 H new ATOM 922 N ILE A 60 2.556 -8.153 -8.515 1.00 0.00 N ATOM 923 CA ILE A 60 2.415 -7.164 -9.594 1.00 0.00 C ATOM 924 C ILE A 60 3.547 -6.135 -9.581 1.00 0.00 C ATOM 925 O ILE A 60 3.503 -5.115 -10.268 1.00 0.00 O ATOM 926 CB ILE A 60 1.048 -6.476 -9.608 1.00 0.00 C ATOM 927 CG1 ILE A 60 0.766 -5.665 -8.341 1.00 0.00 C ATOM 928 CG2 ILE A 60 -0.051 -7.507 -9.877 1.00 0.00 C ATOM 929 CD1 ILE A 60 -0.211 -4.517 -8.601 1.00 0.00 C ATOM 0 H ILE A 60 2.406 -7.777 -7.579 1.00 0.00 H new ATOM 0 HA ILE A 60 2.488 -7.733 -10.521 1.00 0.00 H new ATOM 0 HB ILE A 60 1.059 -5.748 -10.419 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.357 -6.322 -7.573 1.00 0.00 H new ATOM 0 HG13 ILE A 60 1.702 -5.264 -7.952 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -1.021 -7.011 -9.886 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.123 -7.981 -10.843 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.038 -8.265 -9.094 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.382 -3.968 -7.675 1.00 0.00 H new ATOM 0 HD12 ILE A 60 0.209 -3.844 -9.349 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.157 -4.919 -8.965 1.00 0.00 H new ATOM 941 N ALA A 61 4.660 -6.528 -8.968 1.00 0.00 N ATOM 942 CA ALA A 61 5.864 -5.693 -8.842 1.00 0.00 C ATOM 943 C ALA A 61 6.551 -5.409 -10.179 1.00 0.00 C ATOM 944 O ALA A 61 7.136 -4.343 -10.360 1.00 0.00 O ATOM 945 CB ALA A 61 6.866 -6.381 -7.913 1.00 0.00 C ATOM 0 H ALA A 61 4.758 -7.447 -8.537 1.00 0.00 H new ATOM 0 HA ALA A 61 5.536 -4.736 -8.437 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.759 -5.763 -7.819 1.00 0.00 H new ATOM 0 HB2 ALA A 61 6.415 -6.519 -6.930 1.00 0.00 H new ATOM 0 HB3 ALA A 61 7.139 -7.352 -8.327 1.00 0.00 H new ATOM 951 N TYR A 62 6.413 -6.340 -11.119 1.00 0.00 N ATOM 952 CA TYR A 62 6.902 -6.144 -12.491 1.00 0.00 C ATOM 953 C TYR A 62 6.249 -4.954 -13.196 1.00 0.00 C ATOM 954 O TYR A 62 6.884 -4.326 -14.041 1.00 0.00 O ATOM 955 CB TYR A 62 6.752 -7.428 -13.310 1.00 0.00 C ATOM 956 CG TYR A 62 5.328 -7.771 -13.751 1.00 0.00 C ATOM 957 CD1 TYR A 62 4.410 -8.274 -12.836 1.00 0.00 C ATOM 958 CD2 TYR A 62 4.998 -7.583 -15.088 1.00 0.00 C ATOM 959 CE1 TYR A 62 3.124 -8.585 -13.265 1.00 0.00 C ATOM 960 CE2 TYR A 62 3.722 -7.918 -15.527 1.00 0.00 C ATOM 961 CZ TYR A 62 2.803 -8.407 -14.607 1.00 0.00 C ATOM 962 OH TYR A 62 1.586 -8.809 -15.061 1.00 0.00 O ATOM 0 H TYR A 62 5.966 -7.243 -10.960 1.00 0.00 H new ATOM 0 HA TYR A 62 7.962 -5.904 -12.414 1.00 0.00 H new ATOM 0 HB2 TYR A 62 7.378 -7.346 -14.199 1.00 0.00 H new ATOM 0 HB3 TYR A 62 7.141 -8.260 -12.722 1.00 0.00 H new ATOM 0 HD1 TYR A 62 4.692 -8.422 -11.804 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.725 -7.181 -15.778 1.00 0.00 H new ATOM 0 HE1 TYR A 62 2.388 -8.958 -12.569 1.00 0.00 H new ATOM 0 HE2 TYR A 62 3.450 -7.800 -16.565 1.00 0.00 H new ATOM 0 HH TYR A 62 1.514 -8.615 -16.019 1.00 0.00 H new ATOM 972 N MET A 63 5.049 -4.577 -12.762 1.00 0.00 N ATOM 973 CA MET A 63 4.343 -3.395 -13.278 1.00 0.00 C ATOM 974 C MET A 63 4.673 -2.099 -12.535 1.00 0.00 C ATOM 975 O MET A 63 4.086 -1.066 -12.854 1.00 0.00 O ATOM 976 CB MET A 63 2.836 -3.655 -13.231 1.00 0.00 C ATOM 977 CG MET A 63 2.372 -4.657 -14.291 1.00 0.00 C ATOM 978 SD MET A 63 0.582 -4.592 -14.663 1.00 0.00 S ATOM 979 CE MET A 63 -0.158 -5.011 -13.100 1.00 0.00 C ATOM 0 H MET A 63 4.533 -5.080 -12.041 1.00 0.00 H new ATOM 0 HA MET A 63 4.684 -3.245 -14.302 1.00 0.00 H new ATOM 0 HB2 MET A 63 2.567 -4.028 -12.243 1.00 0.00 H new ATOM 0 HB3 MET A 63 2.305 -2.713 -13.371 1.00 0.00 H new ATOM 0 HG2 MET A 63 2.928 -4.477 -15.211 1.00 0.00 H new ATOM 0 HG3 MET A 63 2.625 -5.663 -13.957 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.244 -5.005 -13.198 1.00 0.00 H new ATOM 0 HE2 MET A 63 0.173 -6.004 -12.795 1.00 0.00 H new ATOM 0 HE3 MET A 63 0.143 -4.282 -12.348 1.00 0.00 H new ATOM 989 N LEU A 64 5.689 -2.082 -11.676 1.00 0.00 N ATOM 990 CA LEU A 64 6.184 -0.845 -11.057 1.00 0.00 C ATOM 991 C LEU A 64 6.515 0.236 -12.089 1.00 0.00 C ATOM 992 O LEU A 64 5.867 1.276 -11.976 1.00 0.00 O ATOM 993 CB LEU A 64 7.312 -1.152 -10.071 1.00 0.00 C ATOM 994 CG LEU A 64 7.924 0.136 -9.517 1.00 0.00 C ATOM 995 CD1 LEU A 64 7.069 0.746 -8.404 1.00 0.00 C ATOM 996 CD2 LEU A 64 9.360 -0.078 -9.036 1.00 0.00 C ATOM 0 H LEU A 64 6.194 -2.920 -11.387 1.00 0.00 H new ATOM 0 HA LEU A 64 5.379 -0.406 -10.468 1.00 0.00 H new ATOM 0 HB2 LEU A 64 6.927 -1.758 -9.251 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.083 -1.741 -10.568 1.00 0.00 H new ATOM 0 HG LEU A 64 7.948 0.846 -10.344 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.542 1.658 -8.041 1.00 0.00 H new ATOM 0 HD12 LEU A 64 6.078 0.981 -8.793 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.977 0.034 -7.584 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.758 0.860 -8.650 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.371 -0.829 -8.246 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.976 -0.418 -9.869 1.00 0.00 H new ATOM 1008 N PRO A 65 7.242 -0.013 -13.174 1.00 0.00 N ATOM 1009 CA PRO A 65 7.436 0.984 -14.236 1.00 0.00 C ATOM 1010 C PRO A 65 6.136 1.536 -14.825 1.00 0.00 C ATOM 1011 O PRO A 65 6.029 2.748 -15.000 1.00 0.00 O ATOM 1012 CB PRO A 65 8.236 0.279 -15.334 1.00 0.00 C ATOM 1013 CG PRO A 65 9.019 -0.795 -14.575 1.00 0.00 C ATOM 1014 CD PRO A 65 8.059 -1.202 -13.455 1.00 0.00 C ATOM 0 HA PRO A 65 7.946 1.850 -13.814 1.00 0.00 H new ATOM 0 HB2 PRO A 65 7.582 -0.159 -16.088 1.00 0.00 H new ATOM 0 HB3 PRO A 65 8.901 0.970 -15.852 1.00 0.00 H new ATOM 0 HG2 PRO A 65 9.270 -1.639 -15.217 1.00 0.00 H new ATOM 0 HG3 PRO A 65 9.957 -0.405 -14.180 1.00 0.00 H new ATOM 0 HD2 PRO A 65 7.435 -2.042 -13.761 1.00 0.00 H new ATOM 0 HD3 PRO A 65 8.606 -1.519 -12.567 1.00 0.00 H new ATOM 1022 N GLU A 66 5.109 0.697 -14.924 1.00 0.00 N ATOM 1023 CA GLU A 66 3.828 1.069 -15.544 1.00 0.00 C ATOM 1024 C GLU A 66 2.938 1.898 -14.616 1.00 0.00 C ATOM 1025 O GLU A 66 2.403 2.939 -14.991 1.00 0.00 O ATOM 1026 CB GLU A 66 3.110 -0.211 -15.973 1.00 0.00 C ATOM 1027 CG GLU A 66 2.011 0.037 -17.009 1.00 0.00 C ATOM 1028 CD GLU A 66 2.559 0.503 -18.360 1.00 0.00 C ATOM 1029 OE1 GLU A 66 2.993 -0.387 -19.122 1.00 0.00 O ATOM 1030 OE2 GLU A 66 2.475 1.719 -18.639 1.00 0.00 O ATOM 0 H GLU A 66 5.135 -0.262 -14.578 1.00 0.00 H new ATOM 0 HA GLU A 66 4.036 1.702 -16.407 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.839 -0.909 -16.385 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.673 -0.687 -15.095 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.440 -0.880 -17.151 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.320 0.787 -16.625 1.00 0.00 H new ATOM 1037 N ILE A 67 2.904 1.507 -13.344 1.00 0.00 N ATOM 1038 CA ILE A 67 2.176 2.213 -12.280 1.00 0.00 C ATOM 1039 C ILE A 67 2.836 3.571 -12.034 1.00 0.00 C ATOM 1040 O ILE A 67 2.153 4.577 -11.854 1.00 0.00 O ATOM 1041 CB ILE A 67 2.157 1.367 -11.004 1.00 0.00 C ATOM 1042 CG1 ILE A 67 1.541 -0.018 -11.210 1.00 0.00 C ATOM 1043 CG2 ILE A 67 1.474 2.097 -9.845 1.00 0.00 C ATOM 1044 CD1 ILE A 67 0.090 -0.106 -11.688 1.00 0.00 C ATOM 0 H ILE A 67 3.390 0.674 -13.012 1.00 0.00 H new ATOM 0 HA ILE A 67 1.143 2.377 -12.586 1.00 0.00 H new ATOM 0 HB ILE A 67 3.203 1.212 -10.740 1.00 0.00 H new ATOM 0 HG12 ILE A 67 2.161 -0.553 -11.930 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.612 -0.557 -10.265 1.00 0.00 H new ATOM 0 HG21 ILE A 67 1.482 1.462 -8.959 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.009 3.023 -9.632 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.444 2.327 -10.117 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.198 -1.153 -11.785 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -0.562 0.384 -10.965 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -0.005 0.388 -12.655 1.00 0.00 H new ATOM 1056 N GLN A 68 4.165 3.590 -12.078 1.00 0.00 N ATOM 1057 CA GLN A 68 4.966 4.814 -11.938 1.00 0.00 C ATOM 1058 C GLN A 68 4.797 5.738 -13.145 1.00 0.00 C ATOM 1059 O GLN A 68 4.823 6.961 -13.009 1.00 0.00 O ATOM 1060 CB GLN A 68 6.431 4.397 -11.798 1.00 0.00 C ATOM 1061 CG GLN A 68 7.257 5.496 -11.126 1.00 0.00 C ATOM 1062 CD GLN A 68 8.067 4.908 -9.968 1.00 0.00 C ATOM 1063 OE1 GLN A 68 8.807 3.933 -10.083 1.00 0.00 O ATOM 1064 NE2 GLN A 68 7.916 5.514 -8.794 1.00 0.00 N ATOM 0 H GLN A 68 4.727 2.750 -12.213 1.00 0.00 H new ATOM 0 HA GLN A 68 4.632 5.369 -11.061 1.00 0.00 H new ATOM 0 HB2 GLN A 68 6.496 3.480 -11.213 1.00 0.00 H new ATOM 0 HB3 GLN A 68 6.845 4.177 -12.782 1.00 0.00 H new ATOM 0 HG2 GLN A 68 7.927 5.955 -11.853 1.00 0.00 H new ATOM 0 HG3 GLN A 68 6.599 6.283 -10.758 1.00 0.00 H new ATOM 0 HE21 GLN A 68 7.299 6.322 -8.713 1.00 0.00 H new ATOM 0 HE22 GLN A 68 8.417 5.171 -7.975 1.00 0.00 H new ATOM 1073 N ARG A 69 4.585 5.158 -14.322 1.00 0.00 N ATOM 1074 CA ARG A 69 4.252 5.890 -15.552 1.00 0.00 C ATOM 1075 C ARG A 69 2.913 6.618 -15.406 1.00 0.00 C ATOM 1076 O ARG A 69 2.734 7.720 -15.924 1.00 0.00 O ATOM 1077 CB ARG A 69 4.256 4.854 -16.677 1.00 0.00 C ATOM 1078 CG ARG A 69 4.000 5.394 -18.086 1.00 0.00 C ATOM 1079 CD ARG A 69 2.531 5.267 -18.494 1.00 0.00 C ATOM 1080 NE ARG A 69 2.382 5.710 -19.887 1.00 0.00 N ATOM 1081 CZ ARG A 69 1.334 5.465 -20.686 1.00 0.00 C ATOM 1082 NH1 ARG A 69 0.284 4.742 -20.274 1.00 0.00 N ATOM 1083 NH2 ARG A 69 1.346 5.915 -21.947 1.00 0.00 N ATOM 0 H ARG A 69 4.639 4.148 -14.456 1.00 0.00 H new ATOM 0 HA ARG A 69 4.976 6.675 -15.773 1.00 0.00 H new ATOM 0 HB2 ARG A 69 5.221 4.346 -16.673 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.499 4.102 -16.454 1.00 0.00 H new ATOM 0 HG2 ARG A 69 4.299 6.441 -18.132 1.00 0.00 H new ATOM 0 HG3 ARG A 69 4.622 4.853 -18.799 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.199 4.234 -18.390 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.904 5.871 -17.838 1.00 0.00 H new ATOM 0 HE ARG A 69 3.148 6.255 -20.283 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.267 4.360 -19.328 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -0.498 4.573 -20.906 1.00 0.00 H new ATOM 0 HH21 ARG A 69 2.149 6.440 -22.293 1.00 0.00 H new ATOM 0 HH22 ARG A 69 0.552 5.733 -22.561 1.00 0.00 H new ATOM 1097 N LEU A 70 1.961 5.944 -14.768 1.00 0.00 N ATOM 1098 CA LEU A 70 0.640 6.483 -14.412 1.00 0.00 C ATOM 1099 C LEU A 70 0.725 7.557 -13.325 1.00 0.00 C ATOM 1100 O LEU A 70 0.035 8.574 -13.383 1.00 0.00 O ATOM 1101 CB LEU A 70 -0.231 5.335 -13.897 1.00 0.00 C ATOM 1102 CG LEU A 70 -0.720 4.407 -15.011 1.00 0.00 C ATOM 1103 CD1 LEU A 70 -1.243 3.102 -14.406 1.00 0.00 C ATOM 1104 CD2 LEU A 70 -1.857 5.045 -15.812 1.00 0.00 C ATOM 0 H LEU A 70 2.086 4.976 -14.472 1.00 0.00 H new ATOM 0 HA LEU A 70 0.214 6.943 -15.304 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.337 4.753 -13.171 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -1.092 5.748 -13.372 1.00 0.00 H new ATOM 0 HG LEU A 70 0.125 4.218 -15.673 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.590 2.445 -15.203 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.442 2.611 -13.853 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -2.070 3.320 -13.730 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -2.180 4.359 -16.595 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.695 5.258 -15.148 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.507 5.973 -16.265 1.00 0.00 H new ATOM 1116 N LEU A 71 1.523 7.265 -12.301 1.00 0.00 N ATOM 1117 CA LEU A 71 1.700 8.102 -11.107 1.00 0.00 C ATOM 1118 C LEU A 71 3.175 8.447 -10.890 1.00 0.00 C ATOM 1119 O LEU A 71 3.813 7.915 -9.983 1.00 0.00 O ATOM 1120 CB LEU A 71 1.152 7.339 -9.899 1.00 0.00 C ATOM 1121 CG LEU A 71 -0.284 6.831 -10.056 1.00 0.00 C ATOM 1122 CD1 LEU A 71 -0.549 5.736 -9.021 1.00 0.00 C ATOM 1123 CD2 LEU A 71 -1.323 7.946 -9.923 1.00 0.00 C ATOM 0 H LEU A 71 2.084 6.414 -12.274 1.00 0.00 H new ATOM 0 HA LEU A 71 1.160 9.040 -11.239 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.803 6.488 -9.699 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.199 7.989 -9.025 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.383 6.429 -11.064 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.571 5.372 -9.130 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.148 4.913 -9.176 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.414 6.142 -8.019 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.323 7.528 -10.043 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.238 8.407 -8.939 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.150 8.699 -10.692 1.00 0.00 H new ATOM 1135 N PRO A 72 3.734 9.377 -11.661 1.00 0.00 N ATOM 1136 CA PRO A 72 5.142 9.768 -11.499 1.00 0.00 C ATOM 1137 C PRO A 72 5.411 10.714 -10.327 1.00 0.00 C ATOM 1138 O PRO A 72 6.442 10.600 -9.666 1.00 0.00 O ATOM 1139 CB PRO A 72 5.540 10.395 -12.837 1.00 0.00 C ATOM 1140 CG PRO A 72 4.224 10.931 -13.406 1.00 0.00 C ATOM 1141 CD PRO A 72 3.179 9.933 -12.903 1.00 0.00 C ATOM 0 HA PRO A 72 5.741 8.893 -11.248 1.00 0.00 H new ATOM 0 HB2 PRO A 72 6.270 11.193 -12.701 1.00 0.00 H new ATOM 0 HB3 PRO A 72 5.992 9.660 -13.503 1.00 0.00 H new ATOM 0 HG2 PRO A 72 4.016 11.941 -13.052 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.246 10.973 -14.495 1.00 0.00 H new ATOM 0 HD2 PRO A 72 2.223 10.424 -12.721 1.00 0.00 H new ATOM 0 HD3 PRO A 72 2.999 9.149 -13.638 1.00 0.00 H new ATOM 1149 N ASN A 73 4.398 11.497 -9.968 1.00 0.00 N ATOM 1150 CA ASN A 73 4.522 12.448 -8.854 1.00 0.00 C ATOM 1151 C ASN A 73 3.954 11.911 -7.538 1.00 0.00 C ATOM 1152 O ASN A 73 3.467 12.646 -6.680 1.00 0.00 O ATOM 1153 CB ASN A 73 3.875 13.786 -9.217 1.00 0.00 C ATOM 1154 CG ASN A 73 4.584 14.428 -10.410 1.00 0.00 C ATOM 1155 OD1 ASN A 73 5.620 15.076 -10.278 1.00 0.00 O ATOM 1156 ND2 ASN A 73 4.046 14.286 -11.619 1.00 0.00 N ATOM 0 H ASN A 73 3.486 11.497 -10.425 1.00 0.00 H new ATOM 0 HA ASN A 73 5.589 12.598 -8.690 1.00 0.00 H new ATOM 0 HB2 ASN A 73 2.822 13.633 -9.454 1.00 0.00 H new ATOM 0 HB3 ASN A 73 3.915 14.458 -8.360 1.00 0.00 H new ATOM 0 HD21 ASN A 73 4.493 14.714 -12.430 1.00 0.00 H new ATOM 0 HD22 ASN A 73 3.186 13.749 -11.735 1.00 0.00 H new ATOM 1163 N LYS A 74 3.910 10.585 -7.458 1.00 0.00 N ATOM 1164 CA LYS A 74 3.465 9.853 -6.263 1.00 0.00 C ATOM 1165 C LYS A 74 4.510 8.789 -5.922 1.00 0.00 C ATOM 1166 O LYS A 74 5.034 8.161 -6.841 1.00 0.00 O ATOM 1167 CB LYS A 74 2.125 9.168 -6.541 1.00 0.00 C ATOM 1168 CG LYS A 74 0.945 10.114 -6.771 1.00 0.00 C ATOM 1169 CD LYS A 74 0.629 10.966 -5.540 1.00 0.00 C ATOM 1170 CE LYS A 74 -0.615 11.830 -5.757 1.00 0.00 C ATOM 1171 NZ LYS A 74 -0.833 12.643 -4.551 1.00 0.00 N ATOM 0 H LYS A 74 4.185 9.975 -8.228 1.00 0.00 H new ATOM 0 HA LYS A 74 3.346 10.548 -5.432 1.00 0.00 H new ATOM 0 HB2 LYS A 74 2.236 8.531 -7.419 1.00 0.00 H new ATOM 0 HB3 LYS A 74 1.888 8.515 -5.701 1.00 0.00 H new ATOM 0 HG2 LYS A 74 1.167 10.768 -7.614 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.064 9.532 -7.042 1.00 0.00 H new ATOM 0 HD2 LYS A 74 0.476 10.317 -4.677 1.00 0.00 H new ATOM 0 HD3 LYS A 74 1.481 11.606 -5.311 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.483 12.472 -6.628 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.484 11.201 -5.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -1.730 13.161 -4.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -0.872 12.023 -3.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -0.051 13.320 -4.443 1.00 0.00 H new ATOM 1185 N PRO A 75 4.897 8.671 -4.654 1.00 0.00 N ATOM 1186 CA PRO A 75 5.818 7.615 -4.210 1.00 0.00 C ATOM 1187 C PRO A 75 5.123 6.253 -4.263 1.00 0.00 C ATOM 1188 O PRO A 75 4.029 6.049 -3.737 1.00 0.00 O ATOM 1189 CB PRO A 75 6.256 8.015 -2.800 1.00 0.00 C ATOM 1190 CG PRO A 75 5.123 8.915 -2.303 1.00 0.00 C ATOM 1191 CD PRO A 75 4.602 9.610 -3.562 1.00 0.00 C ATOM 0 HA PRO A 75 6.692 7.516 -4.854 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.384 7.143 -2.159 1.00 0.00 H new ATOM 0 HB3 PRO A 75 7.209 8.543 -2.813 1.00 0.00 H new ATOM 0 HG2 PRO A 75 4.339 8.334 -1.818 1.00 0.00 H new ATOM 0 HG3 PRO A 75 5.483 9.638 -1.571 1.00 0.00 H new ATOM 0 HD2 PRO A 75 3.533 9.811 -3.490 1.00 0.00 H new ATOM 0 HD3 PRO A 75 5.097 10.568 -3.719 1.00 0.00 H new ATOM 1199 N VAL A 76 5.665 5.481 -5.201 1.00 0.00 N ATOM 1200 CA VAL A 76 5.135 4.149 -5.527 1.00 0.00 C ATOM 1201 C VAL A 76 6.228 3.118 -5.233 1.00 0.00 C ATOM 1202 O VAL A 76 7.166 2.955 -6.010 1.00 0.00 O ATOM 1203 CB VAL A 76 4.700 4.070 -6.992 1.00 0.00 C ATOM 1204 CG1 VAL A 76 4.032 2.723 -7.279 1.00 0.00 C ATOM 1205 CG2 VAL A 76 3.732 5.178 -7.412 1.00 0.00 C ATOM 0 H VAL A 76 6.477 5.753 -5.755 1.00 0.00 H new ATOM 0 HA VAL A 76 4.253 3.947 -4.920 1.00 0.00 H new ATOM 0 HB VAL A 76 5.616 4.192 -7.570 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.729 2.683 -8.325 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.736 1.917 -7.074 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.155 2.609 -6.642 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.470 5.054 -8.463 1.00 0.00 H new ATOM 0 HG22 VAL A 76 2.829 5.122 -6.804 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.206 6.149 -7.269 1.00 0.00 H new ATOM 1215 N GLU A 77 5.926 2.325 -4.208 1.00 0.00 N ATOM 1216 CA GLU A 77 6.839 1.287 -3.710 1.00 0.00 C ATOM 1217 C GLU A 77 6.164 -0.084 -3.630 1.00 0.00 C ATOM 1218 O GLU A 77 4.947 -0.232 -3.530 1.00 0.00 O ATOM 1219 CB GLU A 77 7.371 1.659 -2.325 1.00 0.00 C ATOM 1220 CG GLU A 77 8.220 2.930 -2.269 1.00 0.00 C ATOM 1221 CD GLU A 77 9.475 2.905 -3.145 1.00 0.00 C ATOM 1222 OE1 GLU A 77 10.365 2.078 -2.850 1.00 0.00 O ATOM 1223 OE2 GLU A 77 9.575 3.806 -4.005 1.00 0.00 O ATOM 0 H GLU A 77 5.045 2.380 -3.697 1.00 0.00 H new ATOM 0 HA GLU A 77 7.662 1.225 -4.422 1.00 0.00 H new ATOM 0 HB2 GLU A 77 6.524 1.778 -1.649 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.966 0.828 -1.948 1.00 0.00 H new ATOM 0 HG2 GLU A 77 7.602 3.776 -2.569 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.519 3.105 -1.236 1.00 0.00 H new ATOM 1230 N VAL A 78 7.020 -1.096 -3.738 1.00 0.00 N ATOM 1231 CA VAL A 78 6.636 -2.511 -3.631 1.00 0.00 C ATOM 1232 C VAL A 78 6.825 -2.966 -2.183 1.00 0.00 C ATOM 1233 O VAL A 78 7.836 -2.675 -1.544 1.00 0.00 O ATOM 1234 CB VAL A 78 7.489 -3.337 -4.597 1.00 0.00 C ATOM 1235 CG1 VAL A 78 7.189 -4.836 -4.515 1.00 0.00 C ATOM 1236 CG2 VAL A 78 7.296 -2.910 -6.053 1.00 0.00 C ATOM 0 H VAL A 78 8.017 -0.960 -3.905 1.00 0.00 H new ATOM 0 HA VAL A 78 5.589 -2.650 -3.901 1.00 0.00 H new ATOM 0 HB VAL A 78 8.516 -3.150 -4.285 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.822 -5.373 -5.221 1.00 0.00 H new ATOM 0 HG12 VAL A 78 7.389 -5.192 -3.505 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.142 -5.011 -4.761 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.922 -3.526 -6.699 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.250 -3.037 -6.334 1.00 0.00 H new ATOM 0 HG23 VAL A 78 7.578 -1.863 -6.166 1.00 0.00 H new ATOM 1246 N ILE A 79 5.839 -3.702 -1.678 1.00 0.00 N ATOM 1247 CA ILE A 79 5.890 -4.326 -0.348 1.00 0.00 C ATOM 1248 C ILE A 79 6.925 -5.453 -0.385 1.00 0.00 C ATOM 1249 O ILE A 79 6.855 -6.354 -1.218 1.00 0.00 O ATOM 1250 CB ILE A 79 4.515 -4.858 0.061 1.00 0.00 C ATOM 1251 CG1 ILE A 79 3.489 -3.723 0.095 1.00 0.00 C ATOM 1252 CG2 ILE A 79 4.565 -5.538 1.430 1.00 0.00 C ATOM 1253 CD1 ILE A 79 2.058 -4.201 -0.162 1.00 0.00 C ATOM 0 H ILE A 79 4.971 -3.887 -2.181 1.00 0.00 H new ATOM 0 HA ILE A 79 6.179 -3.584 0.396 1.00 0.00 H new ATOM 0 HB ILE A 79 4.216 -5.596 -0.683 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.533 -3.231 1.066 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.756 -2.977 -0.653 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.572 -5.905 1.691 1.00 0.00 H new ATOM 0 HG22 ILE A 79 5.263 -6.374 1.396 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.895 -4.820 2.181 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.378 -3.350 -0.125 1.00 0.00 H new ATOM 0 HD12 ILE A 79 2.001 -4.668 -1.145 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.774 -4.926 0.601 1.00 0.00 H new ATOM 1265 N ASP A 80 7.821 -5.390 0.596 1.00 0.00 N ATOM 1266 CA ASP A 80 8.860 -6.405 0.821 1.00 0.00 C ATOM 1267 C ASP A 80 8.251 -7.797 1.005 1.00 0.00 C ATOM 1268 O ASP A 80 7.346 -8.024 1.807 1.00 0.00 O ATOM 1269 CB ASP A 80 9.699 -6.014 2.039 1.00 0.00 C ATOM 1270 CG ASP A 80 10.776 -7.057 2.347 1.00 0.00 C ATOM 1271 OD1 ASP A 80 11.812 -7.044 1.647 1.00 0.00 O ATOM 1272 OD2 ASP A 80 10.475 -7.930 3.189 1.00 0.00 O ATOM 0 H ASP A 80 7.851 -4.624 1.269 1.00 0.00 H new ATOM 0 HA ASP A 80 9.502 -6.447 -0.059 1.00 0.00 H new ATOM 0 HB2 ASP A 80 10.170 -5.047 1.861 1.00 0.00 H new ATOM 0 HB3 ASP A 80 9.049 -5.897 2.906 1.00 0.00 H new ATOM 1277 N SER A 81 8.761 -8.701 0.173 1.00 0.00 N ATOM 1278 CA SER A 81 8.282 -10.087 0.070 1.00 0.00 C ATOM 1279 C SER A 81 8.261 -10.847 1.398 1.00 0.00 C ATOM 1280 O SER A 81 7.325 -11.596 1.677 1.00 0.00 O ATOM 1281 CB SER A 81 9.115 -10.869 -0.948 1.00 0.00 C ATOM 1282 OG SER A 81 10.494 -10.854 -0.572 1.00 0.00 O ATOM 0 H SER A 81 9.532 -8.493 -0.462 1.00 0.00 H new ATOM 0 HA SER A 81 7.246 -10.009 -0.260 1.00 0.00 H new ATOM 0 HB2 SER A 81 8.758 -11.897 -1.008 1.00 0.00 H new ATOM 0 HB3 SER A 81 8.996 -10.432 -1.939 1.00 0.00 H new ATOM 0 HG SER A 81 11.018 -11.359 -1.229 1.00 0.00 H new ATOM 1288 N LEU A 82 9.232 -10.569 2.264 1.00 0.00 N ATOM 1289 CA LEU A 82 9.376 -11.175 3.595 1.00 0.00 C ATOM 1290 C LEU A 82 8.349 -10.629 4.590 1.00 0.00 C ATOM 1291 O LEU A 82 7.737 -11.401 5.326 1.00 0.00 O ATOM 1292 CB LEU A 82 10.825 -10.942 4.028 1.00 0.00 C ATOM 1293 CG LEU A 82 11.127 -11.385 5.461 1.00 0.00 C ATOM 1294 CD1 LEU A 82 11.036 -12.902 5.631 1.00 0.00 C ATOM 1295 CD2 LEU A 82 12.514 -10.913 5.904 1.00 0.00 C ATOM 0 H LEU A 82 9.968 -9.894 2.056 1.00 0.00 H new ATOM 0 HA LEU A 82 9.169 -12.245 3.563 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.487 -11.476 3.347 1.00 0.00 H new ATOM 0 HB3 LEU A 82 11.056 -9.881 3.931 1.00 0.00 H new ATOM 0 HG LEU A 82 10.366 -10.923 6.089 1.00 0.00 H new ATOM 0 HD11 LEU A 82 11.259 -13.166 6.665 1.00 0.00 H new ATOM 0 HD12 LEU A 82 10.030 -13.237 5.380 1.00 0.00 H new ATOM 0 HD13 LEU A 82 11.755 -13.386 4.970 1.00 0.00 H new ATOM 0 HD21 LEU A 82 12.701 -11.242 6.926 1.00 0.00 H new ATOM 0 HD22 LEU A 82 13.270 -11.335 5.243 1.00 0.00 H new ATOM 0 HD23 LEU A 82 12.560 -9.825 5.859 1.00 0.00 H new ATOM 1307 N LEU A 83 8.148 -9.315 4.612 1.00 0.00 N ATOM 1308 CA LEU A 83 7.096 -8.658 5.403 1.00 0.00 C ATOM 1309 C LEU A 83 5.691 -9.126 5.017 1.00 0.00 C ATOM 1310 O LEU A 83 4.824 -9.293 5.874 1.00 0.00 O ATOM 1311 CB LEU A 83 7.136 -7.138 5.240 1.00 0.00 C ATOM 1312 CG LEU A 83 8.372 -6.481 5.859 1.00 0.00 C ATOM 1313 CD1 LEU A 83 8.324 -4.972 5.607 1.00 0.00 C ATOM 1314 CD2 LEU A 83 8.463 -6.751 7.362 1.00 0.00 C ATOM 0 H LEU A 83 8.717 -8.661 4.075 1.00 0.00 H new ATOM 0 HA LEU A 83 7.300 -8.937 6.437 1.00 0.00 H new ATOM 0 HB2 LEU A 83 7.101 -6.895 4.178 1.00 0.00 H new ATOM 0 HB3 LEU A 83 6.243 -6.710 5.695 1.00 0.00 H new ATOM 0 HG LEU A 83 9.256 -6.912 5.390 1.00 0.00 H new ATOM 0 HD11 LEU A 83 9.203 -4.501 6.047 1.00 0.00 H new ATOM 0 HD12 LEU A 83 8.310 -4.783 4.534 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.425 -4.556 6.061 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.353 -6.268 7.765 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.578 -6.352 7.858 1.00 0.00 H new ATOM 0 HD23 LEU A 83 8.523 -7.825 7.536 1.00 0.00 H new ATOM 1326 N TYR A 84 5.520 -9.338 3.716 1.00 0.00 N ATOM 1327 CA TYR A 84 4.301 -9.876 3.095 1.00 0.00 C ATOM 1328 C TYR A 84 4.061 -11.331 3.506 1.00 0.00 C ATOM 1329 O TYR A 84 2.935 -11.687 3.849 1.00 0.00 O ATOM 1330 CB TYR A 84 4.414 -9.756 1.574 1.00 0.00 C ATOM 1331 CG TYR A 84 3.091 -9.940 0.827 1.00 0.00 C ATOM 1332 CD1 TYR A 84 2.239 -8.851 0.685 1.00 0.00 C ATOM 1333 CD2 TYR A 84 2.783 -11.174 0.266 1.00 0.00 C ATOM 1334 CE1 TYR A 84 1.056 -8.992 -0.032 1.00 0.00 C ATOM 1335 CE2 TYR A 84 1.608 -11.318 -0.463 1.00 0.00 C ATOM 1336 CZ TYR A 84 0.757 -10.228 -0.594 1.00 0.00 C ATOM 1337 OH TYR A 84 -0.359 -10.367 -1.359 1.00 0.00 O ATOM 0 H TYR A 84 6.251 -9.134 3.034 1.00 0.00 H new ATOM 0 HA TYR A 84 3.446 -9.296 3.442 1.00 0.00 H new ATOM 0 HB2 TYR A 84 4.823 -8.776 1.328 1.00 0.00 H new ATOM 0 HB3 TYR A 84 5.127 -10.498 1.215 1.00 0.00 H new ATOM 0 HD1 TYR A 84 2.494 -7.900 1.129 1.00 0.00 H new ATOM 0 HD2 TYR A 84 3.450 -12.013 0.395 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.382 -8.157 -0.150 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.360 -12.264 -0.921 1.00 0.00 H new ATOM 0 HH TYR A 84 -0.698 -9.482 -1.607 1.00 0.00 H new ATOM 1347 N GLY A 85 5.132 -12.118 3.556 1.00 0.00 N ATOM 1348 CA GLY A 85 5.130 -13.518 4.005 1.00 0.00 C ATOM 1349 C GLY A 85 4.766 -13.654 5.485 1.00 0.00 C ATOM 1350 O GLY A 85 3.881 -14.425 5.851 1.00 0.00 O ATOM 0 H GLY A 85 6.058 -11.794 3.277 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.421 -14.088 3.405 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.115 -13.953 3.834 1.00 0.00 H new ATOM 1354 N LYS A 86 5.439 -12.860 6.313 1.00 0.00 N ATOM 1355 CA LYS A 86 5.196 -12.794 7.761 1.00 0.00 C ATOM 1356 C LYS A 86 3.820 -12.224 8.110 1.00 0.00 C ATOM 1357 O LYS A 86 3.297 -12.468 9.196 1.00 0.00 O ATOM 1358 CB LYS A 86 6.249 -11.915 8.438 1.00 0.00 C ATOM 1359 CG LYS A 86 7.657 -12.515 8.429 1.00 0.00 C ATOM 1360 CD LYS A 86 8.625 -11.740 9.326 1.00 0.00 C ATOM 1361 CE LYS A 86 8.924 -10.324 8.830 1.00 0.00 C ATOM 1362 NZ LYS A 86 9.924 -9.701 9.709 1.00 0.00 N ATOM 0 H LYS A 86 6.180 -12.234 5.998 1.00 0.00 H new ATOM 0 HA LYS A 86 5.248 -13.822 8.119 1.00 0.00 H new ATOM 0 HB2 LYS A 86 6.274 -10.946 7.939 1.00 0.00 H new ATOM 0 HB3 LYS A 86 5.948 -11.734 9.470 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.610 -13.552 8.761 1.00 0.00 H new ATOM 0 HG3 LYS A 86 8.039 -12.524 7.408 1.00 0.00 H new ATOM 0 HD2 LYS A 86 8.208 -11.683 10.331 1.00 0.00 H new ATOM 0 HD3 LYS A 86 9.560 -12.294 9.400 1.00 0.00 H new ATOM 0 HE2 LYS A 86 9.294 -10.356 7.805 1.00 0.00 H new ATOM 0 HE3 LYS A 86 8.011 -9.729 8.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 10.129 -8.738 9.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 9.554 -9.658 10.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 10.797 -10.265 9.696 1.00 0.00 H new ATOM 1376 N VAL A 87 3.291 -11.430 7.183 1.00 0.00 N ATOM 1377 CA VAL A 87 2.048 -10.650 7.279 1.00 0.00 C ATOM 1378 C VAL A 87 2.145 -9.732 8.500 1.00 0.00 C ATOM 1379 O VAL A 87 1.378 -9.797 9.459 1.00 0.00 O ATOM 1380 CB VAL A 87 0.798 -11.533 7.298 1.00 0.00 C ATOM 1381 CG1 VAL A 87 -0.474 -10.709 7.093 1.00 0.00 C ATOM 1382 CG2 VAL A 87 0.821 -12.626 6.228 1.00 0.00 C ATOM 0 H VAL A 87 3.747 -11.302 6.280 1.00 0.00 H new ATOM 0 HA VAL A 87 1.937 -10.039 6.383 1.00 0.00 H new ATOM 0 HB VAL A 87 0.798 -12.000 8.283 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.342 -11.368 7.112 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -0.562 -9.971 7.890 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -0.426 -10.200 6.130 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.092 -13.218 6.293 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.887 -12.168 5.241 1.00 0.00 H new ATOM 0 HG23 VAL A 87 1.684 -13.272 6.386 1.00 0.00 H new ATOM 1392 N ASP A 88 3.139 -8.855 8.400 1.00 0.00 N ATOM 1393 CA ASP A 88 3.513 -7.920 9.472 1.00 0.00 C ATOM 1394 C ASP A 88 3.068 -6.493 9.144 1.00 0.00 C ATOM 1395 O ASP A 88 3.708 -5.730 8.422 1.00 0.00 O ATOM 1396 CB ASP A 88 5.017 -7.992 9.744 1.00 0.00 C ATOM 1397 CG ASP A 88 5.465 -7.058 10.870 1.00 0.00 C ATOM 1398 OD1 ASP A 88 4.612 -6.581 11.650 1.00 0.00 O ATOM 1399 OD2 ASP A 88 6.673 -6.735 10.861 1.00 0.00 O ATOM 0 H ASP A 88 3.718 -8.767 7.565 1.00 0.00 H new ATOM 0 HA ASP A 88 2.992 -8.217 10.382 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.286 -9.017 10.000 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.558 -7.739 8.832 1.00 0.00 H new ATOM 1404 N GLY A 89 1.936 -6.176 9.765 1.00 0.00 N ATOM 1405 CA GLY A 89 1.278 -4.866 9.650 1.00 0.00 C ATOM 1406 C GLY A 89 2.140 -3.699 10.133 1.00 0.00 C ATOM 1407 O GLY A 89 2.175 -2.651 9.490 1.00 0.00 O ATOM 0 H GLY A 89 1.438 -6.827 10.372 1.00 0.00 H new ATOM 0 HA2 GLY A 89 1.005 -4.697 8.608 1.00 0.00 H new ATOM 0 HA3 GLY A 89 0.352 -4.883 10.224 1.00 0.00 H new ATOM 1411 N LEU A 90 2.963 -3.945 11.150 1.00 0.00 N ATOM 1412 CA LEU A 90 3.836 -2.913 11.728 1.00 0.00 C ATOM 1413 C LEU A 90 4.981 -2.558 10.777 1.00 0.00 C ATOM 1414 O LEU A 90 5.218 -1.384 10.501 1.00 0.00 O ATOM 1415 CB LEU A 90 4.372 -3.427 13.065 1.00 0.00 C ATOM 1416 CG LEU A 90 5.198 -2.368 13.797 1.00 0.00 C ATOM 1417 CD1 LEU A 90 4.359 -1.154 14.202 1.00 0.00 C ATOM 1418 CD2 LEU A 90 5.873 -2.972 15.029 1.00 0.00 C ATOM 0 H LEU A 90 3.047 -4.858 11.598 1.00 0.00 H new ATOM 0 HA LEU A 90 3.264 -1.999 11.887 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.538 -3.736 13.695 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.986 -4.311 12.894 1.00 0.00 H new ATOM 0 HG LEU A 90 5.960 -2.021 13.099 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.991 -0.431 14.718 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.933 -0.693 13.311 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.555 -1.472 14.866 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.456 -2.204 15.537 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.113 -3.359 15.708 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.532 -3.784 14.721 1.00 0.00 H new ATOM 1430 N GLY A 91 5.624 -3.595 10.246 1.00 0.00 N ATOM 1431 CA GLY A 91 6.735 -3.497 9.286 1.00 0.00 C ATOM 1432 C GLY A 91 6.358 -2.709 8.030 1.00 0.00 C ATOM 1433 O GLY A 91 7.021 -1.733 7.682 1.00 0.00 O ATOM 0 H GLY A 91 5.383 -4.559 10.475 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.587 -3.018 9.769 1.00 0.00 H new ATOM 0 HA3 GLY A 91 7.053 -4.500 9.000 1.00 0.00 H new ATOM 1437 N VAL A 92 5.167 -3.001 7.515 1.00 0.00 N ATOM 1438 CA VAL A 92 4.627 -2.356 6.309 1.00 0.00 C ATOM 1439 C VAL A 92 4.152 -0.933 6.610 1.00 0.00 C ATOM 1440 O VAL A 92 4.400 -0.028 5.814 1.00 0.00 O ATOM 1441 CB VAL A 92 3.518 -3.210 5.690 1.00 0.00 C ATOM 1442 CG1 VAL A 92 2.993 -2.626 4.377 1.00 0.00 C ATOM 1443 CG2 VAL A 92 4.000 -4.626 5.367 1.00 0.00 C ATOM 0 H VAL A 92 4.541 -3.696 7.921 1.00 0.00 H new ATOM 0 HA VAL A 92 5.428 -2.276 5.574 1.00 0.00 H new ATOM 0 HB VAL A 92 2.730 -3.226 6.443 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.208 -3.270 3.980 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.588 -1.630 4.558 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.808 -2.561 3.656 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.182 -5.198 4.930 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.827 -4.576 4.659 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.335 -5.114 6.282 1.00 0.00 H new ATOM 1453 N LEU A 93 3.593 -0.705 7.795 1.00 0.00 N ATOM 1454 CA LEU A 93 3.167 0.631 8.233 1.00 0.00 C ATOM 1455 C LEU A 93 4.347 1.602 8.318 1.00 0.00 C ATOM 1456 O LEU A 93 4.306 2.721 7.807 1.00 0.00 O ATOM 1457 CB LEU A 93 2.515 0.579 9.617 1.00 0.00 C ATOM 1458 CG LEU A 93 1.137 1.240 9.689 1.00 0.00 C ATOM 1459 CD1 LEU A 93 0.565 1.063 11.098 1.00 0.00 C ATOM 1460 CD2 LEU A 93 1.160 2.734 9.363 1.00 0.00 C ATOM 0 H LEU A 93 3.420 -1.438 8.483 1.00 0.00 H new ATOM 0 HA LEU A 93 2.452 0.979 7.488 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.422 -0.463 9.923 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.176 1.064 10.335 1.00 0.00 H new ATOM 0 HG LEU A 93 0.519 0.751 8.936 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.417 1.533 11.154 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.472 0.000 11.322 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.232 1.530 11.823 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.150 3.137 9.433 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.807 3.251 10.071 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.539 2.880 8.352 1.00 0.00 H new ATOM 1472 N LYS A 94 5.435 1.104 8.898 1.00 0.00 N ATOM 1473 CA LYS A 94 6.685 1.862 9.058 1.00 0.00 C ATOM 1474 C LYS A 94 7.373 2.136 7.720 1.00 0.00 C ATOM 1475 O LYS A 94 7.899 3.231 7.530 1.00 0.00 O ATOM 1476 CB LYS A 94 7.638 1.105 9.986 1.00 0.00 C ATOM 1477 CG LYS A 94 7.121 1.163 11.425 1.00 0.00 C ATOM 1478 CD LYS A 94 7.870 0.237 12.384 1.00 0.00 C ATOM 1479 CE LYS A 94 9.276 0.702 12.768 1.00 0.00 C ATOM 1480 NZ LYS A 94 9.225 1.943 13.555 1.00 0.00 N ATOM 0 H LYS A 94 5.481 0.157 9.275 1.00 0.00 H new ATOM 0 HA LYS A 94 6.427 2.826 9.496 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.725 0.067 9.664 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.635 1.541 9.931 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.198 2.188 11.789 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.063 0.901 11.433 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.279 0.126 13.293 1.00 0.00 H new ATOM 0 HD3 LYS A 94 7.942 -0.751 11.929 1.00 0.00 H new ATOM 0 HE2 LYS A 94 9.776 -0.077 13.343 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.868 0.863 11.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.164 2.137 13.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.943 2.733 12.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 8.532 1.838 14.324 1.00 0.00 H new ATOM 1494 N ALA A 95 7.253 1.190 6.793 1.00 0.00 N ATOM 1495 CA ALA A 95 7.760 1.329 5.420 1.00 0.00 C ATOM 1496 C ALA A 95 6.975 2.371 4.620 1.00 0.00 C ATOM 1497 O ALA A 95 7.550 3.302 4.059 1.00 0.00 O ATOM 1498 CB ALA A 95 7.669 -0.037 4.737 1.00 0.00 C ATOM 0 H ALA A 95 6.798 0.295 6.970 1.00 0.00 H new ATOM 0 HA ALA A 95 8.793 1.674 5.460 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.040 0.042 3.715 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.271 -0.760 5.287 1.00 0.00 H new ATOM 0 HB3 ALA A 95 6.630 -0.367 4.721 1.00 0.00 H new ATOM 1504 N ALA A 96 5.662 2.360 4.830 1.00 0.00 N ATOM 1505 CA ALA A 96 4.724 3.305 4.207 1.00 0.00 C ATOM 1506 C ALA A 96 4.949 4.738 4.692 1.00 0.00 C ATOM 1507 O ALA A 96 5.187 5.645 3.896 1.00 0.00 O ATOM 1508 CB ALA A 96 3.296 2.856 4.525 1.00 0.00 C ATOM 0 H ALA A 96 5.207 1.686 5.446 1.00 0.00 H new ATOM 0 HA ALA A 96 4.892 3.304 3.130 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.587 3.547 4.069 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.132 1.854 4.127 1.00 0.00 H new ATOM 0 HB3 ALA A 96 3.150 2.846 5.605 1.00 0.00 H new ATOM 1514 N VAL A 97 5.135 4.885 6.001 1.00 0.00 N ATOM 1515 CA VAL A 97 5.378 6.190 6.634 1.00 0.00 C ATOM 1516 C VAL A 97 6.758 6.737 6.262 1.00 0.00 C ATOM 1517 O VAL A 97 6.951 7.947 6.157 1.00 0.00 O ATOM 1518 CB VAL A 97 5.135 6.000 8.133 1.00 0.00 C ATOM 1519 CG1 VAL A 97 6.380 5.833 9.006 1.00 0.00 C ATOM 1520 CG2 VAL A 97 4.281 7.154 8.665 1.00 0.00 C ATOM 0 H VAL A 97 5.123 4.105 6.659 1.00 0.00 H new ATOM 0 HA VAL A 97 4.697 6.961 6.273 1.00 0.00 H new ATOM 0 HB VAL A 97 4.619 5.043 8.209 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.081 5.706 10.046 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.938 4.955 8.680 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.010 6.718 8.915 1.00 0.00 H new ATOM 0 HG21 VAL A 97 4.109 7.017 9.733 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.801 8.098 8.499 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.325 7.170 8.142 1.00 0.00 H new ATOM 1530 N ALA A 98 7.690 5.810 6.057 1.00 0.00 N ATOM 1531 CA ALA A 98 9.069 6.111 5.643 1.00 0.00 C ATOM 1532 C ALA A 98 9.096 6.678 4.222 1.00 0.00 C ATOM 1533 O ALA A 98 9.826 7.634 3.969 1.00 0.00 O ATOM 1534 CB ALA A 98 9.899 4.826 5.685 1.00 0.00 C ATOM 0 H ALA A 98 7.512 4.812 6.174 1.00 0.00 H new ATOM 0 HA ALA A 98 9.485 6.853 6.325 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.922 5.044 5.379 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.901 4.427 6.699 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.466 4.091 5.007 1.00 0.00 H new ATOM 1540 N ALA A 99 8.217 6.169 3.362 1.00 0.00 N ATOM 1541 CA ALA A 99 8.064 6.640 1.978 1.00 0.00 C ATOM 1542 C ALA A 99 7.387 8.009 1.884 1.00 0.00 C ATOM 1543 O ALA A 99 7.870 8.886 1.169 1.00 0.00 O ATOM 1544 CB ALA A 99 7.269 5.594 1.196 1.00 0.00 C ATOM 0 H ALA A 99 7.581 5.409 3.604 1.00 0.00 H new ATOM 0 HA ALA A 99 9.059 6.767 1.551 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.145 5.927 0.165 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.805 4.645 1.209 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.289 5.464 1.655 1.00 0.00 H new ATOM 1550 N ILE A 100 6.413 8.247 2.758 1.00 0.00 N ATOM 1551 CA ILE A 100 5.731 9.542 2.885 1.00 0.00 C ATOM 1552 C ILE A 100 6.732 10.578 3.400 1.00 0.00 C ATOM 1553 O ILE A 100 6.866 11.673 2.856 1.00 0.00 O ATOM 1554 CB ILE A 100 4.524 9.394 3.814 1.00 0.00 C ATOM 1555 CG1 ILE A 100 3.512 8.396 3.249 1.00 0.00 C ATOM 1556 CG2 ILE A 100 3.843 10.746 4.035 1.00 0.00 C ATOM 1557 CD1 ILE A 100 2.495 7.880 4.270 1.00 0.00 C ATOM 0 H ILE A 100 6.067 7.541 3.408 1.00 0.00 H new ATOM 0 HA ILE A 100 5.359 9.881 1.918 1.00 0.00 H new ATOM 0 HB ILE A 100 4.889 9.017 4.769 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.975 8.868 2.426 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.052 7.546 2.831 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.987 10.618 4.698 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.551 11.441 4.486 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.504 11.143 3.078 1.00 0.00 H new ATOM 0 HD11 ILE A 100 1.816 7.178 3.785 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.019 7.376 5.082 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.925 8.718 4.671 1.00 0.00 H new ATOM 1569 N LYS A 101 7.432 10.213 4.470 1.00 0.00 N ATOM 1570 CA LYS A 101 8.498 11.039 5.056 1.00 0.00 C ATOM 1571 C LYS A 101 9.682 11.285 4.119 1.00 0.00 C ATOM 1572 O LYS A 101 10.289 12.351 4.214 1.00 0.00 O ATOM 1573 CB LYS A 101 9.011 10.421 6.357 1.00 0.00 C ATOM 1574 CG LYS A 101 8.109 10.800 7.534 1.00 0.00 C ATOM 1575 CD LYS A 101 8.711 10.318 8.856 1.00 0.00 C ATOM 1576 CE LYS A 101 8.064 11.010 10.057 1.00 0.00 C ATOM 1577 NZ LYS A 101 8.425 12.433 10.101 1.00 0.00 N ATOM 0 H LYS A 101 7.280 9.333 4.962 1.00 0.00 H new ATOM 0 HA LYS A 101 8.036 12.007 5.249 1.00 0.00 H new ATOM 0 HB2 LYS A 101 9.050 9.336 6.258 1.00 0.00 H new ATOM 0 HB3 LYS A 101 10.029 10.761 6.549 1.00 0.00 H new ATOM 0 HG2 LYS A 101 7.976 11.881 7.563 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.121 10.361 7.397 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.581 9.239 8.944 1.00 0.00 H new ATOM 0 HD3 LYS A 101 9.784 10.511 8.859 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.980 10.908 10.000 1.00 0.00 H new ATOM 0 HE3 LYS A 101 8.382 10.522 10.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.291 12.796 11.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 9.421 12.547 9.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.819 12.965 9.444 1.00 0.00 H new ATOM 1591 N LYS A 102 9.999 10.330 3.249 1.00 0.00 N ATOM 1592 CA LYS A 102 11.062 10.471 2.243 1.00 0.00 C ATOM 1593 C LYS A 102 10.640 11.518 1.211 1.00 0.00 C ATOM 1594 O LYS A 102 11.331 12.522 1.043 1.00 0.00 O ATOM 1595 CB LYS A 102 11.290 9.119 1.564 1.00 0.00 C ATOM 1596 CG LYS A 102 12.538 9.148 0.678 1.00 0.00 C ATOM 1597 CD LYS A 102 12.655 7.832 -0.094 1.00 0.00 C ATOM 1598 CE LYS A 102 13.895 7.806 -0.987 1.00 0.00 C ATOM 1599 NZ LYS A 102 13.776 8.814 -2.050 1.00 0.00 N ATOM 0 H LYS A 102 9.525 9.427 3.217 1.00 0.00 H new ATOM 0 HA LYS A 102 11.989 10.793 2.717 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.396 8.342 2.321 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.419 8.860 0.962 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.482 9.985 -0.018 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.427 9.302 1.290 1.00 0.00 H new ATOM 0 HD2 LYS A 102 12.696 7.000 0.609 1.00 0.00 H new ATOM 0 HD3 LYS A 102 11.764 7.689 -0.705 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.786 8.000 -0.390 1.00 0.00 H new ATOM 0 HE3 LYS A 102 14.015 6.816 -1.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.584 8.730 -2.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 12.892 8.662 -2.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 13.769 9.764 -1.628 1.00 0.00 H new ATOM 1613 N ALA A 103 9.401 11.380 0.746 1.00 0.00 N ATOM 1614 CA ALA A 103 8.771 12.326 -0.187 1.00 0.00 C ATOM 1615 C ALA A 103 8.743 13.753 0.367 1.00 0.00 C ATOM 1616 O ALA A 103 8.893 14.715 -0.385 1.00 0.00 O ATOM 1617 CB ALA A 103 7.344 11.879 -0.511 1.00 0.00 C ATOM 0 H ALA A 103 8.795 10.602 1.006 1.00 0.00 H new ATOM 0 HA ALA A 103 9.375 12.330 -1.094 1.00 0.00 H new ATOM 0 HB1 ALA A 103 6.889 12.588 -1.203 1.00 0.00 H new ATOM 0 HB2 ALA A 103 7.368 10.890 -0.968 1.00 0.00 H new ATOM 0 HB3 ALA A 103 6.758 11.840 0.407 1.00 0.00 H new ATOM 1623 N ALA A 104 8.445 13.879 1.657 1.00 0.00 N ATOM 1624 CA ALA A 104 8.493 15.158 2.379 1.00 0.00 C ATOM 1625 C ALA A 104 9.910 15.720 2.509 1.00 0.00 C ATOM 1626 O ALA A 104 10.087 16.935 2.435 1.00 0.00 O ATOM 1627 CB ALA A 104 7.886 14.940 3.767 1.00 0.00 C ATOM 0 H ALA A 104 8.160 13.092 2.241 1.00 0.00 H new ATOM 0 HA ALA A 104 7.926 15.894 1.808 1.00 0.00 H new ATOM 0 HB1 ALA A 104 7.909 15.876 4.325 1.00 0.00 H new ATOM 0 HB2 ALA A 104 6.854 14.604 3.664 1.00 0.00 H new ATOM 0 HB3 ALA A 104 8.462 14.184 4.301 1.00 0.00 H new ATOM 1633 N ALA A 105 10.866 14.861 2.851 1.00 0.00 N ATOM 1634 CA ALA A 105 12.282 15.233 2.976 1.00 0.00 C ATOM 1635 C ALA A 105 13.078 14.727 1.770 1.00 0.00 C ATOM 1636 O ALA A 105 13.906 13.822 1.864 1.00 0.00 O ATOM 1637 CB ALA A 105 12.784 14.657 4.301 1.00 0.00 C ATOM 0 H ALA A 105 10.684 13.878 3.052 1.00 0.00 H new ATOM 0 HA ALA A 105 12.412 16.315 2.983 1.00 0.00 H new ATOM 0 HB1 ALA A 105 13.836 14.911 4.433 1.00 0.00 H new ATOM 0 HB2 ALA A 105 12.203 15.076 5.123 1.00 0.00 H new ATOM 0 HB3 ALA A 105 12.671 13.573 4.292 1.00 0.00 H new ATOM 1643 N ASN A 106 12.644 15.207 0.609 1.00 0.00 N ATOM 1644 CA ASN A 106 13.245 14.867 -0.690 1.00 0.00 C ATOM 1645 C ASN A 106 13.644 16.125 -1.464 1.00 0.00 C ATOM 1646 O ASN A 106 13.373 17.237 -0.960 1.00 0.00 O ATOM 1647 CB ASN A 106 12.284 14.040 -1.545 1.00 0.00 C ATOM 1648 CG ASN A 106 12.855 12.689 -1.980 1.00 0.00 C ATOM 1649 OD1 ASN A 106 12.418 11.590 -1.641 1.00 0.00 O ATOM 1650 ND2 ASN A 106 13.880 12.722 -2.827 1.00 0.00 N ATOM 1651 OXT ASN A 106 14.227 15.936 -2.553 1.00 0.00 O ATOM 0 H ASN A 106 11.856 15.851 0.535 1.00 0.00 H new ATOM 0 HA ASN A 106 14.138 14.278 -0.481 1.00 0.00 H new ATOM 0 HB2 ASN A 106 11.365 13.872 -0.984 1.00 0.00 H new ATOM 0 HB3 ASN A 106 12.015 14.614 -2.432 1.00 0.00 H new ATOM 0 HD21 ASN A 106 14.281 11.852 -3.176 1.00 0.00 H new ATOM 0 HD22 ASN A 106 14.265 13.618 -3.127 1.00 0.00 H new TER 1658 ASN A 106