USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 985 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 106 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 109 MET CE :methyl 150:sc= -0.735 (180deg=-3.78!) USER MOD Set 2.1: A 10 GLN : amide:sc= 0.094 K(o=0.86,f=-0.63!) USER MOD Set 2.2: A 103 SER OG : rot 110:sc= 0.764 USER MOD Set 3.1: A 65 LYS NZ :NH3+ -165:sc=-0.00723 (180deg=-0.575) USER MOD Set 3.2: A 68 SER OG : rot -57:sc= -0.431 USER MOD Set 4.1: A 23 TYR OH : rot 156:sc= -0.587! USER MOD Set 4.2: A 27 SER OG : rot -140:sc= -1.27 USER MOD Set 4.3: A 112 HIS : no HD1:sc= -6.45! C(o=-8.3!,f=-12!) USER MOD Set 5.1: A 18 TYR OH : rot -148:sc= 0.837 USER MOD Set 5.2: A 92 ASN : amide:sc= -1.54 K(o=-0.7,f=-3.9!) USER MOD Single : A 1 PHE N :NH3+ -146:sc= 0.592 (180deg=0.0204) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 100:sc= -4.32 USER MOD Single : A 20 THR OG1 : rot -62:sc= -1.81! USER MOD Single : A 24 SER OG : rot 180:sc= -0.0744 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 ASN : amide:sc= -0.27 X(o=-0.27,f=-0.37) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= -2.94 K(o=-2.9,f=-5.4!) USER MOD Single : A 37 LYS NZ :NH3+ 164:sc= -0.0166 (180deg=-0.182) USER MOD Single : A 44 GLN : amide:sc= -0.667 K(o=-0.67,f=-3.5!) USER MOD Single : A 47 LYS NZ :NH3+ -161:sc=-0.00971 (180deg=-0.164) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl 160:sc= -2.99! (180deg=-4.15!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -2.34 K(o=-2.3,f=-3.9!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -159:sc= -10.7! (180deg=-12.9!) USER MOD Single : A 73 THR OG1 : rot 46:sc= -4.51! USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0105) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -68:sc= -2.58! USER MOD Single : A 83 SER OG : rot -169:sc= -2.3! USER MOD Single : A 84 ASN : amide:sc= -0.0873 K(o=-0.087,f=-0.78) USER MOD Single : A 87 ASN : amide:sc= -3.37 K(o=-3.4,f=-7.4!) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot -130:sc= -0.0696 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 6:sc= 0.487 USER MOD Single : A 118 CYS SG : rot 94:sc= 0.628 USER MOD Single : A 119 THR OG1 : rot -43:sc= 0.43 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 26.674 -5.630 23.231 1.00 0.00 N ATOM 2 CA PHE A 1 25.756 -4.493 23.506 1.00 0.00 C ATOM 3 C PHE A 1 24.783 -4.280 22.351 1.00 0.00 C ATOM 4 O PHE A 1 23.595 -4.035 22.565 1.00 0.00 O ATOM 5 CB PHE A 1 26.593 -3.233 23.732 1.00 0.00 C ATOM 6 CG PHE A 1 27.400 -2.824 22.533 1.00 0.00 C ATOM 7 CD1 PHE A 1 26.844 -2.024 21.548 1.00 0.00 C ATOM 8 CD2 PHE A 1 28.714 -3.241 22.391 1.00 0.00 C ATOM 9 CE1 PHE A 1 27.584 -1.646 20.443 1.00 0.00 C ATOM 10 CE2 PHE A 1 29.458 -2.866 21.288 1.00 0.00 C ATOM 11 CZ PHE A 1 28.892 -2.067 20.313 1.00 0.00 C ATOM 0 H1 PHE A 1 26.895 -6.121 24.121 1.00 0.00 H new ATOM 0 H2 PHE A 1 26.217 -6.294 22.573 1.00 0.00 H new ATOM 0 H3 PHE A 1 27.553 -5.272 22.806 1.00 0.00 H new ATOM 0 HA PHE A 1 25.166 -4.716 24.395 1.00 0.00 H new ATOM 0 HB2 PHE A 1 25.932 -2.413 24.011 1.00 0.00 H new ATOM 0 HB3 PHE A 1 27.266 -3.400 24.573 1.00 0.00 H new ATOM 0 HD1 PHE A 1 25.821 -1.692 21.644 1.00 0.00 H new ATOM 0 HD2 PHE A 1 29.161 -3.866 23.150 1.00 0.00 H new ATOM 0 HE1 PHE A 1 27.139 -1.022 19.682 1.00 0.00 H new ATOM 0 HE2 PHE A 1 30.481 -3.197 21.188 1.00 0.00 H new ATOM 0 HZ PHE A 1 29.472 -1.772 19.451 1.00 0.00 H new ATOM 22 N ALA A 2 25.293 -4.373 21.128 1.00 0.00 N ATOM 23 CA ALA A 2 24.468 -4.189 19.939 1.00 0.00 C ATOM 24 C ALA A 2 23.827 -2.806 19.924 1.00 0.00 C ATOM 25 O ALA A 2 22.830 -2.566 20.604 1.00 0.00 O ATOM 26 CB ALA A 2 23.399 -5.269 19.868 1.00 0.00 C ATOM 0 H ALA A 2 26.274 -4.575 20.934 1.00 0.00 H new ATOM 0 HA ALA A 2 25.112 -4.271 19.063 1.00 0.00 H new ATOM 0 HB1 ALA A 2 22.790 -5.120 18.976 1.00 0.00 H new ATOM 0 HB2 ALA A 2 23.874 -6.249 19.824 1.00 0.00 H new ATOM 0 HB3 ALA A 2 22.766 -5.213 20.753 1.00 0.00 H new ATOM 32 N LYS A 3 24.407 -1.900 19.144 1.00 0.00 N ATOM 33 CA LYS A 3 23.891 -0.539 19.040 1.00 0.00 C ATOM 34 C LYS A 3 22.813 -0.446 17.964 1.00 0.00 C ATOM 35 O LYS A 3 23.077 -0.010 16.844 1.00 0.00 O ATOM 36 CB LYS A 3 25.027 0.436 18.725 1.00 0.00 C ATOM 37 CG LYS A 3 25.703 1.002 19.963 1.00 0.00 C ATOM 38 CD LYS A 3 24.836 2.053 20.639 1.00 0.00 C ATOM 39 CE LYS A 3 25.190 3.454 20.166 1.00 0.00 C ATOM 40 NZ LYS A 3 26.362 4.008 20.898 1.00 0.00 N ATOM 0 H LYS A 3 25.234 -2.083 18.575 1.00 0.00 H new ATOM 0 HA LYS A 3 23.446 -0.271 19.998 1.00 0.00 H new ATOM 0 HB2 LYS A 3 25.773 -0.073 18.114 1.00 0.00 H new ATOM 0 HB3 LYS A 3 24.634 1.259 18.128 1.00 0.00 H new ATOM 0 HG2 LYS A 3 25.913 0.195 20.665 1.00 0.00 H new ATOM 0 HG3 LYS A 3 26.661 1.442 19.687 1.00 0.00 H new ATOM 0 HD2 LYS A 3 23.786 1.851 20.428 1.00 0.00 H new ATOM 0 HD3 LYS A 3 24.962 1.990 21.720 1.00 0.00 H new ATOM 0 HE2 LYS A 3 25.406 3.433 19.098 1.00 0.00 H new ATOM 0 HE3 LYS A 3 24.332 4.111 20.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 26.571 4.964 20.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 26.147 4.053 21.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 27.188 3.395 20.745 1.00 0.00 H new ATOM 54 N LEU A 4 21.600 -0.860 18.313 1.00 0.00 N ATOM 55 CA LEU A 4 20.481 -0.824 17.376 1.00 0.00 C ATOM 56 C LEU A 4 19.599 0.393 17.631 1.00 0.00 C ATOM 57 O LEU A 4 19.882 1.205 18.512 1.00 0.00 O ATOM 58 CB LEU A 4 19.652 -2.104 17.491 1.00 0.00 C ATOM 59 CG LEU A 4 20.137 -3.269 16.628 1.00 0.00 C ATOM 60 CD1 LEU A 4 21.173 -4.093 17.376 1.00 0.00 C ATOM 61 CD2 LEU A 4 18.964 -4.142 16.205 1.00 0.00 C ATOM 0 H LEU A 4 21.366 -1.224 19.237 1.00 0.00 H new ATOM 0 HA LEU A 4 20.885 -0.752 16.366 1.00 0.00 H new ATOM 0 HB2 LEU A 4 19.646 -2.422 18.534 1.00 0.00 H new ATOM 0 HB3 LEU A 4 18.621 -1.876 17.221 1.00 0.00 H new ATOM 0 HG LEU A 4 20.605 -2.862 15.732 1.00 0.00 H new ATOM 0 HD11 LEU A 4 21.506 -4.917 16.746 1.00 0.00 H new ATOM 0 HD12 LEU A 4 22.025 -3.463 17.630 1.00 0.00 H new ATOM 0 HD13 LEU A 4 20.731 -4.490 18.290 1.00 0.00 H new ATOM 0 HD21 LEU A 4 19.327 -4.967 15.591 1.00 0.00 H new ATOM 0 HD22 LEU A 4 18.468 -4.540 17.091 1.00 0.00 H new ATOM 0 HD23 LEU A 4 18.256 -3.546 15.630 1.00 0.00 H new ATOM 73 N VAL A 5 18.526 0.513 16.854 1.00 0.00 N ATOM 74 CA VAL A 5 17.602 1.631 16.995 1.00 0.00 C ATOM 75 C VAL A 5 16.433 1.501 16.024 1.00 0.00 C ATOM 76 O VAL A 5 16.609 1.602 14.809 1.00 0.00 O ATOM 77 CB VAL A 5 18.311 2.979 16.760 1.00 0.00 C ATOM 78 CG1 VAL A 5 18.876 3.051 15.349 1.00 0.00 C ATOM 79 CG2 VAL A 5 17.360 4.139 17.021 1.00 0.00 C ATOM 0 H VAL A 5 18.276 -0.151 16.121 1.00 0.00 H new ATOM 0 HA VAL A 5 17.224 1.605 18.017 1.00 0.00 H new ATOM 0 HB VAL A 5 19.141 3.055 17.462 1.00 0.00 H new ATOM 0 HG11 VAL A 5 19.372 4.011 15.204 1.00 0.00 H new ATOM 0 HG12 VAL A 5 19.595 2.245 15.204 1.00 0.00 H new ATOM 0 HG13 VAL A 5 18.066 2.949 14.627 1.00 0.00 H new ATOM 0 HG21 VAL A 5 17.880 5.081 16.850 1.00 0.00 H new ATOM 0 HG22 VAL A 5 16.506 4.068 16.347 1.00 0.00 H new ATOM 0 HG23 VAL A 5 17.012 4.099 18.053 1.00 0.00 H new ATOM 89 N ARG A 6 15.240 1.278 16.566 1.00 0.00 N ATOM 90 CA ARG A 6 14.042 1.135 15.747 1.00 0.00 C ATOM 91 C ARG A 6 13.138 2.358 15.887 1.00 0.00 C ATOM 92 O ARG A 6 13.051 2.956 16.960 1.00 0.00 O ATOM 93 CB ARG A 6 13.278 -0.130 16.144 1.00 0.00 C ATOM 94 CG ARG A 6 12.819 -0.960 14.956 1.00 0.00 C ATOM 95 CD ARG A 6 12.786 -2.443 15.292 1.00 0.00 C ATOM 96 NE ARG A 6 11.648 -3.119 14.673 1.00 0.00 N ATOM 97 CZ ARG A 6 11.503 -3.276 13.359 1.00 0.00 C ATOM 98 NH1 ARG A 6 12.422 -2.807 12.523 1.00 0.00 N ATOM 99 NH2 ARG A 6 10.438 -3.903 12.880 1.00 0.00 N ATOM 0 H ARG A 6 15.077 1.192 17.569 1.00 0.00 H new ATOM 0 HA ARG A 6 14.350 1.053 14.705 1.00 0.00 H new ATOM 0 HB2 ARG A 6 13.914 -0.744 16.782 1.00 0.00 H new ATOM 0 HB3 ARG A 6 12.408 0.152 16.738 1.00 0.00 H new ATOM 0 HG2 ARG A 6 11.826 -0.634 14.645 1.00 0.00 H new ATOM 0 HG3 ARG A 6 13.489 -0.792 14.113 1.00 0.00 H new ATOM 0 HD2 ARG A 6 13.712 -2.911 14.957 1.00 0.00 H new ATOM 0 HD3 ARG A 6 12.738 -2.569 16.374 1.00 0.00 H new ATOM 0 HE ARG A 6 10.922 -3.493 15.284 1.00 0.00 H new ATOM 0 HH11 ARG A 6 13.243 -2.324 12.887 1.00 0.00 H new ATOM 0 HH12 ARG A 6 12.306 -2.930 11.517 1.00 0.00 H new ATOM 0 HH21 ARG A 6 9.730 -4.265 13.518 1.00 0.00 H new ATOM 0 HH22 ARG A 6 10.327 -4.023 11.873 1.00 0.00 H new ATOM 113 N PRO A 7 12.450 2.750 14.799 1.00 0.00 N ATOM 114 CA PRO A 7 11.551 3.908 14.809 1.00 0.00 C ATOM 115 C PRO A 7 10.263 3.635 15.585 1.00 0.00 C ATOM 116 O PRO A 7 9.417 2.858 15.141 1.00 0.00 O ATOM 117 CB PRO A 7 11.244 4.127 13.327 1.00 0.00 C ATOM 118 CG PRO A 7 11.401 2.783 12.707 1.00 0.00 C ATOM 119 CD PRO A 7 12.495 2.094 13.477 1.00 0.00 C ATOM 0 HA PRO A 7 12.001 4.771 15.299 1.00 0.00 H new ATOM 0 HB2 PRO A 7 10.235 4.514 13.184 1.00 0.00 H new ATOM 0 HB3 PRO A 7 11.928 4.850 12.883 1.00 0.00 H new ATOM 0 HG2 PRO A 7 10.471 2.218 12.761 1.00 0.00 H new ATOM 0 HG3 PRO A 7 11.661 2.868 11.652 1.00 0.00 H new ATOM 0 HD2 PRO A 7 12.317 1.021 13.555 1.00 0.00 H new ATOM 0 HD3 PRO A 7 13.466 2.222 12.998 1.00 0.00 H new ATOM 127 N PRO A 8 10.092 4.273 16.759 1.00 0.00 N ATOM 128 CA PRO A 8 8.897 4.089 17.587 1.00 0.00 C ATOM 129 C PRO A 8 7.650 4.690 16.945 1.00 0.00 C ATOM 130 O PRO A 8 7.214 5.781 17.313 1.00 0.00 O ATOM 131 CB PRO A 8 9.242 4.828 18.882 1.00 0.00 C ATOM 132 CG PRO A 8 10.253 5.844 18.482 1.00 0.00 C ATOM 133 CD PRO A 8 11.046 5.220 17.367 1.00 0.00 C ATOM 0 HA PRO A 8 8.662 3.035 17.734 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.360 5.298 19.316 1.00 0.00 H new ATOM 0 HB3 PRO A 8 9.642 4.146 19.632 1.00 0.00 H new ATOM 0 HG2 PRO A 8 9.772 6.765 18.151 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.898 6.105 19.321 1.00 0.00 H new ATOM 0 HD2 PRO A 8 11.385 5.966 16.648 1.00 0.00 H new ATOM 0 HD3 PRO A 8 11.934 4.711 17.741 1.00 0.00 H new ATOM 141 N VAL A 9 7.082 3.971 15.982 1.00 0.00 N ATOM 142 CA VAL A 9 5.887 4.432 15.288 1.00 0.00 C ATOM 143 C VAL A 9 5.143 3.271 14.638 1.00 0.00 C ATOM 144 O VAL A 9 5.678 2.588 13.764 1.00 0.00 O ATOM 145 CB VAL A 9 6.230 5.474 14.206 1.00 0.00 C ATOM 146 CG1 VAL A 9 6.590 6.808 14.845 1.00 0.00 C ATOM 147 CG2 VAL A 9 7.362 4.974 13.322 1.00 0.00 C ATOM 0 H VAL A 9 7.431 3.066 15.665 1.00 0.00 H new ATOM 0 HA VAL A 9 5.248 4.895 16.040 1.00 0.00 H new ATOM 0 HB VAL A 9 5.351 5.623 13.579 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.829 7.532 14.066 1.00 0.00 H new ATOM 0 HG12 VAL A 9 5.745 7.171 15.430 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.454 6.678 15.497 1.00 0.00 H new ATOM 0 HG21 VAL A 9 7.590 5.723 12.564 1.00 0.00 H new ATOM 0 HG22 VAL A 9 8.247 4.794 13.932 1.00 0.00 H new ATOM 0 HG23 VAL A 9 7.061 4.046 12.836 1.00 0.00 H new ATOM 157 N GLN A 10 3.906 3.054 15.072 1.00 0.00 N ATOM 158 CA GLN A 10 3.080 1.979 14.535 1.00 0.00 C ATOM 159 C GLN A 10 1.697 1.997 15.176 1.00 0.00 C ATOM 160 O GLN A 10 1.568 2.219 16.379 1.00 0.00 O ATOM 161 CB GLN A 10 3.748 0.623 14.774 1.00 0.00 C ATOM 162 CG GLN A 10 3.021 -0.538 14.113 1.00 0.00 C ATOM 163 CD GLN A 10 2.931 -1.757 15.011 1.00 0.00 C ATOM 164 OE1 GLN A 10 2.951 -1.643 16.236 1.00 0.00 O ATOM 165 NE2 GLN A 10 2.833 -2.933 14.402 1.00 0.00 N ATOM 0 H GLN A 10 3.452 3.610 15.797 1.00 0.00 H new ATOM 0 HA GLN A 10 2.971 2.135 13.462 1.00 0.00 H new ATOM 0 HB2 GLN A 10 4.771 0.660 14.400 1.00 0.00 H new ATOM 0 HB3 GLN A 10 3.807 0.440 15.847 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.016 -0.221 13.835 1.00 0.00 H new ATOM 0 HG3 GLN A 10 3.537 -0.808 13.191 1.00 0.00 H new ATOM 0 HE21 GLN A 10 2.820 -2.980 13.383 1.00 0.00 H new ATOM 0 HE22 GLN A 10 2.771 -3.789 14.953 1.00 0.00 H new ATOM 174 N ILE A 11 0.665 1.767 14.368 1.00 0.00 N ATOM 175 CA ILE A 11 -0.705 1.762 14.870 1.00 0.00 C ATOM 176 C ILE A 11 -1.089 3.141 15.399 1.00 0.00 C ATOM 177 O ILE A 11 -0.432 3.679 16.289 1.00 0.00 O ATOM 178 CB ILE A 11 -0.877 0.728 15.990 1.00 0.00 C ATOM 179 CG1 ILE A 11 -0.500 -0.669 15.489 1.00 0.00 C ATOM 180 CG2 ILE A 11 -2.305 0.746 16.511 1.00 0.00 C ATOM 181 CD1 ILE A 11 -1.417 -1.192 14.406 1.00 0.00 C ATOM 0 H ILE A 11 0.751 1.583 13.368 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.358 1.498 14.038 1.00 0.00 H new ATOM 0 HB ILE A 11 -0.209 0.988 16.811 1.00 0.00 H new ATOM 0 HG12 ILE A 11 0.521 -0.646 15.109 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -0.512 -1.363 16.330 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -2.412 0.007 17.305 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.537 1.736 16.903 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -2.992 0.507 15.699 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -1.089 -2.186 14.100 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.436 -1.248 14.788 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.387 -0.520 13.548 1.00 0.00 H new ATOM 193 N TYR A 12 -2.140 3.720 14.824 1.00 0.00 N ATOM 194 CA TYR A 12 -2.587 5.053 15.218 1.00 0.00 C ATOM 195 C TYR A 12 -4.073 5.235 14.933 1.00 0.00 C ATOM 196 O TYR A 12 -4.884 5.342 15.854 1.00 0.00 O ATOM 197 CB TYR A 12 -1.771 6.124 14.473 1.00 0.00 C ATOM 198 CG TYR A 12 -0.399 5.646 14.040 1.00 0.00 C ATOM 199 CD1 TYR A 12 -0.265 4.575 13.164 1.00 0.00 C ATOM 200 CD2 TYR A 12 0.759 6.247 14.520 1.00 0.00 C ATOM 201 CE1 TYR A 12 0.973 4.115 12.783 1.00 0.00 C ATOM 202 CE2 TYR A 12 2.007 5.791 14.138 1.00 0.00 C ATOM 203 CZ TYR A 12 2.109 4.723 13.271 1.00 0.00 C ATOM 204 OH TYR A 12 3.347 4.271 12.884 1.00 0.00 O ATOM 0 H TYR A 12 -2.696 3.289 14.086 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.429 5.164 16.291 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.328 6.448 13.594 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -1.657 6.996 15.117 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -1.151 4.095 12.775 1.00 0.00 H new ATOM 0 HD2 TYR A 12 0.683 7.082 15.201 1.00 0.00 H new ATOM 0 HE1 TYR A 12 1.055 3.280 12.103 1.00 0.00 H new ATOM 0 HE2 TYR A 12 2.898 6.269 14.517 1.00 0.00 H new ATOM 0 HH TYR A 12 3.703 4.853 12.181 1.00 0.00 H new ATOM 214 N GLY A 13 -4.427 5.267 13.653 1.00 0.00 N ATOM 215 CA GLY A 13 -5.817 5.434 13.272 1.00 0.00 C ATOM 216 C GLY A 13 -5.976 5.979 11.867 1.00 0.00 C ATOM 217 O GLY A 13 -6.454 5.280 10.974 1.00 0.00 O ATOM 0 H GLY A 13 -3.776 5.180 12.872 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.327 4.474 13.345 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -6.304 6.108 13.976 1.00 0.00 H new ATOM 221 N ILE A 14 -5.578 7.233 11.669 1.00 0.00 N ATOM 222 CA ILE A 14 -5.684 7.869 10.362 1.00 0.00 C ATOM 223 C ILE A 14 -4.928 7.073 9.302 1.00 0.00 C ATOM 224 O ILE A 14 -5.444 6.829 8.212 1.00 0.00 O ATOM 225 CB ILE A 14 -5.154 9.320 10.398 1.00 0.00 C ATOM 226 CG1 ILE A 14 -5.514 10.059 9.102 1.00 0.00 C ATOM 227 CG2 ILE A 14 -3.650 9.343 10.640 1.00 0.00 C ATOM 228 CD1 ILE A 14 -4.681 9.653 7.902 1.00 0.00 C ATOM 0 H ILE A 14 -5.180 7.827 12.397 1.00 0.00 H new ATOM 0 HA ILE A 14 -6.742 7.891 10.100 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.634 9.838 11.228 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.566 9.882 8.876 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -5.399 11.131 9.264 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -3.301 10.375 10.661 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.428 8.865 11.594 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -3.144 8.805 9.838 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -5.000 10.222 7.029 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.629 9.856 8.104 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -4.814 8.588 7.710 1.00 0.00 H new ATOM 240 N GLU A 15 -3.708 6.663 9.631 1.00 0.00 N ATOM 241 CA GLU A 15 -2.893 5.889 8.705 1.00 0.00 C ATOM 242 C GLU A 15 -3.455 4.482 8.553 1.00 0.00 C ATOM 243 O GLU A 15 -3.413 3.899 7.470 1.00 0.00 O ATOM 244 CB GLU A 15 -1.442 5.829 9.189 1.00 0.00 C ATOM 245 CG GLU A 15 -0.552 6.892 8.566 1.00 0.00 C ATOM 246 CD GLU A 15 0.361 7.556 9.579 1.00 0.00 C ATOM 247 OE1 GLU A 15 0.810 6.863 10.516 1.00 0.00 O ATOM 248 OE2 GLU A 15 0.625 8.768 9.435 1.00 0.00 O ATOM 0 H GLU A 15 -3.264 6.853 10.529 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.915 6.381 7.733 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.424 5.941 10.273 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.032 4.845 8.963 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.052 6.439 7.780 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -1.175 7.650 8.092 1.00 0.00 H new ATOM 255 N GLY A 16 -3.994 3.947 9.642 1.00 0.00 N ATOM 256 CA GLY A 16 -4.571 2.619 9.602 1.00 0.00 C ATOM 257 C GLY A 16 -5.869 2.593 8.824 1.00 0.00 C ATOM 258 O GLY A 16 -6.235 1.570 8.245 1.00 0.00 O ATOM 0 H GLY A 16 -4.041 4.409 10.550 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -3.861 1.928 9.148 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -4.750 2.270 10.619 1.00 0.00 H new ATOM 262 N ARG A 17 -6.565 3.727 8.806 1.00 0.00 N ATOM 263 CA ARG A 17 -7.828 3.838 8.088 1.00 0.00 C ATOM 264 C ARG A 17 -7.603 3.790 6.582 1.00 0.00 C ATOM 265 O ARG A 17 -8.500 3.418 5.825 1.00 0.00 O ATOM 266 CB ARG A 17 -8.544 5.137 8.469 1.00 0.00 C ATOM 267 CG ARG A 17 -10.053 5.066 8.314 1.00 0.00 C ATOM 268 CD ARG A 17 -10.630 6.400 7.868 1.00 0.00 C ATOM 269 NE ARG A 17 -11.986 6.262 7.341 1.00 0.00 N ATOM 270 CZ ARG A 17 -12.591 7.187 6.599 1.00 0.00 C ATOM 271 NH1 ARG A 17 -11.964 8.318 6.294 1.00 0.00 N ATOM 272 NH2 ARG A 17 -13.824 6.981 6.160 1.00 0.00 N ATOM 0 H ARG A 17 -6.274 4.581 9.281 1.00 0.00 H new ATOM 0 HA ARG A 17 -8.453 2.991 8.370 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -8.304 5.385 9.503 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -8.161 5.948 7.850 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -10.309 4.296 7.586 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -10.504 4.772 9.262 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -10.637 7.092 8.711 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -9.987 6.836 7.104 1.00 0.00 H new ATOM 0 HE ARG A 17 -12.499 5.407 7.554 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -11.014 8.481 6.629 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.432 9.023 5.725 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -14.309 6.114 6.391 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -14.288 7.689 5.591 1.00 0.00 H new ATOM 286 N TYR A 18 -6.402 4.164 6.146 1.00 0.00 N ATOM 287 CA TYR A 18 -6.071 4.153 4.726 1.00 0.00 C ATOM 288 C TYR A 18 -6.272 2.760 4.144 1.00 0.00 C ATOM 289 O TYR A 18 -6.939 2.591 3.123 1.00 0.00 O ATOM 290 CB TYR A 18 -4.627 4.609 4.510 1.00 0.00 C ATOM 291 CG TYR A 18 -4.504 6.029 4.007 1.00 0.00 C ATOM 292 CD1 TYR A 18 -4.999 7.095 4.747 1.00 0.00 C ATOM 293 CD2 TYR A 18 -3.890 6.304 2.791 1.00 0.00 C ATOM 294 CE1 TYR A 18 -4.886 8.394 4.291 1.00 0.00 C ATOM 295 CE2 TYR A 18 -3.772 7.599 2.328 1.00 0.00 C ATOM 296 CZ TYR A 18 -4.273 8.641 3.081 1.00 0.00 C ATOM 297 OH TYR A 18 -4.158 9.934 2.623 1.00 0.00 O ATOM 0 H TYR A 18 -5.646 4.477 6.754 1.00 0.00 H new ATOM 0 HA TYR A 18 -6.737 4.847 4.213 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -4.083 4.518 5.450 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -4.147 3.938 3.798 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -5.480 6.905 5.695 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.498 5.491 2.198 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -5.276 9.212 4.879 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -3.290 7.796 1.382 1.00 0.00 H new ATOM 0 HH TYR A 18 -4.198 9.939 1.644 1.00 0.00 H new ATOM 307 N ALA A 19 -5.695 1.763 4.804 1.00 0.00 N ATOM 308 CA ALA A 19 -5.819 0.385 4.357 1.00 0.00 C ATOM 309 C ALA A 19 -7.246 -0.109 4.537 1.00 0.00 C ATOM 310 O ALA A 19 -7.779 -0.820 3.687 1.00 0.00 O ATOM 311 CB ALA A 19 -4.845 -0.509 5.111 1.00 0.00 C ATOM 0 H ALA A 19 -5.138 1.885 5.650 1.00 0.00 H new ATOM 0 HA ALA A 19 -5.574 0.344 3.296 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.951 -1.537 4.764 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.825 -0.169 4.931 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -5.060 -0.462 6.179 1.00 0.00 H new ATOM 317 N THR A 20 -7.863 0.280 5.647 1.00 0.00 N ATOM 318 CA THR A 20 -9.233 -0.122 5.926 1.00 0.00 C ATOM 319 C THR A 20 -10.205 0.586 4.993 1.00 0.00 C ATOM 320 O THR A 20 -11.323 0.119 4.782 1.00 0.00 O ATOM 321 CB THR A 20 -9.593 0.144 7.387 1.00 0.00 C ATOM 322 OG1 THR A 20 -8.590 0.912 8.022 1.00 0.00 O ATOM 323 CG2 THR A 20 -9.768 -1.130 8.185 1.00 0.00 C ATOM 0 H THR A 20 -7.438 0.869 6.363 1.00 0.00 H new ATOM 0 HA THR A 20 -9.312 -1.195 5.749 1.00 0.00 H new ATOM 0 HB THR A 20 -10.540 0.684 7.364 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.748 0.411 8.026 1.00 0.00 H new ATOM 0 HG21 THR A 20 -10.023 -0.882 9.215 1.00 0.00 H new ATOM 0 HG22 THR A 20 -10.568 -1.727 7.747 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.839 -1.700 8.168 1.00 0.00 H new ATOM 331 N ALA A 21 -9.772 1.704 4.418 1.00 0.00 N ATOM 332 CA ALA A 21 -10.615 2.442 3.493 1.00 0.00 C ATOM 333 C ALA A 21 -10.399 1.965 2.061 1.00 0.00 C ATOM 334 O ALA A 21 -11.047 2.444 1.131 1.00 0.00 O ATOM 335 CB ALA A 21 -10.363 3.937 3.608 1.00 0.00 C ATOM 0 H ALA A 21 -8.851 2.113 4.576 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.655 2.252 3.759 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.005 4.469 2.906 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.584 4.266 4.623 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.319 4.149 3.377 1.00 0.00 H new ATOM 341 N LEU A 22 -9.508 0.992 1.898 1.00 0.00 N ATOM 342 CA LEU A 22 -9.234 0.421 0.587 1.00 0.00 C ATOM 343 C LEU A 22 -9.601 -1.041 0.614 1.00 0.00 C ATOM 344 O LEU A 22 -10.176 -1.572 -0.335 1.00 0.00 O ATOM 345 CB LEU A 22 -7.765 0.598 0.201 1.00 0.00 C ATOM 346 CG LEU A 22 -7.353 -0.105 -1.096 1.00 0.00 C ATOM 347 CD1 LEU A 22 -7.133 0.909 -2.210 1.00 0.00 C ATOM 348 CD2 LEU A 22 -6.102 -0.943 -0.878 1.00 0.00 C ATOM 0 H LEU A 22 -8.964 0.584 2.658 1.00 0.00 H new ATOM 0 HA LEU A 22 -9.830 0.941 -0.163 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -7.555 1.663 0.103 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -7.143 0.224 1.014 1.00 0.00 H new ATOM 0 HG LEU A 22 -8.162 -0.771 -1.396 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.841 0.389 -3.123 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -8.056 1.462 -2.386 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -6.344 1.603 -1.920 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.826 -1.434 -1.811 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.285 -0.299 -0.551 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.297 -1.697 -0.115 1.00 0.00 H new ATOM 360 N TYR A 23 -9.299 -1.681 1.730 1.00 0.00 N ATOM 361 CA TYR A 23 -9.631 -3.063 1.904 1.00 0.00 C ATOM 362 C TYR A 23 -11.099 -3.179 2.311 1.00 0.00 C ATOM 363 O TYR A 23 -11.694 -4.244 2.182 1.00 0.00 O ATOM 364 CB TYR A 23 -8.701 -3.710 2.935 1.00 0.00 C ATOM 365 CG TYR A 23 -9.400 -4.211 4.171 1.00 0.00 C ATOM 366 CD1 TYR A 23 -10.208 -5.332 4.113 1.00 0.00 C ATOM 367 CD2 TYR A 23 -9.258 -3.564 5.386 1.00 0.00 C ATOM 368 CE1 TYR A 23 -10.864 -5.799 5.230 1.00 0.00 C ATOM 369 CE2 TYR A 23 -9.905 -4.019 6.510 1.00 0.00 C ATOM 370 CZ TYR A 23 -10.712 -5.136 6.432 1.00 0.00 C ATOM 371 OH TYR A 23 -11.361 -5.591 7.555 1.00 0.00 O ATOM 0 H TYR A 23 -8.823 -1.254 2.525 1.00 0.00 H new ATOM 0 HA TYR A 23 -9.491 -3.599 0.965 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -8.179 -4.543 2.464 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -7.943 -2.984 3.229 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -10.327 -5.851 3.173 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -8.629 -2.688 5.452 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.492 -6.676 5.167 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -9.782 -3.504 7.451 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.882 -5.288 8.355 1.00 0.00 H new ATOM 381 N SER A 24 -11.698 -2.070 2.781 1.00 0.00 N ATOM 382 CA SER A 24 -13.108 -2.091 3.160 1.00 0.00 C ATOM 383 C SER A 24 -13.912 -2.719 2.031 1.00 0.00 C ATOM 384 O SER A 24 -14.848 -3.484 2.262 1.00 0.00 O ATOM 385 CB SER A 24 -13.617 -0.681 3.458 1.00 0.00 C ATOM 386 OG SER A 24 -12.964 0.279 2.649 1.00 0.00 O ATOM 0 H SER A 24 -11.234 -1.170 2.903 1.00 0.00 H new ATOM 0 HA SER A 24 -13.225 -2.682 4.069 1.00 0.00 H new ATOM 0 HB2 SER A 24 -14.692 -0.635 3.285 1.00 0.00 H new ATOM 0 HB3 SER A 24 -13.453 -0.447 4.510 1.00 0.00 H new ATOM 0 HG SER A 24 -13.309 1.172 2.858 1.00 0.00 H new ATOM 392 N ALA A 25 -13.491 -2.424 0.804 1.00 0.00 N ATOM 393 CA ALA A 25 -14.115 -2.993 -0.376 1.00 0.00 C ATOM 394 C ALA A 25 -13.619 -4.416 -0.540 1.00 0.00 C ATOM 395 O ALA A 25 -14.375 -5.321 -0.895 1.00 0.00 O ATOM 396 CB ALA A 25 -13.796 -2.161 -1.609 1.00 0.00 C ATOM 0 H ALA A 25 -12.716 -1.791 0.606 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.199 -2.993 -0.258 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.274 -2.606 -2.482 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.168 -1.146 -1.469 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.717 -2.134 -1.761 1.00 0.00 H new ATOM 402 N ALA A 26 -12.335 -4.605 -0.248 1.00 0.00 N ATOM 403 CA ALA A 26 -11.715 -5.920 -0.328 1.00 0.00 C ATOM 404 C ALA A 26 -12.343 -6.882 0.676 1.00 0.00 C ATOM 405 O ALA A 26 -12.326 -8.094 0.480 1.00 0.00 O ATOM 406 CB ALA A 26 -10.222 -5.816 -0.078 1.00 0.00 C ATOM 0 H ALA A 26 -11.704 -3.860 0.047 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.883 -6.310 -1.332 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -9.773 -6.807 -0.141 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.772 -5.165 -0.828 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -10.047 -5.401 0.915 1.00 0.00 H new ATOM 412 N SER A 27 -12.893 -6.332 1.755 1.00 0.00 N ATOM 413 CA SER A 27 -13.528 -7.136 2.791 1.00 0.00 C ATOM 414 C SER A 27 -14.824 -7.742 2.268 1.00 0.00 C ATOM 415 O SER A 27 -15.037 -8.951 2.356 1.00 0.00 O ATOM 416 CB SER A 27 -13.819 -6.278 4.023 1.00 0.00 C ATOM 417 OG SER A 27 -13.861 -7.067 5.199 1.00 0.00 O ATOM 0 H SER A 27 -12.911 -5.328 1.934 1.00 0.00 H new ATOM 0 HA SER A 27 -12.847 -7.940 3.071 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.052 -5.510 4.124 1.00 0.00 H new ATOM 0 HB3 SER A 27 -14.771 -5.762 3.894 1.00 0.00 H new ATOM 0 HG SER A 27 -14.588 -6.755 5.777 1.00 0.00 H new ATOM 423 N LYS A 28 -15.684 -6.889 1.714 1.00 0.00 N ATOM 424 CA LYS A 28 -16.957 -7.336 1.164 1.00 0.00 C ATOM 425 C LYS A 28 -16.732 -8.449 0.149 1.00 0.00 C ATOM 426 O LYS A 28 -17.536 -9.373 0.033 1.00 0.00 O ATOM 427 CB LYS A 28 -17.694 -6.168 0.506 1.00 0.00 C ATOM 428 CG LYS A 28 -18.565 -5.379 1.469 1.00 0.00 C ATOM 429 CD LYS A 28 -18.830 -3.972 0.956 1.00 0.00 C ATOM 430 CE LYS A 28 -19.615 -3.994 -0.346 1.00 0.00 C ATOM 431 NZ LYS A 28 -19.624 -2.662 -1.012 1.00 0.00 N ATOM 0 H LYS A 28 -15.520 -5.885 1.635 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.569 -7.721 1.980 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -16.964 -5.496 0.056 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -18.316 -6.551 -0.303 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -19.512 -5.899 1.614 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -18.078 -5.327 2.443 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -19.383 -3.408 1.707 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -17.883 -3.455 0.803 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -19.181 -4.733 -1.019 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -20.640 -4.307 -0.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -20.169 -2.719 -1.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -20.061 -1.961 -0.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -18.648 -2.374 -1.226 1.00 0.00 H new ATOM 445 N GLN A 29 -15.620 -8.358 -0.573 1.00 0.00 N ATOM 446 CA GLN A 29 -15.272 -9.361 -1.566 1.00 0.00 C ATOM 447 C GLN A 29 -14.543 -10.523 -0.905 1.00 0.00 C ATOM 448 O GLN A 29 -14.832 -11.686 -1.184 1.00 0.00 O ATOM 449 CB GLN A 29 -14.397 -8.748 -2.662 1.00 0.00 C ATOM 450 CG GLN A 29 -15.190 -8.192 -3.833 1.00 0.00 C ATOM 451 CD GLN A 29 -15.313 -6.681 -3.788 1.00 0.00 C ATOM 452 OE1 GLN A 29 -14.437 -5.961 -4.265 1.00 0.00 O ATOM 453 NE2 GLN A 29 -16.406 -6.193 -3.211 1.00 0.00 N ATOM 0 H GLN A 29 -14.945 -7.598 -0.487 1.00 0.00 H new ATOM 0 HA GLN A 29 -16.191 -9.732 -2.020 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.794 -7.949 -2.230 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -13.705 -9.506 -3.030 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -14.709 -8.486 -4.766 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -16.186 -8.634 -3.835 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -17.107 -6.827 -2.828 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -16.544 -5.184 -3.151 1.00 0.00 H new ATOM 462 N ASN A 30 -13.588 -10.186 -0.031 1.00 0.00 N ATOM 463 CA ASN A 30 -12.781 -11.172 0.693 1.00 0.00 C ATOM 464 C ASN A 30 -11.408 -11.267 0.057 1.00 0.00 C ATOM 465 O ASN A 30 -10.799 -12.336 0.011 1.00 0.00 O ATOM 466 CB ASN A 30 -13.446 -12.554 0.722 1.00 0.00 C ATOM 467 CG ASN A 30 -12.869 -13.451 1.798 1.00 0.00 C ATOM 468 OD1 ASN A 30 -11.912 -14.189 1.563 1.00 0.00 O ATOM 469 ND2 ASN A 30 -13.449 -13.392 2.992 1.00 0.00 N ATOM 0 H ASN A 30 -13.353 -9.219 0.194 1.00 0.00 H new ATOM 0 HA ASN A 30 -12.690 -10.836 1.726 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -14.517 -12.435 0.888 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -13.325 -13.033 -0.250 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -13.103 -13.972 3.756 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -14.240 -12.766 3.144 1.00 0.00 H new ATOM 476 N LYS A 31 -10.934 -10.134 -0.441 1.00 0.00 N ATOM 477 CA LYS A 31 -9.639 -10.070 -1.090 1.00 0.00 C ATOM 478 C LYS A 31 -8.546 -9.644 -0.114 1.00 0.00 C ATOM 479 O LYS A 31 -7.440 -9.310 -0.530 1.00 0.00 O ATOM 480 CB LYS A 31 -9.690 -9.113 -2.278 1.00 0.00 C ATOM 481 CG LYS A 31 -10.933 -9.276 -3.141 1.00 0.00 C ATOM 482 CD LYS A 31 -10.596 -9.854 -4.506 1.00 0.00 C ATOM 483 CE LYS A 31 -11.658 -10.837 -4.972 1.00 0.00 C ATOM 484 NZ LYS A 31 -11.292 -12.243 -4.649 1.00 0.00 N ATOM 0 H LYS A 31 -11.432 -9.244 -0.406 1.00 0.00 H new ATOM 0 HA LYS A 31 -9.395 -11.070 -1.448 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -9.646 -8.088 -1.910 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.806 -9.268 -2.897 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -11.645 -9.928 -2.635 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.420 -8.309 -3.265 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -10.503 -9.046 -5.232 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -9.629 -10.355 -4.462 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.610 -10.593 -4.502 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.799 -10.736 -6.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.041 -12.882 -4.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -10.396 -12.485 -5.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -11.183 -12.346 -3.620 1.00 0.00 H new ATOM 498 N LEU A 32 -8.850 -9.672 1.187 1.00 0.00 N ATOM 499 CA LEU A 32 -7.876 -9.310 2.211 1.00 0.00 C ATOM 500 C LEU A 32 -6.516 -9.927 1.900 1.00 0.00 C ATOM 501 O LEU A 32 -5.479 -9.366 2.234 1.00 0.00 O ATOM 502 CB LEU A 32 -8.378 -9.780 3.577 1.00 0.00 C ATOM 503 CG LEU A 32 -9.458 -8.895 4.210 1.00 0.00 C ATOM 504 CD1 LEU A 32 -8.817 -7.887 5.148 1.00 0.00 C ATOM 505 CD2 LEU A 32 -10.280 -8.190 3.139 1.00 0.00 C ATOM 0 H LEU A 32 -9.763 -9.942 1.552 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.758 -8.226 2.225 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.772 -10.791 3.474 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.530 -9.836 4.259 1.00 0.00 H new ATOM 0 HG LEU A 32 -10.134 -9.528 4.784 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.591 -7.262 5.594 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.278 -8.414 5.935 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -8.122 -7.261 4.589 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -11.039 -7.568 3.614 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.626 -7.564 2.532 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.764 -8.932 2.504 1.00 0.00 H new ATOM 517 N GLU A 33 -6.532 -11.078 1.237 1.00 0.00 N ATOM 518 CA GLU A 33 -5.296 -11.755 0.861 1.00 0.00 C ATOM 519 C GLU A 33 -4.663 -11.071 -0.349 1.00 0.00 C ATOM 520 O GLU A 33 -3.441 -10.972 -0.452 1.00 0.00 O ATOM 521 CB GLU A 33 -5.565 -13.228 0.551 1.00 0.00 C ATOM 522 CG GLU A 33 -5.429 -14.139 1.761 1.00 0.00 C ATOM 523 CD GLU A 33 -6.323 -15.360 1.675 1.00 0.00 C ATOM 524 OE1 GLU A 33 -6.696 -15.744 0.547 1.00 0.00 O ATOM 525 OE2 GLU A 33 -6.651 -15.932 2.735 1.00 0.00 O ATOM 0 H GLU A 33 -7.384 -11.560 0.950 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.603 -11.697 1.700 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.571 -13.327 0.143 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.873 -13.560 -0.223 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.391 -14.459 1.855 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -5.673 -13.578 2.663 1.00 0.00 H new ATOM 532 N GLN A 34 -5.508 -10.592 -1.255 1.00 0.00 N ATOM 533 CA GLN A 34 -5.048 -9.903 -2.457 1.00 0.00 C ATOM 534 C GLN A 34 -4.803 -8.420 -2.186 1.00 0.00 C ATOM 535 O GLN A 34 -4.429 -7.672 -3.088 1.00 0.00 O ATOM 536 CB GLN A 34 -6.071 -10.066 -3.585 1.00 0.00 C ATOM 537 CG GLN A 34 -5.560 -10.898 -4.751 1.00 0.00 C ATOM 538 CD GLN A 34 -4.947 -10.051 -5.848 1.00 0.00 C ATOM 539 OE1 GLN A 34 -5.249 -10.230 -7.028 1.00 0.00 O ATOM 540 NE2 GLN A 34 -4.080 -9.121 -5.465 1.00 0.00 N ATOM 0 H GLN A 34 -6.522 -10.669 -1.179 1.00 0.00 H new ATOM 0 HA GLN A 34 -4.103 -10.354 -2.761 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -6.971 -10.531 -3.184 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -6.357 -9.080 -3.950 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -4.817 -11.608 -4.388 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -6.383 -11.481 -5.164 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -3.858 -9.007 -4.476 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -3.636 -8.521 -6.160 1.00 0.00 H new ATOM 549 N VAL A 35 -5.017 -7.995 -0.942 1.00 0.00 N ATOM 550 CA VAL A 35 -4.816 -6.599 -0.575 1.00 0.00 C ATOM 551 C VAL A 35 -3.896 -6.472 0.640 1.00 0.00 C ATOM 552 O VAL A 35 -3.117 -5.524 0.737 1.00 0.00 O ATOM 553 CB VAL A 35 -6.154 -5.878 -0.280 1.00 0.00 C ATOM 554 CG1 VAL A 35 -6.097 -4.444 -0.777 1.00 0.00 C ATOM 555 CG2 VAL A 35 -7.343 -6.612 -0.904 1.00 0.00 C ATOM 0 H VAL A 35 -5.327 -8.595 -0.177 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.347 -6.120 -1.434 1.00 0.00 H new ATOM 0 HB VAL A 35 -6.300 -5.877 0.800 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.044 -3.947 -0.564 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.288 -3.916 -0.272 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.918 -4.438 -1.852 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.263 -6.075 -0.675 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.213 -6.663 -1.985 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.401 -7.622 -0.498 1.00 0.00 H new ATOM 565 N GLU A 36 -3.972 -7.438 1.556 1.00 0.00 N ATOM 566 CA GLU A 36 -3.123 -7.424 2.746 1.00 0.00 C ATOM 567 C GLU A 36 -1.703 -7.794 2.359 1.00 0.00 C ATOM 568 O GLU A 36 -0.741 -7.160 2.791 1.00 0.00 O ATOM 569 CB GLU A 36 -3.641 -8.398 3.807 1.00 0.00 C ATOM 570 CG GLU A 36 -2.968 -8.236 5.160 1.00 0.00 C ATOM 571 CD GLU A 36 -3.484 -9.221 6.190 1.00 0.00 C ATOM 572 OE1 GLU A 36 -4.672 -9.599 6.106 1.00 0.00 O ATOM 573 OE2 GLU A 36 -2.701 -9.614 7.080 1.00 0.00 O ATOM 0 H GLU A 36 -4.608 -8.234 1.497 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.142 -6.420 3.170 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.715 -8.256 3.925 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.491 -9.419 3.456 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.892 -8.367 5.044 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.128 -7.220 5.522 1.00 0.00 H new ATOM 580 N LYS A 37 -1.587 -8.806 1.508 1.00 0.00 N ATOM 581 CA LYS A 37 -0.290 -9.241 1.023 1.00 0.00 C ATOM 582 C LYS A 37 0.237 -8.200 0.053 1.00 0.00 C ATOM 583 O LYS A 37 1.445 -7.997 -0.075 1.00 0.00 O ATOM 584 CB LYS A 37 -0.395 -10.604 0.336 1.00 0.00 C ATOM 585 CG LYS A 37 -0.532 -11.766 1.307 1.00 0.00 C ATOM 586 CD LYS A 37 -1.991 -12.082 1.595 1.00 0.00 C ATOM 587 CE LYS A 37 -2.138 -12.941 2.841 1.00 0.00 C ATOM 588 NZ LYS A 37 -1.847 -12.174 4.083 1.00 0.00 N ATOM 0 H LYS A 37 -2.376 -9.338 1.142 1.00 0.00 H new ATOM 0 HA LYS A 37 0.396 -9.347 1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -1.254 -10.598 -0.334 1.00 0.00 H new ATOM 0 HB3 LYS A 37 0.490 -10.760 -0.281 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -0.043 -12.647 0.893 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -0.020 -11.525 2.239 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -2.547 -11.153 1.724 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -2.428 -12.599 0.741 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.151 -13.339 2.890 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -1.463 -13.794 2.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.212 -12.695 4.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -0.819 -12.048 4.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.306 -11.242 4.031 1.00 0.00 H new ATOM 602 N GLU A 38 -0.696 -7.524 -0.616 1.00 0.00 N ATOM 603 CA GLU A 38 -0.359 -6.483 -1.562 1.00 0.00 C ATOM 604 C GLU A 38 -0.126 -5.153 -0.839 1.00 0.00 C ATOM 605 O GLU A 38 0.116 -4.128 -1.470 1.00 0.00 O ATOM 606 CB GLU A 38 -1.484 -6.344 -2.585 1.00 0.00 C ATOM 607 CG GLU A 38 -1.339 -7.274 -3.777 1.00 0.00 C ATOM 608 CD GLU A 38 -1.281 -8.734 -3.373 1.00 0.00 C ATOM 609 OE1 GLU A 38 -0.269 -9.141 -2.764 1.00 0.00 O ATOM 610 OE2 GLU A 38 -2.246 -9.471 -3.664 1.00 0.00 O ATOM 0 H GLU A 38 -1.698 -7.687 -0.513 1.00 0.00 H new ATOM 0 HA GLU A 38 0.563 -6.753 -2.076 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.437 -6.542 -2.094 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.516 -5.314 -2.940 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.178 -7.122 -4.456 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.433 -7.016 -4.326 1.00 0.00 H new ATOM 617 N LEU A 39 -0.185 -5.178 0.490 1.00 0.00 N ATOM 618 CA LEU A 39 0.042 -3.979 1.284 1.00 0.00 C ATOM 619 C LEU A 39 1.418 -4.046 1.927 1.00 0.00 C ATOM 620 O LEU A 39 2.100 -3.032 2.074 1.00 0.00 O ATOM 621 CB LEU A 39 -1.042 -3.829 2.356 1.00 0.00 C ATOM 622 CG LEU A 39 -1.842 -2.525 2.289 1.00 0.00 C ATOM 623 CD1 LEU A 39 -3.259 -2.789 1.802 1.00 0.00 C ATOM 624 CD2 LEU A 39 -1.864 -1.838 3.646 1.00 0.00 C ATOM 0 H LEU A 39 -0.388 -6.015 1.037 1.00 0.00 H new ATOM 0 HA LEU A 39 -0.005 -3.108 0.631 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.734 -4.667 2.271 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -0.574 -3.900 3.338 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.352 -1.861 1.576 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.811 -1.850 1.762 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -3.225 -3.233 0.807 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -3.758 -3.474 2.488 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -2.437 -0.914 3.577 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -2.326 -2.498 4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -0.844 -1.610 3.955 1.00 0.00 H new ATOM 636 N LEU A 40 1.826 -5.258 2.290 1.00 0.00 N ATOM 637 CA LEU A 40 3.129 -5.474 2.897 1.00 0.00 C ATOM 638 C LEU A 40 4.223 -5.366 1.841 1.00 0.00 C ATOM 639 O LEU A 40 5.356 -4.993 2.142 1.00 0.00 O ATOM 640 CB LEU A 40 3.184 -6.847 3.571 1.00 0.00 C ATOM 641 CG LEU A 40 4.439 -7.110 4.404 1.00 0.00 C ATOM 642 CD1 LEU A 40 4.398 -6.310 5.698 1.00 0.00 C ATOM 643 CD2 LEU A 40 4.581 -8.595 4.698 1.00 0.00 C ATOM 0 H LEU A 40 1.270 -6.105 2.173 1.00 0.00 H new ATOM 0 HA LEU A 40 3.291 -4.707 3.655 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.311 -6.954 4.214 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.110 -7.616 2.802 1.00 0.00 H new ATOM 0 HG LEU A 40 5.308 -6.789 3.829 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.299 -6.510 6.278 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.344 -5.246 5.467 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.522 -6.600 6.278 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.479 -8.764 5.292 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.709 -8.941 5.253 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.657 -9.146 3.761 1.00 0.00 H new ATOM 655 N ARG A 41 3.871 -5.687 0.597 1.00 0.00 N ATOM 656 CA ARG A 41 4.820 -5.614 -0.505 1.00 0.00 C ATOM 657 C ARG A 41 5.221 -4.166 -0.764 1.00 0.00 C ATOM 658 O ARG A 41 6.353 -3.885 -1.156 1.00 0.00 O ATOM 659 CB ARG A 41 4.215 -6.229 -1.770 1.00 0.00 C ATOM 660 CG ARG A 41 4.780 -7.599 -2.109 1.00 0.00 C ATOM 661 CD ARG A 41 5.866 -7.506 -3.168 1.00 0.00 C ATOM 662 NE ARG A 41 6.397 -8.820 -3.524 1.00 0.00 N ATOM 663 CZ ARG A 41 7.468 -9.003 -4.294 1.00 0.00 C ATOM 664 NH1 ARG A 41 8.123 -7.960 -4.789 1.00 0.00 N ATOM 665 NH2 ARG A 41 7.885 -10.232 -4.569 1.00 0.00 N ATOM 0 H ARG A 41 2.937 -5.999 0.331 1.00 0.00 H new ATOM 0 HA ARG A 41 5.711 -6.180 -0.233 1.00 0.00 H new ATOM 0 HB2 ARG A 41 3.135 -6.311 -1.644 1.00 0.00 H new ATOM 0 HB3 ARG A 41 4.387 -5.556 -2.610 1.00 0.00 H new ATOM 0 HG2 ARG A 41 5.187 -8.059 -1.208 1.00 0.00 H new ATOM 0 HG3 ARG A 41 3.978 -8.247 -2.464 1.00 0.00 H new ATOM 0 HD2 ARG A 41 5.463 -7.024 -4.059 1.00 0.00 H new ATOM 0 HD3 ARG A 41 6.676 -6.875 -2.802 1.00 0.00 H new ATOM 0 HE ARG A 41 5.919 -9.645 -3.162 1.00 0.00 H new ATOM 0 HH11 ARG A 41 7.807 -7.013 -4.580 1.00 0.00 H new ATOM 0 HH12 ARG A 41 8.943 -8.105 -5.378 1.00 0.00 H new ATOM 0 HH21 ARG A 41 7.385 -11.037 -4.191 1.00 0.00 H new ATOM 0 HH22 ARG A 41 8.705 -10.372 -5.159 1.00 0.00 H new ATOM 679 N VAL A 42 4.284 -3.252 -0.535 1.00 0.00 N ATOM 680 CA VAL A 42 4.539 -1.831 -0.735 1.00 0.00 C ATOM 681 C VAL A 42 5.543 -1.312 0.288 1.00 0.00 C ATOM 682 O VAL A 42 6.319 -0.401 0.005 1.00 0.00 O ATOM 683 CB VAL A 42 3.238 -1.008 -0.635 1.00 0.00 C ATOM 684 CG1 VAL A 42 3.503 0.461 -0.934 1.00 0.00 C ATOM 685 CG2 VAL A 42 2.180 -1.567 -1.574 1.00 0.00 C ATOM 0 H VAL A 42 3.342 -3.470 -0.211 1.00 0.00 H new ATOM 0 HA VAL A 42 4.952 -1.715 -1.737 1.00 0.00 H new ATOM 0 HB VAL A 42 2.864 -1.082 0.386 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.571 1.022 -0.858 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.223 0.854 -0.216 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.905 0.560 -1.942 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.269 -0.974 -1.490 1.00 0.00 H new ATOM 0 HG22 VAL A 42 2.546 -1.527 -2.600 1.00 0.00 H new ATOM 0 HG23 VAL A 42 1.965 -2.601 -1.306 1.00 0.00 H new ATOM 695 N GLY A 43 5.525 -1.904 1.477 1.00 0.00 N ATOM 696 CA GLY A 43 6.440 -1.496 2.524 1.00 0.00 C ATOM 697 C GLY A 43 7.874 -1.864 2.205 1.00 0.00 C ATOM 698 O GLY A 43 8.783 -1.050 2.365 1.00 0.00 O ATOM 0 H GLY A 43 4.891 -2.661 1.734 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.367 -0.418 2.669 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.147 -1.964 3.464 1.00 0.00 H new ATOM 702 N GLN A 44 8.075 -3.094 1.743 1.00 0.00 N ATOM 703 CA GLN A 44 9.407 -3.569 1.392 1.00 0.00 C ATOM 704 C GLN A 44 10.000 -2.719 0.274 1.00 0.00 C ATOM 705 O GLN A 44 11.215 -2.540 0.194 1.00 0.00 O ATOM 706 CB GLN A 44 9.353 -5.036 0.960 1.00 0.00 C ATOM 707 CG GLN A 44 9.536 -6.015 2.108 1.00 0.00 C ATOM 708 CD GLN A 44 8.223 -6.594 2.596 1.00 0.00 C ATOM 709 OE1 GLN A 44 7.269 -6.729 1.830 1.00 0.00 O ATOM 710 NE2 GLN A 44 8.168 -6.940 3.877 1.00 0.00 N ATOM 0 H GLN A 44 7.332 -3.779 1.603 1.00 0.00 H new ATOM 0 HA GLN A 44 10.044 -3.484 2.272 1.00 0.00 H new ATOM 0 HB2 GLN A 44 8.395 -5.229 0.478 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.127 -5.215 0.214 1.00 0.00 H new ATOM 0 HG2 GLN A 44 10.190 -6.826 1.788 1.00 0.00 H new ATOM 0 HG3 GLN A 44 10.036 -5.510 2.935 1.00 0.00 H new ATOM 0 HE21 GLN A 44 8.984 -6.810 4.476 1.00 0.00 H new ATOM 0 HE22 GLN A 44 7.310 -7.335 4.262 1.00 0.00 H new ATOM 719 N ILE A 45 9.131 -2.191 -0.583 1.00 0.00 N ATOM 720 CA ILE A 45 9.566 -1.354 -1.693 1.00 0.00 C ATOM 721 C ILE A 45 10.208 -0.068 -1.185 1.00 0.00 C ATOM 722 O ILE A 45 11.184 0.415 -1.752 1.00 0.00 O ATOM 723 CB ILE A 45 8.387 -1.009 -2.627 1.00 0.00 C ATOM 724 CG1 ILE A 45 7.832 -2.282 -3.270 1.00 0.00 C ATOM 725 CG2 ILE A 45 8.817 -0.015 -3.700 1.00 0.00 C ATOM 726 CD1 ILE A 45 6.390 -2.159 -3.708 1.00 0.00 C ATOM 0 H ILE A 45 8.122 -2.329 -0.529 1.00 0.00 H new ATOM 0 HA ILE A 45 10.305 -1.922 -2.258 1.00 0.00 H new ATOM 0 HB ILE A 45 7.601 -0.545 -2.031 1.00 0.00 H new ATOM 0 HG12 ILE A 45 8.445 -2.540 -4.134 1.00 0.00 H new ATOM 0 HG13 ILE A 45 7.919 -3.105 -2.561 1.00 0.00 H new ATOM 0 HG21 ILE A 45 7.969 0.213 -4.346 1.00 0.00 H new ATOM 0 HG22 ILE A 45 9.169 0.902 -3.227 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.621 -0.448 -4.296 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.064 -3.098 -4.155 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.765 -1.932 -2.844 1.00 0.00 H new ATOM 0 HD13 ILE A 45 6.300 -1.358 -4.442 1.00 0.00 H new ATOM 738 N LEU A 46 9.658 0.483 -0.110 1.00 0.00 N ATOM 739 CA LEU A 46 10.190 1.711 0.466 1.00 0.00 C ATOM 740 C LEU A 46 11.417 1.421 1.326 1.00 0.00 C ATOM 741 O LEU A 46 12.263 2.291 1.531 1.00 0.00 O ATOM 742 CB LEU A 46 9.119 2.421 1.299 1.00 0.00 C ATOM 743 CG LEU A 46 7.698 2.357 0.733 1.00 0.00 C ATOM 744 CD1 LEU A 46 6.805 3.376 1.423 1.00 0.00 C ATOM 745 CD2 LEU A 46 7.703 2.590 -0.770 1.00 0.00 C ATOM 0 H LEU A 46 8.848 0.101 0.378 1.00 0.00 H new ATOM 0 HA LEU A 46 10.490 2.365 -0.353 1.00 0.00 H new ATOM 0 HB2 LEU A 46 9.114 1.987 2.299 1.00 0.00 H new ATOM 0 HB3 LEU A 46 9.402 3.468 1.407 1.00 0.00 H new ATOM 0 HG LEU A 46 7.301 1.360 0.923 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.798 3.317 1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.770 3.165 2.492 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.205 4.377 1.264 1.00 0.00 H new ATOM 0 HD21 LEU A 46 6.682 2.540 -1.149 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.122 3.573 -0.984 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.308 1.824 -1.255 1.00 0.00 H new ATOM 757 N LYS A 47 11.509 0.191 1.823 1.00 0.00 N ATOM 758 CA LYS A 47 12.635 -0.214 2.656 1.00 0.00 C ATOM 759 C LYS A 47 13.818 -0.653 1.797 1.00 0.00 C ATOM 760 O LYS A 47 14.968 -0.595 2.233 1.00 0.00 O ATOM 761 CB LYS A 47 12.220 -1.349 3.593 1.00 0.00 C ATOM 762 CG LYS A 47 13.094 -1.465 4.831 1.00 0.00 C ATOM 763 CD LYS A 47 13.252 -2.912 5.269 1.00 0.00 C ATOM 764 CE LYS A 47 12.188 -3.307 6.280 1.00 0.00 C ATOM 765 NZ LYS A 47 12.412 -2.661 7.604 1.00 0.00 N ATOM 0 H LYS A 47 10.817 -0.542 1.663 1.00 0.00 H new ATOM 0 HA LYS A 47 12.942 0.646 3.252 1.00 0.00 H new ATOM 0 HB2 LYS A 47 11.186 -1.195 3.901 1.00 0.00 H new ATOM 0 HB3 LYS A 47 12.252 -2.291 3.046 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.075 -1.037 4.626 1.00 0.00 H new ATOM 0 HG3 LYS A 47 12.656 -0.884 5.643 1.00 0.00 H new ATOM 0 HD2 LYS A 47 13.189 -3.566 4.399 1.00 0.00 H new ATOM 0 HD3 LYS A 47 14.241 -3.056 5.705 1.00 0.00 H new ATOM 0 HE2 LYS A 47 11.205 -3.027 5.901 1.00 0.00 H new ATOM 0 HE3 LYS A 47 12.186 -4.390 6.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 11.887 -3.180 8.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 13.427 -2.675 7.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 12.078 -1.677 7.571 1.00 0.00 H new ATOM 779 N GLU A 48 13.529 -1.094 0.575 1.00 0.00 N ATOM 780 CA GLU A 48 14.572 -1.544 -0.341 1.00 0.00 C ATOM 781 C GLU A 48 15.599 -0.437 -0.585 1.00 0.00 C ATOM 782 O GLU A 48 15.233 0.712 -0.837 1.00 0.00 O ATOM 783 CB GLU A 48 13.955 -1.982 -1.670 1.00 0.00 C ATOM 784 CG GLU A 48 13.563 -3.451 -1.703 1.00 0.00 C ATOM 785 CD GLU A 48 12.767 -3.814 -2.942 1.00 0.00 C ATOM 786 OE1 GLU A 48 13.390 -4.109 -3.983 1.00 0.00 O ATOM 787 OE2 GLU A 48 11.520 -3.803 -2.869 1.00 0.00 O ATOM 0 H GLU A 48 12.583 -1.149 0.197 1.00 0.00 H new ATOM 0 HA GLU A 48 15.081 -2.393 0.115 1.00 0.00 H new ATOM 0 HB2 GLU A 48 13.072 -1.374 -1.869 1.00 0.00 H new ATOM 0 HB3 GLU A 48 14.665 -1.786 -2.473 1.00 0.00 H new ATOM 0 HG2 GLU A 48 14.463 -4.065 -1.661 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.975 -3.686 -0.816 1.00 0.00 H new ATOM 794 N PRO A 49 16.903 -0.764 -0.513 1.00 0.00 N ATOM 795 CA PRO A 49 17.975 0.216 -0.728 1.00 0.00 C ATOM 796 C PRO A 49 17.852 0.923 -2.073 1.00 0.00 C ATOM 797 O PRO A 49 17.671 2.140 -2.131 1.00 0.00 O ATOM 798 CB PRO A 49 19.252 -0.628 -0.686 1.00 0.00 C ATOM 799 CG PRO A 49 18.883 -1.844 0.091 1.00 0.00 C ATOM 800 CD PRO A 49 17.436 -2.107 -0.216 1.00 0.00 C ATOM 0 HA PRO A 49 17.951 1.011 0.018 1.00 0.00 H new ATOM 0 HB2 PRO A 49 19.587 -0.888 -1.690 1.00 0.00 H new ATOM 0 HB3 PRO A 49 20.068 -0.086 -0.208 1.00 0.00 H new ATOM 0 HG2 PRO A 49 19.503 -2.693 -0.195 1.00 0.00 H new ATOM 0 HG3 PRO A 49 19.033 -1.685 1.159 1.00 0.00 H new ATOM 0 HD2 PRO A 49 17.321 -2.782 -1.064 1.00 0.00 H new ATOM 0 HD3 PRO A 49 16.922 -2.566 0.629 1.00 0.00 H new ATOM 808 N LYS A 50 17.952 0.155 -3.153 1.00 0.00 N ATOM 809 CA LYS A 50 17.852 0.710 -4.500 1.00 0.00 C ATOM 810 C LYS A 50 16.543 1.470 -4.682 1.00 0.00 C ATOM 811 O LYS A 50 16.472 2.432 -5.447 1.00 0.00 O ATOM 812 CB LYS A 50 17.956 -0.406 -5.542 1.00 0.00 C ATOM 813 CG LYS A 50 19.388 -0.777 -5.895 1.00 0.00 C ATOM 814 CD LYS A 50 19.436 -1.915 -6.900 1.00 0.00 C ATOM 815 CE LYS A 50 20.821 -2.537 -6.971 1.00 0.00 C ATOM 816 NZ LYS A 50 20.942 -3.731 -6.090 1.00 0.00 N ATOM 0 H LYS A 50 18.102 -0.853 -3.123 1.00 0.00 H new ATOM 0 HA LYS A 50 18.677 1.408 -4.640 1.00 0.00 H new ATOM 0 HB2 LYS A 50 17.442 -1.291 -5.167 1.00 0.00 H new ATOM 0 HB3 LYS A 50 17.436 -0.095 -6.448 1.00 0.00 H new ATOM 0 HG2 LYS A 50 19.900 0.094 -6.305 1.00 0.00 H new ATOM 0 HG3 LYS A 50 19.924 -1.066 -4.991 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.707 -2.677 -6.623 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.151 -1.544 -7.885 1.00 0.00 H new ATOM 0 HE2 LYS A 50 21.038 -2.823 -8.000 1.00 0.00 H new ATOM 0 HE3 LYS A 50 21.566 -1.796 -6.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.902 -4.124 -6.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 20.761 -3.455 -5.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.249 -4.449 -6.381 1.00 0.00 H new ATOM 830 N MET A 51 15.508 1.033 -3.973 1.00 0.00 N ATOM 831 CA MET A 51 14.201 1.672 -4.054 1.00 0.00 C ATOM 832 C MET A 51 14.176 2.966 -3.248 1.00 0.00 C ATOM 833 O MET A 51 13.584 3.959 -3.670 1.00 0.00 O ATOM 834 CB MET A 51 13.115 0.724 -3.543 1.00 0.00 C ATOM 835 CG MET A 51 13.018 -0.574 -4.326 1.00 0.00 C ATOM 836 SD MET A 51 12.776 -0.305 -6.093 1.00 0.00 S ATOM 837 CE MET A 51 11.081 0.272 -6.117 1.00 0.00 C ATOM 0 H MET A 51 15.550 0.238 -3.335 1.00 0.00 H new ATOM 0 HA MET A 51 14.007 1.911 -5.100 1.00 0.00 H new ATOM 0 HB2 MET A 51 13.311 0.492 -2.496 1.00 0.00 H new ATOM 0 HB3 MET A 51 12.152 1.234 -3.582 1.00 0.00 H new ATOM 0 HG2 MET A 51 13.927 -1.155 -4.172 1.00 0.00 H new ATOM 0 HG3 MET A 51 12.191 -1.168 -3.936 1.00 0.00 H new ATOM 0 HE1 MET A 51 10.892 0.807 -7.047 1.00 0.00 H new ATOM 0 HE2 MET A 51 10.405 -0.580 -6.045 1.00 0.00 H new ATOM 0 HE3 MET A 51 10.912 0.941 -5.273 1.00 0.00 H new ATOM 847 N ALA A 52 14.822 2.947 -2.086 1.00 0.00 N ATOM 848 CA ALA A 52 14.874 4.120 -1.222 1.00 0.00 C ATOM 849 C ALA A 52 15.424 5.331 -1.969 1.00 0.00 C ATOM 850 O ALA A 52 15.088 6.473 -1.652 1.00 0.00 O ATOM 851 CB ALA A 52 15.717 3.830 0.010 1.00 0.00 C ATOM 0 H ALA A 52 15.316 2.132 -1.722 1.00 0.00 H new ATOM 0 HA ALA A 52 13.857 4.353 -0.907 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.747 4.714 0.646 1.00 0.00 H new ATOM 0 HB2 ALA A 52 15.279 2.999 0.563 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.730 3.568 -0.296 1.00 0.00 H new ATOM 857 N ALA A 53 16.268 5.074 -2.962 1.00 0.00 N ATOM 858 CA ALA A 53 16.861 6.144 -3.754 1.00 0.00 C ATOM 859 C ALA A 53 15.925 6.598 -4.875 1.00 0.00 C ATOM 860 O ALA A 53 16.268 7.484 -5.656 1.00 0.00 O ATOM 861 CB ALA A 53 18.194 5.693 -4.332 1.00 0.00 C ATOM 0 H ALA A 53 16.556 4.135 -3.237 1.00 0.00 H new ATOM 0 HA ALA A 53 17.027 6.995 -3.093 1.00 0.00 H new ATOM 0 HB1 ALA A 53 18.627 6.501 -4.922 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.873 5.432 -3.520 1.00 0.00 H new ATOM 0 HB3 ALA A 53 18.038 4.822 -4.969 1.00 0.00 H new ATOM 867 N SER A 54 14.743 5.988 -4.951 1.00 0.00 N ATOM 868 CA SER A 54 13.771 6.339 -5.981 1.00 0.00 C ATOM 869 C SER A 54 12.461 6.815 -5.359 1.00 0.00 C ATOM 870 O SER A 54 11.855 7.777 -5.828 1.00 0.00 O ATOM 871 CB SER A 54 13.508 5.139 -6.892 1.00 0.00 C ATOM 872 OG SER A 54 14.711 4.662 -7.468 1.00 0.00 O ATOM 0 H SER A 54 14.438 5.252 -4.314 1.00 0.00 H new ATOM 0 HA SER A 54 14.187 7.154 -6.573 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.034 4.341 -6.320 1.00 0.00 H new ATOM 0 HB3 SER A 54 12.811 5.423 -7.681 1.00 0.00 H new ATOM 0 HG SER A 54 14.516 3.894 -8.044 1.00 0.00 H new ATOM 878 N LEU A 55 12.028 6.135 -4.304 1.00 0.00 N ATOM 879 CA LEU A 55 10.788 6.490 -3.624 1.00 0.00 C ATOM 880 C LEU A 55 10.988 7.694 -2.708 1.00 0.00 C ATOM 881 O LEU A 55 10.053 8.450 -2.448 1.00 0.00 O ATOM 882 CB LEU A 55 10.267 5.298 -2.819 1.00 0.00 C ATOM 883 CG LEU A 55 9.838 4.093 -3.660 1.00 0.00 C ATOM 884 CD1 LEU A 55 10.341 2.799 -3.039 1.00 0.00 C ATOM 885 CD2 LEU A 55 8.324 4.060 -3.812 1.00 0.00 C ATOM 0 H LEU A 55 12.517 5.335 -3.901 1.00 0.00 H new ATOM 0 HA LEU A 55 10.052 6.758 -4.382 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.044 4.980 -2.124 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.418 5.626 -2.220 1.00 0.00 H new ATOM 0 HG LEU A 55 10.281 4.192 -4.651 1.00 0.00 H new ATOM 0 HD11 LEU A 55 10.025 1.955 -3.652 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.429 2.821 -2.984 1.00 0.00 H new ATOM 0 HD13 LEU A 55 9.929 2.693 -2.035 1.00 0.00 H new ATOM 0 HD21 LEU A 55 8.037 3.197 -4.413 1.00 0.00 H new ATOM 0 HD22 LEU A 55 7.861 3.987 -2.828 1.00 0.00 H new ATOM 0 HD23 LEU A 55 7.988 4.972 -4.304 1.00 0.00 H new ATOM 897 N LEU A 56 12.214 7.868 -2.222 1.00 0.00 N ATOM 898 CA LEU A 56 12.534 8.981 -1.338 1.00 0.00 C ATOM 899 C LEU A 56 13.066 10.175 -2.128 1.00 0.00 C ATOM 900 O LEU A 56 13.002 11.314 -1.666 1.00 0.00 O ATOM 901 CB LEU A 56 13.565 8.550 -0.293 1.00 0.00 C ATOM 902 CG LEU A 56 13.737 9.514 0.882 1.00 0.00 C ATOM 903 CD1 LEU A 56 14.110 8.754 2.145 1.00 0.00 C ATOM 904 CD2 LEU A 56 14.790 10.565 0.560 1.00 0.00 C ATOM 0 H LEU A 56 13.001 7.252 -2.426 1.00 0.00 H new ATOM 0 HA LEU A 56 11.616 9.283 -0.834 1.00 0.00 H new ATOM 0 HB2 LEU A 56 13.278 7.573 0.097 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.529 8.426 -0.786 1.00 0.00 H new ATOM 0 HG LEU A 56 12.787 10.020 1.054 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.228 9.456 2.970 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.323 8.040 2.386 1.00 0.00 H new ATOM 0 HD13 LEU A 56 15.047 8.221 1.985 1.00 0.00 H new ATOM 0 HD21 LEU A 56 14.899 11.242 1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 56 15.744 10.076 0.361 1.00 0.00 H new ATOM 0 HD23 LEU A 56 14.482 11.131 -0.319 1.00 0.00 H new ATOM 916 N ASN A 57 13.594 9.908 -3.320 1.00 0.00 N ATOM 917 CA ASN A 57 14.140 10.963 -4.166 1.00 0.00 C ATOM 918 C ASN A 57 13.028 11.832 -4.748 1.00 0.00 C ATOM 919 O ASN A 57 12.055 11.319 -5.301 1.00 0.00 O ATOM 920 CB ASN A 57 14.970 10.354 -5.298 1.00 0.00 C ATOM 921 CG ASN A 57 16.098 11.266 -5.742 1.00 0.00 C ATOM 922 OD1 ASN A 57 16.678 11.993 -4.936 1.00 0.00 O ATOM 923 ND2 ASN A 57 16.412 11.233 -7.032 1.00 0.00 N ATOM 0 H ASN A 57 13.655 8.972 -3.720 1.00 0.00 H new ATOM 0 HA ASN A 57 14.780 11.593 -3.548 1.00 0.00 H new ATOM 0 HB2 ASN A 57 15.385 9.401 -4.969 1.00 0.00 H new ATOM 0 HB3 ASN A 57 14.321 10.143 -6.148 1.00 0.00 H new ATOM 0 HD21 ASN A 57 17.161 11.826 -7.390 1.00 0.00 H new ATOM 0 HD22 ASN A 57 15.904 10.615 -7.665 1.00 0.00 H new ATOM 930 N PRO A 58 13.160 13.167 -4.640 1.00 0.00 N ATOM 931 CA PRO A 58 12.165 14.104 -5.164 1.00 0.00 C ATOM 932 C PRO A 58 12.301 14.320 -6.670 1.00 0.00 C ATOM 933 O PRO A 58 11.595 15.141 -7.254 1.00 0.00 O ATOM 934 CB PRO A 58 12.479 15.393 -4.410 1.00 0.00 C ATOM 935 CG PRO A 58 13.948 15.331 -4.167 1.00 0.00 C ATOM 936 CD PRO A 58 14.291 13.872 -3.999 1.00 0.00 C ATOM 0 HA PRO A 58 11.146 13.742 -5.024 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.210 16.272 -4.996 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.923 15.451 -3.474 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.498 15.766 -5.001 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.219 15.899 -3.277 1.00 0.00 H new ATOM 0 HD2 PRO A 58 15.239 13.626 -4.478 1.00 0.00 H new ATOM 0 HD3 PRO A 58 14.386 13.602 -2.947 1.00 0.00 H new ATOM 944 N TYR A 59 13.216 13.581 -7.292 1.00 0.00 N ATOM 945 CA TYR A 59 13.448 13.692 -8.727 1.00 0.00 C ATOM 946 C TYR A 59 12.506 12.779 -9.506 1.00 0.00 C ATOM 947 O TYR A 59 12.223 13.020 -10.680 1.00 0.00 O ATOM 948 CB TYR A 59 14.901 13.346 -9.052 1.00 0.00 C ATOM 949 CG TYR A 59 15.897 14.338 -8.492 1.00 0.00 C ATOM 950 CD1 TYR A 59 15.997 14.554 -7.123 1.00 0.00 C ATOM 951 CD2 TYR A 59 16.734 15.060 -9.333 1.00 0.00 C ATOM 952 CE1 TYR A 59 16.903 15.460 -6.608 1.00 0.00 C ATOM 953 CE2 TYR A 59 17.643 15.969 -8.825 1.00 0.00 C ATOM 954 CZ TYR A 59 17.723 16.165 -7.462 1.00 0.00 C ATOM 955 OH TYR A 59 18.627 17.069 -6.953 1.00 0.00 O ATOM 0 H TYR A 59 13.810 12.898 -6.822 1.00 0.00 H new ATOM 0 HA TYR A 59 13.249 14.721 -9.025 1.00 0.00 H new ATOM 0 HB2 TYR A 59 15.127 12.355 -8.659 1.00 0.00 H new ATOM 0 HB3 TYR A 59 15.021 13.294 -10.134 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.355 14.004 -6.450 1.00 0.00 H new ATOM 0 HD2 TYR A 59 16.674 14.909 -10.401 1.00 0.00 H new ATOM 0 HE1 TYR A 59 16.969 15.615 -5.541 1.00 0.00 H new ATOM 0 HE2 TYR A 59 18.287 16.523 -9.492 1.00 0.00 H new ATOM 0 HH TYR A 59 19.128 17.480 -7.688 1.00 0.00 H new ATOM 965 N VAL A 60 12.022 11.730 -8.847 1.00 0.00 N ATOM 966 CA VAL A 60 11.110 10.784 -9.483 1.00 0.00 C ATOM 967 C VAL A 60 9.704 11.368 -9.626 1.00 0.00 C ATOM 968 O VAL A 60 8.827 10.748 -10.225 1.00 0.00 O ATOM 969 CB VAL A 60 11.026 9.460 -8.697 1.00 0.00 C ATOM 970 CG1 VAL A 60 10.442 8.360 -9.568 1.00 0.00 C ATOM 971 CG2 VAL A 60 12.399 9.060 -8.172 1.00 0.00 C ATOM 0 H VAL A 60 12.245 11.514 -7.875 1.00 0.00 H new ATOM 0 HA VAL A 60 11.516 10.585 -10.475 1.00 0.00 H new ATOM 0 HB VAL A 60 10.365 9.608 -7.843 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.390 7.433 -8.997 1.00 0.00 H new ATOM 0 HG12 VAL A 60 9.440 8.644 -9.890 1.00 0.00 H new ATOM 0 HG13 VAL A 60 11.076 8.213 -10.442 1.00 0.00 H new ATOM 0 HG21 VAL A 60 12.319 8.123 -7.620 1.00 0.00 H new ATOM 0 HG22 VAL A 60 13.085 8.930 -9.009 1.00 0.00 H new ATOM 0 HG23 VAL A 60 12.777 9.840 -7.511 1.00 0.00 H new ATOM 981 N LYS A 61 9.494 12.564 -9.079 1.00 0.00 N ATOM 982 CA LYS A 61 8.195 13.223 -9.156 1.00 0.00 C ATOM 983 C LYS A 61 7.095 12.342 -8.575 1.00 0.00 C ATOM 984 O LYS A 61 7.359 11.245 -8.079 1.00 0.00 O ATOM 985 CB LYS A 61 7.867 13.576 -10.608 1.00 0.00 C ATOM 986 CG LYS A 61 7.107 14.884 -10.759 1.00 0.00 C ATOM 987 CD LYS A 61 7.491 15.604 -12.041 1.00 0.00 C ATOM 988 CE LYS A 61 6.415 16.591 -12.468 1.00 0.00 C ATOM 989 NZ LYS A 61 6.601 17.040 -13.876 1.00 0.00 N ATOM 0 H LYS A 61 10.207 13.095 -8.579 1.00 0.00 H new ATOM 0 HA LYS A 61 8.247 14.138 -8.566 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.795 13.637 -11.177 1.00 0.00 H new ATOM 0 HB3 LYS A 61 7.277 12.770 -11.045 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.035 14.686 -10.758 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.313 15.527 -9.903 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.434 16.132 -11.895 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.653 14.875 -12.835 1.00 0.00 H new ATOM 0 HE2 LYS A 61 5.434 16.128 -12.361 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.433 17.456 -11.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 5.848 17.711 -14.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.526 17.505 -13.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 6.559 16.218 -14.511 1.00 0.00 H new ATOM 1003 N ARG A 62 5.860 12.828 -8.642 1.00 0.00 N ATOM 1004 CA ARG A 62 4.717 12.086 -8.124 1.00 0.00 C ATOM 1005 C ARG A 62 3.931 11.439 -9.260 1.00 0.00 C ATOM 1006 O ARG A 62 3.319 10.386 -9.081 1.00 0.00 O ATOM 1007 CB ARG A 62 3.804 13.013 -7.319 1.00 0.00 C ATOM 1008 CG ARG A 62 3.178 14.121 -8.147 1.00 0.00 C ATOM 1009 CD ARG A 62 1.929 14.677 -7.482 1.00 0.00 C ATOM 1010 NE ARG A 62 1.063 15.368 -8.435 1.00 0.00 N ATOM 1011 CZ ARG A 62 1.295 16.597 -8.891 1.00 0.00 C ATOM 1012 NH1 ARG A 62 2.362 17.273 -8.485 1.00 0.00 N ATOM 1013 NH2 ARG A 62 0.456 17.152 -9.756 1.00 0.00 N ATOM 0 H ARG A 62 5.625 13.733 -9.050 1.00 0.00 H new ATOM 0 HA ARG A 62 5.091 11.299 -7.470 1.00 0.00 H new ATOM 0 HB2 ARG A 62 3.011 12.421 -6.862 1.00 0.00 H new ATOM 0 HB3 ARG A 62 4.378 13.458 -6.507 1.00 0.00 H new ATOM 0 HG2 ARG A 62 3.902 14.923 -8.291 1.00 0.00 H new ATOM 0 HG3 ARG A 62 2.925 13.739 -9.136 1.00 0.00 H new ATOM 0 HD2 ARG A 62 1.375 13.864 -7.013 1.00 0.00 H new ATOM 0 HD3 ARG A 62 2.217 15.366 -6.688 1.00 0.00 H new ATOM 0 HE ARG A 62 0.232 14.880 -8.770 1.00 0.00 H new ATOM 0 HH11 ARG A 62 3.010 16.851 -7.820 1.00 0.00 H new ATOM 0 HH12 ARG A 62 2.534 18.214 -8.838 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -0.366 16.637 -10.071 1.00 0.00 H new ATOM 0 HH22 ARG A 62 0.633 18.094 -10.106 1.00 0.00 H new ATOM 1027 N SER A 63 3.951 12.074 -10.427 1.00 0.00 N ATOM 1028 CA SER A 63 3.240 11.557 -11.590 1.00 0.00 C ATOM 1029 C SER A 63 4.118 10.600 -12.390 1.00 0.00 C ATOM 1030 O SER A 63 3.615 9.759 -13.134 1.00 0.00 O ATOM 1031 CB SER A 63 2.764 12.705 -12.481 1.00 0.00 C ATOM 1032 OG SER A 63 3.843 13.266 -13.209 1.00 0.00 O ATOM 0 H SER A 63 4.452 12.947 -10.592 1.00 0.00 H new ATOM 0 HA SER A 63 2.371 11.005 -11.232 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.004 12.342 -13.173 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.295 13.475 -11.868 1.00 0.00 H new ATOM 0 HG SER A 63 3.513 13.997 -13.772 1.00 0.00 H new ATOM 1038 N VAL A 64 5.430 10.723 -12.225 1.00 0.00 N ATOM 1039 CA VAL A 64 6.363 9.854 -12.923 1.00 0.00 C ATOM 1040 C VAL A 64 6.664 8.627 -12.074 1.00 0.00 C ATOM 1041 O VAL A 64 6.840 7.524 -12.592 1.00 0.00 O ATOM 1042 CB VAL A 64 7.679 10.582 -13.260 1.00 0.00 C ATOM 1043 CG1 VAL A 64 8.594 9.686 -14.081 1.00 0.00 C ATOM 1044 CG2 VAL A 64 7.394 11.883 -13.994 1.00 0.00 C ATOM 0 H VAL A 64 5.868 11.414 -11.616 1.00 0.00 H new ATOM 0 HA VAL A 64 5.895 9.552 -13.860 1.00 0.00 H new ATOM 0 HB VAL A 64 8.189 10.821 -12.327 1.00 0.00 H new ATOM 0 HG11 VAL A 64 9.517 10.219 -14.308 1.00 0.00 H new ATOM 0 HG12 VAL A 64 8.826 8.785 -13.513 1.00 0.00 H new ATOM 0 HG13 VAL A 64 8.096 9.411 -15.011 1.00 0.00 H new ATOM 0 HG21 VAL A 64 8.334 12.384 -14.224 1.00 0.00 H new ATOM 0 HG22 VAL A 64 6.861 11.669 -14.920 1.00 0.00 H new ATOM 0 HG23 VAL A 64 6.783 12.530 -13.364 1.00 0.00 H new ATOM 1054 N LYS A 65 6.704 8.829 -10.762 1.00 0.00 N ATOM 1055 CA LYS A 65 6.962 7.742 -9.830 1.00 0.00 C ATOM 1056 C LYS A 65 5.724 6.866 -9.678 1.00 0.00 C ATOM 1057 O LYS A 65 5.829 5.672 -9.397 1.00 0.00 O ATOM 1058 CB LYS A 65 7.380 8.295 -8.466 1.00 0.00 C ATOM 1059 CG LYS A 65 8.151 7.297 -7.617 1.00 0.00 C ATOM 1060 CD LYS A 65 7.215 6.409 -6.813 1.00 0.00 C ATOM 1061 CE LYS A 65 7.717 4.975 -6.760 1.00 0.00 C ATOM 1062 NZ LYS A 65 7.570 4.285 -8.071 1.00 0.00 N ATOM 0 H LYS A 65 6.561 9.737 -10.321 1.00 0.00 H new ATOM 0 HA LYS A 65 7.776 7.136 -10.228 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.994 9.183 -8.616 1.00 0.00 H new ATOM 0 HB3 LYS A 65 6.489 8.611 -7.922 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.778 6.679 -8.260 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.818 7.832 -6.940 1.00 0.00 H new ATOM 0 HD2 LYS A 65 7.121 6.800 -5.800 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.220 6.431 -7.257 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.766 4.969 -6.462 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.166 4.426 -5.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 7.679 3.259 -7.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.628 4.485 -8.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.300 4.628 -8.728 1.00 0.00 H new ATOM 1076 N VAL A 66 4.547 7.463 -9.870 1.00 0.00 N ATOM 1077 CA VAL A 66 3.297 6.724 -9.755 1.00 0.00 C ATOM 1078 C VAL A 66 3.132 5.752 -10.918 1.00 0.00 C ATOM 1079 O VAL A 66 2.540 4.683 -10.766 1.00 0.00 O ATOM 1080 CB VAL A 66 2.080 7.670 -9.704 1.00 0.00 C ATOM 1081 CG1 VAL A 66 1.938 8.436 -11.010 1.00 0.00 C ATOM 1082 CG2 VAL A 66 0.811 6.890 -9.396 1.00 0.00 C ATOM 0 H VAL A 66 4.437 8.450 -10.104 1.00 0.00 H new ATOM 0 HA VAL A 66 3.342 6.165 -8.820 1.00 0.00 H new ATOM 0 HB VAL A 66 2.241 8.392 -8.904 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.073 9.097 -10.952 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.836 9.028 -11.184 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.802 7.733 -11.831 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.037 7.574 -9.364 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.646 6.143 -10.172 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.914 6.394 -8.431 1.00 0.00 H new ATOM 1092 N LYS A 67 3.665 6.126 -12.079 1.00 0.00 N ATOM 1093 CA LYS A 67 3.578 5.278 -13.262 1.00 0.00 C ATOM 1094 C LYS A 67 4.418 4.020 -13.080 1.00 0.00 C ATOM 1095 O LYS A 67 3.952 2.908 -13.331 1.00 0.00 O ATOM 1096 CB LYS A 67 4.040 6.046 -14.503 1.00 0.00 C ATOM 1097 CG LYS A 67 2.897 6.631 -15.317 1.00 0.00 C ATOM 1098 CD LYS A 67 2.009 7.526 -14.466 1.00 0.00 C ATOM 1099 CE LYS A 67 1.570 8.764 -15.232 1.00 0.00 C ATOM 1100 NZ LYS A 67 0.684 9.638 -14.415 1.00 0.00 N ATOM 0 H LYS A 67 4.159 7.006 -12.224 1.00 0.00 H new ATOM 0 HA LYS A 67 2.537 4.984 -13.399 1.00 0.00 H new ATOM 0 HB2 LYS A 67 4.705 6.852 -14.194 1.00 0.00 H new ATOM 0 HB3 LYS A 67 4.622 5.378 -15.138 1.00 0.00 H new ATOM 0 HG2 LYS A 67 3.300 7.204 -16.152 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.301 5.824 -15.742 1.00 0.00 H new ATOM 0 HD2 LYS A 67 1.131 6.967 -14.142 1.00 0.00 H new ATOM 0 HD3 LYS A 67 2.547 7.825 -13.566 1.00 0.00 H new ATOM 0 HE2 LYS A 67 2.449 9.328 -15.544 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.046 8.463 -16.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 0.407 10.471 -14.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.167 9.108 -14.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 1.192 9.947 -13.562 1.00 0.00 H new ATOM 1114 N SER A 68 5.657 4.201 -12.635 1.00 0.00 N ATOM 1115 CA SER A 68 6.558 3.078 -12.410 1.00 0.00 C ATOM 1116 C SER A 68 5.990 2.139 -11.350 1.00 0.00 C ATOM 1117 O SER A 68 6.288 0.944 -11.341 1.00 0.00 O ATOM 1118 CB SER A 68 7.936 3.581 -11.978 1.00 0.00 C ATOM 1119 OG SER A 68 7.940 3.947 -10.608 1.00 0.00 O ATOM 0 H SER A 68 6.059 5.114 -12.423 1.00 0.00 H new ATOM 0 HA SER A 68 6.660 2.528 -13.345 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.681 2.805 -12.152 1.00 0.00 H new ATOM 0 HB3 SER A 68 8.221 4.439 -12.587 1.00 0.00 H new ATOM 0 HG SER A 68 7.251 4.626 -10.449 1.00 0.00 H new ATOM 1125 N LEU A 69 5.169 2.689 -10.461 1.00 0.00 N ATOM 1126 CA LEU A 69 4.554 1.906 -9.396 1.00 0.00 C ATOM 1127 C LEU A 69 3.596 0.865 -9.969 1.00 0.00 C ATOM 1128 O LEU A 69 3.558 -0.278 -9.511 1.00 0.00 O ATOM 1129 CB LEU A 69 3.808 2.828 -8.429 1.00 0.00 C ATOM 1130 CG LEU A 69 4.531 3.106 -7.108 1.00 0.00 C ATOM 1131 CD1 LEU A 69 4.415 4.575 -6.732 1.00 0.00 C ATOM 1132 CD2 LEU A 69 3.974 2.226 -5.999 1.00 0.00 C ATOM 0 H LEU A 69 4.914 3.677 -10.458 1.00 0.00 H new ATOM 0 HA LEU A 69 5.344 1.385 -8.856 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.620 3.778 -8.929 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.836 2.387 -8.208 1.00 0.00 H new ATOM 0 HG LEU A 69 5.587 2.868 -7.239 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.935 4.752 -5.791 1.00 0.00 H new ATOM 0 HD12 LEU A 69 4.863 5.187 -7.515 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.364 4.840 -6.621 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.500 2.437 -5.068 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.911 2.432 -5.870 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.111 1.177 -6.263 1.00 0.00 H new ATOM 1144 N SER A 70 2.821 1.270 -10.970 1.00 0.00 N ATOM 1145 CA SER A 70 1.857 0.379 -11.604 1.00 0.00 C ATOM 1146 C SER A 70 2.551 -0.652 -12.487 1.00 0.00 C ATOM 1147 O SER A 70 2.000 -1.719 -12.755 1.00 0.00 O ATOM 1148 CB SER A 70 0.851 1.184 -12.429 1.00 0.00 C ATOM 1149 OG SER A 70 -0.123 0.336 -13.013 1.00 0.00 O ATOM 0 H SER A 70 2.842 2.212 -11.360 1.00 0.00 H new ATOM 0 HA SER A 70 1.327 -0.154 -10.814 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.361 1.922 -11.793 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.374 1.734 -13.211 1.00 0.00 H new ATOM 0 HG SER A 70 -0.755 0.874 -13.534 1.00 0.00 H new ATOM 1155 N ASP A 71 3.762 -0.338 -12.931 1.00 0.00 N ATOM 1156 CA ASP A 71 4.518 -1.259 -13.769 1.00 0.00 C ATOM 1157 C ASP A 71 5.368 -2.167 -12.900 1.00 0.00 C ATOM 1158 O ASP A 71 5.501 -3.360 -13.169 1.00 0.00 O ATOM 1159 CB ASP A 71 5.397 -0.492 -14.759 1.00 0.00 C ATOM 1160 CG ASP A 71 5.654 -1.277 -16.031 1.00 0.00 C ATOM 1161 OD1 ASP A 71 4.673 -1.705 -16.673 1.00 0.00 O ATOM 1162 OD2 ASP A 71 6.838 -1.461 -16.385 1.00 0.00 O ATOM 0 H ASP A 71 4.238 0.541 -12.727 1.00 0.00 H new ATOM 0 HA ASP A 71 3.817 -1.868 -14.339 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.917 0.454 -15.010 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.349 -0.251 -14.285 1.00 0.00 H new ATOM 1167 N MET A 72 5.921 -1.598 -11.837 1.00 0.00 N ATOM 1168 CA MET A 72 6.733 -2.365 -10.910 1.00 0.00 C ATOM 1169 C MET A 72 5.847 -3.311 -10.116 1.00 0.00 C ATOM 1170 O MET A 72 6.293 -4.369 -9.673 1.00 0.00 O ATOM 1171 CB MET A 72 7.503 -1.434 -9.967 1.00 0.00 C ATOM 1172 CG MET A 72 6.663 -0.893 -8.821 1.00 0.00 C ATOM 1173 SD MET A 72 7.546 0.315 -7.816 1.00 0.00 S ATOM 1174 CE MET A 72 6.395 0.518 -6.459 1.00 0.00 C ATOM 0 H MET A 72 5.821 -0.611 -11.598 1.00 0.00 H new ATOM 0 HA MET A 72 7.459 -2.948 -11.476 1.00 0.00 H new ATOM 0 HB2 MET A 72 8.357 -1.973 -9.557 1.00 0.00 H new ATOM 0 HB3 MET A 72 7.900 -0.597 -10.541 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.760 -0.433 -9.224 1.00 0.00 H new ATOM 0 HG3 MET A 72 6.344 -1.721 -8.188 1.00 0.00 H new ATOM 0 HE1 MET A 72 6.588 1.466 -5.957 1.00 0.00 H new ATOM 0 HE2 MET A 72 5.375 0.511 -6.843 1.00 0.00 H new ATOM 0 HE3 MET A 72 6.521 -0.300 -5.750 1.00 0.00 H new ATOM 1184 N THR A 73 4.579 -2.931 -9.944 1.00 0.00 N ATOM 1185 CA THR A 73 3.645 -3.768 -9.213 1.00 0.00 C ATOM 1186 C THR A 73 3.530 -5.126 -9.881 1.00 0.00 C ATOM 1187 O THR A 73 3.345 -6.144 -9.213 1.00 0.00 O ATOM 1188 CB THR A 73 2.268 -3.120 -9.116 1.00 0.00 C ATOM 1189 OG1 THR A 73 1.444 -3.880 -8.262 1.00 0.00 O ATOM 1190 CG2 THR A 73 1.545 -3.013 -10.433 1.00 0.00 C ATOM 0 H THR A 73 4.186 -2.059 -10.299 1.00 0.00 H new ATOM 0 HA THR A 73 4.031 -3.891 -8.201 1.00 0.00 H new ATOM 0 HB THR A 73 2.450 -2.113 -8.742 1.00 0.00 H new ATOM 0 HG1 THR A 73 1.942 -4.116 -7.452 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.575 -2.542 -10.278 1.00 0.00 H new ATOM 0 HG22 THR A 73 2.135 -2.411 -11.124 1.00 0.00 H new ATOM 0 HG23 THR A 73 1.402 -4.009 -10.851 1.00 0.00 H new ATOM 1198 N ALA A 74 3.661 -5.142 -11.206 1.00 0.00 N ATOM 1199 CA ALA A 74 3.590 -6.390 -11.949 1.00 0.00 C ATOM 1200 C ALA A 74 4.542 -7.414 -11.342 1.00 0.00 C ATOM 1201 O ALA A 74 4.324 -8.622 -11.446 1.00 0.00 O ATOM 1202 CB ALA A 74 3.916 -6.157 -13.416 1.00 0.00 C ATOM 0 H ALA A 74 3.815 -4.312 -11.779 1.00 0.00 H new ATOM 0 HA ALA A 74 2.574 -6.779 -11.885 1.00 0.00 H new ATOM 0 HB1 ALA A 74 3.858 -7.102 -13.956 1.00 0.00 H new ATOM 0 HB2 ALA A 74 3.201 -5.452 -13.840 1.00 0.00 H new ATOM 0 HB3 ALA A 74 4.923 -5.750 -13.505 1.00 0.00 H new ATOM 1208 N LYS A 75 5.597 -6.918 -10.697 1.00 0.00 N ATOM 1209 CA LYS A 75 6.581 -7.784 -10.063 1.00 0.00 C ATOM 1210 C LYS A 75 6.382 -7.833 -8.549 1.00 0.00 C ATOM 1211 O LYS A 75 6.842 -8.765 -7.890 1.00 0.00 O ATOM 1212 CB LYS A 75 7.997 -7.309 -10.390 1.00 0.00 C ATOM 1213 CG LYS A 75 8.444 -7.654 -11.802 1.00 0.00 C ATOM 1214 CD LYS A 75 9.956 -7.593 -11.938 1.00 0.00 C ATOM 1215 CE LYS A 75 10.411 -8.066 -13.310 1.00 0.00 C ATOM 1216 NZ LYS A 75 11.647 -7.367 -13.757 1.00 0.00 N ATOM 0 H LYS A 75 5.789 -5.921 -10.602 1.00 0.00 H new ATOM 0 HA LYS A 75 6.443 -8.791 -10.457 1.00 0.00 H new ATOM 0 HB2 LYS A 75 8.049 -6.229 -10.255 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.693 -7.753 -9.679 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.094 -8.653 -12.061 1.00 0.00 H new ATOM 0 HG3 LYS A 75 7.986 -6.962 -12.509 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.296 -6.571 -11.773 1.00 0.00 H new ATOM 0 HD3 LYS A 75 10.417 -8.211 -11.167 1.00 0.00 H new ATOM 0 HE2 LYS A 75 10.592 -9.141 -13.282 1.00 0.00 H new ATOM 0 HE3 LYS A 75 9.615 -7.895 -14.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 11.924 -7.718 -14.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.468 -6.344 -13.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 12.414 -7.550 -13.079 1.00 0.00 H new ATOM 1230 N GLU A 76 5.693 -6.833 -7.998 1.00 0.00 N ATOM 1231 CA GLU A 76 5.447 -6.791 -6.563 1.00 0.00 C ATOM 1232 C GLU A 76 4.368 -7.794 -6.173 1.00 0.00 C ATOM 1233 O GLU A 76 4.624 -8.731 -5.417 1.00 0.00 O ATOM 1234 CB GLU A 76 5.030 -5.382 -6.134 1.00 0.00 C ATOM 1235 CG GLU A 76 6.079 -4.322 -6.428 1.00 0.00 C ATOM 1236 CD GLU A 76 7.269 -4.405 -5.493 1.00 0.00 C ATOM 1237 OE1 GLU A 76 7.072 -4.755 -4.310 1.00 0.00 O ATOM 1238 OE2 GLU A 76 8.399 -4.121 -5.944 1.00 0.00 O ATOM 0 H GLU A 76 5.300 -6.050 -8.521 1.00 0.00 H new ATOM 0 HA GLU A 76 6.372 -7.057 -6.051 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.103 -5.115 -6.643 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.817 -5.385 -5.065 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.422 -4.431 -7.457 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.625 -3.334 -6.346 1.00 0.00 H new ATOM 1245 N LYS A 77 3.161 -7.587 -6.703 1.00 0.00 N ATOM 1246 CA LYS A 77 2.020 -8.465 -6.428 1.00 0.00 C ATOM 1247 C LYS A 77 0.704 -7.740 -6.697 1.00 0.00 C ATOM 1248 O LYS A 77 -0.264 -8.342 -7.163 1.00 0.00 O ATOM 1249 CB LYS A 77 2.041 -8.961 -4.976 1.00 0.00 C ATOM 1250 CG LYS A 77 2.534 -10.391 -4.829 1.00 0.00 C ATOM 1251 CD LYS A 77 3.056 -10.659 -3.427 1.00 0.00 C ATOM 1252 CE LYS A 77 2.962 -12.133 -3.070 1.00 0.00 C ATOM 1253 NZ LYS A 77 3.826 -12.972 -3.944 1.00 0.00 N ATOM 0 H LYS A 77 2.947 -6.812 -7.331 1.00 0.00 H new ATOM 0 HA LYS A 77 2.100 -9.324 -7.094 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.678 -8.303 -4.385 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.036 -8.888 -4.561 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.722 -11.082 -5.054 1.00 0.00 H new ATOM 0 HG3 LYS A 77 3.324 -10.581 -5.555 1.00 0.00 H new ATOM 0 HD2 LYS A 77 4.093 -10.332 -3.355 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.486 -10.072 -2.707 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.253 -12.274 -2.029 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.927 -12.463 -3.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 3.786 -13.961 -3.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.490 -12.911 -4.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 4.807 -12.631 -3.892 1.00 0.00 H new ATOM 1267 N PHE A 78 0.673 -6.447 -6.385 1.00 0.00 N ATOM 1268 CA PHE A 78 -0.520 -5.634 -6.575 1.00 0.00 C ATOM 1269 C PHE A 78 -1.057 -5.725 -7.985 1.00 0.00 C ATOM 1270 O PHE A 78 -0.612 -6.543 -8.790 1.00 0.00 O ATOM 1271 CB PHE A 78 -0.245 -4.166 -6.267 1.00 0.00 C ATOM 1272 CG PHE A 78 0.901 -3.935 -5.341 1.00 0.00 C ATOM 1273 CD1 PHE A 78 0.928 -4.537 -4.100 1.00 0.00 C ATOM 1274 CD2 PHE A 78 1.957 -3.132 -5.726 1.00 0.00 C ATOM 1275 CE1 PHE A 78 2.001 -4.342 -3.253 1.00 0.00 C ATOM 1276 CE2 PHE A 78 3.027 -2.928 -4.886 1.00 0.00 C ATOM 1277 CZ PHE A 78 3.054 -3.535 -3.644 1.00 0.00 C ATOM 0 H PHE A 78 1.468 -5.939 -5.997 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.263 -6.031 -5.883 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -0.052 -3.641 -7.203 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.142 -3.724 -5.833 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.105 -5.164 -3.789 1.00 0.00 H new ATOM 0 HD2 PHE A 78 1.942 -2.659 -6.697 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.018 -4.820 -2.285 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.845 -2.295 -5.196 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.893 -3.380 -2.982 1.00 0.00 H new ATOM 1287 N SER A 79 -2.012 -4.842 -8.259 1.00 0.00 N ATOM 1288 CA SER A 79 -2.657 -4.736 -9.558 1.00 0.00 C ATOM 1289 C SER A 79 -4.161 -4.539 -9.407 1.00 0.00 C ATOM 1290 O SER A 79 -4.765 -3.771 -10.154 1.00 0.00 O ATOM 1291 CB SER A 79 -2.391 -5.963 -10.438 1.00 0.00 C ATOM 1292 OG SER A 79 -3.263 -5.990 -11.555 1.00 0.00 O ATOM 0 H SER A 79 -2.363 -4.172 -7.574 1.00 0.00 H new ATOM 0 HA SER A 79 -2.224 -3.864 -10.048 1.00 0.00 H new ATOM 0 HB2 SER A 79 -1.356 -5.951 -10.781 1.00 0.00 H new ATOM 0 HB3 SER A 79 -2.521 -6.871 -9.850 1.00 0.00 H new ATOM 0 HG SER A 79 -3.071 -6.781 -12.100 1.00 0.00 H new ATOM 1298 N PRO A 80 -4.809 -5.274 -8.483 1.00 0.00 N ATOM 1299 CA PRO A 80 -6.242 -5.207 -8.296 1.00 0.00 C ATOM 1300 C PRO A 80 -6.715 -4.381 -7.105 1.00 0.00 C ATOM 1301 O PRO A 80 -7.396 -3.371 -7.290 1.00 0.00 O ATOM 1302 CB PRO A 80 -6.588 -6.680 -8.098 1.00 0.00 C ATOM 1303 CG PRO A 80 -5.362 -7.292 -7.469 1.00 0.00 C ATOM 1304 CD PRO A 80 -4.233 -6.288 -7.600 1.00 0.00 C ATOM 0 HA PRO A 80 -6.727 -4.704 -9.133 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.461 -6.797 -7.455 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.825 -7.160 -9.047 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.546 -7.528 -6.421 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -5.103 -8.227 -7.965 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -3.948 -5.870 -6.634 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.338 -6.738 -8.029 1.00 0.00 H new ATOM 1312 N LEU A 81 -6.386 -4.798 -5.886 1.00 0.00 N ATOM 1313 CA LEU A 81 -6.833 -4.057 -4.715 1.00 0.00 C ATOM 1314 C LEU A 81 -5.715 -3.195 -4.180 1.00 0.00 C ATOM 1315 O LEU A 81 -5.792 -2.646 -3.082 1.00 0.00 O ATOM 1316 CB LEU A 81 -7.361 -5.007 -3.650 1.00 0.00 C ATOM 1317 CG LEU A 81 -8.700 -5.658 -4.015 1.00 0.00 C ATOM 1318 CD1 LEU A 81 -8.538 -7.161 -4.167 1.00 0.00 C ATOM 1319 CD2 LEU A 81 -9.772 -5.328 -2.982 1.00 0.00 C ATOM 0 H LEU A 81 -5.824 -5.626 -5.687 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.652 -3.400 -5.007 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.622 -5.789 -3.475 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.476 -4.461 -2.713 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.025 -5.249 -4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -9.499 -7.606 -4.426 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -7.816 -7.371 -4.956 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -8.183 -7.585 -3.228 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.711 -5.803 -3.267 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -9.461 -5.697 -2.004 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.912 -4.248 -2.935 1.00 0.00 H new ATOM 1331 N THR A 82 -4.680 -3.073 -4.988 1.00 0.00 N ATOM 1332 CA THR A 82 -3.533 -2.274 -4.650 1.00 0.00 C ATOM 1333 C THR A 82 -3.177 -1.345 -5.803 1.00 0.00 C ATOM 1334 O THR A 82 -2.262 -0.537 -5.688 1.00 0.00 O ATOM 1335 CB THR A 82 -2.359 -3.169 -4.311 1.00 0.00 C ATOM 1336 OG1 THR A 82 -2.735 -4.533 -4.361 1.00 0.00 O ATOM 1337 CG2 THR A 82 -1.775 -2.891 -2.945 1.00 0.00 C ATOM 0 H THR A 82 -4.617 -3.529 -5.898 1.00 0.00 H new ATOM 0 HA THR A 82 -3.773 -1.665 -3.778 1.00 0.00 H new ATOM 0 HB THR A 82 -1.598 -2.950 -5.060 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.359 -4.727 -3.631 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.938 -3.565 -2.763 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.426 -1.859 -2.902 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.539 -3.048 -2.184 1.00 0.00 H new ATOM 1345 N SER A 83 -3.913 -1.448 -6.918 1.00 0.00 N ATOM 1346 CA SER A 83 -3.653 -0.591 -8.064 1.00 0.00 C ATOM 1347 C SER A 83 -4.367 0.748 -7.905 1.00 0.00 C ATOM 1348 O SER A 83 -4.677 1.430 -8.881 1.00 0.00 O ATOM 1349 CB SER A 83 -4.099 -1.263 -9.360 1.00 0.00 C ATOM 1350 OG SER A 83 -3.010 -1.890 -10.011 1.00 0.00 O ATOM 0 H SER A 83 -4.680 -2.108 -7.043 1.00 0.00 H new ATOM 0 HA SER A 83 -2.578 -0.417 -8.113 1.00 0.00 H new ATOM 0 HB2 SER A 83 -4.871 -2.001 -9.143 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.545 -0.521 -10.023 1.00 0.00 H new ATOM 0 HG SER A 83 -3.280 -2.160 -10.913 1.00 0.00 H new ATOM 1356 N ASN A 84 -4.599 1.109 -6.658 1.00 0.00 N ATOM 1357 CA ASN A 84 -5.247 2.355 -6.295 1.00 0.00 C ATOM 1358 C ASN A 84 -4.565 2.852 -5.044 1.00 0.00 C ATOM 1359 O ASN A 84 -4.179 4.016 -4.935 1.00 0.00 O ATOM 1360 CB ASN A 84 -6.743 2.146 -6.050 1.00 0.00 C ATOM 1361 CG ASN A 84 -7.501 1.839 -7.327 1.00 0.00 C ATOM 1362 OD1 ASN A 84 -7.384 0.749 -7.886 1.00 0.00 O ATOM 1363 ND2 ASN A 84 -8.285 2.803 -7.796 1.00 0.00 N ATOM 0 H ASN A 84 -4.338 0.536 -5.855 1.00 0.00 H new ATOM 0 HA ASN A 84 -5.161 3.083 -7.102 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -6.882 1.328 -5.343 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.161 3.041 -5.589 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -8.820 2.654 -8.652 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -8.352 3.692 -7.300 1.00 0.00 H new ATOM 1370 N LEU A 85 -4.359 1.916 -4.124 1.00 0.00 N ATOM 1371 CA LEU A 85 -3.654 2.197 -2.900 1.00 0.00 C ATOM 1372 C LEU A 85 -2.188 2.454 -3.239 1.00 0.00 C ATOM 1373 O LEU A 85 -1.455 3.050 -2.449 1.00 0.00 O ATOM 1374 CB LEU A 85 -3.791 1.018 -1.924 1.00 0.00 C ATOM 1375 CG LEU A 85 -2.759 0.980 -0.791 1.00 0.00 C ATOM 1376 CD1 LEU A 85 -3.417 0.576 0.521 1.00 0.00 C ATOM 1377 CD2 LEU A 85 -1.626 0.024 -1.135 1.00 0.00 C ATOM 0 H LEU A 85 -4.677 0.951 -4.214 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.077 3.077 -2.416 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.788 1.046 -1.484 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.719 0.089 -2.490 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.343 1.981 -0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.668 0.555 1.312 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -4.194 1.297 0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -3.861 -0.414 0.416 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.902 0.009 -0.320 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.028 -0.979 -1.282 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.135 0.356 -2.050 1.00 0.00 H new ATOM 1389 N ILE A 86 -1.766 2.009 -4.435 1.00 0.00 N ATOM 1390 CA ILE A 86 -0.393 2.211 -4.870 1.00 0.00 C ATOM 1391 C ILE A 86 -0.151 3.680 -5.201 1.00 0.00 C ATOM 1392 O ILE A 86 0.773 4.303 -4.677 1.00 0.00 O ATOM 1393 CB ILE A 86 -0.035 1.316 -6.091 1.00 0.00 C ATOM 1394 CG1 ILE A 86 0.909 0.191 -5.662 1.00 0.00 C ATOM 1395 CG2 ILE A 86 0.594 2.124 -7.222 1.00 0.00 C ATOM 1396 CD1 ILE A 86 0.257 -0.843 -4.772 1.00 0.00 C ATOM 0 H ILE A 86 -2.356 1.514 -5.104 1.00 0.00 H new ATOM 0 HA ILE A 86 0.258 1.919 -4.046 1.00 0.00 H new ATOM 0 HB ILE A 86 -0.963 0.887 -6.467 1.00 0.00 H new ATOM 0 HG12 ILE A 86 1.300 -0.303 -6.552 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.761 0.624 -5.138 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.829 1.462 -8.055 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -0.106 2.891 -7.554 1.00 0.00 H new ATOM 0 HG23 ILE A 86 1.509 2.597 -6.866 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.987 -1.609 -4.509 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.109 -0.363 -3.864 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.577 -1.304 -5.301 1.00 0.00 H new ATOM 1408 N ASN A 87 -0.991 4.228 -6.074 1.00 0.00 N ATOM 1409 CA ASN A 87 -0.873 5.624 -6.474 1.00 0.00 C ATOM 1410 C ASN A 87 -1.176 6.545 -5.299 1.00 0.00 C ATOM 1411 O ASN A 87 -0.581 7.614 -5.164 1.00 0.00 O ATOM 1412 CB ASN A 87 -1.823 5.927 -7.635 1.00 0.00 C ATOM 1413 CG ASN A 87 -1.602 5.006 -8.819 1.00 0.00 C ATOM 1414 OD1 ASN A 87 -0.498 4.508 -9.035 1.00 0.00 O ATOM 1415 ND2 ASN A 87 -2.654 4.777 -9.595 1.00 0.00 N ATOM 0 H ASN A 87 -1.760 3.726 -6.517 1.00 0.00 H new ATOM 0 HA ASN A 87 0.152 5.801 -6.801 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -2.853 5.832 -7.292 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -1.686 6.961 -7.952 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -2.565 4.167 -10.408 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -3.551 5.211 -9.379 1.00 0.00 H new ATOM 1422 N LEU A 88 -2.104 6.120 -4.449 1.00 0.00 N ATOM 1423 CA LEU A 88 -2.487 6.902 -3.282 1.00 0.00 C ATOM 1424 C LEU A 88 -1.366 6.916 -2.248 1.00 0.00 C ATOM 1425 O LEU A 88 -1.200 7.889 -1.512 1.00 0.00 O ATOM 1426 CB LEU A 88 -3.768 6.341 -2.661 1.00 0.00 C ATOM 1427 CG LEU A 88 -4.780 7.392 -2.205 1.00 0.00 C ATOM 1428 CD1 LEU A 88 -6.175 6.791 -2.126 1.00 0.00 C ATOM 1429 CD2 LEU A 88 -4.373 7.977 -0.861 1.00 0.00 C ATOM 0 H LEU A 88 -2.605 5.237 -4.547 1.00 0.00 H new ATOM 0 HA LEU A 88 -2.671 7.926 -3.605 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -4.249 5.686 -3.388 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.498 5.723 -1.805 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.794 8.197 -2.940 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -6.882 7.554 -1.800 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.468 6.421 -3.109 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.176 5.967 -1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.105 8.723 -0.552 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -4.329 7.182 -0.116 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.393 8.445 -0.950 1.00 0.00 H new ATOM 1441 N LEU A 89 -0.596 5.832 -2.198 1.00 0.00 N ATOM 1442 CA LEU A 89 0.508 5.731 -1.253 1.00 0.00 C ATOM 1443 C LEU A 89 1.712 6.534 -1.737 1.00 0.00 C ATOM 1444 O LEU A 89 2.552 6.952 -0.940 1.00 0.00 O ATOM 1445 CB LEU A 89 0.899 4.266 -1.045 1.00 0.00 C ATOM 1446 CG LEU A 89 0.260 3.597 0.172 1.00 0.00 C ATOM 1447 CD1 LEU A 89 0.707 2.148 0.280 1.00 0.00 C ATOM 1448 CD2 LEU A 89 0.609 4.359 1.442 1.00 0.00 C ATOM 0 H LEU A 89 -0.717 5.016 -2.798 1.00 0.00 H new ATOM 0 HA LEU A 89 0.179 6.146 -0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.626 3.702 -1.937 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.983 4.204 -0.948 1.00 0.00 H new ATOM 0 HG LEU A 89 -0.823 3.614 0.046 1.00 0.00 H new ATOM 0 HD11 LEU A 89 0.242 1.688 1.152 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.408 1.607 -0.618 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.791 2.109 0.384 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.146 3.869 2.299 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.691 4.372 1.573 1.00 0.00 H new ATOM 0 HD23 LEU A 89 0.240 5.382 1.366 1.00 0.00 H new ATOM 1460 N ALA A 90 1.790 6.749 -3.048 1.00 0.00 N ATOM 1461 CA ALA A 90 2.891 7.504 -3.634 1.00 0.00 C ATOM 1462 C ALA A 90 2.422 8.859 -4.160 1.00 0.00 C ATOM 1463 O ALA A 90 3.125 9.509 -4.934 1.00 0.00 O ATOM 1464 CB ALA A 90 3.543 6.701 -4.749 1.00 0.00 C ATOM 0 H ALA A 90 1.104 6.411 -3.723 1.00 0.00 H new ATOM 0 HA ALA A 90 3.626 7.688 -2.850 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.364 7.275 -5.179 1.00 0.00 H new ATOM 0 HB2 ALA A 90 3.928 5.764 -4.346 1.00 0.00 H new ATOM 0 HB3 ALA A 90 2.805 6.487 -5.523 1.00 0.00 H new ATOM 1470 N GLU A 91 1.231 9.283 -3.741 1.00 0.00 N ATOM 1471 CA GLU A 91 0.681 10.563 -4.175 1.00 0.00 C ATOM 1472 C GLU A 91 0.381 11.459 -2.978 1.00 0.00 C ATOM 1473 O GLU A 91 0.827 12.606 -2.923 1.00 0.00 O ATOM 1474 CB GLU A 91 -0.593 10.342 -4.995 1.00 0.00 C ATOM 1475 CG GLU A 91 -1.226 11.631 -5.493 1.00 0.00 C ATOM 1476 CD GLU A 91 -2.222 11.396 -6.611 1.00 0.00 C ATOM 1477 OE1 GLU A 91 -2.790 10.285 -6.677 1.00 0.00 O ATOM 1478 OE2 GLU A 91 -2.434 12.322 -7.422 1.00 0.00 O ATOM 0 H GLU A 91 0.631 8.760 -3.103 1.00 0.00 H new ATOM 0 HA GLU A 91 1.425 11.058 -4.799 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.360 9.707 -5.850 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.318 9.802 -4.386 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.727 12.130 -4.663 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.444 12.304 -5.844 1.00 0.00 H new ATOM 1485 N ASN A 92 -0.375 10.931 -2.024 1.00 0.00 N ATOM 1486 CA ASN A 92 -0.734 11.683 -0.827 1.00 0.00 C ATOM 1487 C ASN A 92 0.512 12.116 -0.061 1.00 0.00 C ATOM 1488 O ASN A 92 0.513 13.148 0.610 1.00 0.00 O ATOM 1489 CB ASN A 92 -1.636 10.843 0.078 1.00 0.00 C ATOM 1490 CG ASN A 92 -3.104 10.989 -0.273 1.00 0.00 C ATOM 1491 OD1 ASN A 92 -3.924 11.344 0.574 1.00 0.00 O ATOM 1492 ND2 ASN A 92 -3.442 10.716 -1.528 1.00 0.00 N ATOM 0 H ASN A 92 -0.752 9.984 -2.055 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.275 12.576 -1.140 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -1.349 9.794 -0.000 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.482 11.139 1.116 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -4.415 10.797 -1.823 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -2.729 10.425 -2.197 1.00 0.00 H new ATOM 1499 N GLY A 93 1.572 11.321 -0.166 1.00 0.00 N ATOM 1500 CA GLY A 93 2.809 11.638 0.522 1.00 0.00 C ATOM 1501 C GLY A 93 3.040 10.759 1.734 1.00 0.00 C ATOM 1502 O GLY A 93 3.677 11.177 2.701 1.00 0.00 O ATOM 0 H GLY A 93 1.596 10.462 -0.716 1.00 0.00 H new ATOM 0 HA2 GLY A 93 3.644 11.526 -0.169 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.791 12.683 0.833 1.00 0.00 H new ATOM 1506 N ARG A 94 2.521 9.537 1.683 1.00 0.00 N ATOM 1507 CA ARG A 94 2.672 8.594 2.786 1.00 0.00 C ATOM 1508 C ARG A 94 3.551 7.415 2.378 1.00 0.00 C ATOM 1509 O ARG A 94 3.369 6.297 2.860 1.00 0.00 O ATOM 1510 CB ARG A 94 1.304 8.089 3.245 1.00 0.00 C ATOM 1511 CG ARG A 94 0.506 9.121 4.027 1.00 0.00 C ATOM 1512 CD ARG A 94 0.709 8.962 5.525 1.00 0.00 C ATOM 1513 NE ARG A 94 0.250 10.134 6.267 1.00 0.00 N ATOM 1514 CZ ARG A 94 -1.032 10.447 6.439 1.00 0.00 C ATOM 1515 NH1 ARG A 94 -1.984 9.679 5.926 1.00 0.00 N ATOM 1516 NH2 ARG A 94 -1.363 11.531 7.128 1.00 0.00 N ATOM 0 H ARG A 94 1.992 9.176 0.889 1.00 0.00 H new ATOM 0 HA ARG A 94 3.155 9.116 3.612 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.728 7.781 2.372 1.00 0.00 H new ATOM 0 HB3 ARG A 94 1.442 7.203 3.864 1.00 0.00 H new ATOM 0 HG2 ARG A 94 0.807 10.123 3.722 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -0.553 9.020 3.789 1.00 0.00 H new ATOM 0 HD2 ARG A 94 0.171 8.080 5.872 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.766 8.793 5.732 1.00 0.00 H new ATOM 0 HE ARG A 94 0.953 10.748 6.677 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.735 8.843 5.396 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -2.965 9.924 6.061 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -0.635 12.124 7.526 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.346 11.771 7.260 1.00 0.00 H new ATOM 1530 N LEU A 95 4.504 7.674 1.488 1.00 0.00 N ATOM 1531 CA LEU A 95 5.411 6.632 1.018 1.00 0.00 C ATOM 1532 C LEU A 95 6.745 6.705 1.747 1.00 0.00 C ATOM 1533 O LEU A 95 7.794 6.387 1.187 1.00 0.00 O ATOM 1534 CB LEU A 95 5.630 6.759 -0.492 1.00 0.00 C ATOM 1535 CG LEU A 95 5.835 5.438 -1.234 1.00 0.00 C ATOM 1536 CD1 LEU A 95 4.642 4.517 -1.024 1.00 0.00 C ATOM 1537 CD2 LEU A 95 6.059 5.691 -2.717 1.00 0.00 C ATOM 0 H LEU A 95 4.668 8.594 1.079 1.00 0.00 H new ATOM 0 HA LEU A 95 4.955 5.665 1.230 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.771 7.271 -0.926 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.500 7.393 -0.665 1.00 0.00 H new ATOM 0 HG LEU A 95 6.721 4.949 -0.830 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.806 3.582 -1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 95 4.525 4.310 0.040 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.740 4.998 -1.402 1.00 0.00 H new ATOM 0 HD21 LEU A 95 6.203 4.740 -3.231 1.00 0.00 H new ATOM 0 HD22 LEU A 95 5.191 6.201 -3.134 1.00 0.00 H new ATOM 0 HD23 LEU A 95 6.944 6.313 -2.850 1.00 0.00 H new ATOM 1549 N THR A 96 6.695 7.118 3.007 1.00 0.00 N ATOM 1550 CA THR A 96 7.893 7.223 3.827 1.00 0.00 C ATOM 1551 C THR A 96 7.783 6.301 5.034 1.00 0.00 C ATOM 1552 O THR A 96 8.761 5.676 5.444 1.00 0.00 O ATOM 1553 CB THR A 96 8.103 8.665 4.286 1.00 0.00 C ATOM 1554 OG1 THR A 96 8.079 9.553 3.183 1.00 0.00 O ATOM 1555 CG2 THR A 96 9.414 8.868 5.011 1.00 0.00 C ATOM 0 H THR A 96 5.834 7.386 3.484 1.00 0.00 H new ATOM 0 HA THR A 96 8.752 6.921 3.227 1.00 0.00 H new ATOM 0 HB THR A 96 7.285 8.875 4.975 1.00 0.00 H new ATOM 0 HG1 THR A 96 8.214 10.471 3.499 1.00 0.00 H new ATOM 0 HG21 THR A 96 9.506 9.912 5.312 1.00 0.00 H new ATOM 0 HG22 THR A 96 9.443 8.231 5.895 1.00 0.00 H new ATOM 0 HG23 THR A 96 10.240 8.608 4.349 1.00 0.00 H new ATOM 1563 N ASN A 97 6.580 6.215 5.588 1.00 0.00 N ATOM 1564 CA ASN A 97 6.323 5.364 6.740 1.00 0.00 C ATOM 1565 C ASN A 97 5.159 4.420 6.455 1.00 0.00 C ATOM 1566 O ASN A 97 4.429 4.026 7.365 1.00 0.00 O ATOM 1567 CB ASN A 97 6.017 6.214 7.974 1.00 0.00 C ATOM 1568 CG ASN A 97 7.223 7.003 8.447 1.00 0.00 C ATOM 1569 OD1 ASN A 97 7.940 6.579 9.354 1.00 0.00 O ATOM 1570 ND2 ASN A 97 7.454 8.157 7.832 1.00 0.00 N ATOM 0 H ASN A 97 5.764 6.728 5.255 1.00 0.00 H new ATOM 0 HA ASN A 97 7.217 4.771 6.935 1.00 0.00 H new ATOM 0 HB2 ASN A 97 5.203 6.902 7.745 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.670 5.567 8.780 1.00 0.00 H new ATOM 0 HD21 ASN A 97 8.252 8.730 8.106 1.00 0.00 H new ATOM 0 HD22 ASN A 97 6.834 8.470 7.085 1.00 0.00 H new ATOM 1577 N THR A 98 4.989 4.064 5.181 1.00 0.00 N ATOM 1578 CA THR A 98 3.909 3.169 4.772 1.00 0.00 C ATOM 1579 C THR A 98 3.815 1.922 5.665 1.00 0.00 C ATOM 1580 O THR A 98 2.714 1.523 6.042 1.00 0.00 O ATOM 1581 CB THR A 98 4.056 2.780 3.293 1.00 0.00 C ATOM 1582 OG1 THR A 98 2.793 2.476 2.731 1.00 0.00 O ATOM 1583 CG2 THR A 98 4.959 1.587 3.042 1.00 0.00 C ATOM 0 H THR A 98 5.585 4.382 4.417 1.00 0.00 H new ATOM 0 HA THR A 98 2.974 3.715 4.895 1.00 0.00 H new ATOM 0 HB THR A 98 4.514 3.652 2.826 1.00 0.00 H new ATOM 0 HG1 THR A 98 2.841 1.616 2.264 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.004 1.384 1.972 1.00 0.00 H new ATOM 0 HG22 THR A 98 5.961 1.804 3.413 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.562 0.714 3.560 1.00 0.00 H new ATOM 1591 N PRO A 99 4.951 1.277 6.020 1.00 0.00 N ATOM 1592 CA PRO A 99 4.945 0.079 6.869 1.00 0.00 C ATOM 1593 C PRO A 99 3.980 0.195 8.047 1.00 0.00 C ATOM 1594 O PRO A 99 3.439 -0.805 8.517 1.00 0.00 O ATOM 1595 CB PRO A 99 6.397 -0.026 7.371 1.00 0.00 C ATOM 1596 CG PRO A 99 7.102 1.186 6.846 1.00 0.00 C ATOM 1597 CD PRO A 99 6.325 1.631 5.643 1.00 0.00 C ATOM 0 HA PRO A 99 4.609 -0.798 6.316 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.432 -0.057 8.460 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.870 -0.940 7.010 1.00 0.00 H new ATOM 0 HG2 PRO A 99 7.138 1.973 7.600 1.00 0.00 H new ATOM 0 HG3 PRO A 99 8.133 0.952 6.580 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.435 2.700 5.458 1.00 0.00 H new ATOM 0 HD3 PRO A 99 6.645 1.116 4.737 1.00 0.00 H new ATOM 1605 N ALA A 100 3.769 1.419 8.518 1.00 0.00 N ATOM 1606 CA ALA A 100 2.869 1.659 9.639 1.00 0.00 C ATOM 1607 C ALA A 100 1.414 1.454 9.230 1.00 0.00 C ATOM 1608 O ALA A 100 0.604 0.952 10.008 1.00 0.00 O ATOM 1609 CB ALA A 100 3.075 3.063 10.188 1.00 0.00 C ATOM 0 H ALA A 100 4.208 2.259 8.141 1.00 0.00 H new ATOM 0 HA ALA A 100 3.102 0.937 10.422 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.397 3.230 11.025 1.00 0.00 H new ATOM 0 HB2 ALA A 100 4.105 3.173 10.528 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.871 3.793 9.405 1.00 0.00 H new ATOM 1615 N VAL A 101 1.091 1.845 8.001 1.00 0.00 N ATOM 1616 CA VAL A 101 -0.265 1.703 7.485 1.00 0.00 C ATOM 1617 C VAL A 101 -0.617 0.237 7.255 1.00 0.00 C ATOM 1618 O VAL A 101 -1.781 -0.154 7.349 1.00 0.00 O ATOM 1619 CB VAL A 101 -0.445 2.476 6.164 1.00 0.00 C ATOM 1620 CG1 VAL A 101 -1.899 2.438 5.712 1.00 0.00 C ATOM 1621 CG2 VAL A 101 0.037 3.911 6.316 1.00 0.00 C ATOM 0 H VAL A 101 1.750 2.263 7.344 1.00 0.00 H new ATOM 0 HA VAL A 101 -0.935 2.120 8.237 1.00 0.00 H new ATOM 0 HB VAL A 101 0.160 1.992 5.397 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.004 2.990 4.778 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -2.206 1.403 5.559 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.529 2.894 6.475 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.098 4.442 5.374 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.538 4.407 7.097 1.00 0.00 H new ATOM 0 HG23 VAL A 101 1.093 3.913 6.586 1.00 0.00 H new ATOM 1631 N ILE A 102 0.394 -0.571 6.954 1.00 0.00 N ATOM 1632 CA ILE A 102 0.187 -1.994 6.711 1.00 0.00 C ATOM 1633 C ILE A 102 -0.166 -2.727 8.001 1.00 0.00 C ATOM 1634 O ILE A 102 -0.918 -3.701 7.986 1.00 0.00 O ATOM 1635 CB ILE A 102 1.438 -2.648 6.089 1.00 0.00 C ATOM 1636 CG1 ILE A 102 1.915 -1.846 4.877 1.00 0.00 C ATOM 1637 CG2 ILE A 102 1.143 -4.088 5.695 1.00 0.00 C ATOM 1638 CD1 ILE A 102 3.387 -2.026 4.577 1.00 0.00 C ATOM 0 H ILE A 102 1.364 -0.265 6.873 1.00 0.00 H new ATOM 0 HA ILE A 102 -0.643 -2.076 6.010 1.00 0.00 H new ATOM 0 HB ILE A 102 2.234 -2.650 6.834 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.335 -2.143 4.003 1.00 0.00 H new ATOM 0 HG13 ILE A 102 1.714 -0.789 5.049 1.00 0.00 H new ATOM 0 HG21 ILE A 102 2.035 -4.536 5.258 1.00 0.00 H new ATOM 0 HG22 ILE A 102 0.849 -4.654 6.579 1.00 0.00 H new ATOM 0 HG23 ILE A 102 0.333 -4.107 4.966 1.00 0.00 H new ATOM 0 HD11 ILE A 102 3.656 -1.429 3.706 1.00 0.00 H new ATOM 0 HD12 ILE A 102 3.976 -1.702 5.435 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.591 -3.077 4.374 1.00 0.00 H new ATOM 1650 N SER A 103 0.382 -2.253 9.115 1.00 0.00 N ATOM 1651 CA SER A 103 0.126 -2.866 10.414 1.00 0.00 C ATOM 1652 C SER A 103 -1.364 -2.867 10.736 1.00 0.00 C ATOM 1653 O SER A 103 -1.908 -3.869 11.204 1.00 0.00 O ATOM 1654 CB SER A 103 0.896 -2.127 11.511 1.00 0.00 C ATOM 1655 OG SER A 103 2.217 -2.627 11.633 1.00 0.00 O ATOM 0 H SER A 103 1.006 -1.447 9.145 1.00 0.00 H new ATOM 0 HA SER A 103 0.468 -3.900 10.371 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.927 -1.062 11.283 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.374 -2.235 12.462 1.00 0.00 H new ATOM 0 HG SER A 103 2.852 -1.955 11.308 1.00 0.00 H new ATOM 1661 N ALA A 104 -2.022 -1.741 10.485 1.00 0.00 N ATOM 1662 CA ALA A 104 -3.451 -1.614 10.749 1.00 0.00 C ATOM 1663 C ALA A 104 -4.246 -2.673 9.994 1.00 0.00 C ATOM 1664 O ALA A 104 -5.227 -3.210 10.507 1.00 0.00 O ATOM 1665 CB ALA A 104 -3.935 -0.221 10.375 1.00 0.00 C ATOM 0 H ALA A 104 -1.589 -0.902 10.099 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.613 -1.769 11.816 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.003 -0.140 10.577 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -3.397 0.522 10.964 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.752 -0.045 9.315 1.00 0.00 H new ATOM 1671 N PHE A 105 -3.815 -2.969 8.772 1.00 0.00 N ATOM 1672 CA PHE A 105 -4.485 -3.966 7.944 1.00 0.00 C ATOM 1673 C PHE A 105 -4.528 -5.321 8.642 1.00 0.00 C ATOM 1674 O PHE A 105 -5.513 -6.048 8.541 1.00 0.00 O ATOM 1675 CB PHE A 105 -3.772 -4.100 6.598 1.00 0.00 C ATOM 1676 CG PHE A 105 -4.653 -4.600 5.486 1.00 0.00 C ATOM 1677 CD1 PHE A 105 -5.235 -5.857 5.546 1.00 0.00 C ATOM 1678 CD2 PHE A 105 -4.893 -3.811 4.372 1.00 0.00 C ATOM 1679 CE1 PHE A 105 -6.036 -6.315 4.521 1.00 0.00 C ATOM 1680 CE2 PHE A 105 -5.694 -4.267 3.343 1.00 0.00 C ATOM 1681 CZ PHE A 105 -6.265 -5.520 3.419 1.00 0.00 C ATOM 0 H PHE A 105 -3.004 -2.533 8.333 1.00 0.00 H new ATOM 0 HA PHE A 105 -5.509 -3.632 7.778 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -3.364 -3.129 6.316 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -2.927 -4.779 6.712 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -5.059 -6.486 6.406 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.449 -2.829 4.308 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -6.483 -7.296 4.582 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -5.873 -3.643 2.480 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.891 -5.878 2.615 1.00 0.00 H new ATOM 1691 N SER A 106 -3.449 -5.658 9.342 1.00 0.00 N ATOM 1692 CA SER A 106 -3.366 -6.933 10.045 1.00 0.00 C ATOM 1693 C SER A 106 -4.348 -6.994 11.209 1.00 0.00 C ATOM 1694 O SER A 106 -4.843 -8.065 11.559 1.00 0.00 O ATOM 1695 CB SER A 106 -1.942 -7.177 10.546 1.00 0.00 C ATOM 1696 OG SER A 106 -1.848 -8.409 11.239 1.00 0.00 O ATOM 0 H SER A 106 -2.623 -5.068 9.437 1.00 0.00 H new ATOM 0 HA SER A 106 -3.633 -7.717 9.337 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.252 -7.177 9.702 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.640 -6.362 11.204 1.00 0.00 H new ATOM 0 HG SER A 106 -0.927 -8.541 11.547 1.00 0.00 H new ATOM 1702 N THR A 107 -4.635 -5.843 11.802 1.00 0.00 N ATOM 1703 CA THR A 107 -5.570 -5.784 12.916 1.00 0.00 C ATOM 1704 C THR A 107 -6.979 -5.533 12.407 1.00 0.00 C ATOM 1705 O THR A 107 -7.958 -5.959 13.020 1.00 0.00 O ATOM 1706 CB THR A 107 -5.160 -4.697 13.911 1.00 0.00 C ATOM 1707 OG1 THR A 107 -3.848 -4.927 14.393 1.00 0.00 O ATOM 1708 CG2 THR A 107 -6.080 -4.603 15.109 1.00 0.00 C ATOM 0 H THR A 107 -4.237 -4.944 11.532 1.00 0.00 H new ATOM 0 HA THR A 107 -5.550 -6.743 13.433 1.00 0.00 H new ATOM 0 HB THR A 107 -5.218 -3.761 13.355 1.00 0.00 H new ATOM 0 HG1 THR A 107 -3.604 -4.220 15.027 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.732 -3.813 15.774 1.00 0.00 H new ATOM 0 HG22 THR A 107 -7.092 -4.375 14.774 1.00 0.00 H new ATOM 0 HG23 THR A 107 -6.080 -5.553 15.643 1.00 0.00 H new ATOM 1716 N MET A 108 -7.076 -4.857 11.270 1.00 0.00 N ATOM 1717 CA MET A 108 -8.366 -4.577 10.671 1.00 0.00 C ATOM 1718 C MET A 108 -8.826 -5.769 9.842 1.00 0.00 C ATOM 1719 O MET A 108 -10.022 -5.957 9.620 1.00 0.00 O ATOM 1720 CB MET A 108 -8.293 -3.325 9.801 1.00 0.00 C ATOM 1721 CG MET A 108 -8.020 -2.053 10.586 1.00 0.00 C ATOM 1722 SD MET A 108 -9.332 -1.667 11.762 1.00 0.00 S ATOM 1723 CE MET A 108 -8.382 -0.985 13.118 1.00 0.00 C ATOM 0 H MET A 108 -6.278 -4.495 10.748 1.00 0.00 H new ATOM 0 HA MET A 108 -9.088 -4.400 11.468 1.00 0.00 H new ATOM 0 HB2 MET A 108 -7.509 -3.457 9.055 1.00 0.00 H new ATOM 0 HB3 MET A 108 -9.233 -3.213 9.260 1.00 0.00 H new ATOM 0 HG2 MET A 108 -7.076 -2.157 11.122 1.00 0.00 H new ATOM 0 HG3 MET A 108 -7.903 -1.221 9.892 1.00 0.00 H new ATOM 0 HE1 MET A 108 -9.055 -0.698 13.926 1.00 0.00 H new ATOM 0 HE2 MET A 108 -7.678 -1.733 13.481 1.00 0.00 H new ATOM 0 HE3 MET A 108 -7.834 -0.108 12.773 1.00 0.00 H new ATOM 1733 N MET A 109 -7.868 -6.584 9.396 1.00 0.00 N ATOM 1734 CA MET A 109 -8.192 -7.762 8.607 1.00 0.00 C ATOM 1735 C MET A 109 -8.715 -8.882 9.500 1.00 0.00 C ATOM 1736 O MET A 109 -9.268 -9.861 9.010 1.00 0.00 O ATOM 1737 CB MET A 109 -6.971 -8.249 7.824 1.00 0.00 C ATOM 1738 CG MET A 109 -5.835 -8.742 8.704 1.00 0.00 C ATOM 1739 SD MET A 109 -5.999 -10.483 9.142 1.00 0.00 S ATOM 1740 CE MET A 109 -4.298 -11.028 9.002 1.00 0.00 C ATOM 0 H MET A 109 -6.872 -6.447 9.568 1.00 0.00 H new ATOM 0 HA MET A 109 -8.972 -7.483 7.898 1.00 0.00 H new ATOM 0 HB2 MET A 109 -7.277 -9.054 7.156 1.00 0.00 H new ATOM 0 HB3 MET A 109 -6.606 -7.436 7.196 1.00 0.00 H new ATOM 0 HG2 MET A 109 -4.888 -8.589 8.187 1.00 0.00 H new ATOM 0 HG3 MET A 109 -5.801 -8.144 9.615 1.00 0.00 H new ATOM 0 HE1 MET A 109 -4.119 -11.845 9.701 1.00 0.00 H new ATOM 0 HE2 MET A 109 -4.109 -11.372 7.985 1.00 0.00 H new ATOM 0 HE3 MET A 109 -3.630 -10.199 9.234 1.00 0.00 H new ATOM 1750 N SER A 110 -8.543 -8.739 10.814 1.00 0.00 N ATOM 1751 CA SER A 110 -9.020 -9.752 11.749 1.00 0.00 C ATOM 1752 C SER A 110 -10.398 -9.382 12.287 1.00 0.00 C ATOM 1753 O SER A 110 -11.123 -10.233 12.801 1.00 0.00 O ATOM 1754 CB SER A 110 -8.031 -9.926 12.903 1.00 0.00 C ATOM 1755 OG SER A 110 -6.768 -10.364 12.432 1.00 0.00 O ATOM 0 H SER A 110 -8.082 -7.940 11.249 1.00 0.00 H new ATOM 0 HA SER A 110 -9.100 -10.698 11.213 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.917 -8.981 13.434 1.00 0.00 H new ATOM 0 HB3 SER A 110 -8.426 -10.647 13.618 1.00 0.00 H new ATOM 0 HG SER A 110 -6.768 -10.369 11.452 1.00 0.00 H new ATOM 1761 N VAL A 111 -10.759 -8.109 12.155 1.00 0.00 N ATOM 1762 CA VAL A 111 -12.054 -7.634 12.616 1.00 0.00 C ATOM 1763 C VAL A 111 -13.136 -7.896 11.571 1.00 0.00 C ATOM 1764 O VAL A 111 -14.328 -7.834 11.874 1.00 0.00 O ATOM 1765 CB VAL A 111 -12.020 -6.128 12.939 1.00 0.00 C ATOM 1766 CG1 VAL A 111 -13.334 -5.685 13.564 1.00 0.00 C ATOM 1767 CG2 VAL A 111 -10.850 -5.803 13.857 1.00 0.00 C ATOM 0 H VAL A 111 -10.171 -7.390 11.732 1.00 0.00 H new ATOM 0 HA VAL A 111 -12.288 -8.185 13.527 1.00 0.00 H new ATOM 0 HB VAL A 111 -11.884 -5.580 12.007 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -13.291 -4.619 13.785 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -14.151 -5.879 12.869 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -13.503 -6.240 14.487 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -10.843 -4.735 14.073 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -10.952 -6.361 14.788 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -9.916 -6.080 13.368 1.00 0.00 H new ATOM 1777 N HIS A 112 -12.718 -8.192 10.340 1.00 0.00 N ATOM 1778 CA HIS A 112 -13.653 -8.462 9.267 1.00 0.00 C ATOM 1779 C HIS A 112 -14.215 -9.877 9.381 1.00 0.00 C ATOM 1780 O HIS A 112 -15.318 -10.156 8.913 1.00 0.00 O ATOM 1781 CB HIS A 112 -12.959 -8.272 7.918 1.00 0.00 C ATOM 1782 CG HIS A 112 -12.249 -9.491 7.420 1.00 0.00 C ATOM 1783 ND1 HIS A 112 -11.475 -10.301 8.221 1.00 0.00 N ATOM 1784 CD2 HIS A 112 -12.209 -10.035 6.192 1.00 0.00 C ATOM 1785 CE1 HIS A 112 -10.992 -11.296 7.499 1.00 0.00 C ATOM 1786 NE2 HIS A 112 -11.424 -11.157 6.262 1.00 0.00 N ATOM 0 H HIS A 112 -11.736 -8.249 10.069 1.00 0.00 H new ATOM 0 HA HIS A 112 -14.485 -7.761 9.343 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -13.701 -7.969 7.179 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -12.242 -7.456 8.002 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -12.705 -9.657 5.310 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -10.353 -12.088 7.861 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -11.210 -11.781 5.484 1.00 0.00 H new ATOM 1795 N ARG A 113 -13.445 -10.768 10.002 1.00 0.00 N ATOM 1796 CA ARG A 113 -13.869 -12.150 10.166 1.00 0.00 C ATOM 1797 C ARG A 113 -15.049 -12.245 11.127 1.00 0.00 C ATOM 1798 O ARG A 113 -15.940 -13.077 10.954 1.00 0.00 O ATOM 1799 CB ARG A 113 -12.709 -13.007 10.677 1.00 0.00 C ATOM 1800 CG ARG A 113 -12.684 -14.409 10.091 1.00 0.00 C ATOM 1801 CD ARG A 113 -11.261 -14.894 9.863 1.00 0.00 C ATOM 1802 NE ARG A 113 -10.598 -15.255 11.113 1.00 0.00 N ATOM 1803 CZ ARG A 113 -9.493 -15.994 11.179 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -8.923 -16.449 10.071 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -8.954 -16.276 12.358 1.00 0.00 N ATOM 0 H ARG A 113 -12.529 -10.556 10.397 1.00 0.00 H new ATOM 0 HA ARG A 113 -14.184 -12.525 9.192 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -11.769 -12.508 10.443 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -12.771 -13.077 11.763 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -13.199 -15.095 10.764 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -13.228 -14.419 9.147 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -11.275 -15.757 9.198 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.688 -14.114 9.361 1.00 0.00 H new ATOM 0 HE ARG A 113 -11.005 -14.921 11.987 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -9.331 -16.233 9.162 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -8.076 -17.015 10.128 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -9.386 -15.927 13.213 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -8.107 -16.842 12.409 1.00 0.00 H new ATOM 1819 N GLY A 114 -15.048 -11.386 12.143 1.00 0.00 N ATOM 1820 CA GLY A 114 -16.124 -11.389 13.117 1.00 0.00 C ATOM 1821 C GLY A 114 -17.065 -10.212 12.946 1.00 0.00 C ATOM 1822 O GLY A 114 -17.696 -9.770 13.905 1.00 0.00 O ATOM 0 H GLY A 114 -14.322 -10.689 12.308 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -16.688 -12.317 13.027 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -15.701 -11.369 14.121 1.00 0.00 H new ATOM 1826 N GLU A 115 -17.157 -9.702 11.722 1.00 0.00 N ATOM 1827 CA GLU A 115 -18.027 -8.568 11.429 1.00 0.00 C ATOM 1828 C GLU A 115 -19.178 -8.986 10.518 1.00 0.00 C ATOM 1829 O GLU A 115 -20.293 -8.481 10.640 1.00 0.00 O ATOM 1830 CB GLU A 115 -17.226 -7.441 10.774 1.00 0.00 C ATOM 1831 CG GLU A 115 -18.056 -6.204 10.470 1.00 0.00 C ATOM 1832 CD GLU A 115 -17.233 -4.931 10.494 1.00 0.00 C ATOM 1833 OE1 GLU A 115 -16.243 -4.877 11.255 1.00 0.00 O ATOM 1834 OE2 GLU A 115 -17.578 -3.988 9.752 1.00 0.00 O ATOM 0 H GLU A 115 -16.640 -10.056 10.917 1.00 0.00 H new ATOM 0 HA GLU A 115 -18.444 -8.209 12.370 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.401 -7.163 11.430 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.786 -7.810 9.848 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -18.520 -6.314 9.490 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -18.863 -6.124 11.198 1.00 0.00 H new ATOM 1841 N VAL A 116 -18.897 -9.911 9.605 1.00 0.00 N ATOM 1842 CA VAL A 116 -19.908 -10.396 8.674 1.00 0.00 C ATOM 1843 C VAL A 116 -21.097 -11.017 9.411 1.00 0.00 C ATOM 1844 O VAL A 116 -22.248 -10.697 9.116 1.00 0.00 O ATOM 1845 CB VAL A 116 -19.325 -11.430 7.691 1.00 0.00 C ATOM 1846 CG1 VAL A 116 -20.350 -11.794 6.627 1.00 0.00 C ATOM 1847 CG2 VAL A 116 -18.050 -10.900 7.051 1.00 0.00 C ATOM 0 H VAL A 116 -17.978 -10.339 9.491 1.00 0.00 H new ATOM 0 HA VAL A 116 -20.252 -9.528 8.111 1.00 0.00 H new ATOM 0 HB VAL A 116 -19.077 -12.333 8.249 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -19.920 -12.525 5.942 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -21.234 -12.219 7.103 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -20.632 -10.899 6.072 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -17.653 -11.644 6.360 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.270 -9.981 6.507 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.312 -10.695 7.826 1.00 0.00 H new ATOM 1857 N PRO A 117 -20.841 -11.914 10.382 1.00 0.00 N ATOM 1858 CA PRO A 117 -21.906 -12.566 11.146 1.00 0.00 C ATOM 1859 C PRO A 117 -22.505 -11.648 12.207 1.00 0.00 C ATOM 1860 O PRO A 117 -22.199 -11.770 13.392 1.00 0.00 O ATOM 1861 CB PRO A 117 -21.191 -13.747 11.800 1.00 0.00 C ATOM 1862 CG PRO A 117 -19.786 -13.285 11.970 1.00 0.00 C ATOM 1863 CD PRO A 117 -19.501 -12.365 10.811 1.00 0.00 C ATOM 0 HA PRO A 117 -22.747 -12.853 10.515 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -21.643 -14.003 12.758 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -21.243 -14.638 11.174 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -19.660 -12.765 12.920 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -19.097 -14.129 11.975 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -18.873 -11.526 11.111 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -18.977 -12.883 10.008 1.00 0.00 H new ATOM 1871 N CYS A 118 -23.361 -10.729 11.771 1.00 0.00 N ATOM 1872 CA CYS A 118 -24.003 -9.788 12.682 1.00 0.00 C ATOM 1873 C CYS A 118 -25.516 -9.985 12.689 1.00 0.00 C ATOM 1874 O CYS A 118 -26.229 -9.416 11.862 1.00 0.00 O ATOM 1875 CB CYS A 118 -23.666 -8.351 12.287 1.00 0.00 C ATOM 1876 SG CYS A 118 -22.176 -7.697 13.078 1.00 0.00 S ATOM 0 H CYS A 118 -23.626 -10.616 10.793 1.00 0.00 H new ATOM 0 HA CYS A 118 -23.625 -9.978 13.686 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -23.541 -8.303 11.205 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -24.510 -7.709 12.539 1.00 0.00 H new ATOM 0 HG CYS A 118 -21.155 -7.873 12.293 1.00 0.00 H new ATOM 1882 N THR A 119 -25.999 -10.792 13.626 1.00 0.00 N ATOM 1883 CA THR A 119 -27.427 -11.064 13.740 1.00 0.00 C ATOM 1884 C THR A 119 -27.757 -11.683 15.094 1.00 0.00 C ATOM 1885 O THR A 119 -28.625 -11.192 15.818 1.00 0.00 O ATOM 1886 CB THR A 119 -27.882 -11.995 12.616 1.00 0.00 C ATOM 1887 OG1 THR A 119 -27.300 -11.614 11.382 1.00 0.00 O ATOM 1888 CG2 THR A 119 -29.383 -12.018 12.428 1.00 0.00 C ATOM 0 H THR A 119 -25.422 -11.270 14.318 1.00 0.00 H new ATOM 0 HA THR A 119 -27.959 -10.117 13.655 1.00 0.00 H new ATOM 0 HB THR A 119 -27.555 -12.990 12.916 1.00 0.00 H new ATOM 0 HG1 THR A 119 -27.344 -10.640 11.287 1.00 0.00 H new ATOM 0 HG21 THR A 119 -29.637 -12.698 11.615 1.00 0.00 H new ATOM 0 HG22 THR A 119 -29.860 -12.357 13.348 1.00 0.00 H new ATOM 0 HG23 THR A 119 -29.735 -11.015 12.186 1.00 0.00 H new ATOM 1896 N VAL A 120 -27.060 -12.762 15.431 1.00 0.00 N ATOM 1897 CA VAL A 120 -27.279 -13.448 16.699 1.00 0.00 C ATOM 1898 C VAL A 120 -26.042 -14.234 17.119 1.00 0.00 C ATOM 1899 O VAL A 120 -25.006 -14.119 16.430 1.00 0.00 O ATOM 1900 CB VAL A 120 -28.480 -14.409 16.617 1.00 0.00 C ATOM 1901 CG1 VAL A 120 -29.787 -13.632 16.612 1.00 0.00 C ATOM 1902 CG2 VAL A 120 -28.371 -15.296 15.387 1.00 0.00 C ATOM 1903 OXT VAL A 120 -26.118 -14.958 18.134 1.00 0.00 O ATOM 0 H VAL A 120 -26.339 -13.181 14.844 1.00 0.00 H new ATOM 0 HA VAL A 120 -27.488 -12.679 17.443 1.00 0.00 H new ATOM 0 HB VAL A 120 -28.470 -15.050 17.499 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -30.624 -14.328 16.554 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -29.865 -13.046 17.528 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -29.810 -12.964 15.751 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -29.228 -15.968 15.346 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -28.353 -14.675 14.491 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -27.453 -15.881 15.441 1.00 0.00 H new TER 1913 VAL A 120