USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 980 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 40 GLN : amide:sc= 0.271 K(o=0.26,f=-4.7!) USER MOD Set 1.2: B 711 HIS : no HE2:sc= -0.0127 X(o=0.26,f=-0.098) USER MOD Set 2.1: A 57 SER OG : rot 180:sc= -0.0531 USER MOD Set 2.2: A 62 GLN : amide:sc= 0.825 K(o=0.77,f=-0.053) USER MOD Set 3.1: A 7 THR OG1 : rot 123:sc= 1.56 USER MOD Set 3.2: A 9 THR OG1 : rot 170:sc= 0.631 USER MOD Set 4.1: A 6 LYS NZ :NH3+ 156:sc= 1.93 (180deg=1.15) USER MOD Set 4.2: B 686 GLN : amide:sc= -0.145! K(o=1.8!,f=-0.8) USER MOD Single : A 1 MET CE :methyl -168:sc= -0.246 (180deg=-0.313) USER MOD Single : A 1 MET N :NH3+ 175:sc= 0.851 (180deg=0.834) USER MOD Single : A 2 GLN : amide:sc= -0.0163 X(o=-0.016,f=0) USER MOD Single : A 11 LYS NZ :NH3+ -178:sc= 1.23 (180deg=1.2) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0504 USER MOD Single : A 25 ASN : amide:sc= -0.505 K(o=-0.5,f=-2!) USER MOD Single : A 27 LYS NZ :NH3+ 163:sc= 1.98 (180deg=1.61) USER MOD Single : A 29 LYS NZ :NH3+ 172:sc= 1.04 (180deg=0.978) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 159:sc= 1.18 (180deg=0.861) USER MOD Single : A 41 GLN : amide:sc= 0.92 K(o=0.92,f=-5.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 1.19 K(o=1.2,f=-7.2!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 70:sc= -0.0291 USER MOD Single : A 60 ASN : amide:sc= 0.91 K(o=0.91,f=-0.21) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 57:sc= 0.769 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.0632 K(o=-0.063,f=-0.61) USER MOD Single : B -1 MET CE :methyl -176:sc= 0 (180deg=-0.0208) USER MOD Single : B -2 HIS : no HD1:sc= -0.0197 X(o=-0.02,f=-0.27) USER MOD Single : B -3 GLY N :NH3+ 138:sc= 0.00525 (180deg=0) USER MOD Single : B 676 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 678 THR OG1 : rot 180:sc= 0 USER MOD Single : B 681 SER OG : rot 180:sc= 0.0211 USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= -0.157 X(o=-0.16,f=-0.21) USER MOD Single : B 697 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 704 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 706 THR OG1 : rot -84:sc= 0.956 USER MOD Single : B 708 SER OG : rot 180:sc= 0.0448 USER MOD Single : B 714 HIS : no HD1:sc= -0.0316 K(o=-0.032,f=-1.4) USER MOD Single : B 715 LYS NZ :NH3+ 167:sc= 3.49 (180deg=3.33) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.238 1.478 0.309 1.00 0.00 N ATOM 2 CA MET A 1 2.020 1.393 -0.967 1.00 0.00 C ATOM 3 C MET A 1 1.776 2.617 -1.850 1.00 0.00 C ATOM 4 O MET A 1 0.858 3.372 -1.569 1.00 0.00 O ATOM 5 CB MET A 1 1.759 0.095 -1.774 1.00 0.00 C ATOM 6 CG MET A 1 0.396 -0.078 -2.467 1.00 0.00 C ATOM 7 SD MET A 1 0.277 -1.673 -3.311 1.00 0.00 S ATOM 8 CE MET A 1 -0.889 -1.309 -4.646 1.00 0.00 C ATOM 0 H1 MET A 1 1.357 0.597 0.849 1.00 0.00 H new ATOM 0 H2 MET A 1 1.583 2.280 0.875 1.00 0.00 H new ATOM 0 H3 MET A 1 0.231 1.616 0.090 1.00 0.00 H new ATOM 0 HA MET A 1 3.066 1.368 -0.663 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.532 0.020 -2.539 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.896 -0.749 -1.098 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.401 0.004 -1.728 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.248 0.727 -3.187 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.215 -2.241 -5.108 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.753 -0.783 -4.241 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.402 -0.684 -5.394 1.00 0.00 H new ATOM 20 N GLN A 2 2.482 2.778 -2.977 1.00 0.00 N ATOM 21 CA GLN A 2 2.205 3.823 -3.961 1.00 0.00 C ATOM 22 C GLN A 2 2.182 3.246 -5.354 1.00 0.00 C ATOM 23 O GLN A 2 2.849 2.243 -5.596 1.00 0.00 O ATOM 24 CB GLN A 2 3.211 4.990 -3.837 1.00 0.00 C ATOM 25 CG GLN A 2 4.525 4.931 -4.635 1.00 0.00 C ATOM 26 CD GLN A 2 5.530 4.007 -3.968 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.386 4.407 -3.187 1.00 0.00 O ATOM 28 NE2 GLN A 2 5.381 2.728 -4.245 1.00 0.00 N ATOM 0 H GLN A 2 3.268 2.179 -3.230 1.00 0.00 H new ATOM 0 HA GLN A 2 1.216 4.234 -3.757 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.692 5.904 -4.126 1.00 0.00 H new ATOM 0 HB3 GLN A 2 3.470 5.090 -2.783 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.323 4.583 -5.648 1.00 0.00 H new ATOM 0 HG3 GLN A 2 4.948 5.932 -4.720 1.00 0.00 H new ATOM 0 HE21 GLN A 2 4.658 2.429 -4.900 1.00 0.00 H new ATOM 0 HE22 GLN A 2 5.988 2.037 -3.805 1.00 0.00 H new ATOM 37 N ILE A 3 1.510 3.932 -6.268 1.00 0.00 N ATOM 38 CA ILE A 3 1.473 3.574 -7.688 1.00 0.00 C ATOM 39 C ILE A 3 1.573 4.849 -8.505 1.00 0.00 C ATOM 40 O ILE A 3 1.235 5.928 -8.030 1.00 0.00 O ATOM 41 CB ILE A 3 0.218 2.737 -8.007 1.00 0.00 C ATOM 42 CG1 ILE A 3 -1.057 3.342 -7.394 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.399 1.303 -7.469 1.00 0.00 C ATOM 44 CD1 ILE A 3 -2.275 3.209 -8.301 1.00 0.00 C ATOM 0 H ILE A 3 0.966 4.766 -6.046 1.00 0.00 H new ATOM 0 HA ILE A 3 2.320 2.940 -7.950 1.00 0.00 H new ATOM 0 HB ILE A 3 0.101 2.730 -9.091 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.264 2.852 -6.443 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.885 4.397 -7.178 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.490 0.714 -7.696 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.268 0.845 -7.940 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.547 1.335 -6.390 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.142 3.654 -7.813 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.085 3.723 -9.243 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.470 2.154 -8.496 1.00 0.00 H new ATOM 56 N PHE A 4 2.081 4.707 -9.721 1.00 0.00 N ATOM 57 CA PHE A 4 2.476 5.787 -10.609 1.00 0.00 C ATOM 58 C PHE A 4 1.441 5.892 -11.713 1.00 0.00 C ATOM 59 O PHE A 4 1.444 5.123 -12.663 1.00 0.00 O ATOM 60 CB PHE A 4 3.873 5.488 -11.171 1.00 0.00 C ATOM 61 CG PHE A 4 4.876 4.890 -10.210 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.167 5.563 -9.013 1.00 0.00 C ATOM 63 CD2 PHE A 4 5.532 3.681 -10.499 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.069 5.019 -8.088 1.00 0.00 C ATOM 65 CE2 PHE A 4 6.480 3.174 -9.596 1.00 0.00 C ATOM 66 CZ PHE A 4 6.750 3.835 -8.387 1.00 0.00 C ATOM 0 H PHE A 4 2.236 3.787 -10.134 1.00 0.00 H new ATOM 0 HA PHE A 4 2.524 6.739 -10.080 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.762 4.807 -12.015 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.288 6.416 -11.563 1.00 0.00 H new ATOM 0 HD1 PHE A 4 4.691 6.509 -8.803 1.00 0.00 H new ATOM 0 HD2 PHE A 4 5.308 3.145 -11.410 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.238 5.515 -7.144 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.009 2.263 -9.835 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.476 3.433 -7.696 1.00 0.00 H new ATOM 76 N VAL A 5 0.499 6.808 -11.604 1.00 0.00 N ATOM 77 CA VAL A 5 -0.525 6.967 -12.638 1.00 0.00 C ATOM 78 C VAL A 5 0.070 7.911 -13.670 1.00 0.00 C ATOM 79 O VAL A 5 0.151 9.114 -13.451 1.00 0.00 O ATOM 80 CB VAL A 5 -1.873 7.380 -12.029 1.00 0.00 C ATOM 81 CG1 VAL A 5 -2.986 7.411 -13.095 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.232 6.388 -10.908 1.00 0.00 C ATOM 0 H VAL A 5 0.415 7.453 -10.819 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.779 6.035 -13.143 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.786 8.388 -11.623 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.927 7.707 -12.630 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.724 8.128 -13.873 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.095 6.420 -13.536 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.188 6.669 -10.466 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.305 5.382 -11.322 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.457 6.409 -10.141 1.00 0.00 H new ATOM 92 N LYS A 6 0.561 7.371 -14.782 1.00 0.00 N ATOM 93 CA LYS A 6 1.052 8.186 -15.880 1.00 0.00 C ATOM 94 C LYS A 6 -0.181 8.801 -16.523 1.00 0.00 C ATOM 95 O LYS A 6 -1.076 8.063 -16.943 1.00 0.00 O ATOM 96 CB LYS A 6 1.896 7.307 -16.829 1.00 0.00 C ATOM 97 CG LYS A 6 2.649 8.203 -17.826 1.00 0.00 C ATOM 98 CD LYS A 6 3.633 7.479 -18.755 1.00 0.00 C ATOM 99 CE LYS A 6 4.555 8.482 -19.482 1.00 0.00 C ATOM 100 NZ LYS A 6 5.577 7.815 -20.329 1.00 0.00 N ATOM 0 H LYS A 6 0.628 6.366 -14.943 1.00 0.00 H new ATOM 0 HA LYS A 6 1.719 8.990 -15.568 1.00 0.00 H new ATOM 0 HB2 LYS A 6 2.604 6.709 -16.255 1.00 0.00 H new ATOM 0 HB3 LYS A 6 1.252 6.610 -17.365 1.00 0.00 H new ATOM 0 HG2 LYS A 6 1.917 8.728 -18.440 1.00 0.00 H new ATOM 0 HG3 LYS A 6 3.197 8.960 -17.265 1.00 0.00 H new ATOM 0 HD2 LYS A 6 4.236 6.780 -18.176 1.00 0.00 H new ATOM 0 HD3 LYS A 6 3.080 6.892 -19.488 1.00 0.00 H new ATOM 0 HE2 LYS A 6 3.949 9.141 -20.103 1.00 0.00 H new ATOM 0 HE3 LYS A 6 5.055 9.110 -18.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 5.885 8.466 -21.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 6.394 7.550 -19.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 5.168 6.961 -20.759 1.00 0.00 H new ATOM 114 N THR A 7 -0.276 10.128 -16.589 1.00 0.00 N ATOM 115 CA THR A 7 -1.331 10.708 -17.392 1.00 0.00 C ATOM 116 C THR A 7 -1.053 10.397 -18.836 1.00 0.00 C ATOM 117 O THR A 7 0.070 10.084 -19.211 1.00 0.00 O ATOM 118 CB THR A 7 -1.519 12.199 -17.160 1.00 0.00 C ATOM 119 OG1 THR A 7 -0.299 12.847 -17.381 1.00 0.00 O ATOM 120 CG2 THR A 7 -2.011 12.433 -15.748 1.00 0.00 C ATOM 0 H THR A 7 0.339 10.790 -16.116 1.00 0.00 H new ATOM 0 HA THR A 7 -2.278 10.261 -17.089 1.00 0.00 H new ATOM 0 HB THR A 7 -2.262 12.601 -17.849 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.414 13.535 -18.070 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.146 13.502 -15.582 1.00 0.00 H new ATOM 0 HG22 THR A 7 -2.962 11.921 -15.605 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.280 12.045 -15.039 1.00 0.00 H new ATOM 128 N LEU A 8 -2.059 10.547 -19.669 1.00 0.00 N ATOM 129 CA LEU A 8 -1.880 10.493 -21.102 1.00 0.00 C ATOM 130 C LEU A 8 -0.935 11.630 -21.589 1.00 0.00 C ATOM 131 O LEU A 8 -0.505 11.533 -22.730 1.00 0.00 O ATOM 132 CB LEU A 8 -3.277 10.496 -21.738 1.00 0.00 C ATOM 133 CG LEU A 8 -3.882 9.225 -22.324 1.00 0.00 C ATOM 134 CD1 LEU A 8 -5.334 9.449 -22.764 1.00 0.00 C ATOM 135 CD2 LEU A 8 -3.172 8.787 -23.591 1.00 0.00 C ATOM 0 H LEU A 8 -3.021 10.709 -19.373 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.374 9.580 -21.416 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.971 10.858 -20.979 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.261 11.238 -22.536 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.794 8.482 -21.531 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -5.736 8.524 -23.177 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.932 9.752 -21.905 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.368 10.230 -23.523 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.637 7.878 -23.973 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.246 9.575 -24.341 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.122 8.593 -23.371 1.00 0.00 H new ATOM 147 N THR A 9 -0.596 12.699 -20.832 1.00 0.00 N ATOM 148 CA THR A 9 0.496 13.622 -21.227 1.00 0.00 C ATOM 149 C THR A 9 1.842 13.030 -20.854 1.00 0.00 C ATOM 150 O THR A 9 2.889 13.376 -21.396 1.00 0.00 O ATOM 151 CB THR A 9 0.453 14.976 -20.502 1.00 0.00 C ATOM 152 OG1 THR A 9 -0.332 14.898 -19.330 1.00 0.00 O ATOM 153 CG2 THR A 9 -0.003 16.108 -21.407 1.00 0.00 C ATOM 0 H THR A 9 -1.056 12.943 -19.955 1.00 0.00 H new ATOM 0 HA THR A 9 0.362 13.765 -22.299 1.00 0.00 H new ATOM 0 HB THR A 9 1.476 15.212 -20.208 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.216 15.716 -18.803 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.015 17.041 -20.844 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.684 16.200 -22.248 1.00 0.00 H new ATOM 0 HG23 THR A 9 -1.005 15.895 -21.779 1.00 0.00 H new ATOM 161 N GLY A 10 1.806 12.187 -19.831 1.00 0.00 N ATOM 162 CA GLY A 10 2.949 11.574 -19.243 1.00 0.00 C ATOM 163 C GLY A 10 3.422 12.293 -17.997 1.00 0.00 C ATOM 164 O GLY A 10 4.595 12.189 -17.647 1.00 0.00 O ATOM 0 H GLY A 10 0.933 11.912 -19.382 1.00 0.00 H new ATOM 0 HA2 GLY A 10 2.713 10.540 -18.993 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.758 11.549 -19.973 1.00 0.00 H new ATOM 168 N LYS A 11 2.518 13.012 -17.324 1.00 0.00 N ATOM 169 CA LYS A 11 2.820 13.537 -16.006 1.00 0.00 C ATOM 170 C LYS A 11 2.481 12.388 -15.098 1.00 0.00 C ATOM 171 O LYS A 11 1.309 12.058 -14.930 1.00 0.00 O ATOM 172 CB LYS A 11 2.006 14.799 -15.703 1.00 0.00 C ATOM 173 CG LYS A 11 2.248 15.277 -14.253 1.00 0.00 C ATOM 174 CD LYS A 11 1.293 14.771 -13.159 1.00 0.00 C ATOM 175 CE LYS A 11 -0.193 14.761 -13.537 1.00 0.00 C ATOM 176 NZ LYS A 11 -0.775 16.116 -13.749 1.00 0.00 N ATOM 0 H LYS A 11 1.586 13.237 -17.671 1.00 0.00 H new ATOM 0 HA LYS A 11 3.854 13.861 -15.892 1.00 0.00 H new ATOM 0 HB2 LYS A 11 2.280 15.590 -16.401 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.945 14.597 -15.851 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.261 14.990 -13.971 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.213 16.366 -14.250 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.587 13.758 -12.883 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.421 15.392 -12.273 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.322 14.175 -14.447 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.754 14.255 -12.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.788 16.028 -13.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.655 16.684 -12.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -0.289 16.582 -14.541 1.00 0.00 H new ATOM 190 N THR A 12 3.481 11.730 -14.562 1.00 0.00 N ATOM 191 CA THR A 12 3.251 10.614 -13.682 1.00 0.00 C ATOM 192 C THR A 12 2.906 11.181 -12.312 1.00 0.00 C ATOM 193 O THR A 12 3.725 11.838 -11.670 1.00 0.00 O ATOM 194 CB THR A 12 4.480 9.707 -13.729 1.00 0.00 C ATOM 195 OG1 THR A 12 4.919 9.569 -15.072 1.00 0.00 O ATOM 196 CG2 THR A 12 4.093 8.321 -13.235 1.00 0.00 C ATOM 0 H THR A 12 4.464 11.950 -14.722 1.00 0.00 H new ATOM 0 HA THR A 12 2.412 9.983 -13.976 1.00 0.00 H new ATOM 0 HB THR A 12 5.265 10.141 -13.110 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.708 8.989 -15.100 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.965 7.667 -13.265 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.726 8.389 -12.211 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.311 7.912 -13.874 1.00 0.00 H new ATOM 204 N ILE A 13 1.658 10.954 -11.904 1.00 0.00 N ATOM 205 CA ILE A 13 1.149 11.339 -10.604 1.00 0.00 C ATOM 206 C ILE A 13 1.250 10.085 -9.763 1.00 0.00 C ATOM 207 O ILE A 13 0.567 9.096 -10.022 1.00 0.00 O ATOM 208 CB ILE A 13 -0.271 11.961 -10.684 1.00 0.00 C ATOM 209 CG1 ILE A 13 -1.128 11.829 -9.398 1.00 0.00 C ATOM 210 CG2 ILE A 13 -1.107 11.589 -11.916 1.00 0.00 C ATOM 211 CD1 ILE A 13 -2.431 11.016 -9.491 1.00 0.00 C ATOM 0 H ILE A 13 0.964 10.487 -12.487 1.00 0.00 H new ATOM 0 HA ILE A 13 1.725 12.144 -10.148 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.007 13.013 -10.796 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.506 11.379 -8.624 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -1.382 12.833 -9.059 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.077 12.083 -11.860 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.588 11.911 -12.819 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -1.251 10.509 -11.945 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -2.925 11.009 -8.520 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.091 11.470 -10.230 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.201 9.993 -9.789 1.00 0.00 H new ATOM 223 N THR A 14 2.130 10.110 -8.779 1.00 0.00 N ATOM 224 CA THR A 14 2.295 9.005 -7.857 1.00 0.00 C ATOM 225 C THR A 14 1.280 9.213 -6.739 1.00 0.00 C ATOM 226 O THR A 14 1.038 10.346 -6.312 1.00 0.00 O ATOM 227 CB THR A 14 3.753 8.974 -7.388 1.00 0.00 C ATOM 228 OG1 THR A 14 4.595 8.959 -8.529 1.00 0.00 O ATOM 229 CG2 THR A 14 4.050 7.730 -6.532 1.00 0.00 C ATOM 0 H THR A 14 2.751 10.899 -8.598 1.00 0.00 H new ATOM 0 HA THR A 14 2.104 8.030 -8.304 1.00 0.00 H new ATOM 0 HB THR A 14 3.935 9.857 -6.775 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.532 8.941 -8.244 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.094 7.745 -6.219 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.407 7.732 -5.652 1.00 0.00 H new ATOM 0 HG23 THR A 14 3.860 6.831 -7.118 1.00 0.00 H new ATOM 237 N LEU A 15 0.665 8.124 -6.273 1.00 0.00 N ATOM 238 CA LEU A 15 -0.375 8.181 -5.261 1.00 0.00 C ATOM 239 C LEU A 15 -0.246 6.999 -4.346 1.00 0.00 C ATOM 240 O LEU A 15 0.118 5.927 -4.820 1.00 0.00 O ATOM 241 CB LEU A 15 -1.758 8.271 -5.931 1.00 0.00 C ATOM 242 CG LEU A 15 -2.239 7.075 -6.766 1.00 0.00 C ATOM 243 CD1 LEU A 15 -3.033 6.087 -5.925 1.00 0.00 C ATOM 244 CD2 LEU A 15 -3.208 7.568 -7.831 1.00 0.00 C ATOM 0 H LEU A 15 0.879 7.179 -6.592 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.263 9.078 -4.652 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.496 8.449 -5.149 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.759 9.149 -6.576 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.351 6.599 -7.183 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.356 5.255 -6.550 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.406 5.711 -5.116 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.906 6.586 -5.505 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.553 6.724 -8.428 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.062 8.047 -7.352 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.704 8.287 -8.477 1.00 0.00 H new ATOM 256 N GLU A 16 -0.574 7.174 -3.069 1.00 0.00 N ATOM 257 CA GLU A 16 -0.413 6.137 -2.064 1.00 0.00 C ATOM 258 C GLU A 16 -1.772 5.552 -1.706 1.00 0.00 C ATOM 259 O GLU A 16 -2.732 6.273 -1.429 1.00 0.00 O ATOM 260 CB GLU A 16 0.378 6.650 -0.852 1.00 0.00 C ATOM 261 CG GLU A 16 1.893 6.544 -1.103 1.00 0.00 C ATOM 262 CD GLU A 16 2.698 7.186 0.038 1.00 0.00 C ATOM 263 OE1 GLU A 16 3.014 6.482 1.028 1.00 0.00 O ATOM 264 OE2 GLU A 16 3.036 8.391 -0.048 1.00 0.00 O ATOM 0 H GLU A 16 -0.960 8.045 -2.704 1.00 0.00 H new ATOM 0 HA GLU A 16 0.186 5.323 -2.472 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.110 7.687 -0.650 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.110 6.073 0.033 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.174 5.496 -1.203 1.00 0.00 H new ATOM 0 HG3 GLU A 16 2.142 7.032 -2.045 1.00 0.00 H new ATOM 271 N VAL A 17 -1.836 4.228 -1.806 1.00 0.00 N ATOM 272 CA VAL A 17 -3.014 3.366 -1.739 1.00 0.00 C ATOM 273 C VAL A 17 -2.605 2.007 -1.159 1.00 0.00 C ATOM 274 O VAL A 17 -1.494 1.834 -0.656 1.00 0.00 O ATOM 275 CB VAL A 17 -3.636 3.231 -3.149 1.00 0.00 C ATOM 276 CG1 VAL A 17 -4.496 4.448 -3.492 1.00 0.00 C ATOM 277 CG2 VAL A 17 -2.571 2.972 -4.224 1.00 0.00 C ATOM 0 H VAL A 17 -0.988 3.680 -1.949 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.771 3.799 -1.085 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.288 2.358 -3.133 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.920 4.325 -4.489 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.302 4.541 -2.764 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.880 5.347 -3.468 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.051 2.884 -5.198 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.863 3.801 -4.242 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.041 2.047 -3.996 1.00 0.00 H new ATOM 287 N GLU A 18 -3.480 1.017 -1.289 1.00 0.00 N ATOM 288 CA GLU A 18 -3.281 -0.376 -0.868 1.00 0.00 C ATOM 289 C GLU A 18 -3.564 -1.268 -2.080 1.00 0.00 C ATOM 290 O GLU A 18 -4.309 -0.838 -2.958 1.00 0.00 O ATOM 291 CB GLU A 18 -4.254 -0.740 0.269 1.00 0.00 C ATOM 292 CG GLU A 18 -4.315 0.296 1.392 1.00 0.00 C ATOM 293 CD GLU A 18 -5.106 -0.230 2.603 1.00 0.00 C ATOM 294 OE1 GLU A 18 -6.360 -0.160 2.598 1.00 0.00 O ATOM 295 OE2 GLU A 18 -4.478 -0.707 3.581 1.00 0.00 O ATOM 0 H GLU A 18 -4.396 1.166 -1.712 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.263 -0.515 -0.504 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.253 -0.867 -0.148 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.960 -1.701 0.691 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.303 0.557 1.703 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.780 1.209 1.021 1.00 0.00 H new ATOM 302 N PRO A 19 -3.075 -2.520 -2.153 1.00 0.00 N ATOM 303 CA PRO A 19 -3.483 -3.440 -3.215 1.00 0.00 C ATOM 304 C PRO A 19 -4.998 -3.655 -3.280 1.00 0.00 C ATOM 305 O PRO A 19 -5.563 -3.831 -4.355 1.00 0.00 O ATOM 306 CB PRO A 19 -2.756 -4.756 -2.933 1.00 0.00 C ATOM 307 CG PRO A 19 -1.617 -4.398 -1.992 1.00 0.00 C ATOM 308 CD PRO A 19 -2.136 -3.168 -1.243 1.00 0.00 C ATOM 0 HA PRO A 19 -3.220 -3.023 -4.187 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.427 -5.485 -2.478 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -2.379 -5.201 -3.854 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.390 -5.216 -1.309 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.701 -4.176 -2.539 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.626 -3.454 -0.312 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.319 -2.496 -0.979 1.00 0.00 H new ATOM 316 N SER A 20 -5.686 -3.559 -2.150 1.00 0.00 N ATOM 317 CA SER A 20 -7.115 -3.823 -2.039 1.00 0.00 C ATOM 318 C SER A 20 -7.874 -2.506 -2.010 1.00 0.00 C ATOM 319 O SER A 20 -9.058 -2.487 -1.668 1.00 0.00 O ATOM 320 CB SER A 20 -7.376 -4.694 -0.799 1.00 0.00 C ATOM 321 OG SER A 20 -6.532 -5.845 -0.804 1.00 0.00 O ATOM 0 H SER A 20 -5.257 -3.289 -1.265 1.00 0.00 H new ATOM 0 HA SER A 20 -7.475 -4.379 -2.905 1.00 0.00 H new ATOM 0 HB2 SER A 20 -7.199 -4.111 0.105 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.421 -5.003 -0.779 1.00 0.00 H new ATOM 0 HG SER A 20 -6.711 -6.386 -0.007 1.00 0.00 H new ATOM 327 N ASP A 21 -7.209 -1.401 -2.369 1.00 0.00 N ATOM 328 CA ASP A 21 -7.890 -0.146 -2.521 1.00 0.00 C ATOM 329 C ASP A 21 -8.524 -0.163 -3.908 1.00 0.00 C ATOM 330 O ASP A 21 -7.949 -0.694 -4.876 1.00 0.00 O ATOM 331 CB ASP A 21 -6.921 1.019 -2.302 1.00 0.00 C ATOM 332 CG ASP A 21 -7.423 2.067 -1.291 1.00 0.00 C ATOM 333 OD1 ASP A 21 -8.615 2.067 -0.908 1.00 0.00 O ATOM 334 OD2 ASP A 21 -6.586 2.918 -0.911 1.00 0.00 O ATOM 0 H ASP A 21 -6.207 -1.368 -2.555 1.00 0.00 H new ATOM 0 HA ASP A 21 -8.672 -0.006 -1.774 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.966 0.624 -1.957 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.736 1.510 -3.258 1.00 0.00 H new ATOM 339 N THR A 22 -9.743 0.356 -3.992 1.00 0.00 N ATOM 340 CA THR A 22 -10.559 0.262 -5.182 1.00 0.00 C ATOM 341 C THR A 22 -10.183 1.300 -6.214 1.00 0.00 C ATOM 342 O THR A 22 -9.697 2.383 -5.884 1.00 0.00 O ATOM 343 CB THR A 22 -12.047 0.394 -4.836 1.00 0.00 C ATOM 344 OG1 THR A 22 -12.223 1.419 -3.872 1.00 0.00 O ATOM 345 CG2 THR A 22 -12.583 -0.928 -4.307 1.00 0.00 C ATOM 0 H THR A 22 -10.191 0.857 -3.225 1.00 0.00 H new ATOM 0 HA THR A 22 -10.374 -0.723 -5.612 1.00 0.00 H new ATOM 0 HB THR A 22 -12.602 0.655 -5.737 1.00 0.00 H new ATOM 0 HG1 THR A 22 -13.175 1.503 -3.654 1.00 0.00 H new ATOM 0 HG21 THR A 22 -13.640 -0.821 -4.065 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.461 -1.700 -5.067 1.00 0.00 H new ATOM 0 HG23 THR A 22 -12.032 -1.211 -3.410 1.00 0.00 H new ATOM 353 N ILE A 23 -10.500 0.989 -7.465 1.00 0.00 N ATOM 354 CA ILE A 23 -10.434 1.923 -8.569 1.00 0.00 C ATOM 355 C ILE A 23 -11.291 3.146 -8.265 1.00 0.00 C ATOM 356 O ILE A 23 -10.845 4.236 -8.584 1.00 0.00 O ATOM 357 CB ILE A 23 -10.877 1.220 -9.856 1.00 0.00 C ATOM 358 CG1 ILE A 23 -10.052 -0.039 -10.188 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.875 2.162 -11.072 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.573 -0.047 -9.804 1.00 0.00 C ATOM 0 H ILE A 23 -10.816 0.059 -7.740 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.409 2.268 -8.708 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.900 0.905 -9.651 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.529 -0.889 -9.700 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -10.119 -0.209 -11.263 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.197 1.614 -11.957 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.558 2.992 -10.891 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.868 2.549 -11.231 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.125 -0.996 -10.100 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -8.061 0.770 -10.312 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.476 0.079 -8.726 1.00 0.00 H new ATOM 372 N GLU A 24 -12.459 3.013 -7.633 1.00 0.00 N ATOM 373 CA GLU A 24 -13.274 4.174 -7.251 1.00 0.00 C ATOM 374 C GLU A 24 -12.435 5.145 -6.414 1.00 0.00 C ATOM 375 O GLU A 24 -12.369 6.339 -6.711 1.00 0.00 O ATOM 376 CB GLU A 24 -14.507 3.688 -6.474 1.00 0.00 C ATOM 377 CG GLU A 24 -15.440 4.830 -6.056 1.00 0.00 C ATOM 378 CD GLU A 24 -16.706 4.286 -5.370 1.00 0.00 C ATOM 379 OE1 GLU A 24 -16.679 4.050 -4.138 1.00 0.00 O ATOM 380 OE2 GLU A 24 -17.743 4.107 -6.054 1.00 0.00 O ATOM 0 H GLU A 24 -12.864 2.113 -7.374 1.00 0.00 H new ATOM 0 HA GLU A 24 -13.611 4.705 -8.141 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -15.062 2.980 -7.090 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -14.180 3.149 -5.585 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -14.915 5.503 -5.378 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -15.720 5.415 -6.932 1.00 0.00 H new ATOM 387 N ASN A 25 -11.733 4.611 -5.410 1.00 0.00 N ATOM 388 CA ASN A 25 -10.899 5.417 -4.528 1.00 0.00 C ATOM 389 C ASN A 25 -9.690 5.979 -5.281 1.00 0.00 C ATOM 390 O ASN A 25 -9.352 7.146 -5.123 1.00 0.00 O ATOM 391 CB ASN A 25 -10.521 4.615 -3.265 1.00 0.00 C ATOM 392 CG ASN A 25 -9.017 4.565 -3.039 1.00 0.00 C ATOM 393 OD1 ASN A 25 -8.432 5.429 -2.396 1.00 0.00 O ATOM 394 ND2 ASN A 25 -8.361 3.586 -3.641 1.00 0.00 N ATOM 0 H ASN A 25 -11.730 3.615 -5.191 1.00 0.00 H new ATOM 0 HA ASN A 25 -11.466 6.283 -4.186 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.002 5.063 -2.396 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.906 3.599 -3.354 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -7.344 3.538 -3.576 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -8.872 2.879 -4.170 1.00 0.00 H new ATOM 401 N VAL A 26 -9.060 5.187 -6.144 1.00 0.00 N ATOM 402 CA VAL A 26 -7.904 5.609 -6.928 1.00 0.00 C ATOM 403 C VAL A 26 -8.330 6.772 -7.821 1.00 0.00 C ATOM 404 O VAL A 26 -7.715 7.829 -7.784 1.00 0.00 O ATOM 405 CB VAL A 26 -7.405 4.405 -7.739 1.00 0.00 C ATOM 406 CG1 VAL A 26 -6.389 4.806 -8.810 1.00 0.00 C ATOM 407 CG2 VAL A 26 -6.779 3.312 -6.870 1.00 0.00 C ATOM 0 H VAL A 26 -9.342 4.223 -6.320 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.085 5.951 -6.296 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.302 4.007 -8.214 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -6.067 3.919 -9.356 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.849 5.511 -9.502 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.526 5.274 -8.336 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.447 2.489 -7.503 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -5.926 3.721 -6.329 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.518 2.946 -6.158 1.00 0.00 H new ATOM 417 N LYS A 27 -9.411 6.623 -8.584 1.00 0.00 N ATOM 418 CA LYS A 27 -9.952 7.699 -9.397 1.00 0.00 C ATOM 419 C LYS A 27 -10.288 8.939 -8.575 1.00 0.00 C ATOM 420 O LYS A 27 -10.102 10.040 -9.081 1.00 0.00 O ATOM 421 CB LYS A 27 -11.224 7.227 -10.100 1.00 0.00 C ATOM 422 CG LYS A 27 -11.083 6.158 -11.190 1.00 0.00 C ATOM 423 CD LYS A 27 -12.511 5.780 -11.615 1.00 0.00 C ATOM 424 CE LYS A 27 -12.557 5.108 -12.988 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.920 5.207 -13.588 1.00 0.00 N ATOM 0 H LYS A 27 -9.934 5.750 -8.653 1.00 0.00 H new ATOM 0 HA LYS A 27 -9.181 7.967 -10.120 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.904 6.843 -9.340 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -11.704 8.099 -10.545 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.514 6.540 -12.037 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.547 5.287 -10.813 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -12.942 5.109 -10.872 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -13.130 6.677 -11.632 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.829 5.577 -13.651 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.273 4.060 -12.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -13.865 5.013 -14.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.549 4.513 -13.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -14.297 6.165 -13.438 1.00 0.00 H new ATOM 439 N ALA A 28 -10.743 8.805 -7.330 1.00 0.00 N ATOM 440 CA ALA A 28 -10.953 9.973 -6.476 1.00 0.00 C ATOM 441 C ALA A 28 -9.621 10.669 -6.171 1.00 0.00 C ATOM 442 O ALA A 28 -9.541 11.893 -6.229 1.00 0.00 O ATOM 443 CB ALA A 28 -11.680 9.581 -5.189 1.00 0.00 C ATOM 0 H ALA A 28 -10.971 7.911 -6.894 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.585 10.681 -7.013 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.825 10.466 -4.569 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.649 9.148 -5.436 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.084 8.849 -4.643 1.00 0.00 H new ATOM 449 N LYS A 29 -8.543 9.904 -5.952 1.00 0.00 N ATOM 450 CA LYS A 29 -7.199 10.473 -5.799 1.00 0.00 C ATOM 451 C LYS A 29 -6.764 11.134 -7.112 1.00 0.00 C ATOM 452 O LYS A 29 -6.132 12.184 -7.106 1.00 0.00 O ATOM 453 CB LYS A 29 -6.196 9.402 -5.322 1.00 0.00 C ATOM 454 CG LYS A 29 -6.581 8.860 -3.933 1.00 0.00 C ATOM 455 CD LYS A 29 -5.703 7.703 -3.418 1.00 0.00 C ATOM 456 CE LYS A 29 -6.033 7.455 -1.931 1.00 0.00 C ATOM 457 NZ LYS A 29 -4.997 7.981 -0.993 1.00 0.00 N ATOM 0 H LYS A 29 -8.577 8.887 -5.877 1.00 0.00 H new ATOM 0 HA LYS A 29 -7.220 11.243 -5.028 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -6.166 8.582 -6.040 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -5.194 9.829 -5.284 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.535 9.679 -3.215 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -7.617 8.523 -3.966 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.887 6.801 -4.001 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.648 7.949 -3.535 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.991 7.919 -1.698 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.149 6.384 -1.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.342 7.903 -0.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.122 7.428 -1.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.804 8.979 -1.213 1.00 0.00 H new ATOM 471 N ILE A 30 -7.159 10.579 -8.257 1.00 0.00 N ATOM 472 CA ILE A 30 -6.861 11.191 -9.555 1.00 0.00 C ATOM 473 C ILE A 30 -7.604 12.508 -9.648 1.00 0.00 C ATOM 474 O ILE A 30 -7.003 13.480 -10.042 1.00 0.00 O ATOM 475 CB ILE A 30 -7.205 10.277 -10.751 1.00 0.00 C ATOM 476 CG1 ILE A 30 -6.538 8.890 -10.754 1.00 0.00 C ATOM 477 CG2 ILE A 30 -6.858 10.959 -12.088 1.00 0.00 C ATOM 478 CD1 ILE A 30 -5.244 8.818 -9.958 1.00 0.00 C ATOM 0 H ILE A 30 -7.686 9.707 -8.314 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.785 11.356 -9.613 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.277 10.115 -10.635 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.240 8.161 -10.351 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.334 8.600 -11.785 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.111 10.293 -12.913 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -7.426 11.885 -12.182 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.792 11.183 -12.116 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -4.840 7.807 -10.012 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.522 9.521 -10.374 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -5.442 9.075 -8.917 1.00 0.00 H new ATOM 490 N GLN A 31 -8.871 12.593 -9.270 1.00 0.00 N ATOM 491 CA GLN A 31 -9.615 13.838 -9.258 1.00 0.00 C ATOM 492 C GLN A 31 -8.939 14.847 -8.336 1.00 0.00 C ATOM 493 O GLN A 31 -8.894 16.023 -8.680 1.00 0.00 O ATOM 494 CB GLN A 31 -11.064 13.601 -8.826 1.00 0.00 C ATOM 495 CG GLN A 31 -11.948 14.844 -9.059 1.00 0.00 C ATOM 496 CD GLN A 31 -12.604 15.297 -7.763 1.00 0.00 C ATOM 497 OE1 GLN A 31 -12.037 16.050 -6.974 1.00 0.00 O ATOM 498 NE2 GLN A 31 -13.796 14.791 -7.502 1.00 0.00 N ATOM 0 H GLN A 31 -9.415 11.788 -8.960 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.626 14.243 -10.270 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -11.474 12.756 -9.380 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -11.088 13.332 -7.770 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.343 15.654 -9.467 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -12.715 14.616 -9.799 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -14.244 14.169 -8.174 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -14.268 15.023 -6.628 1.00 0.00 H new ATOM 507 N ASP A 32 -8.360 14.389 -7.223 1.00 0.00 N ATOM 508 CA ASP A 32 -7.652 15.282 -6.319 1.00 0.00 C ATOM 509 C ASP A 32 -6.430 15.884 -7.026 1.00 0.00 C ATOM 510 O ASP A 32 -6.082 17.040 -6.765 1.00 0.00 O ATOM 511 CB ASP A 32 -7.254 14.548 -5.033 1.00 0.00 C ATOM 512 CG ASP A 32 -6.205 15.323 -4.216 1.00 0.00 C ATOM 513 OD1 ASP A 32 -6.577 16.309 -3.536 1.00 0.00 O ATOM 514 OD2 ASP A 32 -5.018 14.909 -4.216 1.00 0.00 O ATOM 0 H ASP A 32 -8.370 13.411 -6.933 1.00 0.00 H new ATOM 0 HA ASP A 32 -8.316 16.099 -6.035 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.141 14.387 -4.420 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.859 13.564 -5.287 1.00 0.00 H new ATOM 519 N LYS A 33 -5.805 15.148 -7.962 1.00 0.00 N ATOM 520 CA LYS A 33 -4.552 15.579 -8.581 1.00 0.00 C ATOM 521 C LYS A 33 -4.736 16.219 -9.958 1.00 0.00 C ATOM 522 O LYS A 33 -3.997 17.132 -10.328 1.00 0.00 O ATOM 523 CB LYS A 33 -3.673 14.335 -8.701 1.00 0.00 C ATOM 524 CG LYS A 33 -3.317 13.755 -7.321 1.00 0.00 C ATOM 525 CD LYS A 33 -2.060 14.413 -6.728 1.00 0.00 C ATOM 526 CE LYS A 33 -1.639 13.643 -5.476 1.00 0.00 C ATOM 527 NZ LYS A 33 -2.333 14.127 -4.247 1.00 0.00 N ATOM 0 H LYS A 33 -6.153 14.252 -8.303 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.102 16.352 -7.959 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.191 13.579 -9.291 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.758 14.586 -9.237 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.156 13.897 -6.640 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.157 12.680 -7.409 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.253 14.411 -7.460 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.262 15.455 -6.479 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.852 12.583 -5.616 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.561 13.736 -5.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.304 13.386 -3.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -1.857 14.981 -3.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -3.323 14.352 -4.473 1.00 0.00 H new ATOM 541 N GLU A 34 -5.758 15.776 -10.686 1.00 0.00 N ATOM 542 CA GLU A 34 -6.000 16.057 -12.094 1.00 0.00 C ATOM 543 C GLU A 34 -7.252 16.889 -12.334 1.00 0.00 C ATOM 544 O GLU A 34 -7.337 17.605 -13.334 1.00 0.00 O ATOM 545 CB GLU A 34 -6.133 14.703 -12.822 1.00 0.00 C ATOM 546 CG GLU A 34 -4.891 13.812 -12.694 1.00 0.00 C ATOM 547 CD GLU A 34 -3.580 14.583 -12.875 1.00 0.00 C ATOM 548 OE1 GLU A 34 -3.367 15.191 -13.946 1.00 0.00 O ATOM 549 OE2 GLU A 34 -2.764 14.598 -11.932 1.00 0.00 O ATOM 0 H GLU A 34 -6.479 15.177 -10.284 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.165 16.646 -12.474 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.996 14.169 -12.423 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.331 14.886 -13.878 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.893 13.334 -11.714 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.944 13.016 -13.437 1.00 0.00 H new ATOM 556 N GLY A 35 -8.231 16.798 -11.437 1.00 0.00 N ATOM 557 CA GLY A 35 -9.437 17.605 -11.486 1.00 0.00 C ATOM 558 C GLY A 35 -10.460 17.004 -12.440 1.00 0.00 C ATOM 559 O GLY A 35 -11.241 17.740 -13.040 1.00 0.00 O ATOM 0 H GLY A 35 -8.204 16.152 -10.648 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -9.868 17.682 -10.488 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.188 18.617 -11.805 1.00 0.00 H new ATOM 563 N ILE A 36 -10.441 15.673 -12.606 1.00 0.00 N ATOM 564 CA ILE A 36 -11.353 14.967 -13.489 1.00 0.00 C ATOM 565 C ILE A 36 -12.201 14.125 -12.555 1.00 0.00 C ATOM 566 O ILE A 36 -11.615 13.359 -11.794 1.00 0.00 O ATOM 567 CB ILE A 36 -10.576 14.061 -14.453 1.00 0.00 C ATOM 568 CG1 ILE A 36 -9.578 14.842 -15.321 1.00 0.00 C ATOM 569 CG2 ILE A 36 -11.558 13.309 -15.361 1.00 0.00 C ATOM 570 CD1 ILE A 36 -8.519 13.876 -15.823 1.00 0.00 C ATOM 0 H ILE A 36 -9.784 15.061 -12.123 1.00 0.00 H new ATOM 0 HA ILE A 36 -11.945 15.646 -14.102 1.00 0.00 H new ATOM 0 HB ILE A 36 -10.004 13.360 -13.845 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -10.092 15.311 -16.160 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -9.117 15.642 -14.742 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -11.003 12.667 -16.044 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -12.224 12.699 -14.751 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -12.146 14.026 -15.934 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -7.801 14.413 -16.442 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -8.003 13.428 -14.974 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.992 13.092 -16.414 1.00 0.00 H new ATOM 582 N PRO A 37 -13.535 14.195 -12.605 1.00 0.00 N ATOM 583 CA PRO A 37 -14.387 13.356 -11.780 1.00 0.00 C ATOM 584 C PRO A 37 -14.129 11.874 -12.057 1.00 0.00 C ATOM 585 O PRO A 37 -13.801 11.518 -13.188 1.00 0.00 O ATOM 586 CB PRO A 37 -15.826 13.785 -12.076 1.00 0.00 C ATOM 587 CG PRO A 37 -15.723 14.991 -13.012 1.00 0.00 C ATOM 588 CD PRO A 37 -14.303 14.961 -13.562 1.00 0.00 C ATOM 0 HA PRO A 37 -14.178 13.481 -10.718 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -16.386 12.975 -12.543 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -16.351 14.048 -11.158 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.456 14.927 -13.816 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.917 15.921 -12.477 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -14.274 14.499 -14.549 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -13.902 15.969 -13.670 1.00 0.00 H new ATOM 596 N PRO A 38 -14.295 10.982 -11.066 1.00 0.00 N ATOM 597 CA PRO A 38 -14.049 9.558 -11.272 1.00 0.00 C ATOM 598 C PRO A 38 -14.952 8.974 -12.342 1.00 0.00 C ATOM 599 O PRO A 38 -14.514 8.122 -13.115 1.00 0.00 O ATOM 600 CB PRO A 38 -14.322 8.902 -9.924 1.00 0.00 C ATOM 601 CG PRO A 38 -15.185 9.893 -9.147 1.00 0.00 C ATOM 602 CD PRO A 38 -14.729 11.244 -9.696 1.00 0.00 C ATOM 0 HA PRO A 38 -13.030 9.385 -11.618 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -14.837 7.950 -10.050 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -13.392 8.694 -9.395 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -16.248 9.725 -9.319 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -15.020 9.817 -8.072 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -15.541 11.971 -9.674 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -13.916 11.656 -9.099 1.00 0.00 H new ATOM 610 N ASP A 39 -16.176 9.484 -12.432 1.00 0.00 N ATOM 611 CA ASP A 39 -17.150 8.978 -13.391 1.00 0.00 C ATOM 612 C ASP A 39 -16.712 9.226 -14.835 1.00 0.00 C ATOM 613 O ASP A 39 -17.146 8.507 -15.733 1.00 0.00 O ATOM 614 CB ASP A 39 -18.514 9.612 -13.104 1.00 0.00 C ATOM 615 CG ASP A 39 -19.592 9.129 -14.087 1.00 0.00 C ATOM 616 OD1 ASP A 39 -20.123 8.006 -13.911 1.00 0.00 O ATOM 617 OD2 ASP A 39 -19.928 9.878 -15.033 1.00 0.00 O ATOM 0 H ASP A 39 -16.517 10.249 -11.850 1.00 0.00 H new ATOM 0 HA ASP A 39 -17.225 7.897 -13.275 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -18.818 9.371 -12.085 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -18.429 10.697 -13.164 1.00 0.00 H new ATOM 622 N GLN A 40 -15.805 10.184 -15.061 1.00 0.00 N ATOM 623 CA GLN A 40 -15.297 10.517 -16.397 1.00 0.00 C ATOM 624 C GLN A 40 -13.966 9.823 -16.681 1.00 0.00 C ATOM 625 O GLN A 40 -13.527 9.803 -17.830 1.00 0.00 O ATOM 626 CB GLN A 40 -15.189 12.053 -16.520 1.00 0.00 C ATOM 627 CG GLN A 40 -14.772 12.591 -17.909 1.00 0.00 C ATOM 628 CD GLN A 40 -15.754 12.251 -19.032 1.00 0.00 C ATOM 629 OE1 GLN A 40 -15.546 11.347 -19.840 1.00 0.00 O ATOM 630 NE2 GLN A 40 -16.857 12.975 -19.103 1.00 0.00 N ATOM 0 H GLN A 40 -15.401 10.753 -14.317 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.993 10.151 -17.151 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -16.153 12.488 -16.258 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -14.468 12.408 -15.783 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -14.665 13.674 -17.850 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -13.792 12.188 -18.164 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -17.021 13.722 -18.429 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -17.545 12.786 -19.832 1.00 0.00 H new ATOM 639 N GLN A 41 -13.290 9.255 -15.681 1.00 0.00 N ATOM 640 CA GLN A 41 -12.022 8.581 -15.922 1.00 0.00 C ATOM 641 C GLN A 41 -12.292 7.193 -16.474 1.00 0.00 C ATOM 642 O GLN A 41 -13.243 6.524 -16.088 1.00 0.00 O ATOM 643 CB GLN A 41 -11.234 8.473 -14.607 1.00 0.00 C ATOM 644 CG GLN A 41 -10.631 9.815 -14.158 1.00 0.00 C ATOM 645 CD GLN A 41 -10.229 9.755 -12.701 1.00 0.00 C ATOM 646 OE1 GLN A 41 -9.569 8.810 -12.304 1.00 0.00 O ATOM 647 NE2 GLN A 41 -10.643 10.686 -11.858 1.00 0.00 N ATOM 0 H GLN A 41 -13.598 9.250 -14.709 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.435 9.152 -16.642 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -11.893 8.097 -13.824 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -10.433 7.743 -14.728 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.762 10.053 -14.771 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.356 10.615 -14.308 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.195 11.473 -12.199 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -10.411 10.617 -10.867 1.00 0.00 H new ATOM 656 N ARG A 42 -11.358 6.738 -17.296 1.00 0.00 N ATOM 657 CA ARG A 42 -11.290 5.397 -17.851 1.00 0.00 C ATOM 658 C ARG A 42 -9.887 4.974 -17.493 1.00 0.00 C ATOM 659 O ARG A 42 -8.939 5.444 -18.101 1.00 0.00 O ATOM 660 CB ARG A 42 -11.579 5.515 -19.351 1.00 0.00 C ATOM 661 CG ARG A 42 -11.673 4.189 -20.111 1.00 0.00 C ATOM 662 CD ARG A 42 -12.062 4.487 -21.570 1.00 0.00 C ATOM 663 NE ARG A 42 -12.481 3.288 -22.321 1.00 0.00 N ATOM 664 CZ ARG A 42 -13.162 3.262 -23.481 1.00 0.00 C ATOM 665 NH1 ARG A 42 -13.494 4.385 -24.115 1.00 0.00 N ATOM 666 NH2 ARG A 42 -13.511 2.092 -23.997 1.00 0.00 N ATOM 0 H ARG A 42 -10.587 7.327 -17.610 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.002 4.659 -17.482 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.517 6.055 -19.481 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -10.796 6.121 -19.808 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.719 3.663 -20.074 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -12.414 3.538 -19.647 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -12.873 5.215 -21.581 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.214 4.947 -22.078 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.228 2.385 -21.919 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.232 5.289 -23.722 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.011 4.341 -24.993 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.263 1.228 -23.515 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.028 2.056 -24.876 1.00 0.00 H new ATOM 680 N LEU A 43 -9.728 4.264 -16.387 1.00 0.00 N ATOM 681 CA LEU A 43 -8.398 3.974 -15.864 1.00 0.00 C ATOM 682 C LEU A 43 -7.932 2.773 -16.642 1.00 0.00 C ATOM 683 O LEU A 43 -8.694 1.826 -16.794 1.00 0.00 O ATOM 684 CB LEU A 43 -8.478 3.676 -14.354 1.00 0.00 C ATOM 685 CG LEU A 43 -7.372 4.347 -13.528 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.405 5.886 -13.627 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.611 3.961 -12.071 1.00 0.00 C ATOM 0 H LEU A 43 -10.496 3.880 -15.836 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.708 4.810 -15.974 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.448 4.005 -13.980 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.427 2.598 -14.203 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.405 4.016 -13.907 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.601 6.307 -13.023 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.274 6.187 -14.666 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.364 6.254 -13.261 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.845 4.417 -11.443 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.594 4.313 -11.758 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.565 2.877 -11.970 1.00 0.00 H new ATOM 699 N ILE A 44 -6.713 2.807 -17.147 1.00 0.00 N ATOM 700 CA ILE A 44 -6.152 1.728 -17.947 1.00 0.00 C ATOM 701 C ILE A 44 -4.933 1.229 -17.208 1.00 0.00 C ATOM 702 O ILE A 44 -4.285 1.971 -16.467 1.00 0.00 O ATOM 703 CB ILE A 44 -5.913 2.222 -19.402 1.00 0.00 C ATOM 704 CG1 ILE A 44 -7.322 2.409 -20.022 1.00 0.00 C ATOM 705 CG2 ILE A 44 -5.024 1.345 -20.297 1.00 0.00 C ATOM 706 CD1 ILE A 44 -7.415 2.595 -21.543 1.00 0.00 C ATOM 0 H ILE A 44 -6.076 3.592 -17.013 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.823 0.878 -18.067 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.333 3.143 -19.346 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.924 1.541 -19.753 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.784 3.276 -19.550 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.938 1.801 -21.283 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.033 1.256 -19.851 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.469 0.354 -20.393 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -8.459 2.714 -21.832 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -6.854 3.483 -21.836 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -6.997 1.721 -22.043 1.00 0.00 H new ATOM 718 N PHE A 45 -4.634 -0.045 -17.408 1.00 0.00 N ATOM 719 CA PHE A 45 -3.460 -0.662 -16.842 1.00 0.00 C ATOM 720 C PHE A 45 -2.989 -1.709 -17.829 1.00 0.00 C ATOM 721 O PHE A 45 -3.714 -2.668 -18.069 1.00 0.00 O ATOM 722 CB PHE A 45 -3.830 -1.301 -15.504 1.00 0.00 C ATOM 723 CG PHE A 45 -2.733 -2.193 -14.980 1.00 0.00 C ATOM 724 CD1 PHE A 45 -1.486 -1.624 -14.680 1.00 0.00 C ATOM 725 CD2 PHE A 45 -2.915 -3.582 -14.898 1.00 0.00 C ATOM 726 CE1 PHE A 45 -0.434 -2.438 -14.230 1.00 0.00 C ATOM 727 CE2 PHE A 45 -1.871 -4.392 -14.432 1.00 0.00 C ATOM 728 CZ PHE A 45 -0.646 -3.819 -14.051 1.00 0.00 C ATOM 0 H PHE A 45 -5.205 -0.676 -17.970 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.667 0.064 -16.662 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -4.040 -0.519 -14.775 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.745 -1.882 -15.621 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.335 -0.561 -14.795 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.855 -4.024 -15.193 1.00 0.00 H new ATOM 0 HE1 PHE A 45 0.534 -2.007 -14.022 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.008 -5.461 -14.365 1.00 0.00 H new ATOM 0 HZ PHE A 45 0.130 -4.435 -13.622 1.00 0.00 H new ATOM 738 N ALA A 46 -1.815 -1.505 -18.423 1.00 0.00 N ATOM 739 CA ALA A 46 -1.164 -2.472 -19.320 1.00 0.00 C ATOM 740 C ALA A 46 -2.060 -2.956 -20.480 1.00 0.00 C ATOM 741 O ALA A 46 -1.912 -4.068 -20.989 1.00 0.00 O ATOM 742 CB ALA A 46 -0.622 -3.624 -18.464 1.00 0.00 C ATOM 0 H ALA A 46 -1.275 -0.649 -18.295 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.341 -1.972 -19.831 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.133 -4.356 -19.107 1.00 0.00 H new ATOM 0 HB2 ALA A 46 0.098 -3.235 -17.744 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.445 -4.100 -17.932 1.00 0.00 H new ATOM 748 N GLY A 47 -3.016 -2.111 -20.879 1.00 0.00 N ATOM 749 CA GLY A 47 -3.975 -2.366 -21.954 1.00 0.00 C ATOM 750 C GLY A 47 -5.345 -2.834 -21.464 1.00 0.00 C ATOM 751 O GLY A 47 -6.278 -2.903 -22.263 1.00 0.00 O ATOM 0 H GLY A 47 -3.146 -1.197 -20.445 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -4.101 -1.455 -22.539 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -3.563 -3.120 -22.624 1.00 0.00 H new ATOM 755 N LYS A 48 -5.502 -3.122 -20.168 1.00 0.00 N ATOM 756 CA LYS A 48 -6.815 -3.358 -19.571 1.00 0.00 C ATOM 757 C LYS A 48 -7.415 -2.011 -19.255 1.00 0.00 C ATOM 758 O LYS A 48 -6.707 -1.023 -19.158 1.00 0.00 O ATOM 759 CB LYS A 48 -6.711 -4.169 -18.261 1.00 0.00 C ATOM 760 CG LYS A 48 -6.196 -5.598 -18.423 1.00 0.00 C ATOM 761 CD LYS A 48 -6.928 -6.440 -19.482 1.00 0.00 C ATOM 762 CE LYS A 48 -6.423 -7.892 -19.437 1.00 0.00 C ATOM 763 NZ LYS A 48 -7.091 -8.757 -20.448 1.00 0.00 N ATOM 0 H LYS A 48 -4.727 -3.197 -19.509 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.427 -3.928 -20.270 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.052 -3.638 -17.574 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.696 -4.205 -17.795 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.138 -5.559 -18.680 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.272 -6.106 -17.462 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.003 -6.414 -19.301 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -6.761 -6.018 -20.473 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.346 -7.905 -19.607 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.594 -8.303 -18.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.717 -9.725 -20.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.116 -8.768 -20.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -6.907 -8.383 -21.401 1.00 0.00 H new ATOM 777 N GLN A 49 -8.697 -2.004 -18.965 1.00 0.00 N ATOM 778 CA GLN A 49 -9.464 -0.886 -18.444 1.00 0.00 C ATOM 779 C GLN A 49 -10.037 -1.385 -17.120 1.00 0.00 C ATOM 780 O GLN A 49 -10.436 -2.551 -17.028 1.00 0.00 O ATOM 781 CB GLN A 49 -10.602 -0.557 -19.425 1.00 0.00 C ATOM 782 CG GLN A 49 -10.088 0.092 -20.716 1.00 0.00 C ATOM 783 CD GLN A 49 -11.019 -0.159 -21.901 1.00 0.00 C ATOM 784 OE1 GLN A 49 -12.026 0.524 -22.062 1.00 0.00 O ATOM 785 NE2 GLN A 49 -10.711 -1.118 -22.760 1.00 0.00 N ATOM 0 H GLN A 49 -9.274 -2.835 -19.095 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.865 0.015 -18.312 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -11.143 -1.471 -19.671 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -11.313 0.113 -18.942 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -9.980 1.166 -20.562 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.097 -0.298 -20.947 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -9.872 -1.680 -22.617 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.313 -1.295 -23.564 1.00 0.00 H new ATOM 794 N LEU A 50 -10.049 -0.524 -16.106 1.00 0.00 N ATOM 795 CA LEU A 50 -10.390 -0.925 -14.740 1.00 0.00 C ATOM 796 C LEU A 50 -11.705 -0.260 -14.365 1.00 0.00 C ATOM 797 O LEU A 50 -11.893 0.914 -14.694 1.00 0.00 O ATOM 798 CB LEU A 50 -9.265 -0.576 -13.741 1.00 0.00 C ATOM 799 CG LEU A 50 -7.806 -0.623 -14.235 1.00 0.00 C ATOM 800 CD1 LEU A 50 -6.856 -0.350 -13.064 1.00 0.00 C ATOM 801 CD2 LEU A 50 -7.411 -1.925 -14.944 1.00 0.00 C ATOM 0 H LEU A 50 -9.824 0.466 -16.205 1.00 0.00 H new ATOM 0 HA LEU A 50 -10.502 -2.008 -14.694 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -9.456 0.429 -13.364 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -9.351 -1.256 -12.894 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.722 0.156 -14.993 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.825 -0.384 -13.416 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -7.065 0.636 -12.648 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -7.001 -1.107 -12.294 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.368 -1.867 -15.256 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.539 -2.765 -14.261 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -8.044 -2.069 -15.819 1.00 0.00 H new ATOM 813 N GLU A 51 -12.595 -0.971 -13.661 1.00 0.00 N ATOM 814 CA GLU A 51 -13.901 -0.440 -13.282 1.00 0.00 C ATOM 815 C GLU A 51 -13.900 -0.114 -11.792 1.00 0.00 C ATOM 816 O GLU A 51 -13.134 -0.684 -11.020 1.00 0.00 O ATOM 817 CB GLU A 51 -15.050 -1.351 -13.756 1.00 0.00 C ATOM 818 CG GLU A 51 -15.179 -2.677 -13.013 1.00 0.00 C ATOM 819 CD GLU A 51 -16.331 -3.535 -13.574 1.00 0.00 C ATOM 820 OE1 GLU A 51 -16.124 -4.266 -14.573 1.00 0.00 O ATOM 821 OE2 GLU A 51 -17.453 -3.491 -13.014 1.00 0.00 O ATOM 0 H GLU A 51 -12.427 -1.925 -13.342 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.091 0.499 -13.801 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -15.988 -0.805 -13.658 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -14.912 -1.560 -14.817 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -14.243 -3.230 -13.090 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -15.350 -2.486 -11.954 1.00 0.00 H new ATOM 828 N ASP A 52 -14.761 0.820 -11.392 1.00 0.00 N ATOM 829 CA ASP A 52 -14.789 1.458 -10.073 1.00 0.00 C ATOM 830 C ASP A 52 -14.863 0.444 -8.938 1.00 0.00 C ATOM 831 O ASP A 52 -14.193 0.610 -7.918 1.00 0.00 O ATOM 832 CB ASP A 52 -15.977 2.431 -9.996 1.00 0.00 C ATOM 833 CG ASP A 52 -15.660 3.768 -10.674 1.00 0.00 C ATOM 834 OD1 ASP A 52 -15.561 3.786 -11.923 1.00 0.00 O ATOM 835 OD2 ASP A 52 -15.471 4.788 -9.972 1.00 0.00 O ATOM 0 H ASP A 52 -15.495 1.171 -12.008 1.00 0.00 H new ATOM 0 HA ASP A 52 -13.853 2.004 -9.950 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.848 1.980 -10.471 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.238 2.605 -8.952 1.00 0.00 H new ATOM 840 N GLY A 53 -15.625 -0.631 -9.151 1.00 0.00 N ATOM 841 CA GLY A 53 -15.901 -1.647 -8.145 1.00 0.00 C ATOM 842 C GLY A 53 -14.780 -2.664 -7.957 1.00 0.00 C ATOM 843 O GLY A 53 -14.994 -3.678 -7.290 1.00 0.00 O ATOM 0 H GLY A 53 -16.074 -0.819 -10.047 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -16.093 -1.155 -7.192 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -16.813 -2.176 -8.420 1.00 0.00 H new ATOM 847 N ARG A 54 -13.601 -2.448 -8.549 1.00 0.00 N ATOM 848 CA ARG A 54 -12.489 -3.399 -8.550 1.00 0.00 C ATOM 849 C ARG A 54 -11.314 -2.787 -7.828 1.00 0.00 C ATOM 850 O ARG A 54 -11.382 -1.624 -7.446 1.00 0.00 O ATOM 851 CB ARG A 54 -12.155 -3.750 -10.000 1.00 0.00 C ATOM 852 CG ARG A 54 -13.281 -4.473 -10.759 1.00 0.00 C ATOM 853 CD ARG A 54 -13.779 -5.767 -10.120 1.00 0.00 C ATOM 854 NE ARG A 54 -14.728 -6.473 -11.002 1.00 0.00 N ATOM 855 CZ ARG A 54 -14.420 -7.314 -11.999 1.00 0.00 C ATOM 856 NH1 ARG A 54 -13.154 -7.612 -12.281 1.00 0.00 N ATOM 857 NH2 ARG A 54 -15.395 -7.865 -12.719 1.00 0.00 N ATOM 0 H ARG A 54 -13.390 -1.586 -9.052 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.753 -4.318 -8.028 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -11.905 -2.833 -10.534 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.265 -4.379 -10.012 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -14.124 -3.790 -10.860 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -12.931 -4.697 -11.766 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -12.931 -6.416 -9.901 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -14.262 -5.542 -9.169 1.00 0.00 H new ATOM 0 HE ARG A 54 -15.720 -6.304 -10.836 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -12.399 -7.198 -11.734 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -12.939 -8.254 -13.044 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -16.369 -7.646 -12.510 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -15.168 -8.506 -13.479 1.00 0.00 H new ATOM 871 N THR A 55 -10.223 -3.517 -7.646 1.00 0.00 N ATOM 872 CA THR A 55 -9.094 -3.092 -6.833 1.00 0.00 C ATOM 873 C THR A 55 -7.815 -3.284 -7.609 1.00 0.00 C ATOM 874 O THR A 55 -7.786 -3.948 -8.643 1.00 0.00 O ATOM 875 CB THR A 55 -9.062 -3.916 -5.541 1.00 0.00 C ATOM 876 OG1 THR A 55 -9.163 -5.290 -5.870 1.00 0.00 O ATOM 877 CG2 THR A 55 -10.197 -3.551 -4.589 1.00 0.00 C ATOM 0 H THR A 55 -10.096 -4.437 -8.067 1.00 0.00 H new ATOM 0 HA THR A 55 -9.196 -2.037 -6.579 1.00 0.00 H new ATOM 0 HB THR A 55 -8.122 -3.699 -5.034 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.142 -5.825 -5.049 1.00 0.00 H new ATOM 0 HG21 THR A 55 -10.129 -4.163 -3.690 1.00 0.00 H new ATOM 0 HG22 THR A 55 -10.120 -2.498 -4.318 1.00 0.00 H new ATOM 0 HG23 THR A 55 -11.154 -3.731 -5.078 1.00 0.00 H new ATOM 885 N LEU A 56 -6.732 -2.724 -7.081 1.00 0.00 N ATOM 886 CA LEU A 56 -5.433 -2.868 -7.734 1.00 0.00 C ATOM 887 C LEU A 56 -5.031 -4.347 -7.848 1.00 0.00 C ATOM 888 O LEU A 56 -4.648 -4.813 -8.925 1.00 0.00 O ATOM 889 CB LEU A 56 -4.404 -1.999 -6.980 1.00 0.00 C ATOM 890 CG LEU A 56 -4.831 -0.525 -6.877 1.00 0.00 C ATOM 891 CD1 LEU A 56 -3.746 0.314 -6.223 1.00 0.00 C ATOM 892 CD2 LEU A 56 -5.139 0.060 -8.262 1.00 0.00 C ATOM 0 H LEU A 56 -6.724 -2.177 -6.220 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.480 -2.509 -8.762 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.260 -2.402 -5.977 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.442 -2.059 -7.489 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.731 -0.497 -6.263 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.075 1.352 -6.163 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.550 -0.063 -5.219 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.834 0.256 -6.817 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.438 1.103 -8.158 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.250 -0.002 -8.889 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.948 -0.505 -8.724 1.00 0.00 H new ATOM 904 N SER A 57 -5.241 -5.112 -6.785 1.00 0.00 N ATOM 905 CA SER A 57 -5.023 -6.551 -6.755 1.00 0.00 C ATOM 906 C SER A 57 -5.946 -7.300 -7.720 1.00 0.00 C ATOM 907 O SER A 57 -5.525 -8.335 -8.241 1.00 0.00 O ATOM 908 CB SER A 57 -5.236 -7.096 -5.343 1.00 0.00 C ATOM 909 OG SER A 57 -4.045 -6.958 -4.594 1.00 0.00 O ATOM 0 H SER A 57 -5.576 -4.739 -5.897 1.00 0.00 H new ATOM 0 HA SER A 57 -3.993 -6.716 -7.070 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.049 -6.559 -4.854 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.529 -8.145 -5.388 1.00 0.00 H new ATOM 0 HG SER A 57 -4.185 -7.307 -3.689 1.00 0.00 H new ATOM 915 N ASP A 58 -7.158 -6.803 -8.019 1.00 0.00 N ATOM 916 CA ASP A 58 -8.037 -7.461 -8.988 1.00 0.00 C ATOM 917 C ASP A 58 -7.412 -7.457 -10.384 1.00 0.00 C ATOM 918 O ASP A 58 -7.685 -8.340 -11.203 1.00 0.00 O ATOM 919 CB ASP A 58 -9.398 -6.775 -9.028 1.00 0.00 C ATOM 920 CG ASP A 58 -10.369 -7.557 -9.925 1.00 0.00 C ATOM 921 OD1 ASP A 58 -10.774 -8.680 -9.537 1.00 0.00 O ATOM 922 OD2 ASP A 58 -10.791 -7.026 -10.978 1.00 0.00 O ATOM 0 H ASP A 58 -7.545 -5.955 -7.605 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.170 -8.495 -8.670 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -9.805 -6.702 -8.019 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -9.288 -5.757 -9.402 1.00 0.00 H new ATOM 927 N TYR A 59 -6.500 -6.505 -10.615 1.00 0.00 N ATOM 928 CA TYR A 59 -5.744 -6.347 -11.849 1.00 0.00 C ATOM 929 C TYR A 59 -4.263 -6.705 -11.674 1.00 0.00 C ATOM 930 O TYR A 59 -3.469 -6.460 -12.577 1.00 0.00 O ATOM 931 CB TYR A 59 -5.970 -4.929 -12.379 1.00 0.00 C ATOM 932 CG TYR A 59 -7.407 -4.690 -12.790 1.00 0.00 C ATOM 933 CD1 TYR A 59 -7.894 -5.274 -13.975 1.00 0.00 C ATOM 934 CD2 TYR A 59 -8.268 -3.933 -11.970 1.00 0.00 C ATOM 935 CE1 TYR A 59 -9.239 -5.111 -14.347 1.00 0.00 C ATOM 936 CE2 TYR A 59 -9.613 -3.790 -12.328 1.00 0.00 C ATOM 937 CZ TYR A 59 -10.116 -4.378 -13.511 1.00 0.00 C ATOM 938 OH TYR A 59 -11.424 -4.184 -13.852 1.00 0.00 O ATOM 0 H TYR A 59 -6.264 -5.800 -9.917 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.106 -7.055 -12.595 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -5.690 -4.208 -11.611 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -5.316 -4.755 -13.234 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -7.230 -5.851 -14.602 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -7.892 -3.467 -11.071 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.603 -5.543 -15.267 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -10.276 -3.223 -11.692 1.00 0.00 H new ATOM 0 HH TYR A 59 -11.909 -5.033 -13.787 1.00 0.00 H new ATOM 948 N ASN A 60 -3.870 -7.305 -10.543 1.00 0.00 N ATOM 949 CA ASN A 60 -2.508 -7.741 -10.198 1.00 0.00 C ATOM 950 C ASN A 60 -1.489 -6.601 -10.084 1.00 0.00 C ATOM 951 O ASN A 60 -0.287 -6.841 -9.962 1.00 0.00 O ATOM 952 CB ASN A 60 -2.038 -8.934 -11.063 1.00 0.00 C ATOM 953 CG ASN A 60 -0.879 -8.667 -12.033 1.00 0.00 C ATOM 954 OD1 ASN A 60 0.186 -9.274 -11.924 1.00 0.00 O ATOM 955 ND2 ASN A 60 -1.064 -7.804 -13.020 1.00 0.00 N ATOM 0 H ASN A 60 -4.535 -7.512 -9.798 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.568 -8.122 -9.178 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -1.743 -9.743 -10.395 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -2.890 -9.292 -11.641 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -0.320 -7.638 -13.698 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -1.950 -7.306 -13.102 1.00 0.00 H new ATOM 962 N ILE A 61 -1.967 -5.361 -10.065 1.00 0.00 N ATOM 963 CA ILE A 61 -1.166 -4.189 -9.756 1.00 0.00 C ATOM 964 C ILE A 61 -0.731 -4.352 -8.306 1.00 0.00 C ATOM 965 O ILE A 61 -1.534 -4.753 -7.463 1.00 0.00 O ATOM 966 CB ILE A 61 -2.054 -2.948 -9.932 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.569 -2.805 -11.374 1.00 0.00 C ATOM 968 CG2 ILE A 61 -1.341 -1.649 -9.508 1.00 0.00 C ATOM 969 CD1 ILE A 61 -3.908 -2.084 -11.395 1.00 0.00 C ATOM 0 H ILE A 61 -2.942 -5.142 -10.269 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.295 -4.080 -10.402 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.906 -3.102 -9.270 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.843 -2.254 -11.972 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -2.673 -3.790 -11.828 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.012 -0.802 -9.652 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.060 -1.715 -8.457 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.446 -1.510 -10.115 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -4.256 -1.993 -12.424 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -4.636 -2.651 -10.815 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -3.793 -1.091 -10.961 1.00 0.00 H new ATOM 981 N GLN A 62 0.521 -4.024 -8.005 1.00 0.00 N ATOM 982 CA GLN A 62 1.085 -4.042 -6.661 1.00 0.00 C ATOM 983 C GLN A 62 1.703 -2.664 -6.411 1.00 0.00 C ATOM 984 O GLN A 62 1.411 -1.707 -7.126 1.00 0.00 O ATOM 985 CB GLN A 62 2.093 -5.206 -6.536 1.00 0.00 C ATOM 986 CG GLN A 62 1.449 -6.566 -6.827 1.00 0.00 C ATOM 987 CD GLN A 62 0.533 -7.087 -5.712 1.00 0.00 C ATOM 988 OE1 GLN A 62 0.989 -7.671 -4.731 1.00 0.00 O ATOM 989 NE2 GLN A 62 -0.777 -6.907 -5.832 1.00 0.00 N ATOM 0 H GLN A 62 1.193 -3.729 -8.713 1.00 0.00 H new ATOM 0 HA GLN A 62 0.330 -4.222 -5.896 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.920 -5.043 -7.227 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.514 -5.213 -5.530 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.872 -6.491 -7.749 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.238 -7.297 -7.003 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -1.153 -6.422 -6.647 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -1.408 -7.254 -5.109 1.00 0.00 H new ATOM 998 N LYS A 63 2.529 -2.521 -5.378 1.00 0.00 N ATOM 999 CA LYS A 63 3.309 -1.321 -5.141 1.00 0.00 C ATOM 1000 C LYS A 63 4.237 -1.043 -6.308 1.00 0.00 C ATOM 1001 O LYS A 63 4.565 -1.928 -7.095 1.00 0.00 O ATOM 1002 CB LYS A 63 4.099 -1.471 -3.830 1.00 0.00 C ATOM 1003 CG LYS A 63 5.309 -2.409 -3.897 1.00 0.00 C ATOM 1004 CD LYS A 63 5.887 -2.626 -2.488 1.00 0.00 C ATOM 1005 CE LYS A 63 7.266 -3.282 -2.596 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.841 -3.612 -1.266 1.00 0.00 N ATOM 0 H LYS A 63 2.674 -3.247 -4.676 1.00 0.00 H new ATOM 0 HA LYS A 63 2.634 -0.470 -5.049 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.442 -0.485 -3.517 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.422 -1.833 -3.057 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.014 -3.365 -4.329 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.072 -1.985 -4.550 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.966 -1.673 -1.965 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.218 -3.256 -1.902 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.187 -4.192 -3.191 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.944 -2.613 -3.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 8.774 -4.054 -1.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.942 -2.742 -0.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.209 -4.272 -0.769 1.00 0.00 H new ATOM 1020 N GLU A 64 4.678 0.211 -6.332 1.00 0.00 N ATOM 1021 CA GLU A 64 5.597 0.802 -7.290 1.00 0.00 C ATOM 1022 C GLU A 64 5.258 0.324 -8.707 1.00 0.00 C ATOM 1023 O GLU A 64 6.107 -0.139 -9.472 1.00 0.00 O ATOM 1024 CB GLU A 64 7.062 0.685 -6.806 1.00 0.00 C ATOM 1025 CG GLU A 64 7.760 -0.670 -6.908 1.00 0.00 C ATOM 1026 CD GLU A 64 9.064 -0.688 -6.086 1.00 0.00 C ATOM 1027 OE1 GLU A 64 9.022 -1.050 -4.886 1.00 0.00 O ATOM 1028 OE2 GLU A 64 10.141 -0.355 -6.638 1.00 0.00 O ATOM 0 H GLU A 64 4.378 0.887 -5.630 1.00 0.00 H new ATOM 0 HA GLU A 64 5.470 1.883 -7.355 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.655 1.406 -7.369 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.091 0.995 -5.761 1.00 0.00 H new ATOM 0 HG2 GLU A 64 7.092 -1.454 -6.552 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.982 -0.890 -7.952 1.00 0.00 H new ATOM 1035 N SER A 65 3.959 0.419 -9.023 1.00 0.00 N ATOM 1036 CA SER A 65 3.427 -0.074 -10.302 1.00 0.00 C ATOM 1037 C SER A 65 2.749 1.074 -11.024 1.00 0.00 C ATOM 1038 O SER A 65 2.276 2.007 -10.378 1.00 0.00 O ATOM 1039 CB SER A 65 2.469 -1.250 -10.075 1.00 0.00 C ATOM 1040 OG SER A 65 3.130 -2.393 -9.557 1.00 0.00 O ATOM 0 H SER A 65 3.256 0.833 -8.410 1.00 0.00 H new ATOM 0 HA SER A 65 4.241 -0.447 -10.923 1.00 0.00 H new ATOM 0 HB2 SER A 65 1.681 -0.946 -9.386 1.00 0.00 H new ATOM 0 HB3 SER A 65 1.986 -1.509 -11.017 1.00 0.00 H new ATOM 0 HG SER A 65 3.580 -2.159 -8.718 1.00 0.00 H new ATOM 1046 N THR A 66 2.697 1.012 -12.350 1.00 0.00 N ATOM 1047 CA THR A 66 2.271 2.125 -13.188 1.00 0.00 C ATOM 1048 C THR A 66 0.854 1.875 -13.696 1.00 0.00 C ATOM 1049 O THR A 66 0.475 0.746 -13.989 1.00 0.00 O ATOM 1050 CB THR A 66 3.278 2.339 -14.342 1.00 0.00 C ATOM 1051 OG1 THR A 66 4.597 2.346 -13.813 1.00 0.00 O ATOM 1052 CG2 THR A 66 3.053 3.653 -15.109 1.00 0.00 C ATOM 0 H THR A 66 2.952 0.178 -12.878 1.00 0.00 H new ATOM 0 HA THR A 66 2.254 3.044 -12.602 1.00 0.00 H new ATOM 0 HB THR A 66 3.130 1.520 -15.046 1.00 0.00 H new ATOM 0 HG1 THR A 66 5.240 2.480 -14.540 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.793 3.741 -15.905 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.053 3.655 -15.542 1.00 0.00 H new ATOM 0 HG23 THR A 66 3.154 4.496 -14.425 1.00 0.00 H new ATOM 1060 N LEU A 67 0.090 2.954 -13.826 1.00 0.00 N ATOM 1061 CA LEU A 67 -1.292 3.018 -14.278 1.00 0.00 C ATOM 1062 C LEU A 67 -1.435 4.083 -15.357 1.00 0.00 C ATOM 1063 O LEU A 67 -0.520 4.883 -15.533 1.00 0.00 O ATOM 1064 CB LEU A 67 -2.144 3.411 -13.059 1.00 0.00 C ATOM 1065 CG LEU A 67 -3.358 2.528 -12.863 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -2.906 1.142 -12.411 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.245 3.134 -11.783 1.00 0.00 C ATOM 0 H LEU A 67 0.452 3.880 -13.599 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.609 2.061 -14.692 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.524 3.368 -12.163 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.470 4.445 -13.172 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.910 2.450 -13.800 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.778 0.503 -12.269 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.256 0.706 -13.170 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.360 1.226 -11.471 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.122 2.503 -11.636 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.687 3.202 -10.849 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.562 4.131 -12.090 1.00 0.00 H new ATOM 1079 N HIS A 68 -2.605 4.186 -15.991 1.00 0.00 N ATOM 1080 CA HIS A 68 -2.824 5.177 -17.053 1.00 0.00 C ATOM 1081 C HIS A 68 -4.148 5.903 -16.867 1.00 0.00 C ATOM 1082 O HIS A 68 -5.176 5.255 -16.659 1.00 0.00 O ATOM 1083 CB HIS A 68 -2.803 4.506 -18.438 1.00 0.00 C ATOM 1084 CG HIS A 68 -1.442 4.370 -19.074 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -0.959 3.216 -19.693 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -0.558 5.390 -19.275 1.00 0.00 C ATOM 1087 CE1 HIS A 68 0.227 3.561 -20.227 1.00 0.00 C ATOM 1088 NE2 HIS A 68 0.502 4.848 -19.969 1.00 0.00 N ATOM 0 H HIS A 68 -3.414 3.599 -15.790 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.013 5.903 -16.990 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.243 3.513 -18.348 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.443 5.079 -19.109 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -1.411 2.302 -19.732 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.667 6.416 -18.955 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.868 2.895 -20.785 1.00 0.00 H new ATOM 1096 N LEU A 69 -4.136 7.237 -16.983 1.00 0.00 N ATOM 1097 CA LEU A 69 -5.360 8.046 -17.066 1.00 0.00 C ATOM 1098 C LEU A 69 -5.743 8.064 -18.532 1.00 0.00 C ATOM 1099 O LEU A 69 -4.978 8.563 -19.352 1.00 0.00 O ATOM 1100 CB LEU A 69 -5.135 9.498 -16.541 1.00 0.00 C ATOM 1101 CG LEU A 69 -5.869 10.684 -17.252 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -7.387 10.550 -17.120 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -5.476 12.033 -16.668 1.00 0.00 C ATOM 0 H LEU A 69 -3.278 7.787 -17.022 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.146 7.621 -16.442 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.422 9.516 -15.490 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.065 9.701 -16.583 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.569 10.637 -18.299 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.871 11.387 -17.623 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.711 9.615 -17.578 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.662 10.552 -16.065 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.010 12.826 -17.192 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.734 12.060 -15.609 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.402 12.181 -16.784 1.00 0.00 H new ATOM 1115 N VAL A 70 -6.938 7.580 -18.838 1.00 0.00 N ATOM 1116 CA VAL A 70 -7.592 7.700 -20.130 1.00 0.00 C ATOM 1117 C VAL A 70 -8.999 8.222 -19.805 1.00 0.00 C ATOM 1118 O VAL A 70 -9.424 8.210 -18.652 1.00 0.00 O ATOM 1119 CB VAL A 70 -7.458 6.331 -20.832 1.00 0.00 C ATOM 1120 CG1 VAL A 70 -8.240 6.255 -22.126 1.00 0.00 C ATOM 1121 CG2 VAL A 70 -5.977 6.006 -21.113 1.00 0.00 C ATOM 0 H VAL A 70 -7.503 7.069 -18.160 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.169 8.401 -20.850 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.878 5.595 -20.147 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.108 5.270 -22.574 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.298 6.422 -21.922 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -7.879 7.018 -22.815 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.905 5.037 -21.608 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.552 6.775 -21.757 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.427 5.975 -20.173 1.00 0.00 H new ATOM 1131 N LEU A 71 -9.726 8.746 -20.785 1.00 0.00 N ATOM 1132 CA LEU A 71 -11.024 9.376 -20.566 1.00 0.00 C ATOM 1133 C LEU A 71 -12.120 8.379 -20.943 1.00 0.00 C ATOM 1134 O LEU A 71 -11.922 7.550 -21.822 1.00 0.00 O ATOM 1135 CB LEU A 71 -11.069 10.639 -21.442 1.00 0.00 C ATOM 1136 CG LEU A 71 -12.298 11.526 -21.189 1.00 0.00 C ATOM 1137 CD1 LEU A 71 -11.922 12.689 -20.282 1.00 0.00 C ATOM 1138 CD2 LEU A 71 -12.890 12.049 -22.489 1.00 0.00 C ATOM 0 H LEU A 71 -9.430 8.746 -21.761 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.178 9.659 -19.525 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.167 11.225 -21.265 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.056 10.343 -22.491 1.00 0.00 H new ATOM 0 HG LEU A 71 -13.056 10.914 -20.701 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.799 13.313 -20.108 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.555 12.304 -19.330 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.142 13.284 -20.758 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.757 12.672 -22.269 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.142 12.641 -23.017 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.195 11.209 -23.113 1.00 0.00 H new ATOM 1150 N ARG A 72 -13.291 8.463 -20.314 1.00 0.00 N ATOM 1151 CA ARG A 72 -14.482 7.679 -20.688 1.00 0.00 C ATOM 1152 C ARG A 72 -15.054 8.109 -22.033 1.00 0.00 C ATOM 1153 O ARG A 72 -15.646 7.289 -22.724 1.00 0.00 O ATOM 1154 CB ARG A 72 -15.569 7.854 -19.610 1.00 0.00 C ATOM 1155 CG ARG A 72 -16.600 6.709 -19.582 1.00 0.00 C ATOM 1156 CD ARG A 72 -17.347 6.760 -18.248 1.00 0.00 C ATOM 1157 NE ARG A 72 -18.500 5.838 -18.189 1.00 0.00 N ATOM 1158 CZ ARG A 72 -19.374 5.797 -17.171 1.00 0.00 C ATOM 1159 NH1 ARG A 72 -19.213 6.616 -16.140 1.00 0.00 N ATOM 1160 NH2 ARG A 72 -20.403 4.957 -17.198 1.00 0.00 N ATOM 0 H ARG A 72 -13.448 9.083 -19.520 1.00 0.00 H new ATOM 0 HA ARG A 72 -14.175 6.636 -20.767 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.092 7.926 -18.633 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -16.090 8.796 -19.780 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -17.300 6.809 -20.412 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -16.101 5.747 -19.700 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -16.655 6.517 -17.442 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -17.695 7.778 -18.073 1.00 0.00 H new ATOM 0 HE ARG A 72 -18.640 5.195 -18.968 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -18.430 7.270 -16.125 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -19.872 6.592 -15.362 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -20.534 4.336 -17.997 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -21.062 4.933 -16.420 1.00 0.00 H new ATOM 1174 N LEU A 73 -14.862 9.385 -22.382 1.00 0.00 N ATOM 1175 CA LEU A 73 -15.541 10.046 -23.503 1.00 0.00 C ATOM 1176 C LEU A 73 -17.051 9.933 -23.206 1.00 0.00 C ATOM 1177 O LEU A 73 -17.830 9.622 -24.104 1.00 0.00 O ATOM 1178 CB LEU A 73 -15.161 9.500 -24.911 1.00 0.00 C ATOM 1179 CG LEU A 73 -13.706 9.453 -25.426 1.00 0.00 C ATOM 1180 CD1 LEU A 73 -13.029 10.770 -25.779 1.00 0.00 C ATOM 1181 CD2 LEU A 73 -12.764 8.592 -24.588 1.00 0.00 C ATOM 0 H LEU A 73 -14.218 10.000 -21.884 1.00 0.00 H new ATOM 0 HA LEU A 73 -15.218 11.085 -23.565 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -15.541 8.480 -24.961 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.727 10.087 -25.634 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.882 8.964 -26.384 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -12.014 10.576 -26.125 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.592 11.268 -26.568 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.996 11.410 -24.897 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.765 8.617 -25.023 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.727 8.979 -23.570 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.127 7.564 -24.573 1.00 0.00 H new ATOM 1193 N ARG A 74 -17.470 10.094 -21.928 1.00 0.00 N ATOM 1194 CA ARG A 74 -18.878 9.843 -21.563 1.00 0.00 C ATOM 1195 C ARG A 74 -19.803 10.804 -22.326 1.00 0.00 C ATOM 1196 O ARG A 74 -20.907 10.433 -22.715 1.00 0.00 O ATOM 1197 CB ARG A 74 -19.128 9.925 -20.038 1.00 0.00 C ATOM 1198 CG ARG A 74 -20.505 9.324 -19.688 1.00 0.00 C ATOM 1199 CD ARG A 74 -20.847 9.307 -18.192 1.00 0.00 C ATOM 1200 NE ARG A 74 -22.194 8.733 -17.993 1.00 0.00 N ATOM 1201 CZ ARG A 74 -22.983 8.905 -16.925 1.00 0.00 C ATOM 1202 NH1 ARG A 74 -22.529 9.510 -15.834 1.00 0.00 N ATOM 1203 NH2 ARG A 74 -24.242 8.464 -16.955 1.00 0.00 N ATOM 0 H ARG A 74 -16.871 10.388 -21.156 1.00 0.00 H new ATOM 0 HA ARG A 74 -19.108 8.818 -21.855 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -18.343 9.388 -19.505 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -19.083 10.964 -19.711 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -21.275 9.888 -20.214 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -20.545 8.302 -20.065 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -20.107 8.720 -17.647 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -20.810 10.319 -17.790 1.00 0.00 H new ATOM 0 HE ARG A 74 -22.559 8.147 -18.744 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -21.568 9.851 -15.802 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -23.141 9.634 -15.028 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -24.599 7.998 -17.789 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -24.847 8.593 -16.144 1.00 0.00 H new ATOM 1217 N GLY A 75 -19.322 12.034 -22.534 1.00 0.00 N ATOM 1218 CA GLY A 75 -20.077 13.083 -23.222 1.00 0.00 C ATOM 1219 C GLY A 75 -21.267 13.584 -22.396 1.00 0.00 C ATOM 1220 O GLY A 75 -22.241 14.088 -22.957 1.00 0.00 O ATOM 0 H GLY A 75 -18.395 12.330 -22.228 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -19.414 13.919 -23.442 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -20.437 12.701 -24.177 1.00 0.00 H new ATOM 1224 N GLY A 76 -21.212 13.422 -21.071 1.00 0.00 N ATOM 1225 CA GLY A 76 -22.223 13.840 -20.118 1.00 0.00 C ATOM 1226 C GLY A 76 -21.705 13.565 -18.707 1.00 0.00 C ATOM 1227 O GLY A 76 -20.507 13.222 -18.565 1.00 0.00 O ATOM 1228 OXT GLY A 76 -22.503 13.699 -17.754 1.00 0.00 O ATOM 0 H GLY A 76 -20.416 12.971 -20.619 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -22.443 14.901 -20.240 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -23.153 13.299 -20.292 1.00 0.00 H new TER 1232 GLY A 76 ATOM 1233 N GLY B -3 -18.015 21.618 -41.214 1.00 0.00 N ATOM 1234 CA GLY B -3 -16.698 22.297 -41.221 1.00 0.00 C ATOM 1235 C GLY B -3 -15.674 21.573 -40.351 1.00 0.00 C ATOM 1236 O GLY B -3 -16.005 21.082 -39.272 1.00 0.00 O ATOM 0 H1 GLY B -3 -18.771 22.328 -41.146 1.00 0.00 H new ATOM 0 H2 GLY B -3 -18.130 21.074 -42.093 1.00 0.00 H new ATOM 0 H3 GLY B -3 -18.070 20.975 -40.399 1.00 0.00 H new ATOM 0 HA2 GLY B -3 -16.327 22.356 -42.244 1.00 0.00 H new ATOM 0 HA3 GLY B -3 -16.816 23.320 -40.865 1.00 0.00 H new ATOM 1242 N HIS B -2 -14.412 21.513 -40.793 1.00 0.00 N ATOM 1243 CA HIS B -2 -13.355 20.704 -40.168 1.00 0.00 C ATOM 1244 C HIS B -2 -13.062 21.113 -38.723 1.00 0.00 C ATOM 1245 O HIS B -2 -12.616 20.284 -37.926 1.00 0.00 O ATOM 1246 CB HIS B -2 -12.074 20.799 -41.005 1.00 0.00 C ATOM 1247 CG HIS B -2 -12.255 20.357 -42.440 1.00 0.00 C ATOM 1248 ND1 HIS B -2 -12.633 21.190 -43.501 1.00 0.00 N ATOM 1249 CD2 HIS B -2 -12.129 19.079 -42.903 1.00 0.00 C ATOM 1250 CE1 HIS B -2 -12.713 20.388 -44.582 1.00 0.00 C ATOM 1251 NE2 HIS B -2 -12.417 19.119 -44.248 1.00 0.00 N ATOM 0 H HIS B -2 -14.090 22.034 -41.609 1.00 0.00 H new ATOM 0 HA HIS B -2 -13.715 19.676 -40.137 1.00 0.00 H new ATOM 0 HB2 HIS B -2 -11.717 21.829 -40.993 1.00 0.00 H new ATOM 0 HB3 HIS B -2 -11.300 20.188 -40.540 1.00 0.00 H new ATOM 0 HD2 HIS B -2 -11.857 18.207 -42.327 1.00 0.00 H new ATOM 0 HE1 HIS B -2 -12.977 20.718 -45.576 1.00 0.00 H new ATOM 0 HE2 HIS B -2 -12.408 18.322 -44.884 1.00 0.00 H new ATOM 1259 N MET B -1 -13.321 22.374 -38.355 1.00 0.00 N ATOM 1260 CA MET B -1 -13.110 22.858 -36.991 1.00 0.00 C ATOM 1261 C MET B -1 -14.059 22.200 -35.969 1.00 0.00 C ATOM 1262 O MET B -1 -13.832 22.321 -34.763 1.00 0.00 O ATOM 1263 CB MET B -1 -13.174 24.394 -36.926 1.00 0.00 C ATOM 1264 CG MET B -1 -14.596 24.963 -36.984 1.00 0.00 C ATOM 1265 SD MET B -1 -15.473 24.800 -38.571 1.00 0.00 S ATOM 1266 CE MET B -1 -14.574 26.017 -39.575 1.00 0.00 C ATOM 0 H MET B -1 -13.681 23.083 -38.994 1.00 0.00 H new ATOM 0 HA MET B -1 -12.103 22.555 -36.705 1.00 0.00 H new ATOM 0 HB2 MET B -1 -12.698 24.728 -36.004 1.00 0.00 H new ATOM 0 HB3 MET B -1 -12.595 24.807 -37.752 1.00 0.00 H new ATOM 0 HG2 MET B -1 -15.191 24.473 -36.214 1.00 0.00 H new ATOM 0 HG3 MET B -1 -14.551 26.021 -36.727 1.00 0.00 H new ATOM 0 HE1 MET B -1 -15.037 26.090 -40.559 1.00 0.00 H new ATOM 0 HE2 MET B -1 -14.608 26.990 -39.085 1.00 0.00 H new ATOM 0 HE3 MET B -1 -13.536 25.702 -39.685 1.00 0.00 H new ATOM 1276 N ASP B 674 -15.107 21.502 -36.418 1.00 0.00 N ATOM 1277 CA ASP B 674 -16.013 20.735 -35.555 1.00 0.00 C ATOM 1278 C ASP B 674 -15.403 19.394 -35.122 1.00 0.00 C ATOM 1279 O ASP B 674 -16.058 18.606 -34.433 1.00 0.00 O ATOM 1280 CB ASP B 674 -17.338 20.514 -36.294 1.00 0.00 C ATOM 1281 CG ASP B 674 -18.445 19.962 -35.377 1.00 0.00 C ATOM 1282 OD1 ASP B 674 -18.756 20.602 -34.341 1.00 0.00 O ATOM 1283 OD2 ASP B 674 -19.076 18.934 -35.738 1.00 0.00 O ATOM 0 H ASP B 674 -15.354 21.453 -37.406 1.00 0.00 H new ATOM 0 HA ASP B 674 -16.187 21.307 -34.644 1.00 0.00 H new ATOM 0 HB2 ASP B 674 -17.669 21.457 -36.729 1.00 0.00 H new ATOM 0 HB3 ASP B 674 -17.177 19.821 -37.120 1.00 0.00 H new ATOM 1288 N GLU B 675 -14.150 19.124 -35.506 1.00 0.00 N ATOM 1289 CA GLU B 675 -13.501 17.840 -35.300 1.00 0.00 C ATOM 1290 C GLU B 675 -12.218 18.107 -34.511 1.00 0.00 C ATOM 1291 O GLU B 675 -12.310 18.344 -33.306 1.00 0.00 O ATOM 1292 CB GLU B 675 -13.296 17.104 -36.645 1.00 0.00 C ATOM 1293 CG GLU B 675 -14.587 16.974 -37.462 1.00 0.00 C ATOM 1294 CD GLU B 675 -14.355 16.166 -38.752 1.00 0.00 C ATOM 1295 OE1 GLU B 675 -14.005 16.768 -39.798 1.00 0.00 O ATOM 1296 OE2 GLU B 675 -14.528 14.922 -38.732 1.00 0.00 O ATOM 0 H GLU B 675 -13.556 19.807 -35.975 1.00 0.00 H new ATOM 0 HA GLU B 675 -14.118 17.156 -34.718 1.00 0.00 H new ATOM 0 HB2 GLU B 675 -12.552 17.639 -37.235 1.00 0.00 H new ATOM 0 HB3 GLU B 675 -12.894 16.110 -36.451 1.00 0.00 H new ATOM 0 HG2 GLU B 675 -15.354 16.488 -36.859 1.00 0.00 H new ATOM 0 HG3 GLU B 675 -14.961 17.966 -37.714 1.00 0.00 H new ATOM 1303 N LYS B 676 -11.058 18.176 -35.191 1.00 0.00 N ATOM 1304 CA LYS B 676 -9.771 18.624 -34.649 1.00 0.00 C ATOM 1305 C LYS B 676 -9.534 18.183 -33.190 1.00 0.00 C ATOM 1306 O LYS B 676 -9.528 19.012 -32.275 1.00 0.00 O ATOM 1307 CB LYS B 676 -9.578 20.135 -34.897 1.00 0.00 C ATOM 1308 CG LYS B 676 -10.796 21.032 -34.577 1.00 0.00 C ATOM 1309 CD LYS B 676 -10.401 22.508 -34.435 1.00 0.00 C ATOM 1310 CE LYS B 676 -9.762 22.739 -33.060 1.00 0.00 C ATOM 1311 NZ LYS B 676 -9.364 24.156 -32.839 1.00 0.00 N ATOM 0 H LYS B 676 -10.994 17.909 -36.173 1.00 0.00 H new ATOM 0 HA LYS B 676 -8.980 18.112 -35.198 1.00 0.00 H new ATOM 0 HB2 LYS B 676 -8.733 20.477 -34.300 1.00 0.00 H new ATOM 0 HB3 LYS B 676 -9.309 20.280 -35.943 1.00 0.00 H new ATOM 0 HG2 LYS B 676 -11.539 20.930 -35.368 1.00 0.00 H new ATOM 0 HG3 LYS B 676 -11.264 20.692 -33.654 1.00 0.00 H new ATOM 0 HD2 LYS B 676 -9.702 22.785 -35.224 1.00 0.00 H new ATOM 0 HD3 LYS B 676 -11.279 23.143 -34.550 1.00 0.00 H new ATOM 0 HE2 LYS B 676 -10.465 22.438 -32.283 1.00 0.00 H new ATOM 0 HE3 LYS B 676 -8.884 22.100 -32.960 1.00 0.00 H new ATOM 0 HZ1 LYS B 676 -8.938 24.254 -31.895 1.00 0.00 H new ATOM 0 HZ2 LYS B 676 -8.672 24.439 -33.562 1.00 0.00 H new ATOM 0 HZ3 LYS B 676 -10.203 24.767 -32.905 1.00 0.00 H new ATOM 1325 N ILE B 677 -9.332 16.869 -32.999 1.00 0.00 N ATOM 1326 CA ILE B 677 -8.895 16.275 -31.729 1.00 0.00 C ATOM 1327 C ILE B 677 -7.736 17.114 -31.188 1.00 0.00 C ATOM 1328 O ILE B 677 -6.851 17.511 -31.953 1.00 0.00 O ATOM 1329 CB ILE B 677 -8.466 14.797 -31.918 1.00 0.00 C ATOM 1330 CG1 ILE B 677 -9.670 13.921 -32.336 1.00 0.00 C ATOM 1331 CG2 ILE B 677 -7.795 14.213 -30.649 1.00 0.00 C ATOM 1332 CD1 ILE B 677 -9.264 12.536 -32.867 1.00 0.00 C ATOM 0 H ILE B 677 -9.471 16.179 -33.737 1.00 0.00 H new ATOM 0 HA ILE B 677 -9.722 16.275 -31.019 1.00 0.00 H new ATOM 0 HB ILE B 677 -7.725 14.785 -32.717 1.00 0.00 H new ATOM 0 HG12 ILE B 677 -10.332 13.794 -31.479 1.00 0.00 H new ATOM 0 HG13 ILE B 677 -10.240 14.443 -33.104 1.00 0.00 H new ATOM 0 HG21 ILE B 677 -7.513 13.176 -30.831 1.00 0.00 H new ATOM 0 HG22 ILE B 677 -6.905 14.794 -30.408 1.00 0.00 H new ATOM 0 HG23 ILE B 677 -8.495 14.257 -29.814 1.00 0.00 H new ATOM 0 HD11 ILE B 677 -10.158 11.975 -33.141 1.00 0.00 H new ATOM 0 HD12 ILE B 677 -8.627 12.655 -33.743 1.00 0.00 H new ATOM 0 HD13 ILE B 677 -8.720 11.995 -32.093 1.00 0.00 H new ATOM 1344 N THR B 678 -7.705 17.334 -29.876 1.00 0.00 N ATOM 1345 CA THR B 678 -6.670 18.097 -29.216 1.00 0.00 C ATOM 1346 C THR B 678 -5.891 17.204 -28.245 1.00 0.00 C ATOM 1347 O THR B 678 -6.398 16.209 -27.718 1.00 0.00 O ATOM 1348 CB THR B 678 -7.300 19.360 -28.603 1.00 0.00 C ATOM 1349 OG1 THR B 678 -6.283 20.306 -28.314 1.00 0.00 O ATOM 1350 CG2 THR B 678 -8.127 19.116 -27.336 1.00 0.00 C ATOM 0 H THR B 678 -8.416 16.977 -29.237 1.00 0.00 H new ATOM 0 HA THR B 678 -5.916 18.451 -29.919 1.00 0.00 H new ATOM 0 HB THR B 678 -7.997 19.732 -29.354 1.00 0.00 H new ATOM 0 HG1 THR B 678 -6.686 21.111 -27.925 1.00 0.00 H new ATOM 0 HG21 THR B 678 -8.530 20.063 -26.977 1.00 0.00 H new ATOM 0 HG22 THR B 678 -8.947 18.435 -27.562 1.00 0.00 H new ATOM 0 HG23 THR B 678 -7.492 18.677 -26.566 1.00 0.00 H new ATOM 1358 N PHE B 679 -4.640 17.597 -28.012 1.00 0.00 N ATOM 1359 CA PHE B 679 -3.718 16.998 -27.065 1.00 0.00 C ATOM 1360 C PHE B 679 -3.365 18.086 -26.026 1.00 0.00 C ATOM 1361 O PHE B 679 -2.428 18.865 -26.242 1.00 0.00 O ATOM 1362 CB PHE B 679 -2.509 16.404 -27.795 1.00 0.00 C ATOM 1363 CG PHE B 679 -2.764 15.041 -28.421 1.00 0.00 C ATOM 1364 CD1 PHE B 679 -2.815 13.875 -27.620 1.00 0.00 C ATOM 1365 CD2 PHE B 679 -2.933 14.924 -29.812 1.00 0.00 C ATOM 1366 CE1 PHE B 679 -3.006 12.612 -28.206 1.00 0.00 C ATOM 1367 CE2 PHE B 679 -3.125 13.659 -30.400 1.00 0.00 C ATOM 1368 CZ PHE B 679 -3.145 12.503 -29.602 1.00 0.00 C ATOM 0 H PHE B 679 -4.226 18.385 -28.509 1.00 0.00 H new ATOM 0 HA PHE B 679 -4.160 16.154 -26.536 1.00 0.00 H new ATOM 0 HB2 PHE B 679 -2.194 17.096 -28.576 1.00 0.00 H new ATOM 0 HB3 PHE B 679 -1.680 16.319 -27.092 1.00 0.00 H new ATOM 0 HD1 PHE B 679 -2.706 13.957 -26.549 1.00 0.00 H new ATOM 0 HD2 PHE B 679 -2.915 15.808 -30.432 1.00 0.00 H new ATOM 0 HE1 PHE B 679 -3.046 11.728 -27.587 1.00 0.00 H new ATOM 0 HE2 PHE B 679 -3.257 13.577 -31.469 1.00 0.00 H new ATOM 0 HZ PHE B 679 -3.267 11.532 -30.059 1.00 0.00 H new ATOM 1378 N PRO B 680 -4.183 18.227 -24.963 1.00 0.00 N ATOM 1379 CA PRO B 680 -4.099 19.287 -23.958 1.00 0.00 C ATOM 1380 C PRO B 680 -2.955 19.054 -22.958 1.00 0.00 C ATOM 1381 O PRO B 680 -2.271 18.031 -22.982 1.00 0.00 O ATOM 1382 CB PRO B 680 -5.461 19.221 -23.237 1.00 0.00 C ATOM 1383 CG PRO B 680 -5.714 17.716 -23.240 1.00 0.00 C ATOM 1384 CD PRO B 680 -5.300 17.351 -24.653 1.00 0.00 C ATOM 0 HA PRO B 680 -3.892 20.256 -24.413 1.00 0.00 H new ATOM 0 HB2 PRO B 680 -5.414 19.630 -22.228 1.00 0.00 H new ATOM 0 HB3 PRO B 680 -6.237 19.772 -23.769 1.00 0.00 H new ATOM 0 HG2 PRO B 680 -5.118 17.197 -22.489 1.00 0.00 H new ATOM 0 HG3 PRO B 680 -6.758 17.474 -23.041 1.00 0.00 H new ATOM 0 HD2 PRO B 680 -5.008 16.303 -24.719 1.00 0.00 H new ATOM 0 HD3 PRO B 680 -6.122 17.498 -25.354 1.00 0.00 H new ATOM 1392 N SER B 681 -2.859 19.937 -21.963 1.00 0.00 N ATOM 1393 CA SER B 681 -1.936 19.886 -20.832 1.00 0.00 C ATOM 1394 C SER B 681 -2.097 18.647 -19.926 1.00 0.00 C ATOM 1395 O SER B 681 -1.404 18.564 -18.914 1.00 0.00 O ATOM 1396 CB SER B 681 -2.119 21.177 -20.017 1.00 0.00 C ATOM 1397 OG SER B 681 -2.211 22.313 -20.875 1.00 0.00 O ATOM 0 H SER B 681 -3.463 20.758 -21.925 1.00 0.00 H new ATOM 0 HA SER B 681 -0.927 19.801 -21.236 1.00 0.00 H new ATOM 0 HB2 SER B 681 -3.020 21.103 -19.408 1.00 0.00 H new ATOM 0 HB3 SER B 681 -1.280 21.301 -19.332 1.00 0.00 H new ATOM 0 HG SER B 681 -2.329 23.122 -20.335 1.00 0.00 H new ATOM 1403 N ASP B 682 -2.968 17.682 -20.267 1.00 0.00 N ATOM 1404 CA ASP B 682 -3.130 16.415 -19.542 1.00 0.00 C ATOM 1405 C ASP B 682 -3.062 15.181 -20.453 1.00 0.00 C ATOM 1406 O ASP B 682 -2.973 14.061 -19.941 1.00 0.00 O ATOM 1407 CB ASP B 682 -4.460 16.376 -18.774 1.00 0.00 C ATOM 1408 CG ASP B 682 -4.589 17.391 -17.626 1.00 0.00 C ATOM 1409 OD1 ASP B 682 -3.686 17.491 -16.765 1.00 0.00 O ATOM 1410 OD2 ASP B 682 -5.643 18.068 -17.562 1.00 0.00 O ATOM 0 H ASP B 682 -3.590 17.765 -21.071 1.00 0.00 H new ATOM 0 HA ASP B 682 -2.290 16.375 -18.849 1.00 0.00 H new ATOM 0 HB2 ASP B 682 -5.273 16.546 -19.480 1.00 0.00 H new ATOM 0 HB3 ASP B 682 -4.596 15.374 -18.367 1.00 0.00 H new ATOM 1415 N ILE B 683 -3.109 15.329 -21.785 1.00 0.00 N ATOM 1416 CA ILE B 683 -3.063 14.209 -22.722 1.00 0.00 C ATOM 1417 C ILE B 683 -2.183 14.611 -23.915 1.00 0.00 C ATOM 1418 O ILE B 683 -2.493 15.598 -24.572 1.00 0.00 O ATOM 1419 CB ILE B 683 -4.495 13.803 -23.140 1.00 0.00 C ATOM 1420 CG1 ILE B 683 -5.248 13.096 -21.989 1.00 0.00 C ATOM 1421 CG2 ILE B 683 -4.456 12.892 -24.384 1.00 0.00 C ATOM 1422 CD1 ILE B 683 -5.962 13.946 -20.949 1.00 0.00 C ATOM 0 H ILE B 683 -3.181 16.239 -22.241 1.00 0.00 H new ATOM 0 HA ILE B 683 -2.621 13.329 -22.256 1.00 0.00 H new ATOM 0 HB ILE B 683 -5.036 14.718 -23.382 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -5.988 12.432 -22.437 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -4.531 12.465 -21.464 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -5.472 12.616 -24.665 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -3.983 13.424 -25.210 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -3.885 11.992 -24.158 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -6.439 13.297 -20.214 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -5.240 14.592 -20.449 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -6.720 14.559 -21.438 1.00 0.00 H new ATOM 1434 N ASP B 684 -1.121 13.856 -24.227 1.00 0.00 N ATOM 1435 CA ASP B 684 -0.201 14.126 -25.340 1.00 0.00 C ATOM 1436 C ASP B 684 -0.017 12.882 -26.231 1.00 0.00 C ATOM 1437 O ASP B 684 -0.341 11.765 -25.806 1.00 0.00 O ATOM 1438 CB ASP B 684 1.155 14.687 -24.871 1.00 0.00 C ATOM 1439 CG ASP B 684 2.305 13.671 -25.032 1.00 0.00 C ATOM 1440 OD1 ASP B 684 2.325 12.642 -24.325 1.00 0.00 O ATOM 1441 OD2 ASP B 684 3.172 13.891 -25.910 1.00 0.00 O ATOM 0 H ASP B 684 -0.872 13.020 -23.699 1.00 0.00 H new ATOM 0 HA ASP B 684 -0.666 14.906 -25.943 1.00 0.00 H new ATOM 0 HB2 ASP B 684 1.388 15.587 -25.440 1.00 0.00 H new ATOM 0 HB3 ASP B 684 1.080 14.982 -23.824 1.00 0.00 H new ATOM 1446 N PRO B 685 0.459 13.046 -27.481 1.00 0.00 N ATOM 1447 CA PRO B 685 0.685 11.930 -28.382 1.00 0.00 C ATOM 1448 C PRO B 685 1.599 10.839 -27.810 1.00 0.00 C ATOM 1449 O PRO B 685 1.362 9.674 -28.104 1.00 0.00 O ATOM 1450 CB PRO B 685 1.283 12.522 -29.659 1.00 0.00 C ATOM 1451 CG PRO B 685 0.793 13.964 -29.656 1.00 0.00 C ATOM 1452 CD PRO B 685 0.739 14.302 -28.165 1.00 0.00 C ATOM 0 HA PRO B 685 -0.263 11.423 -28.563 1.00 0.00 H new ATOM 0 HB2 PRO B 685 2.372 12.470 -29.652 1.00 0.00 H new ATOM 0 HB3 PRO B 685 0.943 11.986 -30.545 1.00 0.00 H new ATOM 0 HG2 PRO B 685 1.473 14.623 -30.196 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -0.185 14.060 -30.128 1.00 0.00 H new ATOM 0 HD2 PRO B 685 1.683 14.729 -27.827 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -0.036 15.040 -27.960 1.00 0.00 H new ATOM 1460 N GLN B 686 2.633 11.164 -27.023 1.00 0.00 N ATOM 1461 CA GLN B 686 3.609 10.170 -26.597 1.00 0.00 C ATOM 1462 C GLN B 686 2.944 9.035 -25.814 1.00 0.00 C ATOM 1463 O GLN B 686 3.053 7.890 -26.262 1.00 0.00 O ATOM 1464 CB GLN B 686 4.823 10.827 -25.907 1.00 0.00 C ATOM 1465 CG GLN B 686 5.546 10.004 -24.814 1.00 0.00 C ATOM 1466 CD GLN B 686 5.261 10.395 -23.352 1.00 0.00 C ATOM 1467 OE1 GLN B 686 5.799 9.780 -22.431 1.00 0.00 O ATOM 1468 NE2 GLN B 686 4.434 11.389 -23.067 1.00 0.00 N ATOM 0 H GLN B 686 2.809 12.106 -26.673 1.00 0.00 H new ATOM 0 HA GLN B 686 4.029 9.685 -27.478 1.00 0.00 H new ATOM 0 HB2 GLN B 686 5.552 11.081 -26.676 1.00 0.00 H new ATOM 0 HB3 GLN B 686 4.491 11.764 -25.460 1.00 0.00 H new ATOM 0 HG2 GLN B 686 5.278 8.956 -24.944 1.00 0.00 H new ATOM 0 HG3 GLN B 686 6.620 10.082 -24.984 1.00 0.00 H new ATOM 0 HE21 GLN B 686 3.981 11.907 -23.820 1.00 0.00 H new ATOM 0 HE22 GLN B 686 4.250 11.636 -22.095 1.00 0.00 H new ATOM 1477 N VAL B 687 2.243 9.281 -24.698 1.00 0.00 N ATOM 1478 CA VAL B 687 1.631 8.181 -23.976 1.00 0.00 C ATOM 1479 C VAL B 687 0.619 7.484 -24.874 1.00 0.00 C ATOM 1480 O VAL B 687 0.499 6.269 -24.787 1.00 0.00 O ATOM 1481 CB VAL B 687 0.991 8.678 -22.684 1.00 0.00 C ATOM 1482 CG1 VAL B 687 0.638 7.515 -21.753 1.00 0.00 C ATOM 1483 CG2 VAL B 687 1.945 9.619 -21.948 1.00 0.00 C ATOM 0 H VAL B 687 2.094 10.205 -24.293 1.00 0.00 H new ATOM 0 HA VAL B 687 2.397 7.457 -23.698 1.00 0.00 H new ATOM 0 HB VAL B 687 0.077 9.206 -22.956 1.00 0.00 H new ATOM 0 HG11 VAL B 687 0.184 7.904 -20.841 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -0.065 6.849 -22.253 1.00 0.00 H new ATOM 0 HG13 VAL B 687 1.544 6.963 -21.500 1.00 0.00 H new ATOM 0 HG21 VAL B 687 1.475 9.966 -21.028 1.00 0.00 H new ATOM 0 HG22 VAL B 687 2.866 9.088 -21.708 1.00 0.00 H new ATOM 0 HG23 VAL B 687 2.174 10.474 -22.583 1.00 0.00 H new ATOM 1493 N PHE B 688 -0.068 8.206 -25.762 1.00 0.00 N ATOM 1494 CA PHE B 688 -1.022 7.603 -26.673 1.00 0.00 C ATOM 1495 C PHE B 688 -0.352 6.601 -27.625 1.00 0.00 C ATOM 1496 O PHE B 688 -0.908 5.540 -27.917 1.00 0.00 O ATOM 1497 CB PHE B 688 -1.756 8.711 -27.445 1.00 0.00 C ATOM 1498 CG PHE B 688 -3.074 8.256 -28.022 1.00 0.00 C ATOM 1499 CD1 PHE B 688 -4.083 7.814 -27.156 1.00 0.00 C ATOM 1500 CD2 PHE B 688 -3.308 8.295 -29.408 1.00 0.00 C ATOM 1501 CE1 PHE B 688 -5.332 7.411 -27.652 1.00 0.00 C ATOM 1502 CE2 PHE B 688 -4.551 7.865 -29.915 1.00 0.00 C ATOM 1503 CZ PHE B 688 -5.549 7.410 -29.040 1.00 0.00 C ATOM 0 H PHE B 688 0.026 9.217 -25.864 1.00 0.00 H new ATOM 0 HA PHE B 688 -1.747 7.033 -26.092 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -1.930 9.556 -26.779 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -1.117 9.068 -28.252 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -3.897 7.783 -26.093 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -2.541 8.652 -30.079 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -6.116 7.105 -26.976 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -4.735 7.886 -30.979 1.00 0.00 H new ATOM 0 HZ PHE B 688 -6.490 7.057 -29.436 1.00 0.00 H new ATOM 1513 N TYR B 689 0.858 6.910 -28.091 1.00 0.00 N ATOM 1514 CA TYR B 689 1.661 6.054 -28.955 1.00 0.00 C ATOM 1515 C TYR B 689 2.319 4.914 -28.180 1.00 0.00 C ATOM 1516 O TYR B 689 2.751 3.931 -28.789 1.00 0.00 O ATOM 1517 CB TYR B 689 2.717 6.904 -29.672 1.00 0.00 C ATOM 1518 CG TYR B 689 2.200 7.976 -30.620 1.00 0.00 C ATOM 1519 CD1 TYR B 689 0.871 7.968 -31.102 1.00 0.00 C ATOM 1520 CD2 TYR B 689 3.081 8.983 -31.054 1.00 0.00 C ATOM 1521 CE1 TYR B 689 0.431 8.942 -32.014 1.00 0.00 C ATOM 1522 CE2 TYR B 689 2.654 9.962 -31.970 1.00 0.00 C ATOM 1523 CZ TYR B 689 1.325 9.944 -32.459 1.00 0.00 C ATOM 1524 OH TYR B 689 0.891 10.879 -33.355 1.00 0.00 O ATOM 0 H TYR B 689 1.319 7.792 -27.868 1.00 0.00 H new ATOM 0 HA TYR B 689 1.000 5.595 -29.690 1.00 0.00 H new ATOM 0 HB2 TYR B 689 3.336 7.387 -28.916 1.00 0.00 H new ATOM 0 HB3 TYR B 689 3.367 6.235 -30.236 1.00 0.00 H new ATOM 0 HD1 TYR B 689 0.186 7.204 -30.765 1.00 0.00 H new ATOM 0 HD2 TYR B 689 4.094 9.005 -30.681 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -0.587 8.926 -32.374 1.00 0.00 H new ATOM 0 HE2 TYR B 689 3.340 10.728 -32.300 1.00 0.00 H new ATOM 0 HH TYR B 689 1.622 11.499 -33.561 1.00 0.00 H new ATOM 1534 N GLU B 690 2.395 5.037 -26.860 1.00 0.00 N ATOM 1535 CA GLU B 690 3.174 4.144 -26.006 1.00 0.00 C ATOM 1536 C GLU B 690 2.274 3.128 -25.300 1.00 0.00 C ATOM 1537 O GLU B 690 2.694 1.987 -25.080 1.00 0.00 O ATOM 1538 CB GLU B 690 3.950 5.041 -25.022 1.00 0.00 C ATOM 1539 CG GLU B 690 4.214 4.433 -23.648 1.00 0.00 C ATOM 1540 CD GLU B 690 4.885 5.450 -22.713 1.00 0.00 C ATOM 1541 OE1 GLU B 690 4.156 6.227 -22.053 1.00 0.00 O ATOM 1542 OE2 GLU B 690 6.133 5.478 -22.607 1.00 0.00 O ATOM 0 H GLU B 690 1.910 5.771 -26.344 1.00 0.00 H new ATOM 0 HA GLU B 690 3.873 3.545 -26.589 1.00 0.00 H new ATOM 0 HB2 GLU B 690 4.907 5.304 -25.474 1.00 0.00 H new ATOM 0 HB3 GLU B 690 3.395 5.970 -24.889 1.00 0.00 H new ATOM 0 HG2 GLU B 690 3.275 4.096 -23.210 1.00 0.00 H new ATOM 0 HG3 GLU B 690 4.851 3.554 -23.752 1.00 0.00 H new ATOM 1549 N LEU B 691 1.053 3.535 -24.934 1.00 0.00 N ATOM 1550 CA LEU B 691 0.056 2.641 -24.369 1.00 0.00 C ATOM 1551 C LEU B 691 -0.314 1.551 -25.383 1.00 0.00 C ATOM 1552 O LEU B 691 0.048 1.627 -26.562 1.00 0.00 O ATOM 1553 CB LEU B 691 -1.148 3.439 -23.818 1.00 0.00 C ATOM 1554 CG LEU B 691 -2.023 4.257 -24.789 1.00 0.00 C ATOM 1555 CD1 LEU B 691 -2.795 3.415 -25.792 1.00 0.00 C ATOM 1556 CD2 LEU B 691 -3.035 5.069 -23.970 1.00 0.00 C ATOM 0 H LEU B 691 0.735 4.500 -25.025 1.00 0.00 H new ATOM 0 HA LEU B 691 0.471 2.118 -23.507 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -1.801 2.733 -23.305 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -0.767 4.127 -23.063 1.00 0.00 H new ATOM 0 HG LEU B 691 -1.342 4.887 -25.361 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -3.385 4.067 -26.437 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -2.096 2.840 -26.399 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -3.459 2.734 -25.260 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -3.662 5.654 -24.643 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -3.660 4.391 -23.389 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -2.503 5.740 -23.296 1.00 0.00 H new ATOM 1568 N ALA B 692 -1.035 0.534 -24.896 1.00 0.00 N ATOM 1569 CA ALA B 692 -1.458 -0.619 -25.685 1.00 0.00 C ATOM 1570 C ALA B 692 -2.085 -0.162 -26.998 1.00 0.00 C ATOM 1571 O ALA B 692 -3.061 0.585 -26.977 1.00 0.00 O ATOM 1572 CB ALA B 692 -2.453 -1.444 -24.862 1.00 0.00 C ATOM 0 H ALA B 692 -1.344 0.493 -23.925 1.00 0.00 H new ATOM 0 HA ALA B 692 -0.594 -1.237 -25.928 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -2.776 -2.309 -25.442 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -1.973 -1.782 -23.943 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -3.318 -0.829 -24.615 1.00 0.00 H new ATOM 1578 N GLU B 693 -1.572 -0.632 -28.134 1.00 0.00 N ATOM 1579 CA GLU B 693 -2.042 -0.184 -29.441 1.00 0.00 C ATOM 1580 C GLU B 693 -3.536 -0.400 -29.574 1.00 0.00 C ATOM 1581 O GLU B 693 -4.237 0.464 -30.088 1.00 0.00 O ATOM 1582 CB GLU B 693 -1.343 -0.964 -30.550 1.00 0.00 C ATOM 1583 CG GLU B 693 0.036 -0.352 -30.835 1.00 0.00 C ATOM 1584 CD GLU B 693 0.801 -1.168 -31.894 1.00 0.00 C ATOM 1585 OE1 GLU B 693 1.529 -2.123 -31.524 1.00 0.00 O ATOM 1586 OE2 GLU B 693 0.692 -0.857 -33.105 1.00 0.00 O ATOM 0 H GLU B 693 -0.826 -1.327 -28.174 1.00 0.00 H new ATOM 0 HA GLU B 693 -1.815 0.878 -29.530 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -1.233 -2.008 -30.257 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -1.951 -0.949 -31.455 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -0.084 0.675 -31.180 1.00 0.00 H new ATOM 0 HG3 GLU B 693 0.617 -0.313 -29.913 1.00 0.00 H new ATOM 1593 N ALA B 694 -4.045 -1.524 -29.069 1.00 0.00 N ATOM 1594 CA ALA B 694 -5.455 -1.815 -29.203 1.00 0.00 C ATOM 1595 C ALA B 694 -6.304 -0.749 -28.483 1.00 0.00 C ATOM 1596 O ALA B 694 -7.339 -0.331 -28.995 1.00 0.00 O ATOM 1597 CB ALA B 694 -5.720 -3.218 -28.659 1.00 0.00 C ATOM 0 H ALA B 694 -3.504 -2.232 -28.572 1.00 0.00 H new ATOM 0 HA ALA B 694 -5.743 -1.786 -30.254 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -6.781 -3.451 -28.754 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -5.137 -3.944 -29.226 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -5.432 -3.261 -27.609 1.00 0.00 H new ATOM 1603 N VAL B 695 -5.836 -0.261 -27.325 1.00 0.00 N ATOM 1604 CA VAL B 695 -6.457 0.848 -26.607 1.00 0.00 C ATOM 1605 C VAL B 695 -6.324 2.123 -27.434 1.00 0.00 C ATOM 1606 O VAL B 695 -7.299 2.857 -27.529 1.00 0.00 O ATOM 1607 CB VAL B 695 -5.836 0.982 -25.199 1.00 0.00 C ATOM 1608 CG1 VAL B 695 -6.000 2.364 -24.550 1.00 0.00 C ATOM 1609 CG2 VAL B 695 -6.453 -0.046 -24.247 1.00 0.00 C ATOM 0 H VAL B 695 -5.007 -0.633 -26.861 1.00 0.00 H new ATOM 0 HA VAL B 695 -7.521 0.659 -26.465 1.00 0.00 H new ATOM 0 HB VAL B 695 -4.770 0.816 -25.354 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -5.533 2.361 -23.565 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -5.523 3.119 -25.176 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -7.060 2.594 -24.448 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -6.006 0.060 -23.258 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -7.528 0.120 -24.179 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -6.265 -1.051 -24.625 1.00 0.00 H new ATOM 1619 N GLN B 696 -5.167 2.402 -28.043 1.00 0.00 N ATOM 1620 CA GLN B 696 -4.995 3.582 -28.885 1.00 0.00 C ATOM 1621 C GLN B 696 -6.015 3.566 -30.021 1.00 0.00 C ATOM 1622 O GLN B 696 -6.668 4.575 -30.245 1.00 0.00 O ATOM 1623 CB GLN B 696 -3.564 3.621 -29.426 1.00 0.00 C ATOM 1624 CG GLN B 696 -3.244 4.824 -30.313 1.00 0.00 C ATOM 1625 CD GLN B 696 -2.010 4.525 -31.156 1.00 0.00 C ATOM 1626 OE1 GLN B 696 -2.068 4.443 -32.380 1.00 0.00 O ATOM 1627 NE2 GLN B 696 -0.879 4.305 -30.507 1.00 0.00 N ATOM 0 H GLN B 696 -4.333 1.820 -27.965 1.00 0.00 H new ATOM 0 HA GLN B 696 -5.164 4.482 -28.294 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -2.872 3.615 -28.584 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -3.381 2.710 -29.995 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -4.093 5.048 -30.959 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -3.071 5.707 -29.697 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -0.852 4.378 -29.490 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -0.034 4.062 -31.023 1.00 0.00 H new ATOM 1636 N LYS B 697 -6.181 2.447 -30.728 1.00 0.00 N ATOM 1637 CA LYS B 697 -7.136 2.353 -31.836 1.00 0.00 C ATOM 1638 C LYS B 697 -8.562 2.577 -31.338 1.00 0.00 C ATOM 1639 O LYS B 697 -9.294 3.376 -31.920 1.00 0.00 O ATOM 1640 CB LYS B 697 -7.022 0.978 -32.525 1.00 0.00 C ATOM 1641 CG LYS B 697 -5.651 0.694 -33.168 1.00 0.00 C ATOM 1642 CD LYS B 697 -5.202 1.710 -34.233 1.00 0.00 C ATOM 1643 CE LYS B 697 -6.178 1.910 -35.408 1.00 0.00 C ATOM 1644 NZ LYS B 697 -6.294 0.711 -36.286 1.00 0.00 N ATOM 0 H LYS B 697 -5.663 1.586 -30.552 1.00 0.00 H new ATOM 0 HA LYS B 697 -6.898 3.131 -32.562 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -7.232 0.200 -31.791 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -7.791 0.907 -33.294 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -4.898 0.661 -32.380 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -5.679 -0.296 -33.623 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -5.042 2.673 -33.748 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -4.239 1.391 -34.633 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -7.163 2.161 -35.015 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -5.847 2.759 -36.006 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -6.964 0.908 -37.056 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -5.362 0.483 -36.688 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -6.637 -0.096 -35.727 1.00 0.00 H new ATOM 1658 N GLU B 698 -8.944 1.892 -30.259 1.00 0.00 N ATOM 1659 CA GLU B 698 -10.289 2.013 -29.701 1.00 0.00 C ATOM 1660 C GLU B 698 -10.552 3.446 -29.228 1.00 0.00 C ATOM 1661 O GLU B 698 -11.621 3.997 -29.492 1.00 0.00 O ATOM 1662 CB GLU B 698 -10.492 1.017 -28.546 1.00 0.00 C ATOM 1663 CG GLU B 698 -10.686 -0.428 -29.018 1.00 0.00 C ATOM 1664 CD GLU B 698 -12.032 -0.623 -29.738 1.00 0.00 C ATOM 1665 OE1 GLU B 698 -13.066 -0.825 -29.055 1.00 0.00 O ATOM 1666 OE2 GLU B 698 -12.068 -0.582 -30.991 1.00 0.00 O ATOM 0 H GLU B 698 -8.338 1.246 -29.754 1.00 0.00 H new ATOM 0 HA GLU B 698 -11.005 1.775 -30.488 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -9.629 1.062 -27.881 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -11.361 1.321 -27.962 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -9.872 -0.702 -29.690 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -10.632 -1.100 -28.161 1.00 0.00 H new ATOM 1673 N LEU B 699 -9.568 4.079 -28.581 1.00 0.00 N ATOM 1674 CA LEU B 699 -9.668 5.463 -28.133 1.00 0.00 C ATOM 1675 C LEU B 699 -9.757 6.384 -29.318 1.00 0.00 C ATOM 1676 O LEU B 699 -10.604 7.251 -29.312 1.00 0.00 O ATOM 1677 CB LEU B 699 -8.439 5.887 -27.324 1.00 0.00 C ATOM 1678 CG LEU B 699 -8.538 5.494 -25.850 1.00 0.00 C ATOM 1679 CD1 LEU B 699 -7.142 5.504 -25.219 1.00 0.00 C ATOM 1680 CD2 LEU B 699 -9.462 6.463 -25.083 1.00 0.00 C ATOM 0 H LEU B 699 -8.676 3.639 -28.354 1.00 0.00 H new ATOM 0 HA LEU B 699 -10.560 5.529 -27.510 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -7.549 5.432 -27.758 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -8.314 6.967 -27.400 1.00 0.00 H new ATOM 0 HG LEU B 699 -8.962 4.492 -25.788 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -7.216 5.224 -24.168 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -6.502 4.792 -25.741 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -6.714 6.503 -25.299 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -9.516 6.162 -24.037 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -9.063 7.475 -25.150 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -10.460 6.437 -25.520 1.00 0.00 H new ATOM 1692 N LEU B 700 -8.909 6.219 -30.322 1.00 0.00 N ATOM 1693 CA LEU B 700 -8.869 7.093 -31.478 1.00 0.00 C ATOM 1694 C LEU B 700 -10.211 7.094 -32.196 1.00 0.00 C ATOM 1695 O LEU B 700 -10.693 8.150 -32.599 1.00 0.00 O ATOM 1696 CB LEU B 700 -7.730 6.617 -32.383 1.00 0.00 C ATOM 1697 CG LEU B 700 -7.567 7.431 -33.675 1.00 0.00 C ATOM 1698 CD1 LEU B 700 -7.317 8.913 -33.377 1.00 0.00 C ATOM 1699 CD2 LEU B 700 -6.392 6.850 -34.464 1.00 0.00 C ATOM 0 H LEU B 700 -8.223 5.465 -30.354 1.00 0.00 H new ATOM 0 HA LEU B 700 -8.682 8.124 -31.178 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -6.796 6.656 -31.823 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -7.902 5.573 -32.644 1.00 0.00 H new ATOM 0 HG LEU B 700 -8.487 7.367 -34.255 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -7.206 9.459 -34.314 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -8.160 9.319 -32.818 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -6.406 9.017 -32.787 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -6.259 7.415 -35.387 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -5.484 6.915 -33.865 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -6.595 5.806 -34.703 1.00 0.00 H new ATOM 1711 N ALA B 701 -10.845 5.922 -32.303 1.00 0.00 N ATOM 1712 CA ALA B 701 -12.200 5.814 -32.806 1.00 0.00 C ATOM 1713 C ALA B 701 -13.164 6.598 -31.907 1.00 0.00 C ATOM 1714 O ALA B 701 -13.978 7.356 -32.420 1.00 0.00 O ATOM 1715 CB ALA B 701 -12.593 4.340 -32.928 1.00 0.00 C ATOM 0 H ALA B 701 -10.427 5.029 -32.042 1.00 0.00 H new ATOM 0 HA ALA B 701 -12.258 6.254 -33.801 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -13.612 4.265 -33.307 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -11.913 3.838 -33.616 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -12.534 3.865 -31.948 1.00 0.00 H new ATOM 1721 N GLU B 702 -13.040 6.487 -30.584 1.00 0.00 N ATOM 1722 CA GLU B 702 -13.805 7.272 -29.622 1.00 0.00 C ATOM 1723 C GLU B 702 -13.606 8.774 -29.877 1.00 0.00 C ATOM 1724 O GLU B 702 -14.569 9.526 -30.001 1.00 0.00 O ATOM 1725 CB GLU B 702 -13.386 6.885 -28.188 1.00 0.00 C ATOM 1726 CG GLU B 702 -14.542 6.748 -27.194 1.00 0.00 C ATOM 1727 CD GLU B 702 -15.285 5.405 -27.312 1.00 0.00 C ATOM 1728 OE1 GLU B 702 -16.160 5.265 -28.201 1.00 0.00 O ATOM 1729 OE2 GLU B 702 -14.998 4.506 -26.481 1.00 0.00 O ATOM 0 H GLU B 702 -12.391 5.834 -30.145 1.00 0.00 H new ATOM 0 HA GLU B 702 -14.867 7.056 -29.741 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -12.845 5.940 -28.226 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -12.691 7.636 -27.813 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -14.156 6.855 -26.180 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -15.249 7.562 -27.353 1.00 0.00 H new ATOM 1736 N TRP B 703 -12.366 9.236 -29.995 1.00 0.00 N ATOM 1737 CA TRP B 703 -12.010 10.633 -30.092 1.00 0.00 C ATOM 1738 C TRP B 703 -12.516 11.215 -31.418 1.00 0.00 C ATOM 1739 O TRP B 703 -13.004 12.345 -31.441 1.00 0.00 O ATOM 1740 CB TRP B 703 -10.482 10.717 -29.927 1.00 0.00 C ATOM 1741 CG TRP B 703 -9.865 10.133 -28.670 1.00 0.00 C ATOM 1742 CD1 TRP B 703 -10.499 9.595 -27.598 1.00 0.00 C ATOM 1743 CD2 TRP B 703 -8.464 10.146 -28.272 1.00 0.00 C ATOM 1744 NE1 TRP B 703 -9.610 9.313 -26.582 1.00 0.00 N ATOM 1745 CE2 TRP B 703 -8.349 9.699 -26.927 1.00 0.00 C ATOM 1746 CE3 TRP B 703 -7.292 10.602 -28.885 1.00 0.00 C ATOM 1747 CZ2 TRP B 703 -7.188 9.823 -26.175 1.00 0.00 C ATOM 1748 CZ3 TRP B 703 -6.102 10.747 -28.139 1.00 0.00 C ATOM 1749 CH2 TRP B 703 -6.062 10.406 -26.768 1.00 0.00 C ATOM 0 H TRP B 703 -11.555 8.618 -30.026 1.00 0.00 H new ATOM 0 HA TRP B 703 -12.480 11.234 -29.314 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -10.026 10.220 -30.784 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -10.198 11.768 -29.980 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -11.562 9.411 -27.547 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -9.861 8.876 -25.695 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -7.298 10.845 -29.937 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -7.155 9.476 -25.153 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -5.212 11.123 -28.622 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -5.173 10.593 -26.184 1.00 0.00 H new ATOM 1760 N LYS B 704 -12.491 10.439 -32.507 1.00 0.00 N ATOM 1761 CA LYS B 704 -12.935 10.915 -33.818 1.00 0.00 C ATOM 1762 C LYS B 704 -14.442 10.751 -34.027 1.00 0.00 C ATOM 1763 O LYS B 704 -14.991 11.433 -34.896 1.00 0.00 O ATOM 1764 CB LYS B 704 -12.115 10.252 -34.949 1.00 0.00 C ATOM 1765 CG LYS B 704 -12.634 8.880 -35.426 1.00 0.00 C ATOM 1766 CD LYS B 704 -11.714 8.297 -36.508 1.00 0.00 C ATOM 1767 CE LYS B 704 -12.303 6.990 -37.070 1.00 0.00 C ATOM 1768 NZ LYS B 704 -11.496 6.443 -38.194 1.00 0.00 N ATOM 0 H LYS B 704 -12.165 9.472 -32.504 1.00 0.00 H new ATOM 0 HA LYS B 704 -12.747 11.988 -33.852 1.00 0.00 H new ATOM 0 HB2 LYS B 704 -12.092 10.929 -35.803 1.00 0.00 H new ATOM 0 HB3 LYS B 704 -11.087 10.134 -34.608 1.00 0.00 H new ATOM 0 HG2 LYS B 704 -12.690 8.193 -34.581 1.00 0.00 H new ATOM 0 HG3 LYS B 704 -13.645 8.985 -35.819 1.00 0.00 H new ATOM 0 HD2 LYS B 704 -11.586 9.021 -37.313 1.00 0.00 H new ATOM 0 HD3 LYS B 704 -10.726 8.107 -36.090 1.00 0.00 H new ATOM 0 HE2 LYS B 704 -12.361 6.248 -36.273 1.00 0.00 H new ATOM 0 HE3 LYS B 704 -13.322 7.171 -37.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 704 -11.932 5.564 -38.539 1.00 0.00 H new ATOM 0 HZ2 LYS B 704 -11.461 7.138 -38.967 1.00 0.00 H new ATOM 0 HZ3 LYS B 704 -10.530 6.244 -37.863 1.00 0.00 H new ATOM 1782 N ARG B 705 -15.124 9.872 -33.277 1.00 0.00 N ATOM 1783 CA ARG B 705 -16.563 9.622 -33.495 1.00 0.00 C ATOM 1784 C ARG B 705 -17.372 10.659 -32.734 1.00 0.00 C ATOM 1785 O ARG B 705 -18.391 11.139 -33.227 1.00 0.00 O ATOM 1786 CB ARG B 705 -16.976 8.169 -33.183 1.00 0.00 C ATOM 1787 CG ARG B 705 -17.045 7.817 -31.692 1.00 0.00 C ATOM 1788 CD ARG B 705 -16.967 6.315 -31.406 1.00 0.00 C ATOM 1789 NE ARG B 705 -18.216 5.598 -31.717 1.00 0.00 N ATOM 1790 CZ ARG B 705 -18.813 4.678 -30.940 1.00 0.00 C ATOM 1791 NH1 ARG B 705 -18.322 4.341 -29.746 1.00 0.00 N ATOM 1792 NH2 ARG B 705 -19.924 4.083 -31.372 1.00 0.00 N ATOM 0 H ARG B 705 -14.711 9.326 -32.521 1.00 0.00 H new ATOM 0 HA ARG B 705 -16.781 9.735 -34.557 1.00 0.00 H new ATOM 0 HB2 ARG B 705 -17.952 7.981 -33.630 1.00 0.00 H new ATOM 0 HB3 ARG B 705 -16.269 7.495 -33.667 1.00 0.00 H new ATOM 0 HG2 ARG B 705 -16.229 8.319 -31.172 1.00 0.00 H new ATOM 0 HG3 ARG B 705 -17.975 8.208 -31.279 1.00 0.00 H new ATOM 0 HD2 ARG B 705 -16.153 5.883 -31.988 1.00 0.00 H new ATOM 0 HD3 ARG B 705 -16.722 6.164 -30.355 1.00 0.00 H new ATOM 0 HE ARG B 705 -18.669 5.820 -32.603 1.00 0.00 H new ATOM 0 HH11 ARG B 705 -17.471 4.785 -29.401 1.00 0.00 H new ATOM 0 HH12 ARG B 705 -18.797 3.639 -29.179 1.00 0.00 H new ATOM 0 HH21 ARG B 705 -20.312 4.327 -32.283 1.00 0.00 H new ATOM 0 HH22 ARG B 705 -20.386 3.383 -30.792 1.00 0.00 H new ATOM 1806 N THR B 706 -16.887 11.033 -31.550 1.00 0.00 N ATOM 1807 CA THR B 706 -17.393 12.170 -30.797 1.00 0.00 C ATOM 1808 C THR B 706 -17.067 13.432 -31.607 1.00 0.00 C ATOM 1809 O THR B 706 -17.892 14.340 -31.741 1.00 0.00 O ATOM 1810 CB THR B 706 -16.756 12.156 -29.401 1.00 0.00 C ATOM 1811 OG1 THR B 706 -15.345 12.162 -29.499 1.00 0.00 O ATOM 1812 CG2 THR B 706 -17.151 10.883 -28.659 1.00 0.00 C ATOM 0 H THR B 706 -16.121 10.545 -31.085 1.00 0.00 H new ATOM 0 HA THR B 706 -18.472 12.135 -30.647 1.00 0.00 H new ATOM 0 HB THR B 706 -17.105 13.042 -28.870 1.00 0.00 H new ATOM 0 HG1 THR B 706 -15.022 11.246 -29.627 1.00 0.00 H new ATOM 0 HG21 THR B 706 -16.694 10.882 -27.669 1.00 0.00 H new ATOM 0 HG22 THR B 706 -18.236 10.842 -28.558 1.00 0.00 H new ATOM 0 HG23 THR B 706 -16.806 10.014 -29.219 1.00 0.00 H new ATOM 1820 N GLY B 707 -15.877 13.431 -32.216 1.00 0.00 N ATOM 1821 CA GLY B 707 -15.428 14.384 -33.205 1.00 0.00 C ATOM 1822 C GLY B 707 -14.564 15.436 -32.540 1.00 0.00 C ATOM 1823 O GLY B 707 -13.375 15.545 -32.845 1.00 0.00 O ATOM 0 H GLY B 707 -15.172 12.722 -32.013 1.00 0.00 H new ATOM 0 HA2 GLY B 707 -14.863 13.875 -33.985 1.00 0.00 H new ATOM 0 HA3 GLY B 707 -16.285 14.854 -33.687 1.00 0.00 H new ATOM 1827 N SER B 708 -15.146 16.149 -31.578 1.00 0.00 N ATOM 1828 CA SER B 708 -14.474 17.145 -30.760 1.00 0.00 C ATOM 1829 C SER B 708 -13.674 16.512 -29.613 1.00 0.00 C ATOM 1830 O SER B 708 -13.102 17.256 -28.813 1.00 0.00 O ATOM 1831 CB SER B 708 -15.552 18.083 -30.205 1.00 0.00 C ATOM 1832 OG SER B 708 -16.575 17.328 -29.561 1.00 0.00 O ATOM 0 H SER B 708 -16.133 16.042 -31.342 1.00 0.00 H new ATOM 0 HA SER B 708 -13.753 17.688 -31.371 1.00 0.00 H new ATOM 0 HB2 SER B 708 -15.107 18.783 -29.498 1.00 0.00 H new ATOM 0 HB3 SER B 708 -15.981 18.675 -31.013 1.00 0.00 H new ATOM 0 HG SER B 708 -17.258 17.936 -29.208 1.00 0.00 H new ATOM 1838 N ASP B 709 -13.663 15.171 -29.502 1.00 0.00 N ATOM 1839 CA ASP B 709 -13.152 14.406 -28.359 1.00 0.00 C ATOM 1840 C ASP B 709 -13.803 14.811 -27.013 1.00 0.00 C ATOM 1841 O ASP B 709 -13.402 14.338 -25.947 1.00 0.00 O ATOM 1842 CB ASP B 709 -11.616 14.383 -28.308 1.00 0.00 C ATOM 1843 CG ASP B 709 -10.902 15.655 -27.761 1.00 0.00 C ATOM 1844 OD1 ASP B 709 -11.119 16.082 -26.596 1.00 0.00 O ATOM 1845 OD2 ASP B 709 -10.045 16.195 -28.505 1.00 0.00 O ATOM 0 H ASP B 709 -14.027 14.569 -30.241 1.00 0.00 H new ATOM 0 HA ASP B 709 -13.462 13.374 -28.524 1.00 0.00 H new ATOM 0 HB2 ASP B 709 -11.311 13.535 -27.695 1.00 0.00 H new ATOM 0 HB3 ASP B 709 -11.247 14.196 -29.317 1.00 0.00 H new ATOM 1850 N PHE B 710 -14.884 15.599 -27.068 1.00 0.00 N ATOM 1851 CA PHE B 710 -15.562 16.300 -25.998 1.00 0.00 C ATOM 1852 C PHE B 710 -14.646 17.263 -25.234 1.00 0.00 C ATOM 1853 O PHE B 710 -14.821 18.480 -25.363 1.00 0.00 O ATOM 1854 CB PHE B 710 -16.282 15.328 -25.062 1.00 0.00 C ATOM 1855 CG PHE B 710 -17.378 14.477 -25.684 1.00 0.00 C ATOM 1856 CD1 PHE B 710 -18.467 15.079 -26.346 1.00 0.00 C ATOM 1857 CD2 PHE B 710 -17.332 13.075 -25.556 1.00 0.00 C ATOM 1858 CE1 PHE B 710 -19.490 14.279 -26.891 1.00 0.00 C ATOM 1859 CE2 PHE B 710 -18.367 12.282 -26.080 1.00 0.00 C ATOM 1860 CZ PHE B 710 -19.439 12.879 -26.758 1.00 0.00 C ATOM 0 H PHE B 710 -15.344 15.772 -27.962 1.00 0.00 H new ATOM 0 HA PHE B 710 -16.319 16.926 -26.470 1.00 0.00 H new ATOM 0 HB2 PHE B 710 -15.539 14.661 -24.624 1.00 0.00 H new ATOM 0 HB3 PHE B 710 -16.718 15.901 -24.244 1.00 0.00 H new ATOM 0 HD1 PHE B 710 -18.517 16.154 -26.435 1.00 0.00 H new ATOM 0 HD2 PHE B 710 -16.498 12.608 -25.053 1.00 0.00 H new ATOM 0 HE1 PHE B 710 -20.315 14.741 -27.412 1.00 0.00 H new ATOM 0 HE2 PHE B 710 -18.337 11.209 -25.960 1.00 0.00 H new ATOM 0 HZ PHE B 710 -20.223 12.266 -27.177 1.00 0.00 H new ATOM 1870 N HIS B 711 -13.691 16.749 -24.449 1.00 0.00 N ATOM 1871 CA HIS B 711 -12.890 17.516 -23.495 1.00 0.00 C ATOM 1872 C HIS B 711 -11.832 16.619 -22.848 1.00 0.00 C ATOM 1873 O HIS B 711 -11.830 16.435 -21.635 1.00 0.00 O ATOM 1874 CB HIS B 711 -13.795 18.203 -22.442 1.00 0.00 C ATOM 1875 CG HIS B 711 -14.951 17.378 -21.902 1.00 0.00 C ATOM 1876 ND1 HIS B 711 -16.265 17.841 -21.779 1.00 0.00 N ATOM 1877 CD2 HIS B 711 -14.890 16.093 -21.431 1.00 0.00 C ATOM 1878 CE1 HIS B 711 -16.962 16.823 -21.244 1.00 0.00 C ATOM 1879 NE2 HIS B 711 -16.164 15.764 -21.024 1.00 0.00 N ATOM 0 H HIS B 711 -13.449 15.758 -24.463 1.00 0.00 H new ATOM 0 HA HIS B 711 -12.367 18.308 -24.030 1.00 0.00 H new ATOM 0 HB2 HIS B 711 -13.171 18.507 -21.602 1.00 0.00 H new ATOM 0 HB3 HIS B 711 -14.202 19.113 -22.883 1.00 0.00 H new ATOM 0 HD1 HIS B 711 -16.621 18.760 -22.041 1.00 0.00 H new ATOM 0 HD2 HIS B 711 -14.015 15.462 -21.387 1.00 0.00 H new ATOM 0 HE1 HIS B 711 -18.018 16.852 -21.022 1.00 0.00 H new ATOM 1887 N ILE B 712 -10.965 15.979 -23.639 1.00 0.00 N ATOM 1888 CA ILE B 712 -10.061 14.937 -23.149 1.00 0.00 C ATOM 1889 C ILE B 712 -9.245 15.290 -21.895 1.00 0.00 C ATOM 1890 O ILE B 712 -9.077 14.427 -21.044 1.00 0.00 O ATOM 1891 CB ILE B 712 -9.242 14.372 -24.335 1.00 0.00 C ATOM 1892 CG1 ILE B 712 -10.102 13.268 -24.978 1.00 0.00 C ATOM 1893 CG2 ILE B 712 -7.874 13.797 -23.964 1.00 0.00 C ATOM 1894 CD1 ILE B 712 -9.417 12.555 -26.131 1.00 0.00 C ATOM 0 H ILE B 712 -10.871 16.170 -24.637 1.00 0.00 H new ATOM 0 HA ILE B 712 -10.679 14.132 -22.751 1.00 0.00 H new ATOM 0 HB ILE B 712 -9.022 15.201 -25.008 1.00 0.00 H new ATOM 0 HG12 ILE B 712 -10.367 12.536 -24.215 1.00 0.00 H new ATOM 0 HG13 ILE B 712 -11.033 13.707 -25.336 1.00 0.00 H new ATOM 0 HG21 ILE B 712 -7.379 13.427 -24.862 1.00 0.00 H new ATOM 0 HG22 ILE B 712 -7.263 14.576 -23.508 1.00 0.00 H new ATOM 0 HG23 ILE B 712 -8.003 12.977 -23.257 1.00 0.00 H new ATOM 0 HD11 ILE B 712 -10.083 11.791 -26.534 1.00 0.00 H new ATOM 0 HD12 ILE B 712 -9.176 13.275 -26.913 1.00 0.00 H new ATOM 0 HD13 ILE B 712 -8.500 12.086 -25.775 1.00 0.00 H new ATOM 1906 N GLY B 713 -8.780 16.523 -21.712 1.00 0.00 N ATOM 1907 CA GLY B 713 -8.071 16.920 -20.491 1.00 0.00 C ATOM 1908 C GLY B 713 -9.058 17.624 -19.569 1.00 0.00 C ATOM 1909 O GLY B 713 -8.890 18.807 -19.265 1.00 0.00 O ATOM 0 H GLY B 713 -8.881 17.272 -22.397 1.00 0.00 H new ATOM 0 HA2 GLY B 713 -7.648 16.045 -19.997 1.00 0.00 H new ATOM 0 HA3 GLY B 713 -7.240 17.582 -20.733 1.00 0.00 H new ATOM 1913 N HIS B 714 -10.146 16.921 -19.232 1.00 0.00 N ATOM 1914 CA HIS B 714 -11.308 17.465 -18.531 1.00 0.00 C ATOM 1915 C HIS B 714 -10.888 18.191 -17.245 1.00 0.00 C ATOM 1916 O HIS B 714 -9.881 17.835 -16.617 1.00 0.00 O ATOM 1917 CB HIS B 714 -12.305 16.333 -18.266 1.00 0.00 C ATOM 1918 CG HIS B 714 -13.576 16.815 -17.621 1.00 0.00 C ATOM 1919 ND1 HIS B 714 -13.935 16.600 -16.293 1.00 0.00 N ATOM 1920 CD2 HIS B 714 -14.537 17.578 -18.221 1.00 0.00 C ATOM 1921 CE1 HIS B 714 -15.107 17.240 -16.121 1.00 0.00 C ATOM 1922 NE2 HIS B 714 -15.490 17.832 -17.262 1.00 0.00 N ATOM 0 H HIS B 714 -10.242 15.929 -19.447 1.00 0.00 H new ATOM 0 HA HIS B 714 -11.797 18.214 -19.154 1.00 0.00 H new ATOM 0 HB2 HIS B 714 -12.545 15.839 -19.207 1.00 0.00 H new ATOM 0 HB3 HIS B 714 -11.838 15.586 -17.624 1.00 0.00 H new ATOM 0 HD2 HIS B 714 -14.547 17.916 -19.247 1.00 0.00 H new ATOM 0 HE1 HIS B 714 -15.661 17.272 -15.194 1.00 0.00 H new ATOM 0 HE2 HIS B 714 -16.342 18.377 -17.396 1.00 0.00 H new ATOM 1930 N LYS B 715 -11.609 19.248 -16.869 1.00 0.00 N ATOM 1931 CA LYS B 715 -11.253 20.144 -15.780 1.00 0.00 C ATOM 1932 C LYS B 715 -12.537 20.826 -15.312 1.00 0.00 C ATOM 1933 O LYS B 715 -13.395 21.137 -16.175 1.00 0.00 O ATOM 1934 CB LYS B 715 -10.233 21.185 -16.286 1.00 0.00 C ATOM 1935 CG LYS B 715 -9.439 21.870 -15.162 1.00 0.00 C ATOM 1936 CD LYS B 715 -8.400 20.980 -14.447 1.00 0.00 C ATOM 1937 CE LYS B 715 -7.299 20.444 -15.384 1.00 0.00 C ATOM 1938 NZ LYS B 715 -7.500 19.025 -15.763 1.00 0.00 N ATOM 1939 OXT LYS B 715 -12.696 21.053 -14.091 1.00 0.00 O ATOM 0 H LYS B 715 -12.481 19.508 -17.330 1.00 0.00 H new ATOM 0 HA LYS B 715 -10.797 19.601 -14.952 1.00 0.00 H new ATOM 0 HB2 LYS B 715 -9.535 20.696 -16.966 1.00 0.00 H new ATOM 0 HB3 LYS B 715 -10.759 21.946 -16.863 1.00 0.00 H new ATOM 0 HG2 LYS B 715 -8.925 22.736 -15.579 1.00 0.00 H new ATOM 0 HG3 LYS B 715 -10.143 22.245 -14.419 1.00 0.00 H new ATOM 0 HD2 LYS B 715 -7.935 21.552 -13.644 1.00 0.00 H new ATOM 0 HD3 LYS B 715 -8.913 20.137 -13.983 1.00 0.00 H new ATOM 0 HE2 LYS B 715 -7.269 21.054 -16.287 1.00 0.00 H new ATOM 0 HE3 LYS B 715 -6.331 20.550 -14.895 1.00 0.00 H new ATOM 0 HZ1 LYS B 715 -6.869 18.784 -16.554 1.00 0.00 H new ATOM 0 HZ2 LYS B 715 -7.284 18.414 -14.949 1.00 0.00 H new ATOM 0 HZ3 LYS B 715 -8.488 18.880 -16.052 1.00 0.00 H new TER 1953 LYS B 715