USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1034 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 5 LYS NZ :NH3+ 178:sc= -1.95 (180deg=-1.62) USER MOD Set 1.2: A 29 GLN : amide:sc= -0.397 K(o=-2.3,f=-3.6) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0 (180deg=-0.0284) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -0.94 K(o=-0.94,f=-6.2!) USER MOD Single : A 12 GLN : amide:sc= -0.218 X(o=-0.22,f=-0.033) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 24 ASN : amide:sc=-0.00816 X(o=-0.0082,f=-0.099) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 87:sc= 0.0448 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 35 ASN : amide:sc= -2.1! C(o=-2.1!,f=-4.2!) USER MOD Single : A 38 GLN : amide:sc= -0.0193 X(o=-0.019,f=-0.13) USER MOD Single : A 44 THR OG1 : rot 82:sc= 0.665 USER MOD Single : A 45 LYS NZ :NH3+ -146:sc= -0.565 (180deg=-1.78!) USER MOD Single : A 55 MET CE :methyl -113:sc= -10.6! (180deg=-18.7!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -173:sc= -0.324 (180deg=-0.459) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -178:sc= -0.311 (180deg=-0.312) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -1.39 K(o=-1.4,f=-4!) USER MOD Single : A 81 MET CE :methyl 180:sc= -21.3! (180deg=-21.3!) USER MOD Single : A 82 THR OG1 : rot 170:sc= 0.537 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 177:sc= -8.79! (180deg=-9.21!) USER MOD Single : A 91 GLN : amide:sc= -0.0744 X(o=-0.074,f=-0.35) USER MOD Single : A 93 SER OG : rot -92:sc= -0.277 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot -99:sc= 1.21 USER MOD Single : A 101 HIS :FLIP no HE2:sc= -7.34! C(o=-8.9!,f=-7.3!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot -136:sc= -4.11! USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.413 -12.985 17.145 1.00 0.00 N ATOM 2 CA MET A 1 -0.354 -12.629 18.327 1.00 0.00 C ATOM 3 C MET A 1 -1.719 -12.056 17.942 1.00 0.00 C ATOM 4 O MET A 1 -2.743 -12.458 18.492 1.00 0.00 O ATOM 5 CB MET A 1 0.421 -11.596 19.147 1.00 0.00 C ATOM 6 CG MET A 1 1.491 -12.271 20.008 1.00 0.00 C ATOM 7 SD MET A 1 2.417 -11.038 20.907 1.00 0.00 S ATOM 8 CE MET A 1 3.826 -12.013 21.409 1.00 0.00 C ATOM 0 H1 MET A 1 1.298 -13.449 17.432 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.143 -13.636 16.554 1.00 0.00 H new ATOM 0 H3 MET A 1 0.633 -12.126 16.602 1.00 0.00 H new ATOM 0 HA MET A 1 -0.513 -13.530 18.919 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.889 -10.873 18.479 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.268 -11.041 19.785 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.023 -12.967 20.705 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.162 -12.854 19.378 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.511 -11.392 21.986 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.490 -12.849 22.023 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.338 -12.394 20.525 1.00 0.00 H new ATOM 18 N MET A 2 -1.690 -11.125 17.000 1.00 0.00 N ATOM 19 CA MET A 2 -2.913 -10.492 16.535 1.00 0.00 C ATOM 20 C MET A 2 -3.268 -10.956 15.121 1.00 0.00 C ATOM 21 O MET A 2 -2.608 -11.835 14.569 1.00 0.00 O ATOM 22 CB MET A 2 -2.736 -8.972 16.544 1.00 0.00 C ATOM 23 CG MET A 2 -2.807 -8.420 17.969 1.00 0.00 C ATOM 24 SD MET A 2 -4.453 -7.820 18.311 1.00 0.00 S ATOM 25 CE MET A 2 -4.357 -7.644 20.085 1.00 0.00 C ATOM 0 H MET A 2 -0.839 -10.794 16.546 1.00 0.00 H new ATOM 0 HA MET A 2 -3.724 -10.777 17.205 1.00 0.00 H new ATOM 0 HB2 MET A 2 -1.777 -8.711 16.097 1.00 0.00 H new ATOM 0 HB3 MET A 2 -3.510 -8.509 15.932 1.00 0.00 H new ATOM 0 HG2 MET A 2 -2.539 -9.199 18.683 1.00 0.00 H new ATOM 0 HG3 MET A 2 -2.084 -7.613 18.092 1.00 0.00 H new ATOM 0 HE1 MET A 2 -5.309 -7.275 20.466 1.00 0.00 H new ATOM 0 HE2 MET A 2 -4.136 -8.612 20.535 1.00 0.00 H new ATOM 0 HE3 MET A 2 -3.567 -6.937 20.338 1.00 0.00 H new ATOM 35 N ASN A 3 -4.310 -10.346 14.576 1.00 0.00 N ATOM 36 CA ASN A 3 -4.760 -10.686 13.237 1.00 0.00 C ATOM 37 C ASN A 3 -4.684 -9.443 12.348 1.00 0.00 C ATOM 38 O ASN A 3 -4.608 -8.322 12.847 1.00 0.00 O ATOM 39 CB ASN A 3 -6.211 -11.170 13.251 1.00 0.00 C ATOM 40 CG ASN A 3 -6.415 -12.262 14.303 1.00 0.00 C ATOM 41 OD1 ASN A 3 -5.487 -12.716 14.952 1.00 0.00 O ATOM 42 ND2 ASN A 3 -7.678 -12.657 14.435 1.00 0.00 N ATOM 0 H ASN A 3 -4.856 -9.618 15.037 1.00 0.00 H new ATOM 0 HA ASN A 3 -4.119 -11.481 12.856 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -6.876 -10.331 13.459 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -6.480 -11.554 12.267 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -7.918 -13.382 15.111 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -8.407 -12.235 13.860 1.00 0.00 H new ATOM 49 N GLU A 4 -4.709 -9.685 11.045 1.00 0.00 N ATOM 50 CA GLU A 4 -4.644 -8.600 10.081 1.00 0.00 C ATOM 51 C GLU A 4 -3.339 -7.818 10.249 1.00 0.00 C ATOM 52 O GLU A 4 -2.860 -7.635 11.367 1.00 0.00 O ATOM 53 CB GLU A 4 -5.857 -7.677 10.212 1.00 0.00 C ATOM 54 CG GLU A 4 -6.015 -6.799 8.969 1.00 0.00 C ATOM 55 CD GLU A 4 -7.467 -6.788 8.487 1.00 0.00 C ATOM 56 OE1 GLU A 4 -8.118 -7.846 8.621 1.00 0.00 O ATOM 57 OE2 GLU A 4 -7.893 -5.720 7.996 1.00 0.00 O ATOM 0 H GLU A 4 -4.773 -10.617 10.635 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.661 -9.029 9.079 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.758 -8.273 10.357 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.746 -7.047 11.095 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.695 -5.782 9.195 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.367 -7.168 8.174 1.00 0.00 H new ATOM 64 N LYS A 5 -2.801 -7.379 9.121 1.00 0.00 N ATOM 65 CA LYS A 5 -1.561 -6.621 9.128 1.00 0.00 C ATOM 66 C LYS A 5 -1.538 -5.677 7.925 1.00 0.00 C ATOM 67 O LYS A 5 -2.079 -5.999 6.868 1.00 0.00 O ATOM 68 CB LYS A 5 -0.358 -7.563 9.194 1.00 0.00 C ATOM 69 CG LYS A 5 -0.247 -8.216 10.574 1.00 0.00 C ATOM 70 CD LYS A 5 1.009 -9.084 10.671 1.00 0.00 C ATOM 71 CE LYS A 5 1.984 -8.525 11.708 1.00 0.00 C ATOM 72 NZ LYS A 5 1.542 -8.875 13.077 1.00 0.00 N ATOM 0 H LYS A 5 -3.201 -7.534 8.196 1.00 0.00 H new ATOM 0 HA LYS A 5 -1.499 -6.000 10.022 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -0.453 -8.334 8.430 1.00 0.00 H new ATOM 0 HB3 LYS A 5 0.555 -7.009 8.976 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -0.221 -7.445 11.344 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -1.130 -8.826 10.764 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.731 -10.103 10.940 1.00 0.00 H new ATOM 0 HD3 LYS A 5 1.497 -9.134 9.698 1.00 0.00 H new ATOM 0 HE2 LYS A 5 2.983 -8.924 11.529 1.00 0.00 H new ATOM 0 HE3 LYS A 5 2.050 -7.442 11.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 2.233 -8.517 13.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 0.613 -8.446 13.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 1.469 -9.909 13.165 1.00 0.00 H new ATOM 86 N ILE A 6 -0.905 -4.530 8.124 1.00 0.00 N ATOM 87 CA ILE A 6 -0.804 -3.537 7.068 1.00 0.00 C ATOM 88 C ILE A 6 0.508 -2.766 7.224 1.00 0.00 C ATOM 89 O ILE A 6 1.007 -2.600 8.336 1.00 0.00 O ATOM 90 CB ILE A 6 -2.045 -2.643 7.053 1.00 0.00 C ATOM 91 CG1 ILE A 6 -2.999 -3.048 5.928 1.00 0.00 C ATOM 92 CG2 ILE A 6 -1.655 -1.166 6.970 1.00 0.00 C ATOM 93 CD1 ILE A 6 -4.451 -2.747 6.305 1.00 0.00 C ATOM 0 H ILE A 6 -0.457 -4.266 9.001 1.00 0.00 H new ATOM 0 HA ILE A 6 -0.776 -4.020 6.091 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.579 -2.783 7.993 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -2.738 -2.513 5.015 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -2.887 -4.112 5.717 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -2.555 -0.552 6.961 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -1.044 -0.902 7.833 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -1.087 -0.990 6.056 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.108 -3.044 5.488 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -4.716 -3.303 7.205 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -4.565 -1.679 6.492 1.00 0.00 H new ATOM 105 N LEU A 7 1.030 -2.315 6.092 1.00 0.00 N ATOM 106 CA LEU A 7 2.275 -1.565 6.089 1.00 0.00 C ATOM 107 C LEU A 7 2.109 -0.315 5.222 1.00 0.00 C ATOM 108 O LEU A 7 1.416 -0.346 4.207 1.00 0.00 O ATOM 109 CB LEU A 7 3.439 -2.461 5.660 1.00 0.00 C ATOM 110 CG LEU A 7 4.710 -2.360 6.505 1.00 0.00 C ATOM 111 CD1 LEU A 7 4.803 -3.522 7.496 1.00 0.00 C ATOM 112 CD2 LEU A 7 5.952 -2.262 5.618 1.00 0.00 C ATOM 0 H LEU A 7 0.614 -2.455 5.171 1.00 0.00 H new ATOM 0 HA LEU A 7 2.519 -1.226 7.096 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.099 -3.496 5.674 1.00 0.00 H new ATOM 0 HB3 LEU A 7 3.693 -2.223 4.627 1.00 0.00 H new ATOM 0 HG LEU A 7 4.659 -1.441 7.090 1.00 0.00 H new ATOM 0 HD11 LEU A 7 5.716 -3.426 8.084 1.00 0.00 H new ATOM 0 HD12 LEU A 7 3.939 -3.503 8.161 1.00 0.00 H new ATOM 0 HD13 LEU A 7 4.821 -4.465 6.950 1.00 0.00 H new ATOM 0 HD21 LEU A 7 6.842 -2.191 6.244 1.00 0.00 H new ATOM 0 HD22 LEU A 7 6.021 -3.149 4.989 1.00 0.00 H new ATOM 0 HD23 LEU A 7 5.880 -1.375 4.988 1.00 0.00 H new ATOM 124 N ILE A 8 2.757 0.756 5.656 1.00 0.00 N ATOM 125 CA ILE A 8 2.690 2.015 4.933 1.00 0.00 C ATOM 126 C ILE A 8 4.102 2.439 4.524 1.00 0.00 C ATOM 127 O ILE A 8 5.041 2.323 5.310 1.00 0.00 O ATOM 128 CB ILE A 8 1.946 3.068 5.757 1.00 0.00 C ATOM 129 CG1 ILE A 8 0.461 2.722 5.875 1.00 0.00 C ATOM 130 CG2 ILE A 8 2.165 4.469 5.182 1.00 0.00 C ATOM 131 CD1 ILE A 8 -0.059 3.013 7.285 1.00 0.00 C ATOM 0 H ILE A 8 3.331 0.778 6.499 1.00 0.00 H new ATOM 0 HA ILE A 8 2.114 1.897 4.015 1.00 0.00 H new ATOM 0 HB ILE A 8 2.358 3.067 6.766 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -0.109 3.299 5.147 1.00 0.00 H new ATOM 0 HG13 ILE A 8 0.309 1.669 5.637 1.00 0.00 H new ATOM 0 HG21 ILE A 8 1.626 5.199 5.786 1.00 0.00 H new ATOM 0 HG22 ILE A 8 3.229 4.705 5.193 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.796 4.503 4.157 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -1.117 2.758 7.342 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.497 2.417 8.008 1.00 0.00 H new ATOM 0 HD13 ILE A 8 0.072 4.071 7.510 1.00 0.00 H new ATOM 143 N VAL A 9 4.208 2.922 3.295 1.00 0.00 N ATOM 144 CA VAL A 9 5.490 3.364 2.772 1.00 0.00 C ATOM 145 C VAL A 9 5.325 4.741 2.127 1.00 0.00 C ATOM 146 O VAL A 9 4.463 4.930 1.270 1.00 0.00 O ATOM 147 CB VAL A 9 6.053 2.316 1.810 1.00 0.00 C ATOM 148 CG1 VAL A 9 7.536 2.566 1.533 1.00 0.00 C ATOM 149 CG2 VAL A 9 5.826 0.901 2.347 1.00 0.00 C ATOM 0 H VAL A 9 3.427 3.017 2.646 1.00 0.00 H new ATOM 0 HA VAL A 9 6.216 3.468 3.578 1.00 0.00 H new ATOM 0 HB VAL A 9 5.517 2.406 0.865 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.911 1.807 0.847 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.662 3.553 1.087 1.00 0.00 H new ATOM 0 HG13 VAL A 9 8.094 2.517 2.468 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.235 0.175 1.644 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.323 0.793 3.311 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.757 0.725 2.469 1.00 0.00 H new ATOM 159 N ASP A 10 6.166 5.668 2.562 1.00 0.00 N ATOM 160 CA ASP A 10 6.124 7.022 2.037 1.00 0.00 C ATOM 161 C ASP A 10 4.668 7.480 1.934 1.00 0.00 C ATOM 162 O ASP A 10 3.770 6.829 2.465 1.00 0.00 O ATOM 163 CB ASP A 10 6.742 7.090 0.639 1.00 0.00 C ATOM 164 CG ASP A 10 7.421 8.417 0.295 1.00 0.00 C ATOM 165 OD1 ASP A 10 8.230 8.874 1.132 1.00 0.00 O ATOM 166 OD2 ASP A 10 7.117 8.945 -0.796 1.00 0.00 O ATOM 0 H ASP A 10 6.880 5.508 3.272 1.00 0.00 H new ATOM 0 HA ASP A 10 6.690 7.663 2.713 1.00 0.00 H new ATOM 0 HB2 ASP A 10 7.475 6.289 0.543 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.961 6.898 -0.097 1.00 0.00 H new ATOM 171 N ASP A 11 4.480 8.597 1.246 1.00 0.00 N ATOM 172 CA ASP A 11 3.148 9.149 1.066 1.00 0.00 C ATOM 173 C ASP A 11 2.593 9.584 2.424 1.00 0.00 C ATOM 174 O ASP A 11 1.422 9.945 2.534 1.00 0.00 O ATOM 175 CB ASP A 11 2.194 8.107 0.478 1.00 0.00 C ATOM 176 CG ASP A 11 1.005 8.682 -0.294 1.00 0.00 C ATOM 177 OD1 ASP A 11 1.264 9.447 -1.248 1.00 0.00 O ATOM 178 OD2 ASP A 11 -0.136 8.343 0.087 1.00 0.00 O ATOM 0 H ASP A 11 5.228 9.134 0.807 1.00 0.00 H new ATOM 0 HA ASP A 11 3.224 9.995 0.383 1.00 0.00 H new ATOM 0 HB2 ASP A 11 2.759 7.454 -0.188 1.00 0.00 H new ATOM 0 HB3 ASP A 11 1.815 7.485 1.289 1.00 0.00 H new ATOM 183 N GLN A 12 3.460 9.536 3.425 1.00 0.00 N ATOM 184 CA GLN A 12 3.072 9.920 4.771 1.00 0.00 C ATOM 185 C GLN A 12 2.911 11.439 4.864 1.00 0.00 C ATOM 186 O GLN A 12 3.890 12.177 4.768 1.00 0.00 O ATOM 187 CB GLN A 12 4.084 9.412 5.800 1.00 0.00 C ATOM 188 CG GLN A 12 5.518 9.669 5.332 1.00 0.00 C ATOM 189 CD GLN A 12 6.440 9.952 6.519 1.00 0.00 C ATOM 190 OE1 GLN A 12 7.419 9.265 6.756 1.00 0.00 O ATOM 191 NE2 GLN A 12 6.073 11.001 7.251 1.00 0.00 N ATOM 0 H GLN A 12 4.430 9.237 3.330 1.00 0.00 H new ATOM 0 HA GLN A 12 2.111 9.458 4.997 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.915 9.907 6.756 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.937 8.344 5.964 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.885 8.803 4.780 1.00 0.00 H new ATOM 0 HG3 GLN A 12 5.534 10.515 4.645 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.241 11.534 6.997 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.623 11.272 8.066 1.00 0.00 H new ATOM 200 N TYR A 13 1.669 11.860 5.048 1.00 0.00 N ATOM 201 CA TYR A 13 1.367 13.278 5.155 1.00 0.00 C ATOM 202 C TYR A 13 0.119 13.510 6.009 1.00 0.00 C ATOM 203 O TYR A 13 -0.587 14.501 5.827 1.00 0.00 O ATOM 204 CB TYR A 13 1.091 13.758 3.729 1.00 0.00 C ATOM 205 CG TYR A 13 1.882 15.006 3.329 1.00 0.00 C ATOM 206 CD1 TYR A 13 1.890 16.112 4.154 1.00 0.00 C ATOM 207 CD2 TYR A 13 2.586 15.025 2.142 1.00 0.00 C ATOM 208 CE1 TYR A 13 2.634 17.286 3.777 1.00 0.00 C ATOM 209 CE2 TYR A 13 3.330 16.199 1.766 1.00 0.00 C ATOM 210 CZ TYR A 13 3.317 17.271 2.602 1.00 0.00 C ATOM 211 OH TYR A 13 4.020 18.380 2.246 1.00 0.00 O ATOM 0 H TYR A 13 0.859 11.244 5.126 1.00 0.00 H new ATOM 0 HA TYR A 13 2.193 13.812 5.624 1.00 0.00 H new ATOM 0 HB2 TYR A 13 1.326 12.953 3.033 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.026 13.967 3.626 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.338 16.097 5.082 1.00 0.00 H new ATOM 0 HD2 TYR A 13 2.579 14.160 1.496 1.00 0.00 H new ATOM 0 HE1 TYR A 13 2.649 18.158 4.413 1.00 0.00 H new ATOM 0 HE2 TYR A 13 3.886 16.227 0.841 1.00 0.00 H new ATOM 0 HH TYR A 13 4.459 18.226 1.383 1.00 0.00 H new ATOM 221 N GLY A 14 -0.114 12.580 6.924 1.00 0.00 N ATOM 222 CA GLY A 14 -1.265 12.671 7.807 1.00 0.00 C ATOM 223 C GLY A 14 -2.365 11.699 7.376 1.00 0.00 C ATOM 224 O GLY A 14 -3.382 11.567 8.055 1.00 0.00 O ATOM 0 H GLY A 14 0.474 11.760 7.073 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -0.961 12.451 8.830 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -1.652 13.690 7.802 1.00 0.00 H new ATOM 228 N ILE A 15 -2.123 11.042 6.251 1.00 0.00 N ATOM 229 CA ILE A 15 -3.080 10.086 5.722 1.00 0.00 C ATOM 230 C ILE A 15 -2.757 8.693 6.267 1.00 0.00 C ATOM 231 O ILE A 15 -3.659 7.898 6.524 1.00 0.00 O ATOM 232 CB ILE A 15 -3.119 10.155 4.194 1.00 0.00 C ATOM 233 CG1 ILE A 15 -3.740 11.470 3.721 1.00 0.00 C ATOM 234 CG2 ILE A 15 -3.837 8.938 3.608 1.00 0.00 C ATOM 235 CD1 ILE A 15 -2.711 12.326 2.977 1.00 0.00 C ATOM 0 H ILE A 15 -1.278 11.153 5.691 1.00 0.00 H new ATOM 0 HA ILE A 15 -4.088 10.333 6.054 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.094 10.132 3.825 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.587 11.262 3.067 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.127 12.022 4.577 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.851 9.012 2.521 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.313 8.029 3.903 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -4.860 8.904 3.982 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.178 13.255 2.651 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.877 12.552 3.642 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.344 11.780 2.108 1.00 0.00 H new ATOM 247 N ARG A 16 -1.466 8.440 6.427 1.00 0.00 N ATOM 248 CA ARG A 16 -1.012 7.157 6.937 1.00 0.00 C ATOM 249 C ARG A 16 -1.666 6.861 8.288 1.00 0.00 C ATOM 250 O ARG A 16 -2.030 5.720 8.568 1.00 0.00 O ATOM 251 CB ARG A 16 0.509 7.136 7.099 1.00 0.00 C ATOM 252 CG ARG A 16 1.003 8.400 7.806 1.00 0.00 C ATOM 253 CD ARG A 16 2.447 8.232 8.282 1.00 0.00 C ATOM 254 NE ARG A 16 2.470 7.584 9.612 1.00 0.00 N ATOM 255 CZ ARG A 16 2.590 6.263 9.802 1.00 0.00 C ATOM 256 NH1 ARG A 16 2.698 5.442 8.748 1.00 0.00 N ATOM 257 NH2 ARG A 16 2.601 5.763 11.045 1.00 0.00 N ATOM 0 H ARG A 16 -0.720 9.102 6.212 1.00 0.00 H new ATOM 0 HA ARG A 16 -1.300 6.393 6.215 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.805 6.256 7.670 1.00 0.00 H new ATOM 0 HB3 ARG A 16 0.981 7.054 6.120 1.00 0.00 H new ATOM 0 HG2 ARG A 16 0.936 9.250 7.127 1.00 0.00 H new ATOM 0 HG3 ARG A 16 0.359 8.620 8.657 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.007 7.631 7.566 1.00 0.00 H new ATOM 0 HD3 ARG A 16 2.937 9.204 8.334 1.00 0.00 H new ATOM 0 HE ARG A 16 2.389 8.180 10.436 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.689 5.823 7.802 1.00 0.00 H new ATOM 0 HH12 ARG A 16 2.789 4.436 8.892 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.518 6.388 11.847 1.00 0.00 H new ATOM 0 HH22 ARG A 16 2.692 4.757 11.189 1.00 0.00 H new ATOM 271 N ILE A 17 -1.796 7.909 9.089 1.00 0.00 N ATOM 272 CA ILE A 17 -2.400 7.775 10.403 1.00 0.00 C ATOM 273 C ILE A 17 -3.893 7.483 10.247 1.00 0.00 C ATOM 274 O ILE A 17 -4.430 6.599 10.914 1.00 0.00 O ATOM 275 CB ILE A 17 -2.101 9.009 11.258 1.00 0.00 C ATOM 276 CG1 ILE A 17 -0.593 9.208 11.426 1.00 0.00 C ATOM 277 CG2 ILE A 17 -2.823 8.931 12.605 1.00 0.00 C ATOM 278 CD1 ILE A 17 -0.242 10.695 11.506 1.00 0.00 C ATOM 0 H ILE A 17 -1.493 8.854 8.853 1.00 0.00 H new ATOM 0 HA ILE A 17 -1.964 6.931 10.938 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.485 9.886 10.737 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -0.254 8.702 12.330 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -0.067 8.751 10.588 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.594 9.820 13.193 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -3.899 8.874 12.438 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.492 8.044 13.145 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.835 10.809 11.625 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -0.560 11.194 10.591 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -0.751 11.144 12.359 1.00 0.00 H new ATOM 290 N LEU A 18 -4.522 8.241 9.361 1.00 0.00 N ATOM 291 CA LEU A 18 -5.943 8.074 9.108 1.00 0.00 C ATOM 292 C LEU A 18 -6.272 6.581 9.037 1.00 0.00 C ATOM 293 O LEU A 18 -7.098 6.087 9.803 1.00 0.00 O ATOM 294 CB LEU A 18 -6.361 8.856 7.861 1.00 0.00 C ATOM 295 CG LEU A 18 -7.840 9.239 7.774 1.00 0.00 C ATOM 296 CD1 LEU A 18 -8.027 10.747 7.951 1.00 0.00 C ATOM 297 CD2 LEU A 18 -8.462 8.734 6.471 1.00 0.00 C ATOM 0 H LEU A 18 -4.074 8.972 8.809 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.528 8.491 9.928 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.766 9.768 7.812 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.107 8.263 6.982 1.00 0.00 H new ATOM 0 HG LEU A 18 -8.368 8.750 8.593 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -9.087 10.992 7.885 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.645 11.049 8.926 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.483 11.275 7.168 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.513 9.020 6.435 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -7.937 9.174 5.623 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.379 7.648 6.425 1.00 0.00 H new ATOM 309 N LEU A 19 -5.610 5.906 8.109 1.00 0.00 N ATOM 310 CA LEU A 19 -5.821 4.480 7.928 1.00 0.00 C ATOM 311 C LEU A 19 -5.221 3.724 9.115 1.00 0.00 C ATOM 312 O LEU A 19 -5.633 2.605 9.417 1.00 0.00 O ATOM 313 CB LEU A 19 -5.278 4.025 6.572 1.00 0.00 C ATOM 314 CG LEU A 19 -3.881 4.532 6.206 1.00 0.00 C ATOM 315 CD1 LEU A 19 -2.945 3.367 5.876 1.00 0.00 C ATOM 316 CD2 LEU A 19 -3.949 5.552 5.068 1.00 0.00 C ATOM 0 H LEU A 19 -4.927 6.320 7.474 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.887 4.253 7.911 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.264 2.935 6.556 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.974 4.346 5.797 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.465 5.045 7.073 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.959 3.754 5.619 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.863 2.710 6.742 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.346 2.806 5.032 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.943 5.896 4.827 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.393 5.087 4.188 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.559 6.401 5.376 1.00 0.00 H new ATOM 328 N ASN A 20 -4.256 4.366 9.758 1.00 0.00 N ATOM 329 CA ASN A 20 -3.595 3.769 10.906 1.00 0.00 C ATOM 330 C ASN A 20 -4.607 3.600 12.041 1.00 0.00 C ATOM 331 O ASN A 20 -4.840 2.487 12.509 1.00 0.00 O ATOM 332 CB ASN A 20 -2.460 4.661 11.413 1.00 0.00 C ATOM 333 CG ASN A 20 -1.570 3.906 12.402 1.00 0.00 C ATOM 334 OD1 ASN A 20 -1.704 2.711 12.611 1.00 0.00 O ATOM 335 ND2 ASN A 20 -0.657 4.667 12.999 1.00 0.00 N ATOM 0 H ASN A 20 -3.916 5.294 9.505 1.00 0.00 H new ATOM 0 HA ASN A 20 -3.187 2.806 10.598 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -1.861 5.008 10.571 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -2.876 5.546 11.895 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -0.015 4.256 13.677 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -0.598 5.661 12.778 1.00 0.00 H new ATOM 342 N GLU A 21 -5.181 4.722 12.450 1.00 0.00 N ATOM 343 CA GLU A 21 -6.163 4.712 13.522 1.00 0.00 C ATOM 344 C GLU A 21 -7.258 3.684 13.229 1.00 0.00 C ATOM 345 O GLU A 21 -7.899 3.177 14.148 1.00 0.00 O ATOM 346 CB GLU A 21 -6.760 6.105 13.731 1.00 0.00 C ATOM 347 CG GLU A 21 -7.721 6.116 14.922 1.00 0.00 C ATOM 348 CD GLU A 21 -7.916 7.537 15.456 1.00 0.00 C ATOM 349 OE1 GLU A 21 -8.662 8.293 14.797 1.00 0.00 O ATOM 350 OE2 GLU A 21 -7.315 7.833 16.511 1.00 0.00 O ATOM 0 H GLU A 21 -4.985 5.644 12.059 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.661 4.425 14.446 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.960 6.826 13.898 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.288 6.417 12.830 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.683 5.701 14.621 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.332 5.476 15.714 1.00 0.00 H new ATOM 357 N VAL A 22 -7.438 3.408 11.946 1.00 0.00 N ATOM 358 CA VAL A 22 -8.444 2.450 11.521 1.00 0.00 C ATOM 359 C VAL A 22 -7.953 1.033 11.824 1.00 0.00 C ATOM 360 O VAL A 22 -8.590 0.300 12.580 1.00 0.00 O ATOM 361 CB VAL A 22 -8.779 2.664 10.043 1.00 0.00 C ATOM 362 CG1 VAL A 22 -9.633 1.515 9.503 1.00 0.00 C ATOM 363 CG2 VAL A 22 -9.471 4.011 9.827 1.00 0.00 C ATOM 0 H VAL A 22 -6.904 3.831 11.187 1.00 0.00 H new ATOM 0 HA VAL A 22 -9.371 2.598 12.075 1.00 0.00 H new ATOM 0 HB VAL A 22 -7.843 2.676 9.485 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -9.857 1.691 8.451 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -9.087 0.577 9.605 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -10.564 1.457 10.067 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -9.698 4.138 8.768 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.396 4.041 10.403 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -8.813 4.815 10.156 1.00 0.00 H new ATOM 373 N PHE A 23 -6.826 0.689 11.218 1.00 0.00 N ATOM 374 CA PHE A 23 -6.243 -0.627 11.414 1.00 0.00 C ATOM 375 C PHE A 23 -5.802 -0.821 12.866 1.00 0.00 C ATOM 376 O PHE A 23 -5.989 -1.895 13.437 1.00 0.00 O ATOM 377 CB PHE A 23 -5.015 -0.711 10.505 1.00 0.00 C ATOM 378 CG PHE A 23 -5.270 -0.251 9.069 1.00 0.00 C ATOM 379 CD1 PHE A 23 -6.515 -0.359 8.531 1.00 0.00 C ATOM 380 CD2 PHE A 23 -4.253 0.268 8.330 1.00 0.00 C ATOM 381 CE1 PHE A 23 -6.752 0.068 7.198 1.00 0.00 C ATOM 382 CE2 PHE A 23 -4.491 0.695 6.997 1.00 0.00 C ATOM 383 CZ PHE A 23 -5.735 0.587 6.459 1.00 0.00 C ATOM 0 H PHE A 23 -6.301 1.299 10.591 1.00 0.00 H new ATOM 0 HA PHE A 23 -6.977 -1.398 11.180 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -4.217 -0.105 10.933 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.659 -1.741 10.488 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -7.323 -0.770 9.118 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -3.265 0.355 8.757 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -7.740 -0.019 6.771 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -3.683 1.106 6.410 1.00 0.00 H new ATOM 0 HZ PHE A 23 -5.915 0.913 5.445 1.00 0.00 H new ATOM 393 N ASN A 24 -5.225 0.234 13.422 1.00 0.00 N ATOM 394 CA ASN A 24 -4.757 0.193 14.797 1.00 0.00 C ATOM 395 C ASN A 24 -5.944 -0.059 15.729 1.00 0.00 C ATOM 396 O ASN A 24 -5.820 -0.778 16.719 1.00 0.00 O ATOM 397 CB ASN A 24 -4.113 1.521 15.200 1.00 0.00 C ATOM 398 CG ASN A 24 -2.985 1.300 16.209 1.00 0.00 C ATOM 399 OD1 ASN A 24 -2.049 0.552 15.979 1.00 0.00 O ATOM 400 ND2 ASN A 24 -3.126 1.991 17.337 1.00 0.00 N ATOM 0 H ASN A 24 -5.071 1.122 12.945 1.00 0.00 H new ATOM 0 HA ASN A 24 -4.019 -0.605 14.877 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.721 2.022 14.315 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -4.868 2.179 15.631 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -2.426 1.912 18.074 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -3.935 2.600 17.465 1.00 0.00 H new ATOM 407 N LYS A 25 -7.069 0.548 15.379 1.00 0.00 N ATOM 408 CA LYS A 25 -8.277 0.399 16.171 1.00 0.00 C ATOM 409 C LYS A 25 -8.568 -1.089 16.375 1.00 0.00 C ATOM 410 O LYS A 25 -9.279 -1.464 17.307 1.00 0.00 O ATOM 411 CB LYS A 25 -9.435 1.170 15.533 1.00 0.00 C ATOM 412 CG LYS A 25 -9.742 2.447 16.318 1.00 0.00 C ATOM 413 CD LYS A 25 -11.137 2.976 15.981 1.00 0.00 C ATOM 414 CE LYS A 25 -11.257 3.295 14.490 1.00 0.00 C ATOM 415 NZ LYS A 25 -12.233 2.389 13.843 1.00 0.00 N ATOM 0 H LYS A 25 -7.169 1.144 14.557 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.140 0.836 17.160 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.184 1.424 14.503 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.322 0.538 15.499 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.674 2.246 17.387 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.996 3.207 16.088 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.887 2.236 16.260 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.341 3.873 16.566 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.570 4.331 14.358 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.283 3.193 14.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.302 2.619 12.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.918 1.404 13.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.165 2.507 14.289 1.00 0.00 H new ATOM 429 N GLU A 26 -8.004 -1.896 15.489 1.00 0.00 N ATOM 430 CA GLU A 26 -8.194 -3.335 15.560 1.00 0.00 C ATOM 431 C GLU A 26 -7.062 -3.981 16.363 1.00 0.00 C ATOM 432 O GLU A 26 -7.214 -5.088 16.876 1.00 0.00 O ATOM 433 CB GLU A 26 -8.291 -3.945 14.160 1.00 0.00 C ATOM 434 CG GLU A 26 -9.397 -3.273 13.345 1.00 0.00 C ATOM 435 CD GLU A 26 -10.779 -3.637 13.891 1.00 0.00 C ATOM 436 OE1 GLU A 26 -10.992 -4.844 14.136 1.00 0.00 O ATOM 437 OE2 GLU A 26 -11.591 -2.700 14.050 1.00 0.00 O ATOM 0 H GLU A 26 -7.415 -1.581 14.718 1.00 0.00 H new ATOM 0 HA GLU A 26 -9.135 -3.533 16.073 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.337 -3.835 13.645 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.490 -5.014 14.238 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.266 -2.191 13.370 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.322 -3.579 12.302 1.00 0.00 H new ATOM 444 N GLY A 27 -5.953 -3.261 16.445 1.00 0.00 N ATOM 445 CA GLY A 27 -4.796 -3.750 17.176 1.00 0.00 C ATOM 446 C GLY A 27 -3.803 -4.435 16.236 1.00 0.00 C ATOM 447 O GLY A 27 -2.831 -5.038 16.687 1.00 0.00 O ATOM 0 H GLY A 27 -5.831 -2.343 16.018 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -4.306 -2.920 17.686 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.118 -4.452 17.945 1.00 0.00 H new ATOM 451 N TYR A 28 -4.081 -4.318 14.946 1.00 0.00 N ATOM 452 CA TYR A 28 -3.224 -4.919 13.938 1.00 0.00 C ATOM 453 C TYR A 28 -1.832 -4.284 13.954 1.00 0.00 C ATOM 454 O TYR A 28 -1.686 -3.107 14.279 1.00 0.00 O ATOM 455 CB TYR A 28 -3.889 -4.628 12.591 1.00 0.00 C ATOM 456 CG TYR A 28 -5.312 -5.175 12.469 1.00 0.00 C ATOM 457 CD1 TYR A 28 -5.767 -6.122 13.364 1.00 0.00 C ATOM 458 CD2 TYR A 28 -6.142 -4.722 11.464 1.00 0.00 C ATOM 459 CE1 TYR A 28 -7.107 -6.637 13.249 1.00 0.00 C ATOM 460 CE2 TYR A 28 -7.482 -5.237 11.349 1.00 0.00 C ATOM 461 CZ TYR A 28 -7.898 -6.169 12.247 1.00 0.00 C ATOM 462 OH TYR A 28 -9.163 -6.655 12.138 1.00 0.00 O ATOM 0 H TYR A 28 -4.888 -3.816 14.575 1.00 0.00 H new ATOM 0 HA TYR A 28 -3.104 -5.987 14.123 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -3.910 -3.550 12.433 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -3.277 -5.054 11.796 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -5.118 -6.477 14.151 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -5.787 -3.981 10.763 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -7.475 -7.378 13.943 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -8.141 -4.891 10.567 1.00 0.00 H new ATOM 0 HH TYR A 28 -9.764 -6.134 12.711 1.00 0.00 H new ATOM 472 N GLN A 29 -0.844 -5.093 13.598 1.00 0.00 N ATOM 473 CA GLN A 29 0.531 -4.625 13.567 1.00 0.00 C ATOM 474 C GLN A 29 0.811 -3.885 12.258 1.00 0.00 C ATOM 475 O GLN A 29 0.699 -4.462 11.178 1.00 0.00 O ATOM 476 CB GLN A 29 1.510 -5.786 13.760 1.00 0.00 C ATOM 477 CG GLN A 29 2.310 -5.619 15.053 1.00 0.00 C ATOM 478 CD GLN A 29 2.675 -6.979 15.651 1.00 0.00 C ATOM 479 OE1 GLN A 29 3.658 -7.603 15.286 1.00 0.00 O ATOM 480 NE2 GLN A 29 1.831 -7.402 16.588 1.00 0.00 N ATOM 0 H GLN A 29 -0.969 -6.069 13.329 1.00 0.00 H new ATOM 0 HA GLN A 29 0.676 -3.929 14.393 1.00 0.00 H new ATOM 0 HB2 GLN A 29 0.962 -6.728 13.786 1.00 0.00 H new ATOM 0 HB3 GLN A 29 2.191 -5.837 12.911 1.00 0.00 H new ATOM 0 HG2 GLN A 29 3.218 -5.050 14.852 1.00 0.00 H new ATOM 0 HG3 GLN A 29 1.727 -5.045 15.774 1.00 0.00 H new ATOM 0 HE21 GLN A 29 1.027 -6.830 16.846 1.00 0.00 H new ATOM 0 HE22 GLN A 29 1.988 -8.299 17.048 1.00 0.00 H new ATOM 489 N THR A 30 1.169 -2.617 12.397 1.00 0.00 N ATOM 490 CA THR A 30 1.466 -1.791 11.239 1.00 0.00 C ATOM 491 C THR A 30 2.844 -1.144 11.384 1.00 0.00 C ATOM 492 O THR A 30 3.302 -0.893 12.498 1.00 0.00 O ATOM 493 CB THR A 30 0.332 -0.776 11.079 1.00 0.00 C ATOM 494 OG1 THR A 30 0.164 -0.234 12.387 1.00 0.00 O ATOM 495 CG2 THR A 30 -1.012 -1.442 10.777 1.00 0.00 C ATOM 0 H THR A 30 1.260 -2.141 13.295 1.00 0.00 H new ATOM 0 HA THR A 30 1.517 -2.389 10.329 1.00 0.00 H new ATOM 0 HB THR A 30 0.580 -0.079 10.279 1.00 0.00 H new ATOM 0 HG1 THR A 30 -0.552 0.435 12.374 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.782 -0.677 10.673 1.00 0.00 H new ATOM 0 HG22 THR A 30 -0.937 -2.010 9.849 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.276 -2.114 11.593 1.00 0.00 H new ATOM 503 N PHE A 31 3.468 -0.893 10.242 1.00 0.00 N ATOM 504 CA PHE A 31 4.785 -0.280 10.228 1.00 0.00 C ATOM 505 C PHE A 31 4.922 0.699 9.060 1.00 0.00 C ATOM 506 O PHE A 31 4.120 0.674 8.128 1.00 0.00 O ATOM 507 CB PHE A 31 5.802 -1.409 10.053 1.00 0.00 C ATOM 508 CG PHE A 31 6.988 -1.333 11.018 1.00 0.00 C ATOM 509 CD1 PHE A 31 8.009 -0.468 10.774 1.00 0.00 C ATOM 510 CD2 PHE A 31 7.021 -2.131 12.119 1.00 0.00 C ATOM 511 CE1 PHE A 31 9.109 -0.398 11.668 1.00 0.00 C ATOM 512 CE2 PHE A 31 8.121 -2.061 13.013 1.00 0.00 C ATOM 513 CZ PHE A 31 9.142 -1.196 12.769 1.00 0.00 C ATOM 0 H PHE A 31 3.086 -1.103 9.320 1.00 0.00 H new ATOM 0 HA PHE A 31 4.947 0.274 11.153 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.296 -2.365 10.190 1.00 0.00 H new ATOM 0 HB3 PHE A 31 6.177 -1.391 9.030 1.00 0.00 H new ATOM 0 HD1 PHE A 31 7.983 0.166 9.900 1.00 0.00 H new ATOM 0 HD2 PHE A 31 6.210 -2.818 12.313 1.00 0.00 H new ATOM 0 HE1 PHE A 31 9.920 0.289 11.474 1.00 0.00 H new ATOM 0 HE2 PHE A 31 8.147 -2.695 13.887 1.00 0.00 H new ATOM 0 HZ PHE A 31 9.979 -1.143 13.450 1.00 0.00 H new ATOM 523 N GLN A 32 5.944 1.537 9.148 1.00 0.00 N ATOM 524 CA GLN A 32 6.196 2.522 8.110 1.00 0.00 C ATOM 525 C GLN A 32 7.634 2.400 7.601 1.00 0.00 C ATOM 526 O GLN A 32 8.543 2.086 8.368 1.00 0.00 O ATOM 527 CB GLN A 32 5.912 3.937 8.616 1.00 0.00 C ATOM 528 CG GLN A 32 6.863 4.950 7.976 1.00 0.00 C ATOM 529 CD GLN A 32 6.315 6.373 8.103 1.00 0.00 C ATOM 530 OE1 GLN A 32 5.569 6.855 7.267 1.00 0.00 O ATOM 531 NE2 GLN A 32 6.725 7.016 9.193 1.00 0.00 N ATOM 0 H GLN A 32 6.608 1.554 9.922 1.00 0.00 H new ATOM 0 HA GLN A 32 5.519 2.326 7.279 1.00 0.00 H new ATOM 0 HB2 GLN A 32 4.881 4.208 8.390 1.00 0.00 H new ATOM 0 HB3 GLN A 32 6.019 3.967 9.700 1.00 0.00 H new ATOM 0 HG2 GLN A 32 7.841 4.889 8.454 1.00 0.00 H new ATOM 0 HG3 GLN A 32 7.007 4.705 6.924 1.00 0.00 H new ATOM 0 HE21 GLN A 32 7.350 6.554 9.853 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.414 7.971 9.369 1.00 0.00 H new ATOM 540 N ALA A 33 7.796 2.656 6.311 1.00 0.00 N ATOM 541 CA ALA A 33 9.107 2.579 5.691 1.00 0.00 C ATOM 542 C ALA A 33 9.381 3.875 4.924 1.00 0.00 C ATOM 543 O ALA A 33 8.474 4.679 4.715 1.00 0.00 O ATOM 544 CB ALA A 33 9.176 1.344 4.792 1.00 0.00 C ATOM 0 H ALA A 33 7.040 2.917 5.678 1.00 0.00 H new ATOM 0 HA ALA A 33 9.884 2.474 6.449 1.00 0.00 H new ATOM 0 HB1 ALA A 33 10.160 1.287 4.327 1.00 0.00 H new ATOM 0 HB2 ALA A 33 9.005 0.449 5.390 1.00 0.00 H new ATOM 0 HB3 ALA A 33 8.412 1.415 4.017 1.00 0.00 H new ATOM 550 N ALA A 34 10.634 4.036 4.526 1.00 0.00 N ATOM 551 CA ALA A 34 11.038 5.220 3.786 1.00 0.00 C ATOM 552 C ALA A 34 11.687 4.795 2.468 1.00 0.00 C ATOM 553 O ALA A 34 12.714 5.345 2.072 1.00 0.00 O ATOM 554 CB ALA A 34 11.974 6.067 4.651 1.00 0.00 C ATOM 0 H ALA A 34 11.383 3.367 4.702 1.00 0.00 H new ATOM 0 HA ALA A 34 10.172 5.836 3.543 1.00 0.00 H new ATOM 0 HB1 ALA A 34 12.277 6.955 4.097 1.00 0.00 H new ATOM 0 HB2 ALA A 34 11.456 6.367 5.562 1.00 0.00 H new ATOM 0 HB3 ALA A 34 12.857 5.483 4.912 1.00 0.00 H new ATOM 560 N ASN A 35 11.062 3.820 1.824 1.00 0.00 N ATOM 561 CA ASN A 35 11.566 3.316 0.558 1.00 0.00 C ATOM 562 C ASN A 35 10.783 2.062 0.166 1.00 0.00 C ATOM 563 O ASN A 35 9.880 1.638 0.886 1.00 0.00 O ATOM 564 CB ASN A 35 13.044 2.935 0.666 1.00 0.00 C ATOM 565 CG ASN A 35 13.938 4.041 0.102 1.00 0.00 C ATOM 566 OD1 ASN A 35 13.519 4.872 -0.687 1.00 0.00 O ATOM 567 ND2 ASN A 35 15.190 4.006 0.550 1.00 0.00 N ATOM 0 H ASN A 35 10.211 3.366 2.155 1.00 0.00 H new ATOM 0 HA ASN A 35 11.449 4.102 -0.188 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.301 2.752 1.709 1.00 0.00 H new ATOM 0 HB3 ASN A 35 13.224 2.006 0.125 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.865 4.702 0.233 1.00 0.00 H new ATOM 0 HD22 ASN A 35 15.475 3.283 1.210 1.00 0.00 H new ATOM 574 N GLY A 36 11.156 1.503 -0.976 1.00 0.00 N ATOM 575 CA GLY A 36 10.499 0.306 -1.474 1.00 0.00 C ATOM 576 C GLY A 36 11.179 -0.955 -0.937 1.00 0.00 C ATOM 577 O GLY A 36 10.512 -1.943 -0.633 1.00 0.00 O ATOM 0 H GLY A 36 11.905 1.857 -1.571 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.450 0.312 -1.178 1.00 0.00 H new ATOM 0 HA3 GLY A 36 10.522 0.300 -2.564 1.00 0.00 H new ATOM 581 N LEU A 37 12.498 -0.881 -0.838 1.00 0.00 N ATOM 582 CA LEU A 37 13.276 -2.005 -0.344 1.00 0.00 C ATOM 583 C LEU A 37 13.057 -2.147 1.164 1.00 0.00 C ATOM 584 O LEU A 37 12.676 -3.215 1.641 1.00 0.00 O ATOM 585 CB LEU A 37 14.746 -1.855 -0.741 1.00 0.00 C ATOM 586 CG LEU A 37 15.364 -3.039 -1.487 1.00 0.00 C ATOM 587 CD1 LEU A 37 16.683 -2.641 -2.151 1.00 0.00 C ATOM 588 CD2 LEU A 37 15.530 -4.245 -0.560 1.00 0.00 C ATOM 0 H LEU A 37 13.048 -0.060 -1.091 1.00 0.00 H new ATOM 0 HA LEU A 37 12.939 -2.934 -0.804 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.844 -0.967 -1.365 1.00 0.00 H new ATOM 0 HB3 LEU A 37 15.329 -1.676 0.162 1.00 0.00 H new ATOM 0 HG LEU A 37 14.680 -3.336 -2.282 1.00 0.00 H new ATOM 0 HD11 LEU A 37 17.101 -3.501 -2.674 1.00 0.00 H new ATOM 0 HD12 LEU A 37 16.503 -1.835 -2.863 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.386 -2.303 -1.390 1.00 0.00 H new ATOM 0 HD21 LEU A 37 15.971 -5.073 -1.115 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.182 -3.978 0.272 1.00 0.00 H new ATOM 0 HD23 LEU A 37 14.555 -4.545 -0.175 1.00 0.00 H new ATOM 600 N GLN A 38 13.308 -1.055 1.871 1.00 0.00 N ATOM 601 CA GLN A 38 13.143 -1.045 3.315 1.00 0.00 C ATOM 602 C GLN A 38 11.738 -1.517 3.692 1.00 0.00 C ATOM 603 O GLN A 38 11.501 -1.929 4.827 1.00 0.00 O ATOM 604 CB GLN A 38 13.428 0.344 3.889 1.00 0.00 C ATOM 605 CG GLN A 38 14.703 0.338 4.734 1.00 0.00 C ATOM 606 CD GLN A 38 14.592 1.319 5.903 1.00 0.00 C ATOM 607 OE1 GLN A 38 13.651 1.296 6.679 1.00 0.00 O ATOM 608 NE2 GLN A 38 15.603 2.180 5.984 1.00 0.00 N ATOM 0 H GLN A 38 13.624 -0.171 1.471 1.00 0.00 H new ATOM 0 HA GLN A 38 13.865 -1.737 3.749 1.00 0.00 H new ATOM 0 HB2 GLN A 38 13.530 1.063 3.076 1.00 0.00 H new ATOM 0 HB3 GLN A 38 12.585 0.669 4.499 1.00 0.00 H new ATOM 0 HG2 GLN A 38 14.886 -0.667 5.114 1.00 0.00 H new ATOM 0 HG3 GLN A 38 15.557 0.604 4.111 1.00 0.00 H new ATOM 0 HE21 GLN A 38 16.359 2.144 5.301 1.00 0.00 H new ATOM 0 HE22 GLN A 38 15.622 2.876 6.729 1.00 0.00 H new ATOM 617 N ALA A 39 10.841 -1.441 2.719 1.00 0.00 N ATOM 618 CA ALA A 39 9.465 -1.855 2.935 1.00 0.00 C ATOM 619 C ALA A 39 9.371 -3.378 2.813 1.00 0.00 C ATOM 620 O ALA A 39 8.621 -4.018 3.549 1.00 0.00 O ATOM 621 CB ALA A 39 8.553 -1.133 1.943 1.00 0.00 C ATOM 0 H ALA A 39 11.041 -1.099 1.779 1.00 0.00 H new ATOM 0 HA ALA A 39 9.135 -1.583 3.938 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.521 -1.444 2.105 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.635 -0.056 2.090 1.00 0.00 H new ATOM 0 HB3 ALA A 39 8.852 -1.384 0.925 1.00 0.00 H new ATOM 627 N LEU A 40 10.141 -3.913 1.877 1.00 0.00 N ATOM 628 CA LEU A 40 10.154 -5.348 1.649 1.00 0.00 C ATOM 629 C LEU A 40 10.568 -6.061 2.938 1.00 0.00 C ATOM 630 O LEU A 40 9.879 -6.971 3.397 1.00 0.00 O ATOM 631 CB LEU A 40 11.034 -5.691 0.446 1.00 0.00 C ATOM 632 CG LEU A 40 10.487 -5.283 -0.924 1.00 0.00 C ATOM 633 CD1 LEU A 40 11.433 -5.719 -2.044 1.00 0.00 C ATOM 634 CD2 LEU A 40 9.069 -5.818 -1.130 1.00 0.00 C ATOM 0 H LEU A 40 10.760 -3.379 1.268 1.00 0.00 H new ATOM 0 HA LEU A 40 9.155 -5.703 1.395 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.005 -5.215 0.584 1.00 0.00 H new ATOM 0 HB3 LEU A 40 11.205 -6.768 0.441 1.00 0.00 H new ATOM 0 HG LEU A 40 10.428 -4.195 -0.958 1.00 0.00 H new ATOM 0 HD11 LEU A 40 11.021 -5.417 -3.007 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.406 -5.249 -1.902 1.00 0.00 H new ATOM 0 HD13 LEU A 40 11.547 -6.803 -2.022 1.00 0.00 H new ATOM 0 HD21 LEU A 40 8.704 -5.514 -2.111 1.00 0.00 H new ATOM 0 HD22 LEU A 40 9.078 -6.906 -1.068 1.00 0.00 H new ATOM 0 HD23 LEU A 40 8.413 -5.416 -0.358 1.00 0.00 H new ATOM 646 N ASP A 41 11.692 -5.622 3.485 1.00 0.00 N ATOM 647 CA ASP A 41 12.206 -6.207 4.711 1.00 0.00 C ATOM 648 C ASP A 41 11.123 -6.151 5.791 1.00 0.00 C ATOM 649 O ASP A 41 10.708 -7.184 6.313 1.00 0.00 O ATOM 650 CB ASP A 41 13.424 -5.435 5.222 1.00 0.00 C ATOM 651 CG ASP A 41 14.613 -6.303 5.637 1.00 0.00 C ATOM 652 OD1 ASP A 41 15.146 -6.999 4.745 1.00 0.00 O ATOM 653 OD2 ASP A 41 14.963 -6.252 6.836 1.00 0.00 O ATOM 0 H ASP A 41 12.261 -4.868 3.101 1.00 0.00 H new ATOM 0 HA ASP A 41 12.495 -7.236 4.498 1.00 0.00 H new ATOM 0 HB2 ASP A 41 13.751 -4.746 4.444 1.00 0.00 H new ATOM 0 HB3 ASP A 41 13.120 -4.830 6.076 1.00 0.00 H new ATOM 658 N ILE A 42 10.697 -4.934 6.093 1.00 0.00 N ATOM 659 CA ILE A 42 9.670 -4.729 7.101 1.00 0.00 C ATOM 660 C ILE A 42 8.412 -5.505 6.706 1.00 0.00 C ATOM 661 O ILE A 42 7.662 -5.960 7.569 1.00 0.00 O ATOM 662 CB ILE A 42 9.428 -3.235 7.323 1.00 0.00 C ATOM 663 CG1 ILE A 42 10.632 -2.578 8.000 1.00 0.00 C ATOM 664 CG2 ILE A 42 8.133 -3.000 8.104 1.00 0.00 C ATOM 665 CD1 ILE A 42 10.354 -2.315 9.481 1.00 0.00 C ATOM 0 H ILE A 42 11.044 -4.079 5.658 1.00 0.00 H new ATOM 0 HA ILE A 42 9.997 -5.121 8.064 1.00 0.00 H new ATOM 0 HB ILE A 42 9.308 -2.760 6.349 1.00 0.00 H new ATOM 0 HG12 ILE A 42 11.506 -3.222 7.899 1.00 0.00 H new ATOM 0 HG13 ILE A 42 10.868 -1.639 7.499 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.984 -1.930 8.248 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.292 -3.411 7.546 1.00 0.00 H new ATOM 0 HG23 ILE A 42 8.199 -3.491 9.075 1.00 0.00 H new ATOM 0 HD11 ILE A 42 11.226 -1.848 9.938 1.00 0.00 H new ATOM 0 HD12 ILE A 42 9.495 -1.652 9.578 1.00 0.00 H new ATOM 0 HD13 ILE A 42 10.143 -3.258 9.985 1.00 0.00 H new ATOM 677 N VAL A 43 8.219 -5.631 5.402 1.00 0.00 N ATOM 678 CA VAL A 43 7.064 -6.344 4.882 1.00 0.00 C ATOM 679 C VAL A 43 7.174 -7.824 5.253 1.00 0.00 C ATOM 680 O VAL A 43 6.213 -8.419 5.738 1.00 0.00 O ATOM 681 CB VAL A 43 6.942 -6.113 3.374 1.00 0.00 C ATOM 682 CG1 VAL A 43 6.306 -7.322 2.684 1.00 0.00 C ATOM 683 CG2 VAL A 43 6.154 -4.835 3.077 1.00 0.00 C ATOM 0 H VAL A 43 8.843 -5.252 4.689 1.00 0.00 H new ATOM 0 HA VAL A 43 6.146 -5.964 5.331 1.00 0.00 H new ATOM 0 HB VAL A 43 7.947 -5.988 2.972 1.00 0.00 H new ATOM 0 HG11 VAL A 43 6.231 -7.132 1.613 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.923 -8.204 2.854 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.310 -7.492 3.093 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.082 -4.694 1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.153 -4.918 3.500 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.665 -3.981 3.521 1.00 0.00 H new ATOM 693 N THR A 44 8.354 -8.376 5.010 1.00 0.00 N ATOM 694 CA THR A 44 8.602 -9.775 5.313 1.00 0.00 C ATOM 695 C THR A 44 8.565 -10.009 6.824 1.00 0.00 C ATOM 696 O THR A 44 8.134 -11.066 7.282 1.00 0.00 O ATOM 697 CB THR A 44 9.933 -10.169 4.669 1.00 0.00 C ATOM 698 OG1 THR A 44 9.759 -9.853 3.291 1.00 0.00 O ATOM 699 CG2 THR A 44 10.162 -11.682 4.678 1.00 0.00 C ATOM 0 H THR A 44 9.149 -7.879 4.607 1.00 0.00 H new ATOM 0 HA THR A 44 7.822 -10.414 4.899 1.00 0.00 H new ATOM 0 HB THR A 44 10.751 -9.675 5.194 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.920 -8.896 3.152 1.00 0.00 H new ATOM 0 HG21 THR A 44 11.120 -11.908 4.210 1.00 0.00 H new ATOM 0 HG22 THR A 44 10.167 -12.043 5.706 1.00 0.00 H new ATOM 0 HG23 THR A 44 9.363 -12.174 4.124 1.00 0.00 H new ATOM 707 N LYS A 45 9.024 -9.005 7.557 1.00 0.00 N ATOM 708 CA LYS A 45 9.048 -9.087 9.008 1.00 0.00 C ATOM 709 C LYS A 45 7.628 -8.913 9.549 1.00 0.00 C ATOM 710 O LYS A 45 7.151 -9.736 10.328 1.00 0.00 O ATOM 711 CB LYS A 45 10.053 -8.087 9.584 1.00 0.00 C ATOM 712 CG LYS A 45 11.110 -8.799 10.431 1.00 0.00 C ATOM 713 CD LYS A 45 11.255 -8.132 11.800 1.00 0.00 C ATOM 714 CE LYS A 45 11.741 -9.134 12.849 1.00 0.00 C ATOM 715 NZ LYS A 45 10.963 -10.390 12.767 1.00 0.00 N ATOM 0 H LYS A 45 9.382 -8.130 7.173 1.00 0.00 H new ATOM 0 HA LYS A 45 9.392 -10.070 9.328 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.537 -7.544 8.772 1.00 0.00 H new ATOM 0 HB3 LYS A 45 9.530 -7.350 10.193 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.834 -9.846 10.560 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.068 -8.784 9.912 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.958 -7.302 11.731 1.00 0.00 H new ATOM 0 HD3 LYS A 45 10.297 -7.714 12.108 1.00 0.00 H new ATOM 0 HE2 LYS A 45 12.799 -9.345 12.696 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.642 -8.703 13.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.854 -10.794 13.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 10.024 -10.191 12.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.463 -11.069 12.158 1.00 0.00 H new ATOM 729 N GLU A 46 6.991 -7.835 9.114 1.00 0.00 N ATOM 730 CA GLU A 46 5.635 -7.543 9.544 1.00 0.00 C ATOM 731 C GLU A 46 4.633 -8.389 8.757 1.00 0.00 C ATOM 732 O GLU A 46 3.433 -8.346 9.024 1.00 0.00 O ATOM 733 CB GLU A 46 5.324 -6.051 9.401 1.00 0.00 C ATOM 734 CG GLU A 46 5.951 -5.249 10.543 1.00 0.00 C ATOM 735 CD GLU A 46 4.873 -4.583 11.401 1.00 0.00 C ATOM 736 OE1 GLU A 46 3.933 -4.022 10.797 1.00 0.00 O ATOM 737 OE2 GLU A 46 5.013 -4.649 12.642 1.00 0.00 O ATOM 0 H GLU A 46 7.390 -7.154 8.468 1.00 0.00 H new ATOM 0 HA GLU A 46 5.547 -7.800 10.600 1.00 0.00 H new ATOM 0 HB2 GLU A 46 5.702 -5.687 8.446 1.00 0.00 H new ATOM 0 HB3 GLU A 46 4.245 -5.900 9.395 1.00 0.00 H new ATOM 0 HG2 GLU A 46 6.559 -5.907 11.163 1.00 0.00 H new ATOM 0 HG3 GLU A 46 6.618 -4.489 10.135 1.00 0.00 H new ATOM 744 N ARG A 47 5.163 -9.140 7.802 1.00 0.00 N ATOM 745 CA ARG A 47 4.331 -9.995 6.974 1.00 0.00 C ATOM 746 C ARG A 47 2.898 -9.460 6.930 1.00 0.00 C ATOM 747 O ARG A 47 1.963 -10.145 7.341 1.00 0.00 O ATOM 748 CB ARG A 47 4.316 -11.430 7.505 1.00 0.00 C ATOM 749 CG ARG A 47 3.868 -11.469 8.967 1.00 0.00 C ATOM 750 CD ARG A 47 2.841 -12.579 9.197 1.00 0.00 C ATOM 751 NE ARG A 47 3.467 -13.902 8.976 1.00 0.00 N ATOM 752 CZ ARG A 47 2.846 -15.071 9.183 1.00 0.00 C ATOM 753 NH1 ARG A 47 1.579 -15.089 9.618 1.00 0.00 N ATOM 754 NH2 ARG A 47 3.493 -16.223 8.956 1.00 0.00 N ATOM 0 H ARG A 47 6.159 -9.174 7.584 1.00 0.00 H new ATOM 0 HA ARG A 47 4.753 -9.996 5.969 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.645 -12.039 6.899 1.00 0.00 H new ATOM 0 HB3 ARG A 47 5.311 -11.866 7.414 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.732 -11.629 9.612 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.437 -10.507 9.245 1.00 0.00 H new ATOM 0 HD2 ARG A 47 2.449 -12.518 10.212 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.996 -12.450 8.521 1.00 0.00 H new ATOM 0 HE ARG A 47 4.432 -13.925 8.645 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.087 -14.213 9.792 1.00 0.00 H new ATOM 0 HH12 ARG A 47 1.106 -15.979 9.775 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.458 -16.209 8.626 1.00 0.00 H new ATOM 0 HH22 ARG A 47 3.020 -17.113 9.114 1.00 0.00 H new ATOM 768 N PRO A 48 2.768 -8.208 6.414 1.00 0.00 N ATOM 769 CA PRO A 48 1.465 -7.573 6.311 1.00 0.00 C ATOM 770 C PRO A 48 0.653 -8.170 5.159 1.00 0.00 C ATOM 771 O PRO A 48 1.220 -8.721 4.216 1.00 0.00 O ATOM 772 CB PRO A 48 1.762 -6.094 6.125 1.00 0.00 C ATOM 773 CG PRO A 48 3.208 -6.014 5.666 1.00 0.00 C ATOM 774 CD PRO A 48 3.853 -7.368 5.917 1.00 0.00 C ATOM 0 HA PRO A 48 0.848 -7.734 7.195 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.093 -5.651 5.387 1.00 0.00 H new ATOM 0 HB3 PRO A 48 1.617 -5.546 7.056 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.259 -5.757 4.608 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.738 -5.232 6.210 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.284 -7.777 5.003 1.00 0.00 H new ATOM 0 HD3 PRO A 48 4.661 -7.293 6.645 1.00 0.00 H new ATOM 782 N ASP A 49 -0.660 -8.040 5.273 1.00 0.00 N ATOM 783 CA ASP A 49 -1.555 -8.559 4.253 1.00 0.00 C ATOM 784 C ASP A 49 -1.929 -7.433 3.288 1.00 0.00 C ATOM 785 O ASP A 49 -2.717 -7.637 2.366 1.00 0.00 O ATOM 786 CB ASP A 49 -2.845 -9.098 4.874 1.00 0.00 C ATOM 787 CG ASP A 49 -2.679 -9.743 6.252 1.00 0.00 C ATOM 788 OD1 ASP A 49 -1.520 -10.059 6.594 1.00 0.00 O ATOM 789 OD2 ASP A 49 -3.716 -9.904 6.931 1.00 0.00 O ATOM 0 H ASP A 49 -1.126 -7.583 6.057 1.00 0.00 H new ATOM 0 HA ASP A 49 -1.041 -9.367 3.733 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -3.560 -8.280 4.956 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -3.278 -9.833 4.195 1.00 0.00 H new ATOM 794 N LEU A 50 -1.347 -6.268 3.534 1.00 0.00 N ATOM 795 CA LEU A 50 -1.610 -5.109 2.698 1.00 0.00 C ATOM 796 C LEU A 50 -0.578 -4.021 3.002 1.00 0.00 C ATOM 797 O LEU A 50 -0.512 -3.519 4.123 1.00 0.00 O ATOM 798 CB LEU A 50 -3.058 -4.646 2.864 1.00 0.00 C ATOM 799 CG LEU A 50 -3.751 -4.142 1.596 1.00 0.00 C ATOM 800 CD1 LEU A 50 -3.328 -2.707 1.274 1.00 0.00 C ATOM 801 CD2 LEU A 50 -3.503 -5.090 0.422 1.00 0.00 C ATOM 0 H LEU A 50 -0.694 -6.102 4.300 1.00 0.00 H new ATOM 0 HA LEU A 50 -1.501 -5.367 1.645 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.640 -5.475 3.267 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.081 -3.849 3.608 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.826 -4.128 1.776 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.835 -2.373 0.369 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.598 -2.053 2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.249 -2.671 1.120 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -4.006 -4.708 -0.466 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.432 -5.160 0.231 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.893 -6.079 0.664 1.00 0.00 H new ATOM 813 N VAL A 51 0.203 -3.690 1.985 1.00 0.00 N ATOM 814 CA VAL A 51 1.229 -2.671 2.130 1.00 0.00 C ATOM 815 C VAL A 51 1.000 -1.571 1.091 1.00 0.00 C ATOM 816 O VAL A 51 0.822 -1.858 -0.092 1.00 0.00 O ATOM 817 CB VAL A 51 2.617 -3.308 2.030 1.00 0.00 C ATOM 818 CG1 VAL A 51 2.600 -4.514 1.090 1.00 0.00 C ATOM 819 CG2 VAL A 51 3.661 -2.281 1.586 1.00 0.00 C ATOM 0 H VAL A 51 0.146 -4.109 1.057 1.00 0.00 H new ATOM 0 HA VAL A 51 1.169 -2.206 3.114 1.00 0.00 H new ATOM 0 HB VAL A 51 2.896 -3.661 3.023 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.598 -4.948 1.037 1.00 0.00 H new ATOM 0 HG12 VAL A 51 1.900 -5.259 1.467 1.00 0.00 H new ATOM 0 HG13 VAL A 51 2.289 -4.195 0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 51 4.638 -2.760 1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.388 -1.884 0.608 1.00 0.00 H new ATOM 0 HG23 VAL A 51 3.702 -1.467 2.310 1.00 0.00 H new ATOM 829 N LEU A 52 1.012 -0.336 1.570 1.00 0.00 N ATOM 830 CA LEU A 52 0.808 0.807 0.698 1.00 0.00 C ATOM 831 C LEU A 52 2.149 1.504 0.455 1.00 0.00 C ATOM 832 O LEU A 52 2.916 1.725 1.390 1.00 0.00 O ATOM 833 CB LEU A 52 -0.270 1.731 1.268 1.00 0.00 C ATOM 834 CG LEU A 52 -0.051 3.230 1.054 1.00 0.00 C ATOM 835 CD1 LEU A 52 -1.346 4.012 1.285 1.00 0.00 C ATOM 836 CD2 LEU A 52 1.094 3.748 1.926 1.00 0.00 C ATOM 0 H LEU A 52 1.160 -0.102 2.552 1.00 0.00 H new ATOM 0 HA LEU A 52 0.436 0.482 -0.274 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -1.227 1.457 0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -0.350 1.545 2.339 1.00 0.00 H new ATOM 0 HG LEU A 52 0.240 3.387 0.015 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.163 5.075 1.126 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.109 3.667 0.587 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.690 3.852 2.307 1.00 0.00 H new ATOM 0 HD21 LEU A 52 1.228 4.816 1.754 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.858 3.576 2.976 1.00 0.00 H new ATOM 0 HD23 LEU A 52 2.013 3.221 1.670 1.00 0.00 H new ATOM 848 N LEU A 53 2.390 1.830 -0.807 1.00 0.00 N ATOM 849 CA LEU A 53 3.625 2.497 -1.184 1.00 0.00 C ATOM 850 C LEU A 53 3.321 3.565 -2.237 1.00 0.00 C ATOM 851 O LEU A 53 2.366 3.434 -3.001 1.00 0.00 O ATOM 852 CB LEU A 53 4.671 1.474 -1.630 1.00 0.00 C ATOM 853 CG LEU A 53 5.863 2.030 -2.411 1.00 0.00 C ATOM 854 CD1 LEU A 53 7.068 1.092 -2.315 1.00 0.00 C ATOM 855 CD2 LEU A 53 5.479 2.324 -3.863 1.00 0.00 C ATOM 0 H LEU A 53 1.752 1.645 -1.581 1.00 0.00 H new ATOM 0 HA LEU A 53 4.059 3.009 -0.326 1.00 0.00 H new ATOM 0 HB2 LEU A 53 5.049 0.961 -0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.176 0.723 -2.247 1.00 0.00 H new ATOM 0 HG LEU A 53 6.156 2.977 -1.958 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.901 1.511 -2.879 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.358 0.978 -1.270 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.805 0.118 -2.727 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.345 2.718 -4.396 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.144 1.405 -4.344 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.674 3.059 -3.885 1.00 0.00 H new ATOM 867 N ASP A 54 4.151 4.597 -2.243 1.00 0.00 N ATOM 868 CA ASP A 54 3.984 5.687 -3.189 1.00 0.00 C ATOM 869 C ASP A 54 5.111 5.636 -4.223 1.00 0.00 C ATOM 870 O ASP A 54 6.272 5.438 -3.871 1.00 0.00 O ATOM 871 CB ASP A 54 4.049 7.043 -2.485 1.00 0.00 C ATOM 872 CG ASP A 54 4.573 8.194 -3.345 1.00 0.00 C ATOM 873 OD1 ASP A 54 4.448 8.080 -4.584 1.00 0.00 O ATOM 874 OD2 ASP A 54 5.088 9.162 -2.745 1.00 0.00 O ATOM 0 H ASP A 54 4.942 4.702 -1.607 1.00 0.00 H new ATOM 0 HA ASP A 54 3.009 5.575 -3.664 1.00 0.00 H new ATOM 0 HB2 ASP A 54 3.051 7.300 -2.131 1.00 0.00 H new ATOM 0 HB3 ASP A 54 4.685 6.948 -1.605 1.00 0.00 H new ATOM 879 N MET A 55 4.727 5.819 -5.478 1.00 0.00 N ATOM 880 CA MET A 55 5.691 5.797 -6.566 1.00 0.00 C ATOM 881 C MET A 55 6.785 6.845 -6.350 1.00 0.00 C ATOM 882 O MET A 55 7.963 6.506 -6.249 1.00 0.00 O ATOM 883 CB MET A 55 4.974 6.072 -7.889 1.00 0.00 C ATOM 884 CG MET A 55 4.283 4.810 -8.411 1.00 0.00 C ATOM 885 SD MET A 55 2.764 4.531 -7.516 1.00 0.00 S ATOM 886 CE MET A 55 3.404 3.703 -6.070 1.00 0.00 C ATOM 0 H MET A 55 3.762 5.983 -5.766 1.00 0.00 H new ATOM 0 HA MET A 55 6.158 4.812 -6.594 1.00 0.00 H new ATOM 0 HB2 MET A 55 4.237 6.863 -7.750 1.00 0.00 H new ATOM 0 HB3 MET A 55 5.691 6.430 -8.628 1.00 0.00 H new ATOM 0 HG2 MET A 55 4.074 4.914 -9.476 1.00 0.00 H new ATOM 0 HG3 MET A 55 4.944 3.951 -8.299 1.00 0.00 H new ATOM 0 HE1 MET A 55 3.060 2.669 -6.061 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.494 3.723 -6.091 1.00 0.00 H new ATOM 0 HE3 MET A 55 3.049 4.211 -5.173 1.00 0.00 H new ATOM 896 N LYS A 56 6.356 8.097 -6.286 1.00 0.00 N ATOM 897 CA LYS A 56 7.284 9.196 -6.085 1.00 0.00 C ATOM 898 C LYS A 56 7.923 9.072 -4.700 1.00 0.00 C ATOM 899 O LYS A 56 7.221 8.957 -3.697 1.00 0.00 O ATOM 900 CB LYS A 56 6.586 10.537 -6.322 1.00 0.00 C ATOM 901 CG LYS A 56 6.820 11.033 -7.750 1.00 0.00 C ATOM 902 CD LYS A 56 5.762 12.061 -8.154 1.00 0.00 C ATOM 903 CE LYS A 56 6.011 12.575 -9.573 1.00 0.00 C ATOM 904 NZ LYS A 56 5.635 14.003 -9.680 1.00 0.00 N ATOM 0 H LYS A 56 5.378 8.374 -6.370 1.00 0.00 H new ATOM 0 HA LYS A 56 8.092 9.150 -6.815 1.00 0.00 H new ATOM 0 HB2 LYS A 56 5.516 10.431 -6.141 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.958 11.275 -5.611 1.00 0.00 H new ATOM 0 HG2 LYS A 56 7.812 11.478 -7.826 1.00 0.00 H new ATOM 0 HG3 LYS A 56 6.795 10.190 -8.440 1.00 0.00 H new ATOM 0 HD2 LYS A 56 4.771 11.611 -8.095 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.775 12.896 -7.453 1.00 0.00 H new ATOM 0 HE2 LYS A 56 7.062 12.449 -9.833 1.00 0.00 H new ATOM 0 HE3 LYS A 56 5.434 11.986 -10.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 5.810 14.336 -10.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.626 14.114 -9.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.204 14.563 -9.013 1.00 0.00 H new ATOM 918 N ILE A 57 9.248 9.099 -4.690 1.00 0.00 N ATOM 919 CA ILE A 57 9.989 8.990 -3.445 1.00 0.00 C ATOM 920 C ILE A 57 11.380 9.598 -3.630 1.00 0.00 C ATOM 921 O ILE A 57 11.849 9.754 -4.757 1.00 0.00 O ATOM 922 CB ILE A 57 10.011 7.539 -2.960 1.00 0.00 C ATOM 923 CG1 ILE A 57 9.324 6.614 -3.966 1.00 0.00 C ATOM 924 CG2 ILE A 57 9.401 7.419 -1.561 1.00 0.00 C ATOM 925 CD1 ILE A 57 9.561 5.144 -3.610 1.00 0.00 C ATOM 0 H ILE A 57 9.827 9.195 -5.524 1.00 0.00 H new ATOM 0 HA ILE A 57 9.495 9.558 -2.656 1.00 0.00 H new ATOM 0 HB ILE A 57 11.050 7.219 -2.887 1.00 0.00 H new ATOM 0 HG12 ILE A 57 8.254 6.820 -3.983 1.00 0.00 H new ATOM 0 HG13 ILE A 57 9.703 6.815 -4.968 1.00 0.00 H new ATOM 0 HG21 ILE A 57 9.429 6.378 -1.240 1.00 0.00 H new ATOM 0 HG22 ILE A 57 9.972 8.030 -0.862 1.00 0.00 H new ATOM 0 HG23 ILE A 57 8.367 7.764 -1.584 1.00 0.00 H new ATOM 0 HD11 ILE A 57 9.062 4.508 -4.341 1.00 0.00 H new ATOM 0 HD12 ILE A 57 10.631 4.936 -3.618 1.00 0.00 H new ATOM 0 HD13 ILE A 57 9.159 4.941 -2.617 1.00 0.00 H new ATOM 937 N PRO A 58 12.019 9.934 -2.478 1.00 0.00 N ATOM 938 CA PRO A 58 13.348 10.521 -2.502 1.00 0.00 C ATOM 939 C PRO A 58 14.408 9.466 -2.823 1.00 0.00 C ATOM 940 O PRO A 58 14.483 8.434 -2.157 1.00 0.00 O ATOM 941 CB PRO A 58 13.528 11.145 -1.128 1.00 0.00 C ATOM 942 CG PRO A 58 12.490 10.487 -0.232 1.00 0.00 C ATOM 943 CD PRO A 58 11.495 9.764 -1.125 1.00 0.00 C ATOM 0 HA PRO A 58 13.461 11.272 -3.284 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.536 10.973 -0.750 1.00 0.00 H new ATOM 0 HB3 PRO A 58 13.382 12.224 -1.167 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.967 9.787 0.454 1.00 0.00 H new ATOM 0 HG3 PRO A 58 11.983 11.235 0.378 1.00 0.00 H new ATOM 0 HD2 PRO A 58 11.418 8.710 -0.860 1.00 0.00 H new ATOM 0 HD3 PRO A 58 10.496 10.190 -1.031 1.00 0.00 H new ATOM 951 N GLY A 59 15.201 9.761 -3.842 1.00 0.00 N ATOM 952 CA GLY A 59 16.254 8.850 -4.259 1.00 0.00 C ATOM 953 C GLY A 59 15.680 7.480 -4.626 1.00 0.00 C ATOM 954 O GLY A 59 15.098 6.801 -3.782 1.00 0.00 O ATOM 0 H GLY A 59 15.136 10.618 -4.391 1.00 0.00 H new ATOM 0 HA2 GLY A 59 16.783 9.268 -5.115 1.00 0.00 H new ATOM 0 HA3 GLY A 59 16.983 8.740 -3.456 1.00 0.00 H new ATOM 958 N MET A 60 15.865 7.115 -5.886 1.00 0.00 N ATOM 959 CA MET A 60 15.373 5.838 -6.375 1.00 0.00 C ATOM 960 C MET A 60 13.851 5.753 -6.251 1.00 0.00 C ATOM 961 O MET A 60 13.324 5.550 -5.158 1.00 0.00 O ATOM 962 CB MET A 60 16.016 4.703 -5.575 1.00 0.00 C ATOM 963 CG MET A 60 15.382 3.356 -5.929 1.00 0.00 C ATOM 964 SD MET A 60 16.224 2.634 -7.327 1.00 0.00 S ATOM 965 CE MET A 60 15.257 1.148 -7.537 1.00 0.00 C ATOM 0 H MET A 60 16.349 7.681 -6.583 1.00 0.00 H new ATOM 0 HA MET A 60 15.638 5.747 -7.428 1.00 0.00 H new ATOM 0 HB2 MET A 60 17.086 4.670 -5.779 1.00 0.00 H new ATOM 0 HB3 MET A 60 15.901 4.894 -4.508 1.00 0.00 H new ATOM 0 HG2 MET A 60 15.437 2.683 -5.073 1.00 0.00 H new ATOM 0 HG3 MET A 60 14.326 3.492 -6.161 1.00 0.00 H new ATOM 0 HE1 MET A 60 15.723 0.515 -8.292 1.00 0.00 H new ATOM 0 HE2 MET A 60 15.208 0.609 -6.591 1.00 0.00 H new ATOM 0 HE3 MET A 60 14.249 1.412 -7.856 1.00 0.00 H new ATOM 975 N ASP A 61 13.186 5.913 -7.386 1.00 0.00 N ATOM 976 CA ASP A 61 11.735 5.857 -7.418 1.00 0.00 C ATOM 977 C ASP A 61 11.280 4.412 -7.201 1.00 0.00 C ATOM 978 O ASP A 61 12.106 3.512 -7.062 1.00 0.00 O ATOM 979 CB ASP A 61 11.195 6.324 -8.771 1.00 0.00 C ATOM 980 CG ASP A 61 12.121 6.065 -9.961 1.00 0.00 C ATOM 981 OD1 ASP A 61 12.585 4.910 -10.079 1.00 0.00 O ATOM 982 OD2 ASP A 61 12.345 7.028 -10.726 1.00 0.00 O ATOM 0 H ASP A 61 13.626 6.082 -8.291 1.00 0.00 H new ATOM 0 HA ASP A 61 11.355 6.511 -6.633 1.00 0.00 H new ATOM 0 HB2 ASP A 61 10.243 5.827 -8.956 1.00 0.00 H new ATOM 0 HB3 ASP A 61 10.991 7.393 -8.714 1.00 0.00 H new ATOM 987 N GLY A 62 9.967 4.236 -7.179 1.00 0.00 N ATOM 988 CA GLY A 62 9.392 2.916 -6.981 1.00 0.00 C ATOM 989 C GLY A 62 8.931 2.314 -8.310 1.00 0.00 C ATOM 990 O GLY A 62 7.960 1.561 -8.350 1.00 0.00 O ATOM 0 H GLY A 62 9.285 4.985 -7.295 1.00 0.00 H new ATOM 0 HA2 GLY A 62 10.129 2.260 -6.517 1.00 0.00 H new ATOM 0 HA3 GLY A 62 8.547 2.982 -6.295 1.00 0.00 H new ATOM 994 N ILE A 63 9.650 2.670 -9.365 1.00 0.00 N ATOM 995 CA ILE A 63 9.326 2.174 -10.692 1.00 0.00 C ATOM 996 C ILE A 63 9.892 0.762 -10.856 1.00 0.00 C ATOM 997 O ILE A 63 9.177 -0.154 -11.259 1.00 0.00 O ATOM 998 CB ILE A 63 9.806 3.157 -11.762 1.00 0.00 C ATOM 999 CG1 ILE A 63 9.196 4.543 -11.546 1.00 0.00 C ATOM 1000 CG2 ILE A 63 9.523 2.619 -13.166 1.00 0.00 C ATOM 1001 CD1 ILE A 63 10.146 5.641 -12.031 1.00 0.00 C ATOM 0 H ILE A 63 10.455 3.295 -9.328 1.00 0.00 H new ATOM 0 HA ILE A 63 8.246 2.102 -10.819 1.00 0.00 H new ATOM 0 HB ILE A 63 10.887 3.263 -11.669 1.00 0.00 H new ATOM 0 HG12 ILE A 63 8.249 4.615 -12.080 1.00 0.00 H new ATOM 0 HG13 ILE A 63 8.977 4.687 -10.488 1.00 0.00 H new ATOM 0 HG21 ILE A 63 9.874 3.336 -13.908 1.00 0.00 H new ATOM 0 HG22 ILE A 63 10.043 1.671 -13.304 1.00 0.00 H new ATOM 0 HG23 ILE A 63 8.451 2.466 -13.288 1.00 0.00 H new ATOM 0 HD11 ILE A 63 9.689 6.617 -11.866 1.00 0.00 H new ATOM 0 HD12 ILE A 63 11.083 5.582 -11.478 1.00 0.00 H new ATOM 0 HD13 ILE A 63 10.343 5.508 -13.095 1.00 0.00 H new ATOM 1013 N GLU A 64 11.170 0.630 -10.535 1.00 0.00 N ATOM 1014 CA GLU A 64 11.840 -0.655 -10.641 1.00 0.00 C ATOM 1015 C GLU A 64 11.631 -1.470 -9.363 1.00 0.00 C ATOM 1016 O GLU A 64 11.747 -2.694 -9.377 1.00 0.00 O ATOM 1017 CB GLU A 64 13.330 -0.474 -10.939 1.00 0.00 C ATOM 1018 CG GLU A 64 13.545 0.542 -12.062 1.00 0.00 C ATOM 1019 CD GLU A 64 13.458 -0.130 -13.434 1.00 0.00 C ATOM 1020 OE1 GLU A 64 14.460 -0.773 -13.814 1.00 0.00 O ATOM 1021 OE2 GLU A 64 12.393 0.016 -14.071 1.00 0.00 O ATOM 0 H GLU A 64 11.760 1.392 -10.201 1.00 0.00 H new ATOM 0 HA GLU A 64 11.401 -1.204 -11.474 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.847 -0.141 -10.039 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.767 -1.432 -11.222 1.00 0.00 H new ATOM 0 HG2 GLU A 64 12.796 1.331 -11.992 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.520 1.016 -11.947 1.00 0.00 H new ATOM 1028 N ILE A 65 11.328 -0.757 -8.288 1.00 0.00 N ATOM 1029 CA ILE A 65 11.102 -1.399 -7.004 1.00 0.00 C ATOM 1030 C ILE A 65 9.831 -2.247 -7.079 1.00 0.00 C ATOM 1031 O ILE A 65 9.882 -3.465 -6.914 1.00 0.00 O ATOM 1032 CB ILE A 65 11.082 -0.360 -5.882 1.00 0.00 C ATOM 1033 CG1 ILE A 65 12.312 0.547 -5.953 1.00 0.00 C ATOM 1034 CG2 ILE A 65 10.944 -1.032 -4.514 1.00 0.00 C ATOM 1035 CD1 ILE A 65 12.386 1.468 -4.733 1.00 0.00 C ATOM 0 H ILE A 65 11.234 0.259 -8.280 1.00 0.00 H new ATOM 0 HA ILE A 65 11.923 -2.075 -6.767 1.00 0.00 H new ATOM 0 HB ILE A 65 10.206 0.274 -6.019 1.00 0.00 H new ATOM 0 HG12 ILE A 65 13.214 -0.062 -6.009 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.275 1.146 -6.863 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.932 -0.271 -3.734 1.00 0.00 H new ATOM 0 HG22 ILE A 65 10.015 -1.600 -4.480 1.00 0.00 H new ATOM 0 HG23 ILE A 65 11.787 -1.704 -4.352 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.269 2.102 -4.809 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.494 2.093 -4.694 1.00 0.00 H new ATOM 0 HD13 ILE A 65 12.448 0.866 -3.826 1.00 0.00 H new ATOM 1047 N LEU A 66 8.719 -1.570 -7.328 1.00 0.00 N ATOM 1048 CA LEU A 66 7.437 -2.246 -7.427 1.00 0.00 C ATOM 1049 C LEU A 66 7.492 -3.270 -8.563 1.00 0.00 C ATOM 1050 O LEU A 66 6.805 -4.290 -8.518 1.00 0.00 O ATOM 1051 CB LEU A 66 6.304 -1.228 -7.571 1.00 0.00 C ATOM 1052 CG LEU A 66 5.800 -0.597 -6.272 1.00 0.00 C ATOM 1053 CD1 LEU A 66 6.949 -0.387 -5.283 1.00 0.00 C ATOM 1054 CD2 LEU A 66 5.040 0.701 -6.551 1.00 0.00 C ATOM 0 H LEU A 66 8.680 -0.560 -7.464 1.00 0.00 H new ATOM 0 HA LEU A 66 7.225 -2.797 -6.511 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.641 -0.430 -8.232 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.464 -1.717 -8.064 1.00 0.00 H new ATOM 0 HG LEU A 66 5.097 -1.288 -5.807 1.00 0.00 H new ATOM 0 HD11 LEU A 66 6.564 0.063 -4.368 1.00 0.00 H new ATOM 0 HD12 LEU A 66 7.408 -1.348 -5.050 1.00 0.00 H new ATOM 0 HD13 LEU A 66 7.694 0.273 -5.726 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.693 1.129 -5.610 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.701 1.410 -7.050 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.184 0.491 -7.192 1.00 0.00 H new ATOM 1066 N LYS A 67 8.314 -2.963 -9.555 1.00 0.00 N ATOM 1067 CA LYS A 67 8.467 -3.843 -10.700 1.00 0.00 C ATOM 1068 C LYS A 67 9.094 -5.162 -10.244 1.00 0.00 C ATOM 1069 O LYS A 67 8.461 -6.214 -10.323 1.00 0.00 O ATOM 1070 CB LYS A 67 9.250 -3.144 -11.814 1.00 0.00 C ATOM 1071 CG LYS A 67 8.340 -2.811 -12.998 1.00 0.00 C ATOM 1072 CD LYS A 67 9.162 -2.482 -14.246 1.00 0.00 C ATOM 1073 CE LYS A 67 8.378 -2.805 -15.519 1.00 0.00 C ATOM 1074 NZ LYS A 67 9.261 -2.727 -16.705 1.00 0.00 N ATOM 0 H LYS A 67 8.882 -2.116 -9.589 1.00 0.00 H new ATOM 0 HA LYS A 67 7.493 -4.082 -11.128 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.700 -2.229 -11.428 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.066 -3.785 -12.147 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.682 -3.655 -13.204 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.703 -1.964 -12.744 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.433 -1.426 -14.239 1.00 0.00 H new ATOM 0 HD3 LYS A 67 10.092 -3.050 -14.233 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.947 -3.803 -15.444 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.548 -2.107 -15.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.713 -2.949 -17.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.652 -1.767 -16.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.038 -3.410 -16.605 1.00 0.00 H new ATOM 1088 N ARG A 68 10.329 -5.063 -9.776 1.00 0.00 N ATOM 1089 CA ARG A 68 11.048 -6.235 -9.307 1.00 0.00 C ATOM 1090 C ARG A 68 10.248 -6.947 -8.214 1.00 0.00 C ATOM 1091 O ARG A 68 10.359 -8.160 -8.048 1.00 0.00 O ATOM 1092 CB ARG A 68 12.424 -5.854 -8.756 1.00 0.00 C ATOM 1093 CG ARG A 68 13.502 -5.987 -9.833 1.00 0.00 C ATOM 1094 CD ARG A 68 14.833 -5.408 -9.351 1.00 0.00 C ATOM 1095 NE ARG A 68 15.605 -6.444 -8.629 1.00 0.00 N ATOM 1096 CZ ARG A 68 15.470 -6.707 -7.322 1.00 0.00 C ATOM 1097 NH1 ARG A 68 14.593 -6.011 -6.586 1.00 0.00 N ATOM 1098 NH2 ARG A 68 16.212 -7.666 -6.751 1.00 0.00 N ATOM 0 H ARG A 68 10.850 -4.189 -9.711 1.00 0.00 H new ATOM 0 HA ARG A 68 11.182 -6.903 -10.158 1.00 0.00 H new ATOM 0 HB2 ARG A 68 12.400 -4.829 -8.385 1.00 0.00 H new ATOM 0 HB3 ARG A 68 12.670 -6.494 -7.909 1.00 0.00 H new ATOM 0 HG2 ARG A 68 13.632 -7.037 -10.095 1.00 0.00 H new ATOM 0 HG3 ARG A 68 13.183 -5.470 -10.738 1.00 0.00 H new ATOM 0 HD2 ARG A 68 15.408 -5.041 -10.201 1.00 0.00 H new ATOM 0 HD3 ARG A 68 14.652 -4.555 -8.696 1.00 0.00 H new ATOM 0 HE ARG A 68 16.282 -6.992 -9.159 1.00 0.00 H new ATOM 0 HH11 ARG A 68 14.028 -5.281 -7.021 1.00 0.00 H new ATOM 0 HH12 ARG A 68 14.490 -6.211 -5.591 1.00 0.00 H new ATOM 0 HH21 ARG A 68 16.880 -8.196 -7.311 1.00 0.00 H new ATOM 0 HH22 ARG A 68 16.109 -7.866 -5.756 1.00 0.00 H new ATOM 1112 N MET A 69 9.459 -6.160 -7.495 1.00 0.00 N ATOM 1113 CA MET A 69 8.641 -6.700 -6.423 1.00 0.00 C ATOM 1114 C MET A 69 7.631 -7.715 -6.961 1.00 0.00 C ATOM 1115 O MET A 69 7.559 -8.842 -6.475 1.00 0.00 O ATOM 1116 CB MET A 69 7.897 -5.559 -5.726 1.00 0.00 C ATOM 1117 CG MET A 69 8.386 -5.384 -4.287 1.00 0.00 C ATOM 1118 SD MET A 69 8.770 -3.669 -3.977 1.00 0.00 S ATOM 1119 CE MET A 69 7.311 -3.183 -3.070 1.00 0.00 C ATOM 0 H MET A 69 9.370 -5.154 -7.634 1.00 0.00 H new ATOM 0 HA MET A 69 9.294 -7.208 -5.713 1.00 0.00 H new ATOM 0 HB2 MET A 69 8.045 -4.632 -6.280 1.00 0.00 H new ATOM 0 HB3 MET A 69 6.826 -5.764 -5.728 1.00 0.00 H new ATOM 0 HG2 MET A 69 7.621 -5.726 -3.590 1.00 0.00 H new ATOM 0 HG3 MET A 69 9.269 -5.999 -4.117 1.00 0.00 H new ATOM 0 HE1 MET A 69 7.370 -2.122 -2.827 1.00 0.00 H new ATOM 0 HE2 MET A 69 6.426 -3.367 -3.679 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.245 -3.763 -2.149 1.00 0.00 H new ATOM 1129 N LYS A 70 6.876 -7.279 -7.959 1.00 0.00 N ATOM 1130 CA LYS A 70 5.873 -8.135 -8.569 1.00 0.00 C ATOM 1131 C LYS A 70 6.565 -9.166 -9.464 1.00 0.00 C ATOM 1132 O LYS A 70 6.166 -10.329 -9.501 1.00 0.00 O ATOM 1133 CB LYS A 70 4.823 -7.295 -9.298 1.00 0.00 C ATOM 1134 CG LYS A 70 5.280 -6.956 -10.718 1.00 0.00 C ATOM 1135 CD LYS A 70 5.150 -8.170 -11.640 1.00 0.00 C ATOM 1136 CE LYS A 70 4.422 -7.800 -12.934 1.00 0.00 C ATOM 1137 NZ LYS A 70 4.711 -8.793 -13.993 1.00 0.00 N ATOM 0 H LYS A 70 6.939 -6.343 -8.360 1.00 0.00 H new ATOM 0 HA LYS A 70 5.329 -8.689 -7.804 1.00 0.00 H new ATOM 0 HB2 LYS A 70 3.879 -7.839 -9.336 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.638 -6.376 -8.743 1.00 0.00 H new ATOM 0 HG2 LYS A 70 4.683 -6.132 -11.109 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.316 -6.618 -10.700 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.140 -8.561 -11.875 1.00 0.00 H new ATOM 0 HD3 LYS A 70 4.607 -8.964 -11.127 1.00 0.00 H new ATOM 0 HE2 LYS A 70 3.348 -7.754 -12.754 1.00 0.00 H new ATOM 0 HE3 LYS A 70 4.733 -6.808 -13.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 4.209 -8.527 -14.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 5.734 -8.817 -14.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 4.392 -9.733 -13.683 1.00 0.00 H new ATOM 1151 N VAL A 71 7.591 -8.702 -10.162 1.00 0.00 N ATOM 1152 CA VAL A 71 8.342 -9.569 -11.054 1.00 0.00 C ATOM 1153 C VAL A 71 8.997 -10.686 -10.240 1.00 0.00 C ATOM 1154 O VAL A 71 9.228 -11.780 -10.754 1.00 0.00 O ATOM 1155 CB VAL A 71 9.350 -8.745 -11.859 1.00 0.00 C ATOM 1156 CG1 VAL A 71 10.054 -9.611 -12.906 1.00 0.00 C ATOM 1157 CG2 VAL A 71 8.675 -7.537 -12.510 1.00 0.00 C ATOM 0 H VAL A 71 7.920 -7.737 -10.128 1.00 0.00 H new ATOM 0 HA VAL A 71 7.677 -10.041 -11.777 1.00 0.00 H new ATOM 0 HB VAL A 71 10.107 -8.373 -11.168 1.00 0.00 H new ATOM 0 HG11 VAL A 71 10.765 -9.001 -13.464 1.00 0.00 H new ATOM 0 HG12 VAL A 71 10.584 -10.423 -12.409 1.00 0.00 H new ATOM 0 HG13 VAL A 71 9.315 -10.026 -13.592 1.00 0.00 H new ATOM 0 HG21 VAL A 71 9.413 -6.969 -13.076 1.00 0.00 H new ATOM 0 HG22 VAL A 71 7.887 -7.878 -13.182 1.00 0.00 H new ATOM 0 HG23 VAL A 71 8.243 -6.902 -11.737 1.00 0.00 H new ATOM 1167 N ILE A 72 9.279 -10.373 -8.984 1.00 0.00 N ATOM 1168 CA ILE A 72 9.903 -11.337 -8.094 1.00 0.00 C ATOM 1169 C ILE A 72 8.869 -12.386 -7.679 1.00 0.00 C ATOM 1170 O ILE A 72 9.192 -13.567 -7.557 1.00 0.00 O ATOM 1171 CB ILE A 72 10.564 -10.625 -6.912 1.00 0.00 C ATOM 1172 CG1 ILE A 72 11.941 -10.083 -7.300 1.00 0.00 C ATOM 1173 CG2 ILE A 72 10.633 -11.541 -5.689 1.00 0.00 C ATOM 1174 CD1 ILE A 72 13.016 -11.163 -7.158 1.00 0.00 C ATOM 0 H ILE A 72 9.087 -9.465 -8.561 1.00 0.00 H new ATOM 0 HA ILE A 72 10.706 -11.866 -8.608 1.00 0.00 H new ATOM 0 HB ILE A 72 9.946 -9.770 -6.639 1.00 0.00 H new ATOM 0 HG12 ILE A 72 11.917 -9.722 -8.328 1.00 0.00 H new ATOM 0 HG13 ILE A 72 12.191 -9.231 -6.668 1.00 0.00 H new ATOM 0 HG21 ILE A 72 11.107 -11.010 -4.863 1.00 0.00 H new ATOM 0 HG22 ILE A 72 9.625 -11.837 -5.399 1.00 0.00 H new ATOM 0 HG23 ILE A 72 11.216 -12.429 -5.932 1.00 0.00 H new ATOM 0 HD11 ILE A 72 13.985 -10.751 -7.440 1.00 0.00 H new ATOM 0 HD12 ILE A 72 13.054 -11.505 -6.124 1.00 0.00 H new ATOM 0 HD13 ILE A 72 12.776 -12.003 -7.809 1.00 0.00 H new ATOM 1186 N ASP A 73 7.647 -11.917 -7.474 1.00 0.00 N ATOM 1187 CA ASP A 73 6.563 -12.800 -7.076 1.00 0.00 C ATOM 1188 C ASP A 73 5.224 -12.118 -7.362 1.00 0.00 C ATOM 1189 O ASP A 73 5.149 -10.891 -7.425 1.00 0.00 O ATOM 1190 CB ASP A 73 6.627 -13.109 -5.579 1.00 0.00 C ATOM 1191 CG ASP A 73 7.143 -14.505 -5.228 1.00 0.00 C ATOM 1192 OD1 ASP A 73 7.350 -15.289 -6.180 1.00 0.00 O ATOM 1193 OD2 ASP A 73 7.320 -14.757 -4.017 1.00 0.00 O ATOM 0 H ASP A 73 7.383 -10.937 -7.576 1.00 0.00 H new ATOM 0 HA ASP A 73 6.659 -13.728 -7.640 1.00 0.00 H new ATOM 0 HB2 ASP A 73 7.268 -12.370 -5.098 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.630 -12.990 -5.156 1.00 0.00 H new ATOM 1198 N GLU A 74 4.200 -12.942 -7.527 1.00 0.00 N ATOM 1199 CA GLU A 74 2.867 -12.433 -7.805 1.00 0.00 C ATOM 1200 C GLU A 74 1.989 -12.535 -6.556 1.00 0.00 C ATOM 1201 O GLU A 74 0.901 -11.964 -6.509 1.00 0.00 O ATOM 1202 CB GLU A 74 2.232 -13.174 -8.983 1.00 0.00 C ATOM 1203 CG GLU A 74 1.552 -14.463 -8.519 1.00 0.00 C ATOM 1204 CD GLU A 74 1.024 -15.265 -9.710 1.00 0.00 C ATOM 1205 OE1 GLU A 74 1.822 -15.477 -10.649 1.00 0.00 O ATOM 1206 OE2 GLU A 74 -0.164 -15.647 -9.655 1.00 0.00 O ATOM 0 H GLU A 74 4.266 -13.958 -7.474 1.00 0.00 H new ATOM 0 HA GLU A 74 2.951 -11.382 -8.082 1.00 0.00 H new ATOM 0 HB2 GLU A 74 1.502 -12.529 -9.471 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.996 -13.408 -9.724 1.00 0.00 H new ATOM 0 HG2 GLU A 74 2.260 -15.069 -7.954 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.730 -14.222 -7.845 1.00 0.00 H new ATOM 1213 N ASN A 75 2.495 -13.267 -5.574 1.00 0.00 N ATOM 1214 CA ASN A 75 1.771 -13.452 -4.328 1.00 0.00 C ATOM 1215 C ASN A 75 1.856 -12.169 -3.499 1.00 0.00 C ATOM 1216 O ASN A 75 1.073 -11.972 -2.571 1.00 0.00 O ATOM 1217 CB ASN A 75 2.375 -14.589 -3.503 1.00 0.00 C ATOM 1218 CG ASN A 75 3.904 -14.529 -3.523 1.00 0.00 C ATOM 1219 OD1 ASN A 75 4.517 -13.544 -3.146 1.00 0.00 O ATOM 1220 ND2 ASN A 75 4.483 -15.635 -3.983 1.00 0.00 N ATOM 0 H ASN A 75 3.398 -13.739 -5.616 1.00 0.00 H new ATOM 0 HA ASN A 75 0.737 -13.694 -4.572 1.00 0.00 H new ATOM 0 HB2 ASN A 75 2.018 -14.526 -2.475 1.00 0.00 H new ATOM 0 HB3 ASN A 75 2.040 -15.548 -3.899 1.00 0.00 H new ATOM 0 HD21 ASN A 75 5.500 -15.694 -4.036 1.00 0.00 H new ATOM 0 HD22 ASN A 75 3.910 -16.424 -4.283 1.00 0.00 H new ATOM 1227 N ILE A 76 2.814 -11.329 -3.863 1.00 0.00 N ATOM 1228 CA ILE A 76 3.012 -10.070 -3.164 1.00 0.00 C ATOM 1229 C ILE A 76 1.817 -9.152 -3.429 1.00 0.00 C ATOM 1230 O ILE A 76 1.395 -8.990 -4.573 1.00 0.00 O ATOM 1231 CB ILE A 76 4.358 -9.452 -3.545 1.00 0.00 C ATOM 1232 CG1 ILE A 76 4.625 -8.180 -2.738 1.00 0.00 C ATOM 1233 CG2 ILE A 76 4.441 -9.203 -5.052 1.00 0.00 C ATOM 1234 CD1 ILE A 76 5.904 -7.487 -3.213 1.00 0.00 C ATOM 0 H ILE A 76 3.462 -11.496 -4.633 1.00 0.00 H new ATOM 0 HA ILE A 76 3.056 -10.234 -2.087 1.00 0.00 H new ATOM 0 HB ILE A 76 5.144 -10.164 -3.293 1.00 0.00 H new ATOM 0 HG12 ILE A 76 3.780 -7.499 -2.836 1.00 0.00 H new ATOM 0 HG13 ILE A 76 4.713 -8.428 -1.680 1.00 0.00 H new ATOM 0 HG21 ILE A 76 5.408 -8.763 -5.295 1.00 0.00 H new ATOM 0 HG22 ILE A 76 4.328 -10.148 -5.584 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.646 -8.520 -5.352 1.00 0.00 H new ATOM 0 HD11 ILE A 76 6.070 -6.586 -2.623 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.751 -8.162 -3.090 1.00 0.00 H new ATOM 0 HD13 ILE A 76 5.803 -7.219 -4.265 1.00 0.00 H new ATOM 1246 N ARG A 77 1.304 -8.576 -2.351 1.00 0.00 N ATOM 1247 CA ARG A 77 0.166 -7.679 -2.452 1.00 0.00 C ATOM 1248 C ARG A 77 0.540 -6.288 -1.935 1.00 0.00 C ATOM 1249 O ARG A 77 0.755 -6.104 -0.738 1.00 0.00 O ATOM 1250 CB ARG A 77 -1.026 -8.209 -1.653 1.00 0.00 C ATOM 1251 CG ARG A 77 -2.012 -7.085 -1.328 1.00 0.00 C ATOM 1252 CD ARG A 77 -3.433 -7.629 -1.176 1.00 0.00 C ATOM 1253 NE ARG A 77 -3.766 -8.505 -2.322 1.00 0.00 N ATOM 1254 CZ ARG A 77 -4.822 -9.329 -2.356 1.00 0.00 C ATOM 1255 NH1 ARG A 77 -5.654 -9.396 -1.308 1.00 0.00 N ATOM 1256 NH2 ARG A 77 -5.045 -10.087 -3.438 1.00 0.00 N ATOM 0 H ARG A 77 1.656 -8.713 -1.404 1.00 0.00 H new ATOM 0 HA ARG A 77 -0.115 -7.617 -3.503 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -1.532 -8.988 -2.222 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -0.674 -8.667 -0.729 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -1.709 -6.586 -0.407 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -1.988 -6.336 -2.119 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -3.520 -8.187 -0.244 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -4.143 -6.804 -1.120 1.00 0.00 H new ATOM 0 HE ARG A 77 -3.153 -8.480 -3.137 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -5.484 -8.820 -0.484 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -6.458 -10.023 -1.334 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -4.411 -10.037 -4.235 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -5.849 -10.714 -3.464 1.00 0.00 H new ATOM 1270 N VAL A 78 0.605 -5.344 -2.863 1.00 0.00 N ATOM 1271 CA VAL A 78 0.948 -3.976 -2.516 1.00 0.00 C ATOM 1272 C VAL A 78 0.066 -3.015 -3.316 1.00 0.00 C ATOM 1273 O VAL A 78 -0.241 -3.271 -4.479 1.00 0.00 O ATOM 1274 CB VAL A 78 2.443 -3.739 -2.738 1.00 0.00 C ATOM 1275 CG1 VAL A 78 2.727 -3.348 -4.189 1.00 0.00 C ATOM 1276 CG2 VAL A 78 2.981 -2.684 -1.770 1.00 0.00 C ATOM 0 H VAL A 78 0.426 -5.500 -3.855 1.00 0.00 H new ATOM 0 HA VAL A 78 0.756 -3.791 -1.459 1.00 0.00 H new ATOM 0 HB VAL A 78 2.964 -4.675 -2.536 1.00 0.00 H new ATOM 0 HG11 VAL A 78 3.797 -3.185 -4.319 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.398 -4.148 -4.852 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.189 -2.432 -4.431 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.046 -2.535 -1.949 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.452 -1.744 -1.925 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.829 -3.020 -0.744 1.00 0.00 H new ATOM 1286 N ILE A 79 -0.317 -1.929 -2.660 1.00 0.00 N ATOM 1287 CA ILE A 79 -1.157 -0.928 -3.296 1.00 0.00 C ATOM 1288 C ILE A 79 -0.297 0.270 -3.702 1.00 0.00 C ATOM 1289 O ILE A 79 0.629 0.646 -2.985 1.00 0.00 O ATOM 1290 CB ILE A 79 -2.333 -0.562 -2.388 1.00 0.00 C ATOM 1291 CG1 ILE A 79 -3.567 -1.403 -2.723 1.00 0.00 C ATOM 1292 CG2 ILE A 79 -2.627 0.938 -2.450 1.00 0.00 C ATOM 1293 CD1 ILE A 79 -4.851 -0.679 -2.313 1.00 0.00 C ATOM 0 H ILE A 79 -0.061 -1.720 -1.695 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.600 -1.326 -4.209 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.056 -0.793 -1.360 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.589 -1.613 -3.792 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -3.507 -2.363 -2.211 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.467 1.171 -1.796 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -1.748 1.495 -2.125 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -2.876 1.218 -3.474 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -5.713 -1.298 -2.562 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.836 -0.492 -1.239 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.920 0.270 -2.845 1.00 0.00 H new ATOM 1305 N ILE A 80 -0.635 0.837 -4.851 1.00 0.00 N ATOM 1306 CA ILE A 80 0.095 1.986 -5.361 1.00 0.00 C ATOM 1307 C ILE A 80 -0.770 3.239 -5.217 1.00 0.00 C ATOM 1308 O ILE A 80 -1.998 3.154 -5.211 1.00 0.00 O ATOM 1309 CB ILE A 80 0.568 1.727 -6.793 1.00 0.00 C ATOM 1310 CG1 ILE A 80 -0.565 1.956 -7.795 1.00 0.00 C ATOM 1311 CG2 ILE A 80 1.176 0.329 -6.925 1.00 0.00 C ATOM 1312 CD1 ILE A 80 -0.866 3.448 -7.951 1.00 0.00 C ATOM 0 H ILE A 80 -1.404 0.523 -5.443 1.00 0.00 H new ATOM 0 HA ILE A 80 0.999 2.153 -4.776 1.00 0.00 H new ATOM 0 HB ILE A 80 1.355 2.444 -7.028 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.291 1.534 -8.762 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.462 1.433 -7.461 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.504 0.170 -7.952 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.030 0.239 -6.253 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.428 -0.419 -6.664 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.675 3.583 -8.669 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.163 3.862 -6.987 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.025 3.964 -8.308 1.00 0.00 H new ATOM 1324 N MET A 81 -0.097 4.375 -5.104 1.00 0.00 N ATOM 1325 CA MET A 81 -0.789 5.644 -4.960 1.00 0.00 C ATOM 1326 C MET A 81 -0.076 6.749 -5.743 1.00 0.00 C ATOM 1327 O MET A 81 1.147 6.868 -5.683 1.00 0.00 O ATOM 1328 CB MET A 81 -0.852 6.027 -3.480 1.00 0.00 C ATOM 1329 CG MET A 81 0.116 5.178 -2.653 1.00 0.00 C ATOM 1330 SD MET A 81 0.120 5.736 -0.957 1.00 0.00 S ATOM 1331 CE MET A 81 1.778 5.274 -0.484 1.00 0.00 C ATOM 0 H MET A 81 0.921 4.443 -5.109 1.00 0.00 H new ATOM 0 HA MET A 81 -1.797 5.534 -5.359 1.00 0.00 H new ATOM 0 HB2 MET A 81 -0.607 7.083 -3.363 1.00 0.00 H new ATOM 0 HB3 MET A 81 -1.868 5.893 -3.109 1.00 0.00 H new ATOM 0 HG2 MET A 81 -0.177 4.129 -2.699 1.00 0.00 H new ATOM 0 HG3 MET A 81 1.121 5.247 -3.070 1.00 0.00 H new ATOM 0 HE1 MET A 81 1.951 5.553 0.556 1.00 0.00 H new ATOM 0 HE2 MET A 81 1.902 4.197 -0.596 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.496 5.790 -1.122 1.00 0.00 H new ATOM 1341 N THR A 82 -0.871 7.529 -6.461 1.00 0.00 N ATOM 1342 CA THR A 82 -0.332 8.620 -7.255 1.00 0.00 C ATOM 1343 C THR A 82 -1.443 9.287 -8.069 1.00 0.00 C ATOM 1344 O THR A 82 -2.363 8.617 -8.536 1.00 0.00 O ATOM 1345 CB THR A 82 0.802 8.061 -8.117 1.00 0.00 C ATOM 1346 OG1 THR A 82 0.896 8.979 -9.203 1.00 0.00 O ATOM 1347 CG2 THR A 82 0.432 6.734 -8.782 1.00 0.00 C ATOM 0 H THR A 82 -1.885 7.427 -6.509 1.00 0.00 H new ATOM 0 HA THR A 82 0.079 9.406 -6.621 1.00 0.00 H new ATOM 0 HB THR A 82 1.692 7.923 -7.502 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.707 8.792 -9.720 1.00 0.00 H new ATOM 0 HG21 THR A 82 1.271 6.381 -9.382 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.198 5.996 -8.015 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.437 6.878 -9.424 1.00 0.00 H new ATOM 1355 N ALA A 83 -1.320 10.598 -8.214 1.00 0.00 N ATOM 1356 CA ALA A 83 -2.302 11.363 -8.964 1.00 0.00 C ATOM 1357 C ALA A 83 -2.407 10.799 -10.382 1.00 0.00 C ATOM 1358 O ALA A 83 -1.483 10.144 -10.864 1.00 0.00 O ATOM 1359 CB ALA A 83 -1.913 12.843 -8.952 1.00 0.00 C ATOM 0 H ALA A 83 -0.556 11.150 -7.825 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.286 11.281 -8.503 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.649 13.417 -9.514 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.881 13.202 -7.923 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.931 12.965 -9.410 1.00 0.00 H new ATOM 1365 N TYR A 84 -3.540 11.073 -11.012 1.00 0.00 N ATOM 1366 CA TYR A 84 -3.778 10.601 -12.365 1.00 0.00 C ATOM 1367 C TYR A 84 -3.086 11.503 -13.390 1.00 0.00 C ATOM 1368 O TYR A 84 -3.688 11.885 -14.392 1.00 0.00 O ATOM 1369 CB TYR A 84 -5.291 10.675 -12.578 1.00 0.00 C ATOM 1370 CG TYR A 84 -5.904 12.030 -12.221 1.00 0.00 C ATOM 1371 CD1 TYR A 84 -5.967 13.030 -13.170 1.00 0.00 C ATOM 1372 CD2 TYR A 84 -6.395 12.253 -10.951 1.00 0.00 C ATOM 1373 CE1 TYR A 84 -6.545 14.306 -12.835 1.00 0.00 C ATOM 1374 CE2 TYR A 84 -6.973 13.529 -10.615 1.00 0.00 C ATOM 1375 CZ TYR A 84 -7.019 14.492 -11.574 1.00 0.00 C ATOM 1376 OH TYR A 84 -7.564 15.697 -11.257 1.00 0.00 O ATOM 0 H TYR A 84 -4.304 11.616 -10.610 1.00 0.00 H new ATOM 0 HA TYR A 84 -3.387 9.592 -12.494 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -5.512 10.451 -13.622 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.770 9.901 -11.978 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -5.583 12.856 -14.164 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -6.346 11.470 -10.208 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -6.601 15.097 -13.568 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -7.361 13.716 -9.625 1.00 0.00 H new ATOM 0 HH TYR A 84 -7.862 15.686 -10.323 1.00 0.00 H new ATOM 1386 N GLY A 85 -1.832 11.818 -13.102 1.00 0.00 N ATOM 1387 CA GLY A 85 -1.052 12.668 -13.986 1.00 0.00 C ATOM 1388 C GLY A 85 -0.015 11.851 -14.759 1.00 0.00 C ATOM 1389 O GLY A 85 0.495 12.299 -15.784 1.00 0.00 O ATOM 0 H GLY A 85 -1.336 11.500 -12.269 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.715 13.176 -14.686 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.551 13.441 -13.404 1.00 0.00 H new ATOM 1393 N GLU A 86 0.265 10.665 -14.238 1.00 0.00 N ATOM 1394 CA GLU A 86 1.231 9.781 -14.867 1.00 0.00 C ATOM 1395 C GLU A 86 0.622 8.394 -15.080 1.00 0.00 C ATOM 1396 O GLU A 86 1.194 7.389 -14.660 1.00 0.00 O ATOM 1397 CB GLU A 86 2.515 9.694 -14.038 1.00 0.00 C ATOM 1398 CG GLU A 86 2.203 9.720 -12.540 1.00 0.00 C ATOM 1399 CD GLU A 86 3.460 9.442 -11.714 1.00 0.00 C ATOM 1400 OE1 GLU A 86 4.486 10.095 -12.005 1.00 0.00 O ATOM 1401 OE2 GLU A 86 3.367 8.584 -10.810 1.00 0.00 O ATOM 0 H GLU A 86 -0.160 10.296 -13.387 1.00 0.00 H new ATOM 0 HA GLU A 86 1.493 10.195 -15.841 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.051 8.778 -14.286 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.172 10.526 -14.291 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.792 10.692 -12.267 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.441 8.976 -12.311 1.00 0.00 H new ATOM 1408 N LEU A 87 -0.531 8.383 -15.733 1.00 0.00 N ATOM 1409 CA LEU A 87 -1.225 7.136 -16.007 1.00 0.00 C ATOM 1410 C LEU A 87 -0.217 6.094 -16.496 1.00 0.00 C ATOM 1411 O LEU A 87 -0.322 4.917 -16.157 1.00 0.00 O ATOM 1412 CB LEU A 87 -2.386 7.371 -16.976 1.00 0.00 C ATOM 1413 CG LEU A 87 -3.451 8.368 -16.517 1.00 0.00 C ATOM 1414 CD1 LEU A 87 -4.096 9.071 -17.713 1.00 0.00 C ATOM 1415 CD2 LEU A 87 -4.491 7.687 -15.624 1.00 0.00 C ATOM 0 H LEU A 87 -1.002 9.218 -16.080 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.675 6.742 -15.096 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.977 7.718 -17.925 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.871 6.414 -17.169 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.963 9.136 -15.916 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.850 9.774 -17.359 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.332 9.610 -18.274 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.567 8.331 -18.360 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.237 8.418 -15.311 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.979 6.886 -16.179 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.999 7.272 -14.744 1.00 0.00 H new ATOM 1427 N ASP A 88 0.738 6.565 -17.286 1.00 0.00 N ATOM 1428 CA ASP A 88 1.764 5.689 -17.825 1.00 0.00 C ATOM 1429 C ASP A 88 2.310 4.801 -16.705 1.00 0.00 C ATOM 1430 O ASP A 88 2.462 3.594 -16.883 1.00 0.00 O ATOM 1431 CB ASP A 88 2.930 6.495 -18.400 1.00 0.00 C ATOM 1432 CG ASP A 88 3.164 6.312 -19.901 1.00 0.00 C ATOM 1433 OD1 ASP A 88 3.878 5.348 -20.251 1.00 0.00 O ATOM 1434 OD2 ASP A 88 2.623 7.141 -20.665 1.00 0.00 O ATOM 0 H ASP A 88 0.822 7.542 -17.565 1.00 0.00 H new ATOM 0 HA ASP A 88 1.314 5.090 -18.617 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.754 7.552 -18.201 1.00 0.00 H new ATOM 0 HB3 ASP A 88 3.841 6.218 -17.869 1.00 0.00 H new ATOM 1439 N MET A 89 2.590 5.434 -15.575 1.00 0.00 N ATOM 1440 CA MET A 89 3.116 4.716 -14.426 1.00 0.00 C ATOM 1441 C MET A 89 2.028 3.868 -13.764 1.00 0.00 C ATOM 1442 O MET A 89 2.193 2.661 -13.597 1.00 0.00 O ATOM 1443 CB MET A 89 3.672 5.716 -13.410 1.00 0.00 C ATOM 1444 CG MET A 89 4.041 5.019 -12.099 1.00 0.00 C ATOM 1445 SD MET A 89 5.568 4.115 -12.297 1.00 0.00 S ATOM 1446 CE MET A 89 6.102 4.033 -10.596 1.00 0.00 C ATOM 0 H MET A 89 2.463 6.436 -15.431 1.00 0.00 H new ATOM 0 HA MET A 89 3.910 4.052 -14.768 1.00 0.00 H new ATOM 0 HB2 MET A 89 4.552 6.209 -13.824 1.00 0.00 H new ATOM 0 HB3 MET A 89 2.932 6.493 -13.217 1.00 0.00 H new ATOM 0 HG2 MET A 89 4.146 5.756 -11.303 1.00 0.00 H new ATOM 0 HG3 MET A 89 3.242 4.339 -11.801 1.00 0.00 H new ATOM 0 HE1 MET A 89 7.021 3.451 -10.531 1.00 0.00 H new ATOM 0 HE2 MET A 89 6.284 5.041 -10.223 1.00 0.00 H new ATOM 0 HE3 MET A 89 5.328 3.557 -9.994 1.00 0.00 H new ATOM 1456 N ILE A 90 0.940 4.534 -13.405 1.00 0.00 N ATOM 1457 CA ILE A 90 -0.175 3.857 -12.765 1.00 0.00 C ATOM 1458 C ILE A 90 -0.557 2.624 -13.588 1.00 0.00 C ATOM 1459 O ILE A 90 -0.800 1.554 -13.032 1.00 0.00 O ATOM 1460 CB ILE A 90 -1.334 4.829 -12.539 1.00 0.00 C ATOM 1461 CG1 ILE A 90 -0.916 5.975 -11.615 1.00 0.00 C ATOM 1462 CG2 ILE A 90 -2.572 4.095 -12.019 1.00 0.00 C ATOM 1463 CD1 ILE A 90 -1.211 7.332 -12.256 1.00 0.00 C ATOM 0 H ILE A 90 0.807 5.536 -13.545 1.00 0.00 H new ATOM 0 HA ILE A 90 0.111 3.504 -11.774 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.602 5.271 -13.499 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.447 5.894 -10.666 1.00 0.00 H new ATOM 0 HG13 ILE A 90 0.148 5.898 -11.392 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -3.381 4.809 -11.867 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -2.882 3.345 -12.746 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.336 3.608 -11.073 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -0.904 8.129 -11.578 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.660 7.420 -13.192 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.279 7.416 -12.455 1.00 0.00 H new ATOM 1475 N GLN A 91 -0.599 2.817 -14.898 1.00 0.00 N ATOM 1476 CA GLN A 91 -0.948 1.734 -15.802 1.00 0.00 C ATOM 1477 C GLN A 91 -0.084 0.504 -15.517 1.00 0.00 C ATOM 1478 O GLN A 91 -0.605 -0.573 -15.233 1.00 0.00 O ATOM 1479 CB GLN A 91 -0.811 2.173 -17.261 1.00 0.00 C ATOM 1480 CG GLN A 91 -2.134 2.729 -17.793 1.00 0.00 C ATOM 1481 CD GLN A 91 -2.660 1.878 -18.950 1.00 0.00 C ATOM 1482 OE1 GLN A 91 -1.925 1.449 -19.825 1.00 0.00 O ATOM 1483 NE2 GLN A 91 -3.971 1.657 -18.906 1.00 0.00 N ATOM 0 H GLN A 91 -0.397 3.706 -15.355 1.00 0.00 H new ATOM 0 HA GLN A 91 -1.991 1.468 -15.632 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -0.033 2.932 -17.345 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -0.497 1.326 -17.871 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -2.871 2.754 -16.990 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -1.992 3.757 -18.128 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -4.528 2.045 -18.145 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -4.419 1.099 -19.633 1.00 0.00 H new ATOM 1492 N GLU A 92 1.223 0.706 -15.601 1.00 0.00 N ATOM 1493 CA GLU A 92 2.165 -0.373 -15.354 1.00 0.00 C ATOM 1494 C GLU A 92 1.908 -0.998 -13.982 1.00 0.00 C ATOM 1495 O GLU A 92 2.001 -2.215 -13.823 1.00 0.00 O ATOM 1496 CB GLU A 92 3.608 0.122 -15.470 1.00 0.00 C ATOM 1497 CG GLU A 92 4.297 -0.481 -16.696 1.00 0.00 C ATOM 1498 CD GLU A 92 5.143 0.568 -17.420 1.00 0.00 C ATOM 1499 OE1 GLU A 92 6.312 0.736 -17.011 1.00 0.00 O ATOM 1500 OE2 GLU A 92 4.602 1.179 -18.367 1.00 0.00 O ATOM 0 H GLU A 92 1.652 1.601 -15.837 1.00 0.00 H new ATOM 0 HA GLU A 92 2.017 -1.140 -16.114 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.619 1.210 -15.541 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.161 -0.145 -14.569 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.929 -1.315 -16.389 1.00 0.00 H new ATOM 0 HG3 GLU A 92 3.548 -0.883 -17.378 1.00 0.00 H new ATOM 1507 N SER A 93 1.589 -0.139 -13.025 1.00 0.00 N ATOM 1508 CA SER A 93 1.318 -0.592 -11.672 1.00 0.00 C ATOM 1509 C SER A 93 0.222 -1.659 -11.687 1.00 0.00 C ATOM 1510 O SER A 93 0.283 -2.627 -10.930 1.00 0.00 O ATOM 1511 CB SER A 93 0.910 0.576 -10.771 1.00 0.00 C ATOM 1512 OG SER A 93 -0.497 0.798 -10.791 1.00 0.00 O ATOM 0 H SER A 93 1.512 0.869 -13.160 1.00 0.00 H new ATOM 0 HA SER A 93 2.232 -1.025 -11.267 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.231 0.375 -9.749 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.425 1.481 -11.095 1.00 0.00 H new ATOM 0 HG SER A 93 -0.715 1.451 -11.488 1.00 0.00 H new ATOM 1518 N LYS A 94 -0.754 -1.447 -12.557 1.00 0.00 N ATOM 1519 CA LYS A 94 -1.862 -2.378 -12.680 1.00 0.00 C ATOM 1520 C LYS A 94 -1.359 -3.684 -13.298 1.00 0.00 C ATOM 1521 O LYS A 94 -1.576 -4.761 -12.745 1.00 0.00 O ATOM 1522 CB LYS A 94 -3.017 -1.738 -13.452 1.00 0.00 C ATOM 1523 CG LYS A 94 -4.334 -1.880 -12.687 1.00 0.00 C ATOM 1524 CD LYS A 94 -5.469 -2.304 -13.622 1.00 0.00 C ATOM 1525 CE LYS A 94 -6.646 -1.331 -13.532 1.00 0.00 C ATOM 1526 NZ LYS A 94 -7.864 -1.935 -14.116 1.00 0.00 N ATOM 0 H LYS A 94 -0.800 -0.644 -13.184 1.00 0.00 H new ATOM 0 HA LYS A 94 -2.264 -2.624 -11.697 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.804 -0.683 -13.623 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.109 -2.208 -14.431 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.219 -2.616 -11.892 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.586 -0.933 -12.210 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -5.104 -2.344 -14.648 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -5.803 -3.309 -13.363 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.828 -1.066 -12.490 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.403 -0.408 -14.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -8.653 -1.261 -14.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -7.692 -2.165 -15.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -8.104 -2.804 -13.597 1.00 0.00 H new ATOM 1540 N GLU A 95 -0.695 -3.545 -14.437 1.00 0.00 N ATOM 1541 CA GLU A 95 -0.159 -4.701 -15.136 1.00 0.00 C ATOM 1542 C GLU A 95 0.957 -5.349 -14.313 1.00 0.00 C ATOM 1543 O GLU A 95 1.399 -6.454 -14.623 1.00 0.00 O ATOM 1544 CB GLU A 95 0.341 -4.315 -16.530 1.00 0.00 C ATOM 1545 CG GLU A 95 1.803 -3.867 -16.483 1.00 0.00 C ATOM 1546 CD GLU A 95 2.727 -4.952 -17.042 1.00 0.00 C ATOM 1547 OE1 GLU A 95 3.060 -5.870 -16.263 1.00 0.00 O ATOM 1548 OE2 GLU A 95 3.079 -4.837 -18.236 1.00 0.00 O ATOM 0 H GLU A 95 -0.516 -2.650 -14.893 1.00 0.00 H new ATOM 0 HA GLU A 95 -0.960 -5.429 -15.262 1.00 0.00 H new ATOM 0 HB2 GLU A 95 0.239 -5.165 -17.205 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -0.276 -3.512 -16.932 1.00 0.00 H new ATOM 0 HG2 GLU A 95 1.925 -2.949 -17.058 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.084 -3.639 -15.455 1.00 0.00 H new ATOM 1555 N LEU A 96 1.379 -4.633 -13.281 1.00 0.00 N ATOM 1556 CA LEU A 96 2.434 -5.124 -12.412 1.00 0.00 C ATOM 1557 C LEU A 96 1.852 -6.154 -11.442 1.00 0.00 C ATOM 1558 O LEU A 96 2.589 -6.944 -10.853 1.00 0.00 O ATOM 1559 CB LEU A 96 3.143 -3.959 -11.719 1.00 0.00 C ATOM 1560 CG LEU A 96 4.582 -3.689 -12.163 1.00 0.00 C ATOM 1561 CD1 LEU A 96 4.613 -2.935 -13.494 1.00 0.00 C ATOM 1562 CD2 LEU A 96 5.365 -2.957 -11.072 1.00 0.00 C ATOM 0 H LEU A 96 1.009 -3.717 -13.028 1.00 0.00 H new ATOM 0 HA LEU A 96 3.202 -5.633 -12.995 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.558 -3.054 -11.883 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.144 -4.148 -10.645 1.00 0.00 H new ATOM 0 HG LEU A 96 5.075 -4.648 -12.324 1.00 0.00 H new ATOM 0 HD11 LEU A 96 5.648 -2.756 -13.787 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.117 -3.530 -14.261 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.097 -1.981 -13.384 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.384 -2.778 -11.414 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.882 -2.004 -10.855 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.387 -3.567 -10.169 1.00 0.00 H new ATOM 1574 N GLY A 97 0.535 -6.114 -11.306 1.00 0.00 N ATOM 1575 CA GLY A 97 -0.155 -7.034 -10.418 1.00 0.00 C ATOM 1576 C GLY A 97 -0.581 -6.333 -9.126 1.00 0.00 C ATOM 1577 O GLY A 97 -0.739 -6.977 -8.090 1.00 0.00 O ATOM 0 H GLY A 97 -0.073 -5.458 -11.796 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.032 -7.442 -10.921 1.00 0.00 H new ATOM 0 HA3 GLY A 97 0.497 -7.875 -10.182 1.00 0.00 H new ATOM 1581 N ALA A 98 -0.753 -5.024 -9.230 1.00 0.00 N ATOM 1582 CA ALA A 98 -1.157 -4.229 -8.083 1.00 0.00 C ATOM 1583 C ALA A 98 -2.659 -4.404 -7.850 1.00 0.00 C ATOM 1584 O ALA A 98 -3.426 -4.550 -8.801 1.00 0.00 O ATOM 1585 CB ALA A 98 -0.770 -2.767 -8.312 1.00 0.00 C ATOM 0 H ALA A 98 -0.620 -4.494 -10.091 1.00 0.00 H new ATOM 0 HA ALA A 98 -0.642 -4.565 -7.183 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.073 -2.171 -7.451 1.00 0.00 H new ATOM 0 HB2 ALA A 98 0.310 -2.693 -8.443 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.270 -2.394 -9.206 1.00 0.00 H new ATOM 1591 N LEU A 99 -3.035 -4.385 -6.579 1.00 0.00 N ATOM 1592 CA LEU A 99 -4.432 -4.539 -6.210 1.00 0.00 C ATOM 1593 C LEU A 99 -5.257 -3.439 -6.879 1.00 0.00 C ATOM 1594 O LEU A 99 -6.254 -3.722 -7.542 1.00 0.00 O ATOM 1595 CB LEU A 99 -4.581 -4.580 -4.687 1.00 0.00 C ATOM 1596 CG LEU A 99 -3.530 -5.395 -3.932 1.00 0.00 C ATOM 1597 CD1 LEU A 99 -3.128 -6.641 -4.723 1.00 0.00 C ATOM 1598 CD2 LEU A 99 -2.320 -4.529 -3.572 1.00 0.00 C ATOM 0 H LEU A 99 -2.397 -4.265 -5.793 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.819 -5.492 -6.572 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.557 -3.557 -4.312 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.565 -4.984 -4.449 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.972 -5.738 -2.996 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.380 -7.202 -4.163 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.005 -7.268 -4.885 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.712 -6.343 -5.685 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.587 -5.132 -3.036 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.869 -4.136 -4.484 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -2.640 -3.701 -2.940 1.00 0.00 H new ATOM 1610 N THR A 100 -4.811 -2.207 -6.684 1.00 0.00 N ATOM 1611 CA THR A 100 -5.497 -1.063 -7.261 1.00 0.00 C ATOM 1612 C THR A 100 -4.612 0.183 -7.183 1.00 0.00 C ATOM 1613 O THR A 100 -3.733 0.273 -6.327 1.00 0.00 O ATOM 1614 CB THR A 100 -6.837 -0.902 -6.541 1.00 0.00 C ATOM 1615 OG1 THR A 100 -7.302 0.379 -6.955 1.00 0.00 O ATOM 1616 CG2 THR A 100 -6.675 -0.768 -5.025 1.00 0.00 C ATOM 0 H THR A 100 -3.983 -1.976 -6.135 1.00 0.00 H new ATOM 0 HA THR A 100 -5.698 -1.216 -8.321 1.00 0.00 H new ATOM 0 HB THR A 100 -7.474 -1.758 -6.764 1.00 0.00 H new ATOM 0 HG1 THR A 100 -7.106 1.039 -6.258 1.00 0.00 H new ATOM 0 HG21 THR A 100 -7.656 -0.656 -4.563 1.00 0.00 H new ATOM 0 HG22 THR A 100 -6.188 -1.660 -4.631 1.00 0.00 H new ATOM 0 HG23 THR A 100 -6.066 0.108 -4.800 1.00 0.00 H new ATOM 1624 N HIS A 101 -4.875 1.114 -8.089 1.00 0.00 N ATOM 1625 CA HIS A 101 -4.114 2.350 -8.134 1.00 0.00 C ATOM 1626 C HIS A 101 -4.994 3.512 -7.668 1.00 0.00 C ATOM 1627 O HIS A 101 -6.027 3.794 -8.273 1.00 0.00 O ATOM 1628 CB HIS A 101 -3.525 2.575 -9.528 1.00 0.00 C ATOM 1629 CG HIS A 101 -4.435 2.151 -10.656 1.00 0.00 C ATOM 1630 ND1 HIS A 101 -5.795 2.166 -10.757 1.00 0.00 N flip ATOM 1631 CD2 HIS A 101 -3.960 1.639 -11.851 1.00 0.00 C flip ATOM 1632 CE1 HIS A 101 -6.133 1.691 -11.949 1.00 0.00 C flip ATOM 1633 NE2 HIS A 101 -4.997 1.363 -12.629 1.00 0.00 N flip ATOM 0 H HIS A 101 -5.605 1.036 -8.797 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.267 2.284 -7.451 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -3.288 3.632 -9.644 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -2.586 2.027 -9.607 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -6.443 2.488 -10.038 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -2.921 1.490 -12.106 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -7.142 1.582 -12.320 1.00 0.00 H new ATOM 1641 N PHE A 102 -4.552 4.154 -6.597 1.00 0.00 N ATOM 1642 CA PHE A 102 -5.286 5.279 -6.043 1.00 0.00 C ATOM 1643 C PHE A 102 -4.587 6.602 -6.363 1.00 0.00 C ATOM 1644 O PHE A 102 -3.382 6.628 -6.608 1.00 0.00 O ATOM 1645 CB PHE A 102 -5.319 5.087 -4.525 1.00 0.00 C ATOM 1646 CG PHE A 102 -6.009 3.798 -4.075 1.00 0.00 C ATOM 1647 CD1 PHE A 102 -6.949 3.217 -4.868 1.00 0.00 C ATOM 1648 CD2 PHE A 102 -5.683 3.233 -2.882 1.00 0.00 C ATOM 1649 CE1 PHE A 102 -7.589 2.021 -4.451 1.00 0.00 C ATOM 1650 CE2 PHE A 102 -6.324 2.037 -2.464 1.00 0.00 C ATOM 1651 CZ PHE A 102 -7.264 1.456 -3.257 1.00 0.00 C ATOM 0 H PHE A 102 -3.695 3.917 -6.098 1.00 0.00 H new ATOM 0 HA PHE A 102 -6.288 5.316 -6.471 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.297 5.091 -4.146 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -5.830 5.937 -4.073 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -7.208 3.666 -5.815 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.936 3.694 -2.252 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -8.334 1.559 -5.082 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -6.065 1.589 -1.516 1.00 0.00 H new ATOM 0 HZ PHE A 102 -7.752 0.547 -2.939 1.00 0.00 H new ATOM 1661 N ALA A 103 -5.374 7.668 -6.351 1.00 0.00 N ATOM 1662 CA ALA A 103 -4.846 8.991 -6.638 1.00 0.00 C ATOM 1663 C ALA A 103 -4.921 9.850 -5.374 1.00 0.00 C ATOM 1664 O ALA A 103 -5.821 9.676 -4.554 1.00 0.00 O ATOM 1665 CB ALA A 103 -5.617 9.606 -7.807 1.00 0.00 C ATOM 0 H ALA A 103 -6.373 7.642 -6.147 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.799 8.930 -6.934 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -5.221 10.598 -8.022 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -5.508 8.973 -8.688 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -6.672 9.685 -7.545 1.00 0.00 H new ATOM 1671 N LYS A 104 -3.963 10.757 -5.256 1.00 0.00 N ATOM 1672 CA LYS A 104 -3.909 11.643 -4.106 1.00 0.00 C ATOM 1673 C LYS A 104 -5.322 11.839 -3.551 1.00 0.00 C ATOM 1674 O LYS A 104 -5.592 11.505 -2.399 1.00 0.00 O ATOM 1675 CB LYS A 104 -3.205 12.952 -4.470 1.00 0.00 C ATOM 1676 CG LYS A 104 -1.834 13.042 -3.798 1.00 0.00 C ATOM 1677 CD LYS A 104 -1.491 14.491 -3.443 1.00 0.00 C ATOM 1678 CE LYS A 104 -1.315 15.337 -4.705 1.00 0.00 C ATOM 1679 NZ LYS A 104 -2.423 16.310 -4.835 1.00 0.00 N ATOM 0 H LYS A 104 -3.218 10.898 -5.938 1.00 0.00 H new ATOM 0 HA LYS A 104 -3.312 11.197 -3.310 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.089 13.018 -5.552 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -3.821 13.798 -4.163 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -1.827 12.431 -2.895 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -1.072 12.637 -4.463 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -2.282 14.915 -2.824 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -0.575 14.518 -2.852 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -0.362 15.865 -4.666 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -1.286 14.691 -5.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -2.288 16.876 -5.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -3.328 15.800 -4.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -2.433 16.938 -4.006 1.00 0.00 H new ATOM 1693 N PRO A 105 -6.209 12.394 -4.420 1.00 0.00 N ATOM 1694 CA PRO A 105 -7.587 12.638 -4.029 1.00 0.00 C ATOM 1695 C PRO A 105 -8.386 11.333 -3.993 1.00 0.00 C ATOM 1696 O PRO A 105 -8.991 10.945 -4.991 1.00 0.00 O ATOM 1697 CB PRO A 105 -8.116 13.630 -5.052 1.00 0.00 C ATOM 1698 CG PRO A 105 -7.170 13.550 -6.239 1.00 0.00 C ATOM 1699 CD PRO A 105 -5.924 12.802 -5.793 1.00 0.00 C ATOM 0 HA PRO A 105 -7.673 13.042 -3.020 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -9.135 13.380 -5.347 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -8.142 14.639 -4.640 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.647 13.035 -7.073 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -6.911 14.549 -6.588 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -5.730 11.939 -6.431 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -5.041 13.439 -5.842 1.00 0.00 H new ATOM 1707 N PHE A 106 -8.360 10.693 -2.834 1.00 0.00 N ATOM 1708 CA PHE A 106 -9.075 9.441 -2.655 1.00 0.00 C ATOM 1709 C PHE A 106 -10.100 9.551 -1.524 1.00 0.00 C ATOM 1710 O PHE A 106 -9.955 10.381 -0.628 1.00 0.00 O ATOM 1711 CB PHE A 106 -8.035 8.382 -2.283 1.00 0.00 C ATOM 1712 CG PHE A 106 -6.802 8.944 -1.571 1.00 0.00 C ATOM 1713 CD1 PHE A 106 -6.946 9.655 -0.421 1.00 0.00 C ATOM 1714 CD2 PHE A 106 -5.563 8.732 -2.089 1.00 0.00 C ATOM 1715 CE1 PHE A 106 -5.802 10.176 0.239 1.00 0.00 C ATOM 1716 CE2 PHE A 106 -4.419 9.253 -1.429 1.00 0.00 C ATOM 1717 CZ PHE A 106 -4.562 9.964 -0.279 1.00 0.00 C ATOM 0 H PHE A 106 -7.855 11.018 -2.009 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.609 9.184 -3.570 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -8.504 7.636 -1.641 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -7.716 7.867 -3.189 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.930 9.823 -0.010 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.449 8.167 -3.003 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -5.916 10.741 1.152 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -3.435 9.084 -1.841 1.00 0.00 H new ATOM 0 HZ PHE A 106 -3.692 10.360 0.223 1.00 0.00 H new ATOM 1727 N ASP A 107 -11.114 8.702 -1.603 1.00 0.00 N ATOM 1728 CA ASP A 107 -12.163 8.693 -0.598 1.00 0.00 C ATOM 1729 C ASP A 107 -11.987 7.472 0.306 1.00 0.00 C ATOM 1730 O ASP A 107 -11.583 6.406 -0.156 1.00 0.00 O ATOM 1731 CB ASP A 107 -13.546 8.606 -1.246 1.00 0.00 C ATOM 1732 CG ASP A 107 -14.691 9.171 -0.403 1.00 0.00 C ATOM 1733 OD1 ASP A 107 -14.868 8.666 0.726 1.00 0.00 O ATOM 1734 OD2 ASP A 107 -15.365 10.095 -0.908 1.00 0.00 O ATOM 0 H ASP A 107 -11.231 8.015 -2.348 1.00 0.00 H new ATOM 0 HA ASP A 107 -12.090 9.618 -0.027 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -13.519 9.137 -2.198 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -13.761 7.561 -1.470 1.00 0.00 H new ATOM 1739 N ILE A 108 -12.299 7.667 1.579 1.00 0.00 N ATOM 1740 CA ILE A 108 -12.180 6.595 2.552 1.00 0.00 C ATOM 1741 C ILE A 108 -13.349 5.623 2.379 1.00 0.00 C ATOM 1742 O ILE A 108 -13.219 4.434 2.665 1.00 0.00 O ATOM 1743 CB ILE A 108 -12.060 7.166 3.967 1.00 0.00 C ATOM 1744 CG1 ILE A 108 -10.665 6.914 4.543 1.00 0.00 C ATOM 1745 CG2 ILE A 108 -13.163 6.618 4.875 1.00 0.00 C ATOM 1746 CD1 ILE A 108 -10.328 5.422 4.532 1.00 0.00 C ATOM 0 H ILE A 108 -12.634 8.552 1.959 1.00 0.00 H new ATOM 0 HA ILE A 108 -11.265 6.028 2.383 1.00 0.00 H new ATOM 0 HB ILE A 108 -12.196 8.246 3.912 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -9.923 7.462 3.962 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -10.615 7.294 5.563 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.055 7.040 5.874 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -14.137 6.891 4.470 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.084 5.532 4.929 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -9.331 5.271 4.947 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -11.057 4.880 5.134 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -10.355 5.050 3.508 1.00 0.00 H new ATOM 1758 N ASP A 109 -14.463 6.165 1.910 1.00 0.00 N ATOM 1759 CA ASP A 109 -15.654 5.361 1.695 1.00 0.00 C ATOM 1760 C ASP A 109 -15.459 4.493 0.450 1.00 0.00 C ATOM 1761 O ASP A 109 -15.755 3.299 0.469 1.00 0.00 O ATOM 1762 CB ASP A 109 -16.882 6.244 1.468 1.00 0.00 C ATOM 1763 CG ASP A 109 -18.152 5.494 1.061 1.00 0.00 C ATOM 1764 OD1 ASP A 109 -18.311 4.348 1.535 1.00 0.00 O ATOM 1765 OD2 ASP A 109 -18.935 6.084 0.286 1.00 0.00 O ATOM 0 H ASP A 109 -14.566 7.152 1.673 1.00 0.00 H new ATOM 0 HA ASP A 109 -15.811 4.747 2.582 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -17.084 6.801 2.383 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -16.647 6.976 0.695 1.00 0.00 H new ATOM 1770 N GLU A 110 -14.963 5.126 -0.602 1.00 0.00 N ATOM 1771 CA GLU A 110 -14.726 4.427 -1.853 1.00 0.00 C ATOM 1772 C GLU A 110 -13.617 3.387 -1.678 1.00 0.00 C ATOM 1773 O GLU A 110 -13.615 2.357 -2.350 1.00 0.00 O ATOM 1774 CB GLU A 110 -14.383 5.410 -2.975 1.00 0.00 C ATOM 1775 CG GLU A 110 -12.879 5.687 -3.021 1.00 0.00 C ATOM 1776 CD GLU A 110 -12.536 6.664 -4.147 1.00 0.00 C ATOM 1777 OE1 GLU A 110 -13.402 7.515 -4.444 1.00 0.00 O ATOM 1778 OE2 GLU A 110 -11.416 6.537 -4.687 1.00 0.00 O ATOM 0 H GLU A 110 -14.718 6.116 -0.614 1.00 0.00 H new ATOM 0 HA GLU A 110 -15.642 3.909 -2.136 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -14.711 5.004 -3.932 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -14.924 6.344 -2.823 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -12.552 6.098 -2.066 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -12.338 4.752 -3.168 1.00 0.00 H new ATOM 1785 N ILE A 111 -12.701 3.693 -0.772 1.00 0.00 N ATOM 1786 CA ILE A 111 -11.589 2.798 -0.499 1.00 0.00 C ATOM 1787 C ILE A 111 -12.116 1.523 0.162 1.00 0.00 C ATOM 1788 O ILE A 111 -11.492 0.468 0.069 1.00 0.00 O ATOM 1789 CB ILE A 111 -10.512 3.515 0.318 1.00 0.00 C ATOM 1790 CG1 ILE A 111 -9.544 4.272 -0.595 1.00 0.00 C ATOM 1791 CG2 ILE A 111 -9.782 2.536 1.241 1.00 0.00 C ATOM 1792 CD1 ILE A 111 -8.332 4.777 0.191 1.00 0.00 C ATOM 0 H ILE A 111 -12.706 4.549 -0.217 1.00 0.00 H new ATOM 0 HA ILE A 111 -11.104 2.498 -1.428 1.00 0.00 H new ATOM 0 HB ILE A 111 -11.000 4.254 0.953 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -9.212 3.618 -1.402 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -10.058 5.114 -1.058 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -9.022 3.071 1.810 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -10.496 2.081 1.927 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -9.307 1.758 0.643 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -7.660 5.311 -0.480 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -8.665 5.449 0.981 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -7.806 3.930 0.633 1.00 0.00 H new ATOM 1804 N ARG A 112 -13.260 1.663 0.815 1.00 0.00 N ATOM 1805 CA ARG A 112 -13.878 0.536 1.492 1.00 0.00 C ATOM 1806 C ARG A 112 -14.212 -0.568 0.487 1.00 0.00 C ATOM 1807 O ARG A 112 -14.299 -1.740 0.852 1.00 0.00 O ATOM 1808 CB ARG A 112 -15.158 0.962 2.215 1.00 0.00 C ATOM 1809 CG ARG A 112 -14.855 1.993 3.304 1.00 0.00 C ATOM 1810 CD ARG A 112 -15.841 1.866 4.467 1.00 0.00 C ATOM 1811 NE ARG A 112 -16.801 2.992 4.442 1.00 0.00 N ATOM 1812 CZ ARG A 112 -17.564 3.353 5.482 1.00 0.00 C ATOM 1813 NH1 ARG A 112 -17.484 2.678 6.637 1.00 0.00 N ATOM 1814 NH2 ARG A 112 -18.407 4.388 5.368 1.00 0.00 N ATOM 0 H ARG A 112 -13.775 2.540 0.890 1.00 0.00 H new ATOM 0 HA ARG A 112 -13.167 0.160 2.227 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -15.863 1.382 1.497 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -15.637 0.089 2.659 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -13.837 1.854 3.668 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -14.909 2.998 2.884 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -16.377 0.919 4.399 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -15.301 1.859 5.414 1.00 0.00 H new ATOM 0 HE ARG A 112 -16.887 3.527 3.578 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -16.842 1.890 6.724 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -18.065 2.952 7.429 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -18.468 4.902 4.489 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -18.988 4.662 6.160 1.00 0.00 H new ATOM 1828 N ASP A 113 -14.389 -0.156 -0.760 1.00 0.00 N ATOM 1829 CA ASP A 113 -14.711 -1.096 -1.820 1.00 0.00 C ATOM 1830 C ASP A 113 -13.450 -1.870 -2.210 1.00 0.00 C ATOM 1831 O ASP A 113 -13.435 -3.099 -2.172 1.00 0.00 O ATOM 1832 CB ASP A 113 -15.223 -0.368 -3.065 1.00 0.00 C ATOM 1833 CG ASP A 113 -16.585 -0.841 -3.577 1.00 0.00 C ATOM 1834 OD1 ASP A 113 -17.428 -1.177 -2.717 1.00 0.00 O ATOM 1835 OD2 ASP A 113 -16.752 -0.855 -4.815 1.00 0.00 O ATOM 0 H ASP A 113 -14.315 0.816 -1.060 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.486 -1.768 -1.451 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.285 0.698 -2.844 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -14.491 -0.486 -3.863 1.00 0.00 H new ATOM 1840 N ALA A 114 -12.422 -1.118 -2.576 1.00 0.00 N ATOM 1841 CA ALA A 114 -11.160 -1.718 -2.973 1.00 0.00 C ATOM 1842 C ALA A 114 -10.644 -2.607 -1.839 1.00 0.00 C ATOM 1843 O ALA A 114 -9.987 -3.617 -2.087 1.00 0.00 O ATOM 1844 CB ALA A 114 -10.166 -0.617 -3.348 1.00 0.00 C ATOM 0 H ALA A 114 -12.438 -0.099 -2.606 1.00 0.00 H new ATOM 0 HA ALA A 114 -11.295 -2.349 -3.852 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -9.219 -1.068 -3.646 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -10.566 -0.032 -4.176 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -10.004 0.034 -2.489 1.00 0.00 H new ATOM 1850 N VAL A 115 -10.962 -2.199 -0.619 1.00 0.00 N ATOM 1851 CA VAL A 115 -10.539 -2.946 0.553 1.00 0.00 C ATOM 1852 C VAL A 115 -11.021 -4.393 0.432 1.00 0.00 C ATOM 1853 O VAL A 115 -10.285 -5.325 0.754 1.00 0.00 O ATOM 1854 CB VAL A 115 -11.039 -2.254 1.823 1.00 0.00 C ATOM 1855 CG1 VAL A 115 -11.067 -3.227 3.003 1.00 0.00 C ATOM 1856 CG2 VAL A 115 -10.191 -1.023 2.147 1.00 0.00 C ATOM 0 H VAL A 115 -11.507 -1.361 -0.417 1.00 0.00 H new ATOM 0 HA VAL A 115 -9.451 -2.970 0.618 1.00 0.00 H new ATOM 0 HB VAL A 115 -12.060 -1.919 1.642 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -11.426 -2.710 3.893 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -11.733 -4.059 2.773 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -10.062 -3.607 3.185 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -10.568 -0.550 3.054 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -9.155 -1.325 2.299 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -10.245 -0.316 1.319 1.00 0.00 H new ATOM 1866 N LYS A 116 -12.253 -4.536 -0.033 1.00 0.00 N ATOM 1867 CA LYS A 116 -12.841 -5.854 -0.201 1.00 0.00 C ATOM 1868 C LYS A 116 -11.858 -6.755 -0.951 1.00 0.00 C ATOM 1869 O LYS A 116 -11.917 -7.978 -0.833 1.00 0.00 O ATOM 1870 CB LYS A 116 -14.212 -5.747 -0.871 1.00 0.00 C ATOM 1871 CG LYS A 116 -15.163 -6.827 -0.351 1.00 0.00 C ATOM 1872 CD LYS A 116 -16.611 -6.512 -0.729 1.00 0.00 C ATOM 1873 CE LYS A 116 -17.275 -7.712 -1.406 1.00 0.00 C ATOM 1874 NZ LYS A 116 -18.518 -7.298 -2.094 1.00 0.00 N ATOM 0 H LYS A 116 -12.860 -3.761 -0.299 1.00 0.00 H new ATOM 0 HA LYS A 116 -13.021 -6.317 0.769 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -14.637 -4.761 -0.682 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -14.101 -5.844 -1.951 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -14.879 -7.795 -0.763 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -15.075 -6.903 0.733 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -17.172 -6.238 0.164 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -16.637 -5.652 -1.398 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -16.587 -8.159 -2.124 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -17.501 -8.477 -0.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -18.955 -8.125 -2.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -19.180 -6.893 -1.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -18.294 -6.585 -2.817 1.00 0.00 H new ATOM 1888 N LYS A 117 -10.977 -6.115 -1.707 1.00 0.00 N ATOM 1889 CA LYS A 117 -9.983 -6.844 -2.476 1.00 0.00 C ATOM 1890 C LYS A 117 -8.597 -6.588 -1.882 1.00 0.00 C ATOM 1891 O LYS A 117 -7.715 -7.442 -1.963 1.00 0.00 O ATOM 1892 CB LYS A 117 -10.090 -6.490 -3.961 1.00 0.00 C ATOM 1893 CG LYS A 117 -9.568 -5.076 -4.227 1.00 0.00 C ATOM 1894 CD LYS A 117 -8.989 -4.962 -5.638 1.00 0.00 C ATOM 1895 CE LYS A 117 -9.757 -3.928 -6.464 1.00 0.00 C ATOM 1896 NZ LYS A 117 -10.157 -4.500 -7.769 1.00 0.00 N ATOM 0 H LYS A 117 -10.931 -5.101 -1.803 1.00 0.00 H new ATOM 0 HA LYS A 117 -10.164 -7.917 -2.413 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.522 -7.208 -4.552 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.129 -6.564 -4.282 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -10.377 -4.356 -4.103 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -8.802 -4.823 -3.494 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -7.938 -4.680 -5.582 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.032 -5.933 -6.132 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -10.641 -3.601 -5.917 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -9.136 -3.046 -6.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -10.677 -3.785 -8.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -9.308 -4.790 -8.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -10.767 -5.328 -7.613 1.00 0.00 H new ATOM 1910 N TYR A 118 -8.447 -5.409 -1.297 1.00 0.00 N ATOM 1911 CA TYR A 118 -7.183 -5.030 -0.688 1.00 0.00 C ATOM 1912 C TYR A 118 -6.960 -5.781 0.626 1.00 0.00 C ATOM 1913 O TYR A 118 -5.825 -5.926 1.078 1.00 0.00 O ATOM 1914 CB TYR A 118 -7.288 -3.533 -0.394 1.00 0.00 C ATOM 1915 CG TYR A 118 -7.124 -3.176 1.084 1.00 0.00 C ATOM 1916 CD1 TYR A 118 -7.973 -3.723 2.025 1.00 0.00 C ATOM 1917 CD2 TYR A 118 -6.127 -2.307 1.478 1.00 0.00 C ATOM 1918 CE1 TYR A 118 -7.818 -3.387 3.417 1.00 0.00 C ATOM 1919 CE2 TYR A 118 -5.972 -1.971 2.869 1.00 0.00 C ATOM 1920 CZ TYR A 118 -6.825 -2.527 3.770 1.00 0.00 C ATOM 1921 OH TYR A 118 -6.679 -2.210 5.085 1.00 0.00 O ATOM 0 H TYR A 118 -9.180 -4.703 -1.232 1.00 0.00 H new ATOM 0 HA TYR A 118 -6.351 -5.268 -1.351 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -6.528 -3.006 -0.971 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -8.257 -3.173 -0.739 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -8.754 -4.403 1.717 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -5.463 -1.879 0.742 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -8.475 -3.808 4.163 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -5.195 -1.292 3.190 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.534 -1.245 5.175 1.00 0.00 H new ATOM 1931 N LEU A 119 -8.062 -6.239 1.203 1.00 0.00 N ATOM 1932 CA LEU A 119 -8.001 -6.972 2.456 1.00 0.00 C ATOM 1933 C LEU A 119 -9.419 -7.168 2.996 1.00 0.00 C ATOM 1934 O LEU A 119 -10.274 -6.299 2.836 1.00 0.00 O ATOM 1935 CB LEU A 119 -7.059 -6.274 3.439 1.00 0.00 C ATOM 1936 CG LEU A 119 -5.934 -7.135 4.016 1.00 0.00 C ATOM 1937 CD1 LEU A 119 -6.289 -7.636 5.418 1.00 0.00 C ATOM 1938 CD2 LEU A 119 -5.582 -8.284 3.069 1.00 0.00 C ATOM 0 H LEU A 119 -9.002 -6.116 0.826 1.00 0.00 H new ATOM 0 HA LEU A 119 -7.580 -7.965 2.297 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -6.612 -5.416 2.936 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -7.653 -5.885 4.266 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.044 -6.513 4.113 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -5.472 -8.245 5.804 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.450 -6.784 6.079 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -7.198 -8.236 5.371 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.780 -8.880 3.503 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.460 -8.912 2.917 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.256 -7.879 2.111 1.00 0.00 H new ATOM 1950 N PRO A 120 -9.629 -8.346 3.642 1.00 0.00 N ATOM 1951 CA PRO A 120 -10.929 -8.668 4.207 1.00 0.00 C ATOM 1952 C PRO A 120 -11.178 -7.878 5.494 1.00 0.00 C ATOM 1953 O PRO A 120 -11.429 -8.463 6.547 1.00 0.00 O ATOM 1954 CB PRO A 120 -10.900 -10.171 4.429 1.00 0.00 C ATOM 1955 CG PRO A 120 -9.433 -10.566 4.418 1.00 0.00 C ATOM 1956 CD PRO A 120 -8.640 -9.400 3.851 1.00 0.00 C ATOM 0 HA PRO A 120 -11.754 -8.392 3.550 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -11.368 -10.435 5.377 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -11.451 -10.692 3.646 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -9.094 -10.803 5.426 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -9.283 -11.460 3.813 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -7.859 -9.079 4.541 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -8.148 -9.672 2.917 1.00 0.00 H new ATOM 1964 N LEU A 121 -11.100 -6.562 5.367 1.00 0.00 N ATOM 1965 CA LEU A 121 -11.314 -5.686 6.506 1.00 0.00 C ATOM 1966 C LEU A 121 -12.797 -5.318 6.590 1.00 0.00 C ATOM 1967 O LEU A 121 -13.550 -5.539 5.642 1.00 0.00 O ATOM 1968 CB LEU A 121 -10.383 -4.474 6.432 1.00 0.00 C ATOM 1969 CG LEU A 121 -10.666 -3.349 7.431 1.00 0.00 C ATOM 1970 CD1 LEU A 121 -10.403 -3.811 8.865 1.00 0.00 C ATOM 1971 CD2 LEU A 121 -9.870 -2.091 7.079 1.00 0.00 C ATOM 0 H LEU A 121 -10.891 -6.081 4.492 1.00 0.00 H new ATOM 0 HA LEU A 121 -11.059 -6.199 7.434 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -9.359 -4.817 6.582 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -10.436 -4.061 5.425 1.00 0.00 H new ATOM 0 HG LEU A 121 -11.723 -3.090 7.365 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -10.612 -2.993 9.555 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -11.049 -4.657 9.099 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -9.360 -4.113 8.965 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -10.089 -1.307 7.804 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -8.804 -2.317 7.100 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -10.149 -1.751 6.082 1.00 0.00 H new ATOM 1983 N LYS A 122 -13.172 -4.762 7.732 1.00 0.00 N ATOM 1984 CA LYS A 122 -14.552 -4.362 7.952 1.00 0.00 C ATOM 1985 C LYS A 122 -15.099 -3.712 6.679 1.00 0.00 C ATOM 1986 O LYS A 122 -14.570 -2.702 6.217 1.00 0.00 O ATOM 1987 CB LYS A 122 -14.660 -3.472 9.192 1.00 0.00 C ATOM 1988 CG LYS A 122 -16.083 -2.935 9.359 1.00 0.00 C ATOM 1989 CD LYS A 122 -16.982 -3.968 10.041 1.00 0.00 C ATOM 1990 CE LYS A 122 -18.441 -3.790 9.618 1.00 0.00 C ATOM 1991 NZ LYS A 122 -19.346 -4.023 10.766 1.00 0.00 N ATOM 0 H LYS A 122 -12.545 -4.579 8.515 1.00 0.00 H new ATOM 0 HA LYS A 122 -15.173 -5.233 8.158 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -14.376 -4.040 10.078 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.961 -2.640 9.109 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -16.063 -2.019 9.949 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -16.495 -2.677 8.383 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -16.646 -4.973 9.786 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -16.899 -3.869 11.123 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -18.592 -2.784 9.227 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -18.680 -4.485 8.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -20.332 -3.898 10.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -19.213 -4.991 11.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -19.129 -3.344 11.523 1.00 0.00 H new ATOM 2005 N SER A 123 -16.150 -4.319 6.148 1.00 0.00 N ATOM 2006 CA SER A 123 -16.774 -3.813 4.938 1.00 0.00 C ATOM 2007 C SER A 123 -17.937 -2.885 5.297 1.00 0.00 C ATOM 2008 O SER A 123 -18.644 -3.121 6.275 1.00 0.00 O ATOM 2009 CB SER A 123 -17.264 -4.958 4.050 1.00 0.00 C ATOM 2010 OG SER A 123 -16.269 -5.964 3.878 1.00 0.00 O ATOM 0 H SER A 123 -16.585 -5.157 6.534 1.00 0.00 H new ATOM 0 HA SER A 123 -16.027 -3.250 4.379 1.00 0.00 H new ATOM 0 HB2 SER A 123 -18.156 -5.402 4.491 1.00 0.00 H new ATOM 0 HB3 SER A 123 -17.553 -4.563 3.076 1.00 0.00 H new ATOM 0 HG SER A 123 -16.621 -6.678 3.306 1.00 0.00 H new ATOM 2016 N ASN A 124 -18.098 -1.849 4.487 1.00 0.00 N ATOM 2017 CA ASN A 124 -19.162 -0.885 4.707 1.00 0.00 C ATOM 2018 C ASN A 124 -20.442 -1.626 5.102 1.00 0.00 C ATOM 2019 O ASN A 124 -20.754 -2.675 4.541 1.00 0.00 O ATOM 2020 CB ASN A 124 -19.452 -0.085 3.436 1.00 0.00 C ATOM 2021 CG ASN A 124 -20.754 0.707 3.572 1.00 0.00 C ATOM 2022 OD1 ASN A 124 -21.741 0.449 2.903 1.00 0.00 O ATOM 2023 ND2 ASN A 124 -20.701 1.684 4.473 1.00 0.00 N ATOM 0 H ASN A 124 -17.509 -1.656 3.677 1.00 0.00 H new ATOM 0 HA ASN A 124 -18.843 -0.204 5.496 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -18.626 0.598 3.235 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -19.521 -0.761 2.584 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -21.519 2.271 4.638 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -19.842 1.846 4.999 1.00 0.00 H new TER 2030 ASN A 124