USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1066 hydrogens (31 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 163:sc= -1.4 (180deg=-2.29!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -2.39! C(o=-2.4!,f=-11!) USER MOD Single : A 13 ASN : amide:sc= -4.4! C(o=-4.4!,f=-5.4!) USER MOD Single : A 15 ASN : amide:sc= -5.49! C(o=-5.5!,f=-8.7!) USER MOD Single : A 16 ASN : amide:sc= -7.85! C(o=-7.8!,f=-12!) USER MOD Single : A 21 THR OG1 : rot 170:sc= -2.66! USER MOD Single : A 28 HIS : no HD1:sc= -0.0827 X(o=-0.083,f=-0.2) USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -0.498 X(o=-0.5,f=-0.026) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -175:sc= -0.0385 (180deg=-0.0662) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN :FLIP amide:sc= -0.0218 F(o=-1.1!,f=-0.022) USER MOD Single : A 55 GLN : amide:sc= -0.146 K(o=-0.15,f=-4.2!) USER MOD Single : A 61 THR OG1 : rot 17:sc= 0.0788 USER MOD Single : A 63 GLN : amide:sc= -4.24! C(o=-4.2!,f=-5.5!) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot 79:sc= 0.846 USER MOD Single : A 70 LYS NZ :NH3+ -178:sc= 1.62 (180deg=1.62) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HE2:sc= -3.32! C(o=-3.3!,f=-4!) USER MOD Single : A 81 THR OG1 : rot -160:sc= -1.88! USER MOD Single : A 97 LYS NZ :NH3+ -167:sc=-0.00203 (180deg=-0.283) USER MOD Single : A 100 GLN : amide:sc= -2.25! C(o=-2.3!,f=-3.1!) USER MOD Single : A 105 MET CE :methyl -159:sc= -2.05! (180deg=-3.04) USER MOD Single : A 106 SER OG : rot -69:sc= 1.05 USER MOD Single : A 111 ASN : amide:sc=-0.00421 X(o=-0.0042,f=0.36) USER MOD Single : A 119 ASN : amide:sc= -11.1! C(o=-11!,f=-12!) USER MOD Single : A 125 LYS NZ :NH3+ 163:sc= 0.134 (180deg=0.0164) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 APC O2' : rot -8:sc= 0.434 USER MOD Single : A 130 APC O3' : rot -92:sc= 1.55 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.805 16.874 6.803 1.00 0.00 N ATOM 2 CA MET A 1 15.036 16.536 6.034 1.00 0.00 C ATOM 3 C MET A 1 15.106 15.024 5.826 1.00 0.00 C ATOM 4 O MET A 1 15.336 14.550 4.733 1.00 0.00 O ATOM 5 CB MET A 1 16.268 16.998 6.814 1.00 0.00 C ATOM 6 CG MET A 1 16.169 16.509 8.260 1.00 0.00 C ATOM 7 SD MET A 1 17.362 17.406 9.284 1.00 0.00 S ATOM 8 CE MET A 1 17.952 15.985 10.235 1.00 0.00 C ATOM 0 H1 MET A 1 13.892 17.835 7.192 1.00 0.00 H new ATOM 0 H2 MET A 1 12.979 16.829 6.173 1.00 0.00 H new ATOM 0 H3 MET A 1 13.684 16.195 7.581 1.00 0.00 H new ATOM 0 HA MET A 1 15.009 17.037 5.066 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.173 16.609 6.348 1.00 0.00 H new ATOM 0 HB3 MET A 1 16.340 18.085 6.791 1.00 0.00 H new ATOM 0 HG2 MET A 1 15.159 16.664 8.639 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.366 15.438 8.307 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.711 16.312 10.945 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.118 15.538 10.776 1.00 0.00 H new ATOM 0 HE3 MET A 1 18.382 15.247 9.558 1.00 0.00 H new ATOM 20 N LYS A 2 14.913 14.264 6.870 1.00 0.00 N ATOM 21 CA LYS A 2 14.969 12.780 6.737 1.00 0.00 C ATOM 22 C LYS A 2 14.134 12.344 5.530 1.00 0.00 C ATOM 23 O LYS A 2 13.490 13.149 4.887 1.00 0.00 O ATOM 24 CB LYS A 2 14.410 12.129 8.005 1.00 0.00 C ATOM 25 CG LYS A 2 13.082 12.795 8.391 1.00 0.00 C ATOM 26 CD LYS A 2 11.951 12.274 7.497 1.00 0.00 C ATOM 27 CE LYS A 2 11.996 10.746 7.442 1.00 0.00 C ATOM 28 NZ LYS A 2 10.610 10.203 7.512 1.00 0.00 N ATOM 0 H LYS A 2 14.719 14.607 7.811 1.00 0.00 H new ATOM 0 HA LYS A 2 16.004 12.468 6.596 1.00 0.00 H new ATOM 0 HB2 LYS A 2 14.258 11.062 7.840 1.00 0.00 H new ATOM 0 HB3 LYS A 2 15.126 12.226 8.821 1.00 0.00 H new ATOM 0 HG2 LYS A 2 12.854 12.589 9.437 1.00 0.00 H new ATOM 0 HG3 LYS A 2 13.166 13.877 8.290 1.00 0.00 H new ATOM 0 HD2 LYS A 2 10.987 12.605 7.884 1.00 0.00 H new ATOM 0 HD3 LYS A 2 12.050 12.686 6.493 1.00 0.00 H new ATOM 0 HE2 LYS A 2 12.480 10.419 6.521 1.00 0.00 H new ATOM 0 HE3 LYS A 2 12.591 10.359 8.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 10.642 9.164 7.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 10.164 10.504 8.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 10.056 10.562 6.708 1.00 0.00 H new ATOM 42 N LYS A 3 14.136 11.077 5.217 1.00 0.00 N ATOM 43 CA LYS A 3 13.338 10.603 4.052 1.00 0.00 C ATOM 44 C LYS A 3 13.061 9.105 4.186 1.00 0.00 C ATOM 45 O LYS A 3 13.852 8.359 4.728 1.00 0.00 O ATOM 46 CB LYS A 3 14.124 10.860 2.763 1.00 0.00 C ATOM 47 CG LYS A 3 13.487 10.085 1.607 1.00 0.00 C ATOM 48 CD LYS A 3 14.213 10.425 0.305 1.00 0.00 C ATOM 49 CE LYS A 3 14.199 9.206 -0.618 1.00 0.00 C ATOM 50 NZ LYS A 3 14.273 9.655 -2.038 1.00 0.00 N ATOM 0 H LYS A 3 14.653 10.353 5.715 1.00 0.00 H new ATOM 0 HA LYS A 3 12.391 11.142 4.021 1.00 0.00 H new ATOM 0 HB2 LYS A 3 14.133 11.926 2.537 1.00 0.00 H new ATOM 0 HB3 LYS A 3 15.162 10.553 2.891 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.544 9.013 1.798 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.430 10.338 1.524 1.00 0.00 H new ATOM 0 HD2 LYS A 3 13.729 11.271 -0.184 1.00 0.00 H new ATOM 0 HD3 LYS A 3 15.240 10.724 0.516 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.041 8.553 -0.388 1.00 0.00 H new ATOM 0 HE3 LYS A 3 13.291 8.625 -0.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 14.263 8.826 -2.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.456 10.261 -2.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 15.151 10.192 -2.187 1.00 0.00 H new ATOM 64 N LEU A 4 11.947 8.656 3.673 1.00 0.00 N ATOM 65 CA LEU A 4 11.625 7.203 3.751 1.00 0.00 C ATOM 66 C LEU A 4 10.631 6.829 2.653 1.00 0.00 C ATOM 67 O LEU A 4 9.751 7.587 2.301 1.00 0.00 O ATOM 68 CB LEU A 4 11.069 6.847 5.148 1.00 0.00 C ATOM 69 CG LEU A 4 9.535 6.927 5.227 1.00 0.00 C ATOM 70 CD1 LEU A 4 9.013 8.215 4.603 1.00 0.00 C ATOM 71 CD2 LEU A 4 8.904 5.714 4.532 1.00 0.00 C ATOM 0 H LEU A 4 11.248 9.232 3.204 1.00 0.00 H new ATOM 0 HA LEU A 4 12.539 6.628 3.598 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.388 5.839 5.413 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.500 7.523 5.887 1.00 0.00 H new ATOM 0 HG LEU A 4 9.255 6.924 6.280 1.00 0.00 H new ATOM 0 HD11 LEU A 4 7.926 8.240 4.675 1.00 0.00 H new ATOM 0 HD12 LEU A 4 9.432 9.071 5.132 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.308 8.257 3.554 1.00 0.00 H new ATOM 0 HD21 LEU A 4 7.818 5.783 4.595 1.00 0.00 H new ATOM 0 HD22 LEU A 4 9.206 5.697 3.485 1.00 0.00 H new ATOM 0 HD23 LEU A 4 9.239 4.799 5.021 1.00 0.00 H new ATOM 83 N GLN A 5 10.766 5.656 2.109 1.00 0.00 N ATOM 84 CA GLN A 5 9.824 5.226 1.049 1.00 0.00 C ATOM 85 C GLN A 5 8.926 4.149 1.636 1.00 0.00 C ATOM 86 O GLN A 5 9.189 3.617 2.696 1.00 0.00 O ATOM 87 CB GLN A 5 10.587 4.671 -0.154 1.00 0.00 C ATOM 88 CG GLN A 5 11.396 5.800 -0.801 1.00 0.00 C ATOM 89 CD GLN A 5 12.799 5.841 -0.193 1.00 0.00 C ATOM 90 OE1 GLN A 5 12.951 5.942 1.007 1.00 0.00 O ATOM 91 NE2 GLN A 5 13.840 5.769 -0.979 1.00 0.00 N ATOM 0 H GLN A 5 11.488 4.978 2.353 1.00 0.00 H new ATOM 0 HA GLN A 5 9.233 6.075 0.707 1.00 0.00 H new ATOM 0 HB2 GLN A 5 11.251 3.866 0.161 1.00 0.00 H new ATOM 0 HB3 GLN A 5 9.891 4.246 -0.877 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.460 5.644 -1.878 1.00 0.00 H new ATOM 0 HG3 GLN A 5 10.894 6.755 -0.647 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.713 5.684 -1.987 1.00 0.00 H new ATOM 0 HE22 GLN A 5 14.780 5.798 -0.584 1.00 0.00 H new ATOM 100 N ILE A 6 7.862 3.830 0.978 1.00 0.00 N ATOM 101 CA ILE A 6 6.952 2.804 1.531 1.00 0.00 C ATOM 102 C ILE A 6 6.673 1.749 0.465 1.00 0.00 C ATOM 103 O ILE A 6 6.069 2.020 -0.553 1.00 0.00 O ATOM 104 CB ILE A 6 5.666 3.505 1.982 1.00 0.00 C ATOM 105 CG1 ILE A 6 5.839 3.963 3.438 1.00 0.00 C ATOM 106 CG2 ILE A 6 4.458 2.568 1.867 1.00 0.00 C ATOM 107 CD1 ILE A 6 5.385 2.865 4.412 1.00 0.00 C ATOM 0 H ILE A 6 7.581 4.232 0.084 1.00 0.00 H new ATOM 0 HA ILE A 6 7.399 2.299 2.387 1.00 0.00 H new ATOM 0 HB ILE A 6 5.483 4.364 1.337 1.00 0.00 H new ATOM 0 HG12 ILE A 6 6.884 4.212 3.624 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.260 4.870 3.610 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.559 3.091 2.193 1.00 0.00 H new ATOM 0 HG22 ILE A 6 4.339 2.254 0.830 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.616 1.692 2.496 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.516 3.211 5.437 1.00 0.00 H new ATOM 0 HD12 ILE A 6 4.334 2.636 4.238 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.983 1.967 4.253 1.00 0.00 H new ATOM 119 N ALA A 7 7.111 0.544 0.699 1.00 0.00 N ATOM 120 CA ALA A 7 6.875 -0.542 -0.286 1.00 0.00 C ATOM 121 C ALA A 7 5.498 -1.144 -0.026 1.00 0.00 C ATOM 122 O ALA A 7 5.369 -2.303 0.315 1.00 0.00 O ATOM 123 CB ALA A 7 7.944 -1.621 -0.116 1.00 0.00 C ATOM 0 H ALA A 7 7.625 0.265 1.535 1.00 0.00 H new ATOM 0 HA ALA A 7 6.923 -0.146 -1.300 1.00 0.00 H new ATOM 0 HB1 ALA A 7 7.773 -2.420 -0.838 1.00 0.00 H new ATOM 0 HB2 ALA A 7 8.930 -1.186 -0.282 1.00 0.00 H new ATOM 0 HB3 ALA A 7 7.893 -2.028 0.894 1.00 0.00 H new ATOM 129 N VAL A 8 4.466 -0.360 -0.169 1.00 0.00 N ATOM 130 CA VAL A 8 3.100 -0.888 0.087 1.00 0.00 C ATOM 131 C VAL A 8 2.621 -1.704 -1.116 1.00 0.00 C ATOM 132 O VAL A 8 2.502 -2.907 -1.045 1.00 0.00 O ATOM 133 CB VAL A 8 2.119 0.268 0.367 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.385 1.448 -0.576 1.00 0.00 C ATOM 135 CG2 VAL A 8 0.677 -0.224 0.166 1.00 0.00 C ATOM 0 H VAL A 8 4.510 0.619 -0.451 1.00 0.00 H new ATOM 0 HA VAL A 8 3.134 -1.534 0.964 1.00 0.00 H new ATOM 0 HB VAL A 8 2.262 0.601 1.395 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.681 2.252 -0.360 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.403 1.808 -0.430 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.260 1.124 -1.609 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.017 0.593 0.364 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.550 -0.568 -0.860 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.474 -1.047 0.852 1.00 0.00 H new ATOM 145 N GLY A 9 2.323 -1.078 -2.213 1.00 0.00 N ATOM 146 CA GLY A 9 1.830 -1.864 -3.367 1.00 0.00 C ATOM 147 C GLY A 9 0.571 -2.586 -2.925 1.00 0.00 C ATOM 148 O GLY A 9 0.601 -3.730 -2.514 1.00 0.00 O ATOM 0 H GLY A 9 2.398 -0.071 -2.360 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.620 -1.211 -4.214 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.586 -2.578 -3.695 1.00 0.00 H new ATOM 152 N ILE A 10 -0.536 -1.914 -2.997 1.00 0.00 N ATOM 153 CA ILE A 10 -1.808 -2.549 -2.566 1.00 0.00 C ATOM 154 C ILE A 10 -1.876 -3.911 -3.227 1.00 0.00 C ATOM 155 O ILE A 10 -1.105 -4.216 -4.116 1.00 0.00 O ATOM 156 CB ILE A 10 -3.039 -1.711 -2.959 1.00 0.00 C ATOM 157 CG1 ILE A 10 -2.617 -0.312 -3.429 1.00 0.00 C ATOM 158 CG2 ILE A 10 -3.959 -1.573 -1.737 1.00 0.00 C ATOM 159 CD1 ILE A 10 -3.851 0.476 -3.874 1.00 0.00 C ATOM 0 H ILE A 10 -0.618 -0.955 -3.334 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.821 -2.630 -1.479 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.560 -2.212 -3.775 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.108 0.215 -2.622 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.908 -0.393 -4.253 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.834 -0.981 -2.005 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.277 -2.562 -1.408 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.420 -1.078 -0.930 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.548 1.469 -4.207 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.341 -0.048 -4.694 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.544 0.570 -3.038 1.00 0.00 H new ATOM 171 N ILE A 11 -2.760 -4.746 -2.798 1.00 0.00 N ATOM 172 CA ILE A 11 -2.823 -6.087 -3.408 1.00 0.00 C ATOM 173 C ILE A 11 -4.268 -6.410 -3.795 1.00 0.00 C ATOM 174 O ILE A 11 -4.952 -7.146 -3.123 1.00 0.00 O ATOM 175 CB ILE A 11 -2.273 -7.102 -2.396 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.724 -6.720 -0.981 1.00 0.00 C ATOM 177 CG2 ILE A 11 -0.740 -7.084 -2.444 1.00 0.00 C ATOM 178 CD1 ILE A 11 -2.082 -7.668 0.034 1.00 0.00 C ATOM 0 H ILE A 11 -3.437 -4.563 -2.058 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.221 -6.128 -4.316 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.647 -8.095 -2.646 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.440 -5.691 -0.763 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.810 -6.773 -0.907 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.345 -7.803 -1.727 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.404 -7.349 -3.446 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.380 -6.086 -2.193 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.403 -7.396 1.040 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.388 -8.692 -0.180 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.997 -7.592 -0.033 1.00 0.00 H new ATOM 190 N ARG A 12 -4.730 -5.868 -4.894 1.00 0.00 N ATOM 191 CA ARG A 12 -6.132 -6.161 -5.341 1.00 0.00 C ATOM 192 C ARG A 12 -6.112 -7.479 -6.100 1.00 0.00 C ATOM 193 O ARG A 12 -5.149 -7.777 -6.771 1.00 0.00 O ATOM 194 CB ARG A 12 -6.660 -5.066 -6.278 1.00 0.00 C ATOM 195 CG ARG A 12 -5.497 -4.356 -6.966 1.00 0.00 C ATOM 196 CD ARG A 12 -6.030 -3.363 -8.001 1.00 0.00 C ATOM 197 NE ARG A 12 -6.313 -4.095 -9.269 1.00 0.00 N ATOM 198 CZ ARG A 12 -7.007 -3.529 -10.216 1.00 0.00 C ATOM 199 NH1 ARG A 12 -6.440 -2.661 -11.008 1.00 0.00 N ATOM 200 NH2 ARG A 12 -8.265 -3.832 -10.375 1.00 0.00 N ATOM 0 H ARG A 12 -4.203 -5.239 -5.500 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.782 -6.206 -4.467 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -7.321 -5.504 -7.025 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.251 -4.346 -5.712 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -4.891 -3.833 -6.227 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.849 -5.087 -7.450 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -6.937 -2.883 -7.632 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -5.300 -2.573 -8.176 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.961 -5.044 -9.396 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.455 -2.426 -10.886 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -6.982 -2.217 -11.750 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.708 -4.513 -9.758 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -8.807 -3.388 -11.117 1.00 0.00 H new ATOM 214 N ASN A 13 -7.129 -8.297 -6.010 1.00 0.00 N ATOM 215 CA ASN A 13 -7.029 -9.574 -6.762 1.00 0.00 C ATOM 216 C ASN A 13 -8.381 -10.276 -6.998 1.00 0.00 C ATOM 217 O ASN A 13 -8.427 -11.236 -7.692 1.00 0.00 O ATOM 218 CB ASN A 13 -6.070 -10.500 -6.005 1.00 0.00 C ATOM 219 CG ASN A 13 -6.847 -11.418 -5.057 1.00 0.00 C ATOM 220 OD1 ASN A 13 -7.161 -11.041 -3.948 1.00 0.00 O ATOM 221 ND2 ASN A 13 -7.179 -12.614 -5.457 1.00 0.00 N ATOM 0 H ASN A 13 -7.984 -8.145 -5.475 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.654 -9.339 -7.758 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -5.499 -11.099 -6.714 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -5.353 -9.906 -5.439 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -7.703 -13.232 -4.837 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -6.915 -12.931 -6.390 1.00 0.00 H new ATOM 228 N GLU A 14 -9.485 -9.841 -6.483 1.00 0.00 N ATOM 229 CA GLU A 14 -10.740 -10.612 -6.795 1.00 0.00 C ATOM 230 C GLU A 14 -11.395 -9.951 -8.004 1.00 0.00 C ATOM 231 O GLU A 14 -11.990 -10.580 -8.857 1.00 0.00 O ATOM 232 CB GLU A 14 -11.682 -10.567 -5.590 1.00 0.00 C ATOM 233 CG GLU A 14 -11.224 -11.583 -4.540 1.00 0.00 C ATOM 234 CD GLU A 14 -11.697 -12.982 -4.941 1.00 0.00 C ATOM 235 OE1 GLU A 14 -12.158 -13.130 -6.061 1.00 0.00 O ATOM 236 OE2 GLU A 14 -11.589 -13.879 -4.123 1.00 0.00 O ATOM 0 H GLU A 14 -9.590 -9.023 -5.883 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.514 -11.656 -7.012 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.692 -9.565 -5.161 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.702 -10.789 -5.905 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -10.138 -11.566 -4.452 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -11.627 -11.318 -3.562 1.00 0.00 H new ATOM 243 N ASN A 15 -11.214 -8.683 -8.074 1.00 0.00 N ATOM 244 CA ASN A 15 -11.706 -7.844 -9.196 1.00 0.00 C ATOM 245 C ASN A 15 -10.889 -6.581 -9.039 1.00 0.00 C ATOM 246 O ASN A 15 -10.238 -6.082 -9.936 1.00 0.00 O ATOM 247 CB ASN A 15 -13.198 -7.546 -9.024 1.00 0.00 C ATOM 248 CG ASN A 15 -13.671 -6.627 -10.152 1.00 0.00 C ATOM 249 OD1 ASN A 15 -12.967 -5.716 -10.543 1.00 0.00 O ATOM 250 ND2 ASN A 15 -14.840 -6.828 -10.694 1.00 0.00 N ATOM 0 H ASN A 15 -10.715 -8.154 -7.359 1.00 0.00 H new ATOM 0 HA ASN A 15 -11.602 -8.312 -10.175 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -13.768 -8.475 -9.035 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -13.376 -7.074 -8.058 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -15.164 -6.221 -11.447 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -15.430 -7.592 -10.365 1.00 0.00 H new ATOM 257 N ASN A 16 -10.896 -6.141 -7.824 1.00 0.00 N ATOM 258 CA ASN A 16 -10.122 -4.985 -7.365 1.00 0.00 C ATOM 259 C ASN A 16 -10.089 -5.154 -5.855 1.00 0.00 C ATOM 260 O ASN A 16 -10.197 -4.198 -5.113 1.00 0.00 O ATOM 261 CB ASN A 16 -10.833 -3.676 -7.722 1.00 0.00 C ATOM 262 CG ASN A 16 -9.798 -2.568 -7.929 1.00 0.00 C ATOM 263 OD1 ASN A 16 -9.638 -2.065 -9.022 1.00 0.00 O ATOM 264 ND2 ASN A 16 -9.086 -2.160 -6.913 1.00 0.00 N ATOM 0 H ASN A 16 -11.450 -6.574 -7.085 1.00 0.00 H new ATOM 0 HA ASN A 16 -9.133 -4.938 -7.821 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -11.425 -3.808 -8.627 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -11.524 -3.397 -6.927 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -8.396 -1.419 -7.038 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -9.220 -2.582 -5.994 1.00 0.00 H new ATOM 271 N GLU A 17 -10.010 -6.389 -5.379 1.00 0.00 N ATOM 272 CA GLU A 17 -10.058 -6.575 -3.904 1.00 0.00 C ATOM 273 C GLU A 17 -8.677 -6.434 -3.299 1.00 0.00 C ATOM 274 O GLU A 17 -7.916 -7.378 -3.210 1.00 0.00 O ATOM 275 CB GLU A 17 -10.661 -7.932 -3.565 1.00 0.00 C ATOM 276 CG GLU A 17 -12.177 -7.869 -3.773 1.00 0.00 C ATOM 277 CD GLU A 17 -12.486 -7.279 -5.152 1.00 0.00 C ATOM 278 OE1 GLU A 17 -12.414 -6.068 -5.287 1.00 0.00 O ATOM 279 OE2 GLU A 17 -12.786 -8.047 -6.050 1.00 0.00 O ATOM 0 H GLU A 17 -9.918 -7.238 -5.936 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.692 -5.798 -3.477 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -10.226 -8.706 -4.197 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.433 -8.198 -2.533 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.607 -8.867 -3.690 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.635 -7.259 -2.995 1.00 0.00 H new ATOM 286 N ILE A 18 -8.356 -5.245 -2.879 1.00 0.00 N ATOM 287 CA ILE A 18 -7.026 -4.994 -2.274 1.00 0.00 C ATOM 288 C ILE A 18 -7.058 -5.340 -0.793 1.00 0.00 C ATOM 289 O ILE A 18 -8.093 -5.316 -0.157 1.00 0.00 O ATOM 290 CB ILE A 18 -6.678 -3.513 -2.415 1.00 0.00 C ATOM 291 CG1 ILE A 18 -7.787 -2.684 -1.736 1.00 0.00 C ATOM 292 CG2 ILE A 18 -6.548 -3.155 -3.897 1.00 0.00 C ATOM 293 CD1 ILE A 18 -8.242 -1.516 -2.622 1.00 0.00 C ATOM 0 H ILE A 18 -8.966 -4.429 -2.931 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.284 -5.609 -2.783 1.00 0.00 H new ATOM 0 HB ILE A 18 -5.725 -3.294 -1.933 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.639 -3.327 -1.515 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -7.423 -2.299 -0.784 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -6.300 -2.098 -3.996 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.759 -3.757 -4.349 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -7.492 -3.355 -4.404 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -9.024 -0.955 -2.111 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -7.395 -0.859 -2.822 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -8.630 -1.904 -3.564 1.00 0.00 H new ATOM 305 N PHE A 19 -5.921 -5.624 -0.237 1.00 0.00 N ATOM 306 CA PHE A 19 -5.847 -5.924 1.222 1.00 0.00 C ATOM 307 C PHE A 19 -5.785 -4.588 1.975 1.00 0.00 C ATOM 308 O PHE A 19 -4.985 -4.410 2.869 1.00 0.00 O ATOM 309 CB PHE A 19 -4.582 -6.738 1.516 1.00 0.00 C ATOM 310 CG PHE A 19 -4.741 -7.484 2.820 1.00 0.00 C ATOM 311 CD1 PHE A 19 -5.857 -8.303 3.027 1.00 0.00 C ATOM 312 CD2 PHE A 19 -3.769 -7.363 3.821 1.00 0.00 C ATOM 313 CE1 PHE A 19 -6.002 -9.002 4.232 1.00 0.00 C ATOM 314 CE2 PHE A 19 -3.913 -8.061 5.027 1.00 0.00 C ATOM 315 CZ PHE A 19 -5.028 -8.881 5.231 1.00 0.00 C ATOM 0 H PHE A 19 -5.029 -5.663 -0.731 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.717 -6.500 1.537 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.396 -7.442 0.705 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.717 -6.076 1.569 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.608 -8.396 2.256 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.908 -6.731 3.663 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.864 -9.633 4.391 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.164 -7.966 5.799 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.138 -9.421 6.160 1.00 0.00 H new ATOM 325 N ILE A 20 -6.598 -3.635 1.594 1.00 0.00 N ATOM 326 CA ILE A 20 -6.565 -2.305 2.259 1.00 0.00 C ATOM 327 C ILE A 20 -7.365 -2.334 3.548 1.00 0.00 C ATOM 328 O ILE A 20 -8.282 -3.111 3.715 1.00 0.00 O ATOM 329 CB ILE A 20 -7.165 -1.238 1.342 1.00 0.00 C ATOM 330 CG1 ILE A 20 -7.118 0.127 2.040 1.00 0.00 C ATOM 331 CG2 ILE A 20 -8.621 -1.591 1.027 1.00 0.00 C ATOM 332 CD1 ILE A 20 -5.668 0.500 2.357 1.00 0.00 C ATOM 0 H ILE A 20 -7.286 -3.726 0.846 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.524 -2.067 2.477 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.590 -1.196 0.417 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -7.567 0.888 1.401 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.704 0.096 2.959 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -9.047 -0.830 0.374 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -8.661 -2.560 0.529 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -9.193 -1.635 1.954 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -5.642 1.470 2.853 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.233 -0.254 3.013 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -5.094 0.550 1.431 1.00 0.00 H new ATOM 344 N THR A 21 -7.041 -1.458 4.442 1.00 0.00 N ATOM 345 CA THR A 21 -7.788 -1.385 5.723 1.00 0.00 C ATOM 346 C THR A 21 -9.159 -0.774 5.440 1.00 0.00 C ATOM 347 O THR A 21 -9.336 0.425 5.479 1.00 0.00 O ATOM 348 CB THR A 21 -7.016 -0.501 6.693 1.00 0.00 C ATOM 349 OG1 THR A 21 -7.759 -0.336 7.896 1.00 0.00 O ATOM 350 CG2 THR A 21 -6.769 0.860 6.046 1.00 0.00 C ATOM 0 H THR A 21 -6.284 -0.781 4.344 1.00 0.00 H new ATOM 0 HA THR A 21 -7.908 -2.376 6.160 1.00 0.00 H new ATOM 0 HB THR A 21 -6.061 -0.971 6.930 1.00 0.00 H new ATOM 0 HG1 THR A 21 -7.195 0.094 8.572 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.216 1.496 6.737 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.190 0.729 5.132 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.724 1.328 5.807 1.00 0.00 H new ATOM 358 N ARG A 22 -10.118 -1.592 5.124 1.00 0.00 N ATOM 359 CA ARG A 22 -11.474 -1.080 4.797 1.00 0.00 C ATOM 360 C ARG A 22 -12.336 -0.999 6.058 1.00 0.00 C ATOM 361 O ARG A 22 -13.209 -1.816 6.269 1.00 0.00 O ATOM 362 CB ARG A 22 -12.120 -2.031 3.787 1.00 0.00 C ATOM 363 CG ARG A 22 -13.556 -1.587 3.492 1.00 0.00 C ATOM 364 CD ARG A 22 -13.544 -0.184 2.893 1.00 0.00 C ATOM 365 NE ARG A 22 -14.939 0.338 2.837 1.00 0.00 N ATOM 366 CZ ARG A 22 -15.161 1.605 2.608 1.00 0.00 C ATOM 367 NH1 ARG A 22 -14.160 2.428 2.448 1.00 0.00 N ATOM 368 NH2 ARG A 22 -16.385 2.049 2.537 1.00 0.00 N ATOM 0 H ARG A 22 -10.020 -2.606 5.078 1.00 0.00 H new ATOM 0 HA ARG A 22 -11.394 -0.078 4.375 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.539 -2.045 2.865 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.119 -3.048 4.180 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -14.028 -2.285 2.801 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -14.146 -1.597 4.408 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.920 0.476 3.496 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -13.111 -0.206 1.893 1.00 0.00 H new ATOM 0 HE ARG A 22 -15.724 -0.297 2.978 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -13.202 2.082 2.502 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -14.336 3.417 2.269 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -17.168 1.407 2.660 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -16.559 3.038 2.358 1.00 0.00 H new ATOM 382 N ARG A 23 -12.105 -0.008 6.883 1.00 0.00 N ATOM 383 CA ARG A 23 -12.917 0.153 8.130 1.00 0.00 C ATOM 384 C ARG A 23 -13.278 -1.219 8.703 1.00 0.00 C ATOM 385 O ARG A 23 -14.388 -1.693 8.553 1.00 0.00 O ATOM 386 CB ARG A 23 -14.208 0.930 7.819 1.00 0.00 C ATOM 387 CG ARG A 23 -14.397 1.071 6.303 1.00 0.00 C ATOM 388 CD ARG A 23 -15.721 1.782 6.014 1.00 0.00 C ATOM 389 NE ARG A 23 -16.799 0.770 5.837 1.00 0.00 N ATOM 390 CZ ARG A 23 -18.050 1.136 5.895 1.00 0.00 C ATOM 391 NH1 ARG A 23 -18.390 2.354 5.571 1.00 0.00 N ATOM 392 NH2 ARG A 23 -18.960 0.284 6.276 1.00 0.00 N ATOM 0 H ARG A 23 -11.385 0.701 6.746 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.327 0.706 8.861 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -15.064 0.413 8.252 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.166 1.917 8.280 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -13.569 1.635 5.874 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.391 0.088 5.833 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -15.971 2.456 6.834 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -15.630 2.393 5.116 1.00 0.00 H new ATOM 0 HE ARG A 23 -16.560 -0.208 5.671 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -17.678 3.020 5.272 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -19.368 2.640 5.616 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -18.694 -0.668 6.528 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -19.938 0.569 6.322 1.00 0.00 H new ATOM 406 N ALA A 24 -12.348 -1.867 9.347 1.00 0.00 N ATOM 407 CA ALA A 24 -12.637 -3.214 9.915 1.00 0.00 C ATOM 408 C ALA A 24 -13.987 -3.195 10.640 1.00 0.00 C ATOM 409 O ALA A 24 -14.850 -4.009 10.382 1.00 0.00 O ATOM 410 CB ALA A 24 -11.535 -3.599 10.904 1.00 0.00 C ATOM 0 H ALA A 24 -11.401 -1.523 9.505 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.674 -3.943 9.105 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -11.747 -4.584 11.319 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -10.575 -3.621 10.388 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -11.497 -2.866 11.710 1.00 0.00 H new ATOM 416 N ALA A 25 -14.176 -2.276 11.548 1.00 0.00 N ATOM 417 CA ALA A 25 -15.469 -2.212 12.288 1.00 0.00 C ATOM 418 C ALA A 25 -16.517 -1.510 11.424 1.00 0.00 C ATOM 419 O ALA A 25 -16.304 -1.253 10.257 1.00 0.00 O ATOM 420 CB ALA A 25 -15.275 -1.429 13.588 1.00 0.00 C ATOM 0 H ALA A 25 -13.491 -1.567 11.809 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.805 -3.223 12.519 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -16.220 -1.382 14.129 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.528 -1.928 14.205 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -14.939 -0.418 13.357 1.00 0.00 H new ATOM 426 N ASP A 26 -17.650 -1.194 11.990 1.00 0.00 N ATOM 427 CA ASP A 26 -18.708 -0.507 11.199 1.00 0.00 C ATOM 428 C ASP A 26 -18.370 0.980 11.095 1.00 0.00 C ATOM 429 O ASP A 26 -18.103 1.636 12.082 1.00 0.00 O ATOM 430 CB ASP A 26 -20.061 -0.681 11.893 1.00 0.00 C ATOM 431 CG ASP A 26 -20.411 -2.169 11.970 1.00 0.00 C ATOM 432 OD1 ASP A 26 -19.896 -2.921 11.160 1.00 0.00 O ATOM 433 OD2 ASP A 26 -21.190 -2.529 12.838 1.00 0.00 O ATOM 0 H ASP A 26 -17.888 -1.382 12.964 1.00 0.00 H new ATOM 0 HA ASP A 26 -18.760 -0.940 10.200 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -20.025 -0.253 12.895 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -20.834 -0.143 11.345 1.00 0.00 H new ATOM 438 N ALA A 27 -18.368 1.518 9.907 1.00 0.00 N ATOM 439 CA ALA A 27 -18.035 2.960 9.750 1.00 0.00 C ATOM 440 C ALA A 27 -19.163 3.685 9.015 1.00 0.00 C ATOM 441 O ALA A 27 -19.566 4.766 9.393 1.00 0.00 O ATOM 442 CB ALA A 27 -16.741 3.097 8.944 1.00 0.00 C ATOM 0 H ALA A 27 -18.582 1.023 9.041 1.00 0.00 H new ATOM 0 HA ALA A 27 -17.908 3.404 10.737 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -16.495 4.152 8.828 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -15.930 2.591 9.468 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -16.875 2.645 7.961 1.00 0.00 H new ATOM 448 N HIS A 28 -19.668 3.109 7.957 1.00 0.00 N ATOM 449 CA HIS A 28 -20.753 3.787 7.197 1.00 0.00 C ATOM 450 C HIS A 28 -20.251 5.168 6.775 1.00 0.00 C ATOM 451 O HIS A 28 -21.020 6.060 6.477 1.00 0.00 O ATOM 452 CB HIS A 28 -21.993 3.939 8.083 1.00 0.00 C ATOM 453 CG HIS A 28 -23.212 4.092 7.214 1.00 0.00 C ATOM 454 ND1 HIS A 28 -23.628 3.100 6.342 1.00 0.00 N ATOM 455 CD2 HIS A 28 -24.115 5.119 7.072 1.00 0.00 C ATOM 456 CE1 HIS A 28 -24.735 3.543 5.720 1.00 0.00 C ATOM 457 NE2 HIS A 28 -25.076 4.769 6.127 1.00 0.00 N ATOM 0 H HIS A 28 -19.377 2.203 7.589 1.00 0.00 H new ATOM 0 HA HIS A 28 -21.020 3.197 6.320 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -22.101 3.068 8.730 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -21.885 4.807 8.733 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -24.084 6.054 7.611 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -25.282 2.976 4.981 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -25.869 5.328 5.813 1.00 0.00 H new ATOM 465 N MET A 29 -18.958 5.343 6.754 1.00 0.00 N ATOM 466 CA MET A 29 -18.381 6.658 6.361 1.00 0.00 C ATOM 467 C MET A 29 -17.586 6.496 5.068 1.00 0.00 C ATOM 468 O MET A 29 -17.630 7.335 4.190 1.00 0.00 O ATOM 469 CB MET A 29 -17.446 7.150 7.466 1.00 0.00 C ATOM 470 CG MET A 29 -18.157 8.214 8.303 1.00 0.00 C ATOM 471 SD MET A 29 -16.964 9.020 9.399 1.00 0.00 S ATOM 472 CE MET A 29 -16.607 10.444 8.341 1.00 0.00 C ATOM 0 H MET A 29 -18.273 4.626 6.994 1.00 0.00 H new ATOM 0 HA MET A 29 -19.185 7.378 6.210 1.00 0.00 H new ATOM 0 HB2 MET A 29 -17.145 6.316 8.100 1.00 0.00 H new ATOM 0 HB3 MET A 29 -16.537 7.564 7.030 1.00 0.00 H new ATOM 0 HG2 MET A 29 -18.624 8.952 7.651 1.00 0.00 H new ATOM 0 HG3 MET A 29 -18.954 7.757 8.889 1.00 0.00 H new ATOM 0 HE1 MET A 29 -15.878 11.089 8.832 1.00 0.00 H new ATOM 0 HE2 MET A 29 -16.203 10.098 7.390 1.00 0.00 H new ATOM 0 HE3 MET A 29 -17.525 11.004 8.163 1.00 0.00 H new ATOM 482 N ALA A 30 -16.848 5.428 4.948 1.00 0.00 N ATOM 483 CA ALA A 30 -16.041 5.218 3.718 1.00 0.00 C ATOM 484 C ALA A 30 -14.811 6.124 3.769 1.00 0.00 C ATOM 485 O ALA A 30 -14.584 6.819 4.739 1.00 0.00 O ATOM 486 CB ALA A 30 -16.881 5.560 2.490 1.00 0.00 C ATOM 0 H ALA A 30 -16.770 4.692 5.650 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.727 4.176 3.656 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.288 5.405 1.589 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.760 4.917 2.460 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -17.195 6.602 2.543 1.00 0.00 H new ATOM 492 N ASN A 31 -14.007 6.110 2.740 1.00 0.00 N ATOM 493 CA ASN A 31 -12.783 6.963 2.735 1.00 0.00 C ATOM 494 C ASN A 31 -11.699 6.303 3.594 1.00 0.00 C ATOM 495 O ASN A 31 -10.577 6.766 3.657 1.00 0.00 O ATOM 496 CB ASN A 31 -13.117 8.345 3.302 1.00 0.00 C ATOM 497 CG ASN A 31 -12.130 9.378 2.757 1.00 0.00 C ATOM 498 OD1 ASN A 31 -12.443 10.110 1.840 1.00 0.00 O ATOM 499 ND2 ASN A 31 -10.940 9.470 3.288 1.00 0.00 N ATOM 0 H ASN A 31 -14.145 5.545 1.902 1.00 0.00 H new ATOM 0 HA ASN A 31 -12.421 7.072 1.713 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -14.136 8.623 3.032 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -13.071 8.323 4.391 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -10.275 10.156 2.932 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -10.676 8.856 4.058 1.00 0.00 H new ATOM 506 N LYS A 32 -12.031 5.229 4.259 1.00 0.00 N ATOM 507 CA LYS A 32 -11.036 4.526 5.112 1.00 0.00 C ATOM 508 C LYS A 32 -10.176 3.598 4.251 1.00 0.00 C ATOM 509 O LYS A 32 -9.984 2.446 4.577 1.00 0.00 O ATOM 510 CB LYS A 32 -11.778 3.705 6.166 1.00 0.00 C ATOM 511 CG LYS A 32 -11.011 3.752 7.489 1.00 0.00 C ATOM 512 CD LYS A 32 -9.761 2.873 7.394 1.00 0.00 C ATOM 513 CE LYS A 32 -9.323 2.461 8.800 1.00 0.00 C ATOM 514 NZ LYS A 32 -8.503 3.547 9.408 1.00 0.00 N ATOM 0 H LYS A 32 -12.959 4.806 4.246 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.390 5.257 5.598 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -12.785 4.098 6.304 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.881 2.673 5.831 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.728 4.779 7.720 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.649 3.407 8.302 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.970 1.988 6.792 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.958 3.416 6.895 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.197 2.261 9.420 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.746 1.537 8.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -8.206 3.264 10.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -7.662 3.717 8.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -9.068 4.418 9.464 1.00 0.00 H new ATOM 528 N LEU A 33 -9.658 4.078 3.154 1.00 0.00 N ATOM 529 CA LEU A 33 -8.816 3.204 2.287 1.00 0.00 C ATOM 530 C LEU A 33 -7.403 3.779 2.211 1.00 0.00 C ATOM 531 O LEU A 33 -7.038 4.432 1.254 1.00 0.00 O ATOM 532 CB LEU A 33 -9.422 3.140 0.877 1.00 0.00 C ATOM 533 CG LEU A 33 -10.723 2.330 0.890 1.00 0.00 C ATOM 534 CD1 LEU A 33 -11.025 1.853 -0.532 1.00 0.00 C ATOM 535 CD2 LEU A 33 -10.579 1.109 1.804 1.00 0.00 C ATOM 0 H LEU A 33 -9.780 5.034 2.821 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.779 2.199 2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.618 4.148 0.512 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.710 2.685 0.189 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.532 2.960 1.260 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.949 1.275 -0.533 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.135 2.715 -1.189 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.206 1.228 -0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.510 0.543 1.804 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.769 0.476 1.441 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.355 1.438 2.819 1.00 0.00 H new ATOM 547 N GLU A 34 -6.604 3.541 3.215 1.00 0.00 N ATOM 548 CA GLU A 34 -5.216 4.077 3.201 1.00 0.00 C ATOM 549 C GLU A 34 -4.328 3.153 2.354 1.00 0.00 C ATOM 550 O GLU A 34 -4.708 2.761 1.268 1.00 0.00 O ATOM 551 CB GLU A 34 -4.699 4.170 4.643 1.00 0.00 C ATOM 552 CG GLU A 34 -3.776 5.385 4.774 1.00 0.00 C ATOM 553 CD GLU A 34 -3.205 5.447 6.192 1.00 0.00 C ATOM 554 OE1 GLU A 34 -3.673 4.695 7.030 1.00 0.00 O ATOM 555 OE2 GLU A 34 -2.312 6.247 6.416 1.00 0.00 O ATOM 0 H GLU A 34 -6.853 2.999 4.043 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.196 5.074 2.761 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.536 4.258 5.336 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.161 3.260 4.908 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -2.966 5.319 4.048 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.328 6.299 4.553 1.00 0.00 H new ATOM 562 N PHE A 35 -3.156 2.799 2.816 1.00 0.00 N ATOM 563 CA PHE A 35 -2.291 1.904 1.990 1.00 0.00 C ATOM 564 C PHE A 35 -1.416 1.028 2.895 1.00 0.00 C ATOM 565 O PHE A 35 -0.674 1.536 3.712 1.00 0.00 O ATOM 566 CB PHE A 35 -1.375 2.739 1.077 1.00 0.00 C ATOM 567 CG PHE A 35 -1.721 4.211 1.169 1.00 0.00 C ATOM 568 CD1 PHE A 35 -1.378 4.942 2.313 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.380 4.842 0.109 1.00 0.00 C ATOM 570 CE1 PHE A 35 -1.696 6.302 2.396 1.00 0.00 C ATOM 571 CE2 PHE A 35 -2.698 6.203 0.191 1.00 0.00 C ATOM 572 CZ PHE A 35 -2.355 6.934 1.335 1.00 0.00 C ATOM 0 H PHE A 35 -2.765 3.085 3.714 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.940 1.273 1.382 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.334 2.587 1.362 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.476 2.401 0.046 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.868 4.456 3.131 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -2.644 4.279 -0.774 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.433 6.865 3.279 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.208 6.689 -0.628 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.599 7.984 1.399 1.00 0.00 H new ATOM 582 N PRO A 36 -1.507 -0.268 2.702 1.00 0.00 N ATOM 583 CA PRO A 36 -0.706 -1.234 3.475 1.00 0.00 C ATOM 584 C PRO A 36 0.787 -0.929 3.287 1.00 0.00 C ATOM 585 O PRO A 36 1.399 -1.357 2.330 1.00 0.00 O ATOM 586 CB PRO A 36 -1.068 -2.599 2.871 1.00 0.00 C ATOM 587 CG PRO A 36 -1.997 -2.350 1.661 1.00 0.00 C ATOM 588 CD PRO A 36 -2.411 -0.879 1.705 1.00 0.00 C ATOM 0 HA PRO A 36 -0.905 -1.198 4.546 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.168 -3.129 2.559 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.566 -3.225 3.612 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.482 -2.577 0.727 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.872 -2.998 1.708 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.302 -0.407 0.729 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.455 -0.769 1.997 1.00 0.00 H new ATOM 596 N GLY A 37 1.367 -0.172 4.180 1.00 0.00 N ATOM 597 CA GLY A 37 2.809 0.193 4.050 1.00 0.00 C ATOM 598 C GLY A 37 3.702 -1.050 3.929 1.00 0.00 C ATOM 599 O GLY A 37 3.325 -2.065 3.377 1.00 0.00 O ATOM 0 H GLY A 37 0.900 0.213 5.001 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.946 0.826 3.173 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.116 0.778 4.917 1.00 0.00 H new ATOM 603 N GLY A 38 4.899 -0.948 4.437 1.00 0.00 N ATOM 604 CA GLY A 38 5.877 -2.072 4.369 1.00 0.00 C ATOM 605 C GLY A 38 7.277 -1.474 4.513 1.00 0.00 C ATOM 606 O GLY A 38 8.177 -2.080 5.066 1.00 0.00 O ATOM 0 H GLY A 38 5.249 -0.113 4.907 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.686 -2.795 5.162 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.783 -2.605 3.423 1.00 0.00 H new ATOM 610 N LYS A 39 7.442 -0.267 4.026 1.00 0.00 N ATOM 611 CA LYS A 39 8.752 0.442 4.117 1.00 0.00 C ATOM 612 C LYS A 39 9.804 -0.253 3.256 1.00 0.00 C ATOM 613 O LYS A 39 10.390 -1.240 3.652 1.00 0.00 O ATOM 614 CB LYS A 39 9.230 0.475 5.568 1.00 0.00 C ATOM 615 CG LYS A 39 10.588 1.180 5.634 1.00 0.00 C ATOM 616 CD LYS A 39 10.397 2.690 5.501 1.00 0.00 C ATOM 617 CE LYS A 39 11.527 3.267 4.645 1.00 0.00 C ATOM 618 NZ LYS A 39 12.715 3.541 5.503 1.00 0.00 N ATOM 0 H LYS A 39 6.707 0.265 3.560 1.00 0.00 H new ATOM 0 HA LYS A 39 8.613 1.460 3.753 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.504 0.998 6.191 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.314 -0.539 5.959 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.082 0.949 6.578 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.236 0.815 4.837 1.00 0.00 H new ATOM 0 HD2 LYS A 39 9.431 2.908 5.044 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.396 3.157 6.486 1.00 0.00 H new ATOM 0 HE2 LYS A 39 11.792 2.566 3.853 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.197 4.185 4.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.451 4.011 4.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.438 4.159 6.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.086 2.645 5.878 1.00 0.00 H new ATOM 632 N ILE A 40 10.066 0.271 2.092 1.00 0.00 N ATOM 633 CA ILE A 40 11.106 -0.351 1.222 1.00 0.00 C ATOM 634 C ILE A 40 12.480 0.113 1.698 1.00 0.00 C ATOM 635 O ILE A 40 12.699 1.279 1.958 1.00 0.00 O ATOM 636 CB ILE A 40 10.889 0.029 -0.258 1.00 0.00 C ATOM 637 CG1 ILE A 40 12.244 0.149 -0.991 1.00 0.00 C ATOM 638 CG2 ILE A 40 10.124 1.352 -0.366 1.00 0.00 C ATOM 639 CD1 ILE A 40 12.851 1.539 -0.769 1.00 0.00 C ATOM 0 H ILE A 40 9.609 1.097 1.706 1.00 0.00 H new ATOM 0 HA ILE A 40 11.036 -1.436 1.294 1.00 0.00 H new ATOM 0 HB ILE A 40 10.301 -0.760 -0.728 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.930 -0.616 -0.628 1.00 0.00 H new ATOM 0 HG13 ILE A 40 12.105 -0.028 -2.058 1.00 0.00 H new ATOM 0 HG21 ILE A 40 9.980 1.604 -1.417 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.153 1.252 0.119 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.694 2.143 0.122 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.805 1.607 -1.292 1.00 0.00 H new ATOM 0 HD12 ILE A 40 12.171 2.299 -1.154 1.00 0.00 H new ATOM 0 HD13 ILE A 40 13.009 1.701 0.297 1.00 0.00 H new ATOM 651 N GLU A 41 13.405 -0.792 1.810 1.00 0.00 N ATOM 652 CA GLU A 41 14.762 -0.404 2.267 1.00 0.00 C ATOM 653 C GLU A 41 15.720 -1.590 2.113 1.00 0.00 C ATOM 654 O GLU A 41 16.896 -1.420 1.856 1.00 0.00 O ATOM 655 CB GLU A 41 14.688 0.033 3.730 1.00 0.00 C ATOM 656 CG GLU A 41 14.525 -1.195 4.628 1.00 0.00 C ATOM 657 CD GLU A 41 13.671 -0.828 5.844 1.00 0.00 C ATOM 658 OE1 GLU A 41 13.851 0.261 6.364 1.00 0.00 O ATOM 659 OE2 GLU A 41 12.851 -1.642 6.235 1.00 0.00 O ATOM 0 H GLU A 41 13.280 -1.783 1.605 1.00 0.00 H new ATOM 0 HA GLU A 41 15.135 0.423 1.662 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.592 0.578 4.003 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.850 0.715 3.874 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.055 -2.006 4.072 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.502 -1.555 4.951 1.00 0.00 H new ATOM 666 N MET A 42 15.228 -2.792 2.262 1.00 0.00 N ATOM 667 CA MET A 42 16.114 -3.982 2.119 1.00 0.00 C ATOM 668 C MET A 42 16.819 -3.926 0.762 1.00 0.00 C ATOM 669 O MET A 42 16.414 -3.199 -0.125 1.00 0.00 O ATOM 670 CB MET A 42 15.270 -5.255 2.208 1.00 0.00 C ATOM 671 CG MET A 42 14.672 -5.374 3.612 1.00 0.00 C ATOM 672 SD MET A 42 15.673 -6.514 4.599 1.00 0.00 S ATOM 673 CE MET A 42 14.605 -6.547 6.060 1.00 0.00 C ATOM 0 H MET A 42 14.253 -3.000 2.476 1.00 0.00 H new ATOM 0 HA MET A 42 16.859 -3.985 2.915 1.00 0.00 H new ATOM 0 HB2 MET A 42 14.474 -5.229 1.463 1.00 0.00 H new ATOM 0 HB3 MET A 42 15.885 -6.128 1.988 1.00 0.00 H new ATOM 0 HG2 MET A 42 14.640 -4.395 4.089 1.00 0.00 H new ATOM 0 HG3 MET A 42 13.645 -5.733 3.552 1.00 0.00 H new ATOM 0 HE1 MET A 42 15.040 -7.204 6.814 1.00 0.00 H new ATOM 0 HE2 MET A 42 14.513 -5.540 6.466 1.00 0.00 H new ATOM 0 HE3 MET A 42 13.619 -6.918 5.781 1.00 0.00 H new ATOM 683 N GLY A 43 17.873 -4.678 0.591 1.00 0.00 N ATOM 684 CA GLY A 43 18.600 -4.652 -0.711 1.00 0.00 C ATOM 685 C GLY A 43 18.748 -3.203 -1.167 1.00 0.00 C ATOM 686 O GLY A 43 19.237 -2.357 -0.446 1.00 0.00 O ATOM 0 H GLY A 43 18.261 -5.307 1.294 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.581 -5.115 -0.604 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.055 -5.228 -1.458 1.00 0.00 H new ATOM 690 N GLU A 44 18.314 -2.912 -2.357 1.00 0.00 N ATOM 691 CA GLU A 44 18.408 -1.518 -2.867 1.00 0.00 C ATOM 692 C GLU A 44 17.503 -1.375 -4.090 1.00 0.00 C ATOM 693 O GLU A 44 17.696 -0.512 -4.923 1.00 0.00 O ATOM 694 CB GLU A 44 19.855 -1.203 -3.255 1.00 0.00 C ATOM 695 CG GLU A 44 20.422 -2.354 -4.087 1.00 0.00 C ATOM 696 CD GLU A 44 21.220 -3.292 -3.180 1.00 0.00 C ATOM 697 OE1 GLU A 44 22.215 -2.848 -2.631 1.00 0.00 O ATOM 698 OE2 GLU A 44 20.823 -4.438 -3.050 1.00 0.00 O ATOM 0 H GLU A 44 17.896 -3.582 -3.003 1.00 0.00 H new ATOM 0 HA GLU A 44 18.092 -0.821 -2.091 1.00 0.00 H new ATOM 0 HB2 GLU A 44 19.896 -0.274 -3.824 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.459 -1.055 -2.360 1.00 0.00 H new ATOM 0 HG2 GLU A 44 19.613 -2.900 -4.571 1.00 0.00 H new ATOM 0 HG3 GLU A 44 21.062 -1.964 -4.879 1.00 0.00 H new ATOM 705 N THR A 45 16.516 -2.219 -4.201 1.00 0.00 N ATOM 706 CA THR A 45 15.595 -2.145 -5.363 1.00 0.00 C ATOM 707 C THR A 45 14.170 -2.360 -4.857 1.00 0.00 C ATOM 708 O THR A 45 13.958 -3.188 -4.010 1.00 0.00 O ATOM 709 CB THR A 45 15.969 -3.255 -6.347 1.00 0.00 C ATOM 710 OG1 THR A 45 17.363 -3.196 -6.609 1.00 0.00 O ATOM 711 CG2 THR A 45 15.196 -3.079 -7.653 1.00 0.00 C ATOM 0 H THR A 45 16.309 -2.960 -3.532 1.00 0.00 H new ATOM 0 HA THR A 45 15.667 -1.178 -5.860 1.00 0.00 H new ATOM 0 HB THR A 45 15.715 -4.222 -5.913 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.608 -3.906 -7.238 1.00 0.00 H new ATOM 0 HG21 THR A 45 15.469 -3.874 -8.347 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.126 -3.125 -7.451 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.441 -2.113 -8.093 1.00 0.00 H new ATOM 719 N PRO A 46 13.232 -1.620 -5.386 1.00 0.00 N ATOM 720 CA PRO A 46 11.819 -1.746 -4.976 1.00 0.00 C ATOM 721 C PRO A 46 11.382 -3.209 -5.037 1.00 0.00 C ATOM 722 O PRO A 46 10.405 -3.593 -4.431 1.00 0.00 O ATOM 723 CB PRO A 46 11.047 -0.880 -5.978 1.00 0.00 C ATOM 724 CG PRO A 46 12.093 -0.070 -6.790 1.00 0.00 C ATOM 725 CD PRO A 46 13.488 -0.613 -6.427 1.00 0.00 C ATOM 0 HA PRO A 46 11.642 -1.422 -3.950 1.00 0.00 H new ATOM 0 HB2 PRO A 46 10.445 -1.502 -6.640 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.361 -0.210 -5.459 1.00 0.00 H new ATOM 0 HG2 PRO A 46 11.909 -0.172 -7.860 1.00 0.00 H new ATOM 0 HG3 PRO A 46 12.022 0.992 -6.554 1.00 0.00 H new ATOM 0 HD2 PRO A 46 13.980 -1.054 -7.294 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.140 0.180 -6.060 1.00 0.00 H new ATOM 733 N GLU A 47 12.110 -4.036 -5.738 1.00 0.00 N ATOM 734 CA GLU A 47 11.738 -5.474 -5.796 1.00 0.00 C ATOM 735 C GLU A 47 12.188 -6.141 -4.494 1.00 0.00 C ATOM 736 O GLU A 47 11.430 -6.258 -3.568 1.00 0.00 O ATOM 737 CB GLU A 47 12.426 -6.143 -6.986 1.00 0.00 C ATOM 738 CG GLU A 47 11.395 -6.415 -8.083 1.00 0.00 C ATOM 739 CD GLU A 47 11.990 -6.047 -9.442 1.00 0.00 C ATOM 740 OE1 GLU A 47 12.659 -6.887 -10.021 1.00 0.00 O ATOM 741 OE2 GLU A 47 11.768 -4.930 -9.880 1.00 0.00 O ATOM 0 H GLU A 47 12.941 -3.778 -6.269 1.00 0.00 H new ATOM 0 HA GLU A 47 10.660 -5.576 -5.917 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.220 -5.501 -7.369 1.00 0.00 H new ATOM 0 HB3 GLU A 47 12.894 -7.076 -6.672 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.106 -7.466 -8.073 1.00 0.00 H new ATOM 0 HG3 GLU A 47 10.491 -5.834 -7.900 1.00 0.00 H new ATOM 748 N GLN A 48 13.418 -6.571 -4.404 1.00 0.00 N ATOM 749 CA GLN A 48 13.878 -7.220 -3.136 1.00 0.00 C ATOM 750 C GLN A 48 13.381 -6.420 -1.940 1.00 0.00 C ATOM 751 O GLN A 48 13.103 -6.958 -0.896 1.00 0.00 O ATOM 752 CB GLN A 48 15.403 -7.258 -3.073 1.00 0.00 C ATOM 753 CG GLN A 48 15.915 -8.422 -3.918 1.00 0.00 C ATOM 754 CD GLN A 48 17.357 -8.765 -3.524 1.00 0.00 C ATOM 755 OE1 GLN A 48 18.008 -7.993 -2.692 1.00 0.00 O flip ATOM 756 NE2 GLN A 48 17.901 -9.751 -3.980 1.00 0.00 N flip ATOM 0 H GLN A 48 14.119 -6.504 -5.142 1.00 0.00 H new ATOM 0 HA GLN A 48 13.481 -8.235 -3.114 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.817 -6.318 -3.439 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.733 -7.371 -2.040 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.275 -9.293 -3.778 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.871 -8.161 -4.975 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.398 -10.357 -4.629 1.00 0.00 H new ATOM 0 HE22 GLN A 48 18.860 -9.973 -3.714 1.00 0.00 H new ATOM 765 N ALA A 49 13.287 -5.139 -2.086 1.00 0.00 N ATOM 766 CA ALA A 49 12.826 -4.291 -0.959 1.00 0.00 C ATOM 767 C ALA A 49 11.371 -4.608 -0.628 1.00 0.00 C ATOM 768 O ALA A 49 11.063 -5.038 0.451 1.00 0.00 O ATOM 769 CB ALA A 49 12.936 -2.818 -1.341 1.00 0.00 C ATOM 0 H ALA A 49 13.511 -4.634 -2.944 1.00 0.00 H new ATOM 0 HA ALA A 49 13.452 -4.495 -0.090 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.596 -2.200 -0.510 1.00 0.00 H new ATOM 0 HB2 ALA A 49 13.974 -2.578 -1.571 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.316 -2.622 -2.216 1.00 0.00 H new ATOM 775 N VAL A 50 10.476 -4.382 -1.544 1.00 0.00 N ATOM 776 CA VAL A 50 9.034 -4.650 -1.263 1.00 0.00 C ATOM 777 C VAL A 50 8.787 -6.159 -1.139 1.00 0.00 C ATOM 778 O VAL A 50 8.175 -6.622 -0.202 1.00 0.00 O ATOM 779 CB VAL A 50 8.189 -4.059 -2.399 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.160 -5.005 -3.601 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.765 -3.833 -1.908 1.00 0.00 C ATOM 0 H VAL A 50 10.677 -4.023 -2.477 1.00 0.00 H new ATOM 0 HA VAL A 50 8.751 -4.184 -0.319 1.00 0.00 H new ATOM 0 HB VAL A 50 8.635 -3.113 -2.706 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.555 -4.566 -4.395 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.176 -5.163 -3.964 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.728 -5.960 -3.302 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.164 -3.413 -2.715 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.334 -4.783 -1.591 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.776 -3.141 -1.066 1.00 0.00 H new ATOM 791 N VAL A 51 9.259 -6.912 -2.083 1.00 0.00 N ATOM 792 CA VAL A 51 9.074 -8.391 -2.066 1.00 0.00 C ATOM 793 C VAL A 51 9.601 -8.976 -0.747 1.00 0.00 C ATOM 794 O VAL A 51 8.959 -9.794 -0.119 1.00 0.00 O ATOM 795 CB VAL A 51 9.848 -8.983 -3.248 1.00 0.00 C ATOM 796 CG1 VAL A 51 11.330 -9.081 -2.898 1.00 0.00 C ATOM 797 CG2 VAL A 51 9.314 -10.375 -3.573 1.00 0.00 C ATOM 0 H VAL A 51 9.779 -6.560 -2.887 1.00 0.00 H new ATOM 0 HA VAL A 51 8.015 -8.636 -2.148 1.00 0.00 H new ATOM 0 HB VAL A 51 9.720 -8.334 -4.115 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.876 -9.503 -3.742 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.718 -8.087 -2.675 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.456 -9.724 -2.027 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.869 -10.790 -4.414 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.434 -11.023 -2.704 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.258 -10.308 -3.833 1.00 0.00 H new ATOM 807 N ARG A 52 10.762 -8.561 -0.321 1.00 0.00 N ATOM 808 CA ARG A 52 11.315 -9.087 0.957 1.00 0.00 C ATOM 809 C ARG A 52 10.486 -8.499 2.095 1.00 0.00 C ATOM 810 O ARG A 52 10.172 -9.164 3.060 1.00 0.00 O ATOM 811 CB ARG A 52 12.783 -8.672 1.091 1.00 0.00 C ATOM 812 CG ARG A 52 13.604 -9.360 0.000 1.00 0.00 C ATOM 813 CD ARG A 52 14.407 -10.502 0.622 1.00 0.00 C ATOM 814 NE ARG A 52 14.630 -11.570 -0.393 1.00 0.00 N ATOM 815 CZ ARG A 52 15.540 -12.483 -0.187 1.00 0.00 C ATOM 816 NH1 ARG A 52 15.588 -13.108 0.958 1.00 0.00 N ATOM 817 NH2 ARG A 52 16.402 -12.768 -1.123 1.00 0.00 N ATOM 0 H ARG A 52 11.351 -7.881 -0.802 1.00 0.00 H new ATOM 0 HA ARG A 52 11.268 -10.176 0.984 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.876 -7.589 1.004 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.162 -8.947 2.075 1.00 0.00 H new ATOM 0 HG2 ARG A 52 12.946 -9.744 -0.779 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.275 -8.643 -0.474 1.00 0.00 H new ATOM 0 HD2 ARG A 52 15.364 -10.129 0.988 1.00 0.00 H new ATOM 0 HD3 ARG A 52 13.873 -10.909 1.481 1.00 0.00 H new ATOM 0 HE ARG A 52 14.073 -11.588 -1.247 1.00 0.00 H new ATOM 0 HH11 ARG A 52 14.915 -12.883 1.691 1.00 0.00 H new ATOM 0 HH12 ARG A 52 16.299 -13.822 1.120 1.00 0.00 H new ATOM 0 HH21 ARG A 52 16.365 -12.277 -2.017 1.00 0.00 H new ATOM 0 HH22 ARG A 52 17.113 -13.481 -0.962 1.00 0.00 H new ATOM 831 N GLU A 53 10.088 -7.263 1.951 1.00 0.00 N ATOM 832 CA GLU A 53 9.225 -6.619 2.983 1.00 0.00 C ATOM 833 C GLU A 53 7.860 -7.293 2.928 1.00 0.00 C ATOM 834 O GLU A 53 7.041 -7.158 3.814 1.00 0.00 O ATOM 835 CB GLU A 53 9.046 -5.133 2.665 1.00 0.00 C ATOM 836 CG GLU A 53 10.392 -4.423 2.749 1.00 0.00 C ATOM 837 CD GLU A 53 10.536 -3.762 4.118 1.00 0.00 C ATOM 838 OE1 GLU A 53 9.625 -3.902 4.916 1.00 0.00 O ATOM 839 OE2 GLU A 53 11.555 -3.132 4.346 1.00 0.00 O ATOM 0 H GLU A 53 10.326 -6.668 1.157 1.00 0.00 H new ATOM 0 HA GLU A 53 9.682 -6.721 3.967 1.00 0.00 H new ATOM 0 HB2 GLU A 53 8.623 -5.013 1.668 1.00 0.00 H new ATOM 0 HB3 GLU A 53 8.343 -4.684 3.366 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.201 -5.136 2.591 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.469 -3.673 1.962 1.00 0.00 H new ATOM 846 N LEU A 54 7.621 -8.020 1.875 1.00 0.00 N ATOM 847 CA LEU A 54 6.326 -8.720 1.704 1.00 0.00 C ATOM 848 C LEU A 54 6.352 -10.003 2.539 1.00 0.00 C ATOM 849 O LEU A 54 5.548 -10.194 3.429 1.00 0.00 O ATOM 850 CB LEU A 54 6.166 -9.065 0.214 1.00 0.00 C ATOM 851 CG LEU A 54 5.106 -8.178 -0.451 1.00 0.00 C ATOM 852 CD1 LEU A 54 3.848 -8.155 0.406 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.649 -6.755 -0.598 1.00 0.00 C ATOM 0 H LEU A 54 8.284 -8.159 1.112 1.00 0.00 H new ATOM 0 HA LEU A 54 5.494 -8.096 2.030 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.121 -8.939 -0.296 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.885 -10.113 0.109 1.00 0.00 H new ATOM 0 HG LEU A 54 4.866 -8.579 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.096 -7.524 -0.068 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.459 -9.168 0.509 1.00 0.00 H new ATOM 0 HD13 LEU A 54 4.087 -7.756 1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.895 -6.125 -1.071 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.891 -6.355 0.386 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.548 -6.770 -1.215 1.00 0.00 H new ATOM 865 N GLN A 55 7.277 -10.880 2.257 1.00 0.00 N ATOM 866 CA GLN A 55 7.368 -12.154 3.030 1.00 0.00 C ATOM 867 C GLN A 55 7.657 -11.853 4.505 1.00 0.00 C ATOM 868 O GLN A 55 6.950 -12.299 5.387 1.00 0.00 O ATOM 869 CB GLN A 55 8.493 -13.030 2.462 1.00 0.00 C ATOM 870 CG GLN A 55 9.686 -12.163 2.038 1.00 0.00 C ATOM 871 CD GLN A 55 10.936 -12.616 2.795 1.00 0.00 C ATOM 872 OE1 GLN A 55 11.155 -12.217 3.923 1.00 0.00 O ATOM 873 NE2 GLN A 55 11.772 -13.434 2.219 1.00 0.00 N ATOM 0 H GLN A 55 7.976 -10.770 1.523 1.00 0.00 H new ATOM 0 HA GLN A 55 6.418 -12.683 2.948 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.811 -13.755 3.211 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.125 -13.596 1.606 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.847 -12.247 0.963 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.480 -11.113 2.248 1.00 0.00 H new ATOM 0 HE21 GLN A 55 11.588 -13.769 1.273 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.610 -13.739 2.714 1.00 0.00 H new ATOM 882 N GLU A 56 8.692 -11.108 4.784 1.00 0.00 N ATOM 883 CA GLU A 56 9.025 -10.792 6.203 1.00 0.00 C ATOM 884 C GLU A 56 7.769 -10.335 6.948 1.00 0.00 C ATOM 885 O GLU A 56 7.701 -10.398 8.159 1.00 0.00 O ATOM 886 CB GLU A 56 10.072 -9.679 6.246 1.00 0.00 C ATOM 887 CG GLU A 56 9.579 -8.472 5.451 1.00 0.00 C ATOM 888 CD GLU A 56 8.851 -7.496 6.378 1.00 0.00 C ATOM 889 OE1 GLU A 56 8.608 -7.858 7.517 1.00 0.00 O ATOM 890 OE2 GLU A 56 8.549 -6.400 5.929 1.00 0.00 O ATOM 0 H GLU A 56 9.322 -10.704 4.091 1.00 0.00 H new ATOM 0 HA GLU A 56 9.420 -11.688 6.683 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.267 -9.390 7.279 1.00 0.00 H new ATOM 0 HB3 GLU A 56 11.014 -10.038 5.832 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.422 -7.972 4.973 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.909 -8.799 4.656 1.00 0.00 H new ATOM 897 N GLU A 57 6.775 -9.873 6.241 1.00 0.00 N ATOM 898 CA GLU A 57 5.539 -9.412 6.924 1.00 0.00 C ATOM 899 C GLU A 57 4.671 -10.619 7.286 1.00 0.00 C ATOM 900 O GLU A 57 4.822 -11.212 8.335 1.00 0.00 O ATOM 901 CB GLU A 57 4.765 -8.472 5.997 1.00 0.00 C ATOM 902 CG GLU A 57 5.021 -7.029 6.434 1.00 0.00 C ATOM 903 CD GLU A 57 5.171 -6.122 5.213 1.00 0.00 C ATOM 904 OE1 GLU A 57 4.547 -6.407 4.204 1.00 0.00 O ATOM 905 OE2 GLU A 57 5.914 -5.154 5.310 1.00 0.00 O ATOM 0 H GLU A 57 6.767 -9.796 5.224 1.00 0.00 H new ATOM 0 HA GLU A 57 5.804 -8.878 7.837 1.00 0.00 H new ATOM 0 HB2 GLU A 57 5.082 -8.615 4.964 1.00 0.00 H new ATOM 0 HB3 GLU A 57 3.699 -8.695 6.038 1.00 0.00 H new ATOM 0 HG2 GLU A 57 4.197 -6.679 7.056 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.923 -6.981 7.044 1.00 0.00 H new ATOM 912 N VAL A 58 3.756 -10.979 6.433 1.00 0.00 N ATOM 913 CA VAL A 58 2.873 -12.133 6.730 1.00 0.00 C ATOM 914 C VAL A 58 3.603 -13.447 6.428 1.00 0.00 C ATOM 915 O VAL A 58 4.093 -14.098 7.328 1.00 0.00 O ATOM 916 CB VAL A 58 1.620 -11.986 5.881 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.608 -13.066 6.241 1.00 0.00 C ATOM 918 CG2 VAL A 58 1.024 -10.609 6.162 1.00 0.00 C ATOM 0 H VAL A 58 3.583 -10.520 5.539 1.00 0.00 H new ATOM 0 HA VAL A 58 2.600 -12.153 7.785 1.00 0.00 H new ATOM 0 HB VAL A 58 1.869 -12.090 4.825 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.284 -12.949 5.626 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.045 -14.048 6.063 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.337 -12.975 7.293 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.122 -10.474 5.566 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.775 -10.529 7.220 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.749 -9.838 5.901 1.00 0.00 H new ATOM 928 N GLY A 59 3.707 -13.850 5.186 1.00 0.00 N ATOM 929 CA GLY A 59 4.441 -15.121 4.910 1.00 0.00 C ATOM 930 C GLY A 59 3.878 -15.878 3.696 1.00 0.00 C ATOM 931 O GLY A 59 4.146 -17.052 3.531 1.00 0.00 O ATOM 0 H GLY A 59 3.326 -13.368 4.371 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.494 -14.898 4.738 1.00 0.00 H new ATOM 0 HA3 GLY A 59 4.391 -15.763 5.789 1.00 0.00 H new ATOM 935 N ILE A 60 3.135 -15.245 2.824 1.00 0.00 N ATOM 936 CA ILE A 60 2.634 -16.002 1.634 1.00 0.00 C ATOM 937 C ILE A 60 3.775 -16.071 0.614 1.00 0.00 C ATOM 938 O ILE A 60 4.930 -15.958 0.976 1.00 0.00 O ATOM 939 CB ILE A 60 1.408 -15.314 1.014 1.00 0.00 C ATOM 940 CG1 ILE A 60 1.768 -13.889 0.616 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.259 -15.285 2.026 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.823 -13.781 -0.908 1.00 0.00 C ATOM 0 H ILE A 60 2.859 -14.265 2.879 1.00 0.00 H new ATOM 0 HA ILE A 60 2.324 -17.002 1.936 1.00 0.00 H new ATOM 0 HB ILE A 60 1.096 -15.872 0.131 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.030 -13.192 1.014 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.731 -13.613 1.045 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.607 -14.796 1.580 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.005 -16.305 2.306 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.570 -14.734 2.914 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.081 -12.761 -1.191 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.577 -14.466 -1.294 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.850 -14.039 -1.326 1.00 0.00 H new ATOM 954 N THR A 61 3.492 -16.250 -0.649 1.00 0.00 N ATOM 955 CA THR A 61 4.615 -16.316 -1.629 1.00 0.00 C ATOM 956 C THR A 61 4.282 -15.513 -2.905 1.00 0.00 C ATOM 957 O THR A 61 4.856 -14.464 -3.112 1.00 0.00 O ATOM 958 CB THR A 61 4.936 -17.785 -1.950 1.00 0.00 C ATOM 959 OG1 THR A 61 5.787 -18.304 -0.937 1.00 0.00 O ATOM 960 CG2 THR A 61 5.642 -17.888 -3.306 1.00 0.00 C ATOM 0 H THR A 61 2.555 -16.351 -1.038 1.00 0.00 H new ATOM 0 HA THR A 61 5.501 -15.860 -1.188 1.00 0.00 H new ATOM 0 HB THR A 61 4.008 -18.355 -1.990 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.758 -17.717 -0.153 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.864 -18.933 -3.522 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.994 -17.486 -4.085 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.571 -17.318 -3.277 1.00 0.00 H new ATOM 968 N PRO A 62 3.384 -16.008 -3.735 1.00 0.00 N ATOM 969 CA PRO A 62 3.026 -15.301 -4.975 1.00 0.00 C ATOM 970 C PRO A 62 2.433 -13.932 -4.663 1.00 0.00 C ATOM 971 O PRO A 62 2.473 -13.465 -3.544 1.00 0.00 O ATOM 972 CB PRO A 62 1.977 -16.179 -5.658 1.00 0.00 C ATOM 973 CG PRO A 62 1.663 -17.350 -4.702 1.00 0.00 C ATOM 974 CD PRO A 62 2.659 -17.271 -3.527 1.00 0.00 C ATOM 0 HA PRO A 62 3.900 -15.137 -5.606 1.00 0.00 H new ATOM 0 HB2 PRO A 62 1.075 -15.605 -5.871 1.00 0.00 H new ATOM 0 HB3 PRO A 62 2.350 -16.552 -6.612 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.637 -17.284 -4.340 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.757 -18.304 -5.221 1.00 0.00 H new ATOM 0 HD2 PRO A 62 2.141 -17.277 -2.568 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.339 -18.123 -3.527 1.00 0.00 H new ATOM 982 N GLN A 63 1.885 -13.311 -5.672 1.00 0.00 N ATOM 983 CA GLN A 63 1.268 -11.960 -5.553 1.00 0.00 C ATOM 984 C GLN A 63 1.581 -11.211 -6.848 1.00 0.00 C ATOM 985 O GLN A 63 0.891 -10.295 -7.234 1.00 0.00 O ATOM 986 CB GLN A 63 1.852 -11.183 -4.368 1.00 0.00 C ATOM 987 CG GLN A 63 3.378 -11.215 -4.436 1.00 0.00 C ATOM 988 CD GLN A 63 3.933 -9.810 -4.202 1.00 0.00 C ATOM 989 OE1 GLN A 63 3.299 -8.991 -3.566 1.00 0.00 O ATOM 990 NE2 GLN A 63 5.099 -9.493 -4.695 1.00 0.00 N ATOM 0 H GLN A 63 1.839 -13.703 -6.612 1.00 0.00 H new ATOM 0 HA GLN A 63 0.195 -12.057 -5.388 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.499 -10.152 -4.387 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.510 -11.620 -3.430 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.771 -11.901 -3.686 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.701 -11.587 -5.408 1.00 0.00 H new ATOM 0 HE21 GLN A 63 5.631 -10.180 -5.229 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.478 -8.558 -4.547 1.00 0.00 H new ATOM 999 N HIS A 64 2.624 -11.613 -7.527 1.00 0.00 N ATOM 1000 CA HIS A 64 2.998 -10.945 -8.805 1.00 0.00 C ATOM 1001 C HIS A 64 2.917 -9.433 -8.631 1.00 0.00 C ATOM 1002 O HIS A 64 2.264 -8.744 -9.390 1.00 0.00 O ATOM 1003 CB HIS A 64 2.036 -11.383 -9.906 1.00 0.00 C ATOM 1004 CG HIS A 64 2.807 -11.687 -11.161 1.00 0.00 C ATOM 1005 ND1 HIS A 64 3.376 -10.691 -11.940 1.00 0.00 N ATOM 1006 CD2 HIS A 64 3.108 -12.871 -11.789 1.00 0.00 C ATOM 1007 CE1 HIS A 64 3.984 -11.289 -12.982 1.00 0.00 C ATOM 1008 NE2 HIS A 64 3.850 -12.617 -12.938 1.00 0.00 N ATOM 0 H HIS A 64 3.235 -12.380 -7.248 1.00 0.00 H new ATOM 0 HA HIS A 64 4.016 -11.224 -9.078 1.00 0.00 H new ATOM 0 HB2 HIS A 64 1.480 -12.264 -9.587 1.00 0.00 H new ATOM 0 HB3 HIS A 64 1.305 -10.597 -10.098 1.00 0.00 H new ATOM 0 HD2 HIS A 64 2.813 -13.851 -11.443 1.00 0.00 H new ATOM 0 HE1 HIS A 64 4.515 -10.759 -13.759 1.00 0.00 H new ATOM 0 HE2 HIS A 64 4.214 -13.299 -13.604 1.00 0.00 H new ATOM 1016 N PHE A 65 3.574 -8.911 -7.637 1.00 0.00 N ATOM 1017 CA PHE A 65 3.532 -7.444 -7.416 1.00 0.00 C ATOM 1018 C PHE A 65 3.747 -6.700 -8.736 1.00 0.00 C ATOM 1019 O PHE A 65 4.317 -7.212 -9.679 1.00 0.00 O ATOM 1020 CB PHE A 65 4.600 -7.031 -6.395 1.00 0.00 C ATOM 1021 CG PHE A 65 5.987 -7.505 -6.795 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.198 -8.281 -7.949 1.00 0.00 C ATOM 1023 CD2 PHE A 65 7.080 -7.155 -5.990 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.491 -8.698 -8.287 1.00 0.00 C ATOM 1025 CE2 PHE A 65 8.371 -7.573 -6.330 1.00 0.00 C ATOM 1026 CZ PHE A 65 8.576 -8.344 -7.478 1.00 0.00 C ATOM 0 H PHE A 65 4.138 -9.437 -6.969 1.00 0.00 H new ATOM 0 HA PHE A 65 2.550 -7.179 -7.023 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.604 -5.946 -6.294 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.345 -7.442 -5.418 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.362 -8.555 -8.575 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.925 -6.559 -5.103 1.00 0.00 H new ATOM 0 HE1 PHE A 65 7.651 -9.294 -9.173 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.209 -7.300 -5.706 1.00 0.00 H new ATOM 0 HZ PHE A 65 9.573 -8.667 -7.741 1.00 0.00 H new ATOM 1036 N SER A 66 3.276 -5.492 -8.805 1.00 0.00 N ATOM 1037 CA SER A 66 3.426 -4.690 -10.046 1.00 0.00 C ATOM 1038 C SER A 66 3.516 -3.220 -9.648 1.00 0.00 C ATOM 1039 O SER A 66 2.839 -2.785 -8.747 1.00 0.00 O ATOM 1040 CB SER A 66 2.202 -4.913 -10.935 1.00 0.00 C ATOM 1041 OG SER A 66 1.640 -6.186 -10.648 1.00 0.00 O ATOM 0 H SER A 66 2.787 -5.019 -8.045 1.00 0.00 H new ATOM 0 HA SER A 66 4.321 -4.985 -10.593 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.464 -4.129 -10.762 1.00 0.00 H new ATOM 0 HB3 SER A 66 2.486 -4.856 -11.986 1.00 0.00 H new ATOM 0 HG SER A 66 1.111 -6.132 -9.825 1.00 0.00 H new ATOM 1047 N LEU A 67 4.349 -2.451 -10.284 1.00 0.00 N ATOM 1048 CA LEU A 67 4.456 -1.020 -9.887 1.00 0.00 C ATOM 1049 C LEU A 67 3.124 -0.312 -10.139 1.00 0.00 C ATOM 1050 O LEU A 67 2.455 0.094 -9.223 1.00 0.00 O ATOM 1051 CB LEU A 67 5.555 -0.328 -10.703 1.00 0.00 C ATOM 1052 CG LEU A 67 6.269 0.762 -9.874 1.00 0.00 C ATOM 1053 CD1 LEU A 67 6.500 1.983 -10.757 1.00 0.00 C ATOM 1054 CD2 LEU A 67 5.427 1.192 -8.664 1.00 0.00 C ATOM 0 H LEU A 67 4.954 -2.743 -11.051 1.00 0.00 H new ATOM 0 HA LEU A 67 4.705 -0.968 -8.827 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.282 -1.068 -11.038 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.120 0.119 -11.597 1.00 0.00 H new ATOM 0 HG LEU A 67 7.212 0.350 -9.514 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.004 2.759 -10.181 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.120 1.704 -11.609 1.00 0.00 H new ATOM 0 HD13 LEU A 67 5.542 2.361 -11.114 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.961 1.960 -8.104 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.473 1.591 -9.008 1.00 0.00 H new ATOM 0 HD23 LEU A 67 5.249 0.331 -8.020 1.00 0.00 H new ATOM 1066 N PHE A 68 2.759 -0.154 -11.381 1.00 0.00 N ATOM 1067 CA PHE A 68 1.484 0.539 -11.746 1.00 0.00 C ATOM 1068 C PHE A 68 1.733 2.052 -11.757 1.00 0.00 C ATOM 1069 O PHE A 68 1.411 2.741 -12.704 1.00 0.00 O ATOM 1070 CB PHE A 68 0.356 0.150 -10.758 1.00 0.00 C ATOM 1071 CG PHE A 68 -0.284 1.379 -10.132 1.00 0.00 C ATOM 1072 CD1 PHE A 68 0.298 1.985 -9.010 1.00 0.00 C ATOM 1073 CD2 PHE A 68 -1.458 1.911 -10.682 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -0.293 3.119 -8.439 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -2.049 3.044 -10.110 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.466 3.648 -8.989 1.00 0.00 C ATOM 0 H PHE A 68 3.302 -0.483 -12.179 1.00 0.00 H new ATOM 0 HA PHE A 68 1.159 0.230 -12.739 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.404 -0.430 -11.282 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.762 -0.490 -9.974 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.203 1.577 -8.585 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -1.907 1.447 -11.548 1.00 0.00 H new ATOM 0 HE1 PHE A 68 0.156 3.585 -7.575 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -2.955 3.452 -10.533 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.922 4.522 -8.549 1.00 0.00 H new ATOM 1086 N GLU A 69 2.308 2.566 -10.709 1.00 0.00 N ATOM 1087 CA GLU A 69 2.590 4.022 -10.640 1.00 0.00 C ATOM 1088 C GLU A 69 2.832 4.372 -9.182 1.00 0.00 C ATOM 1089 O GLU A 69 2.685 3.541 -8.317 1.00 0.00 O ATOM 1090 CB GLU A 69 1.397 4.817 -11.177 1.00 0.00 C ATOM 1091 CG GLU A 69 1.759 5.428 -12.535 1.00 0.00 C ATOM 1092 CD GLU A 69 1.021 6.757 -12.712 1.00 0.00 C ATOM 1093 OE1 GLU A 69 1.479 7.744 -12.162 1.00 0.00 O ATOM 1094 OE2 GLU A 69 0.011 6.764 -13.396 1.00 0.00 O ATOM 0 H GLU A 69 2.597 2.033 -9.889 1.00 0.00 H new ATOM 0 HA GLU A 69 3.462 4.271 -11.246 1.00 0.00 H new ATOM 0 HB2 GLU A 69 0.529 4.166 -11.279 1.00 0.00 H new ATOM 0 HB3 GLU A 69 1.124 5.604 -10.473 1.00 0.00 H new ATOM 0 HG2 GLU A 69 2.836 5.587 -12.599 1.00 0.00 H new ATOM 0 HG3 GLU A 69 1.490 4.741 -13.338 1.00 0.00 H new ATOM 1101 N LYS A 70 3.215 5.575 -8.889 1.00 0.00 N ATOM 1102 CA LYS A 70 3.466 5.921 -7.468 1.00 0.00 C ATOM 1103 C LYS A 70 3.448 7.434 -7.292 1.00 0.00 C ATOM 1104 O LYS A 70 3.124 8.173 -8.201 1.00 0.00 O ATOM 1105 CB LYS A 70 4.830 5.375 -7.051 1.00 0.00 C ATOM 1106 CG LYS A 70 5.788 5.435 -8.241 1.00 0.00 C ATOM 1107 CD LYS A 70 7.107 6.064 -7.799 1.00 0.00 C ATOM 1108 CE LYS A 70 7.967 5.008 -7.106 1.00 0.00 C ATOM 1109 NZ LYS A 70 9.052 5.682 -6.342 1.00 0.00 N ATOM 0 H LYS A 70 3.364 6.327 -9.561 1.00 0.00 H new ATOM 0 HA LYS A 70 2.687 5.481 -6.846 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.228 5.957 -6.220 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.731 4.347 -6.702 1.00 0.00 H new ATOM 0 HG2 LYS A 70 5.963 4.433 -8.632 1.00 0.00 H new ATOM 0 HG3 LYS A 70 5.346 6.019 -9.048 1.00 0.00 H new ATOM 0 HD2 LYS A 70 7.636 6.470 -8.661 1.00 0.00 H new ATOM 0 HD3 LYS A 70 6.917 6.896 -7.121 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.354 4.406 -6.435 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.394 4.329 -7.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.660 4.965 -5.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 9.621 6.265 -6.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.634 6.287 -5.607 1.00 0.00 H new ATOM 1123 N LEU A 71 3.803 7.901 -6.131 1.00 0.00 N ATOM 1124 CA LEU A 71 3.815 9.365 -5.901 1.00 0.00 C ATOM 1125 C LEU A 71 5.032 9.749 -5.069 1.00 0.00 C ATOM 1126 O LEU A 71 5.842 8.922 -4.700 1.00 0.00 O ATOM 1127 CB LEU A 71 2.545 9.794 -5.155 1.00 0.00 C ATOM 1128 CG LEU A 71 2.281 8.879 -3.947 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.465 8.914 -2.970 1.00 0.00 C ATOM 1130 CD2 LEU A 71 1.022 9.364 -3.223 1.00 0.00 C ATOM 0 H LEU A 71 4.085 7.331 -5.333 1.00 0.00 H new ATOM 0 HA LEU A 71 3.856 9.868 -6.867 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.647 10.826 -4.819 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.692 9.763 -5.833 1.00 0.00 H new ATOM 0 HG LEU A 71 2.149 7.857 -4.301 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.257 8.260 -2.123 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.367 8.573 -3.479 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.613 9.933 -2.614 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.826 8.722 -2.364 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.170 10.389 -2.883 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.173 9.327 -3.905 1.00 0.00 H new ATOM 1142 N GLU A 72 5.138 11.000 -4.756 1.00 0.00 N ATOM 1143 CA GLU A 72 6.264 11.482 -3.926 1.00 0.00 C ATOM 1144 C GLU A 72 5.847 12.824 -3.340 1.00 0.00 C ATOM 1145 O GLU A 72 6.081 13.868 -3.914 1.00 0.00 O ATOM 1146 CB GLU A 72 7.522 11.640 -4.786 1.00 0.00 C ATOM 1147 CG GLU A 72 8.759 11.254 -3.966 1.00 0.00 C ATOM 1148 CD GLU A 72 9.984 11.205 -4.882 1.00 0.00 C ATOM 1149 OE1 GLU A 72 9.826 10.818 -6.028 1.00 0.00 O ATOM 1150 OE2 GLU A 72 11.058 11.554 -4.420 1.00 0.00 O ATOM 0 H GLU A 72 4.480 11.723 -5.045 1.00 0.00 H new ATOM 0 HA GLU A 72 6.494 10.772 -3.131 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.450 11.010 -5.672 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.610 12.669 -5.133 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.918 11.977 -3.166 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.607 10.284 -3.493 1.00 0.00 H new ATOM 1157 N TYR A 73 5.214 12.799 -2.202 1.00 0.00 N ATOM 1158 CA TYR A 73 4.762 14.067 -1.579 1.00 0.00 C ATOM 1159 C TYR A 73 5.973 14.716 -0.927 1.00 0.00 C ATOM 1160 O TYR A 73 6.462 14.269 0.091 1.00 0.00 O ATOM 1161 CB TYR A 73 3.681 13.766 -0.533 1.00 0.00 C ATOM 1162 CG TYR A 73 2.497 14.676 -0.754 1.00 0.00 C ATOM 1163 CD1 TYR A 73 2.693 16.051 -0.923 1.00 0.00 C ATOM 1164 CD2 TYR A 73 1.204 14.143 -0.793 1.00 0.00 C ATOM 1165 CE1 TYR A 73 1.595 16.893 -1.131 1.00 0.00 C ATOM 1166 CE2 TYR A 73 0.105 14.985 -1.001 1.00 0.00 C ATOM 1167 CZ TYR A 73 0.301 16.360 -1.170 1.00 0.00 C ATOM 1168 OH TYR A 73 -0.782 17.191 -1.374 1.00 0.00 O ATOM 0 H TYR A 73 4.991 11.953 -1.678 1.00 0.00 H new ATOM 0 HA TYR A 73 4.335 14.740 -2.323 1.00 0.00 H new ATOM 0 HB2 TYR A 73 3.370 12.724 -0.606 1.00 0.00 H new ATOM 0 HB3 TYR A 73 4.081 13.910 0.471 1.00 0.00 H new ATOM 0 HD1 TYR A 73 3.691 16.462 -0.893 1.00 0.00 H new ATOM 0 HD2 TYR A 73 1.054 13.082 -0.663 1.00 0.00 H new ATOM 0 HE1 TYR A 73 1.746 17.954 -1.262 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -0.893 14.574 -1.031 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.606 16.660 -1.374 1.00 0.00 H new ATOM 1178 N GLU A 74 6.486 15.750 -1.531 1.00 0.00 N ATOM 1179 CA GLU A 74 7.691 16.403 -0.974 1.00 0.00 C ATOM 1180 C GLU A 74 7.292 17.605 -0.129 1.00 0.00 C ATOM 1181 O GLU A 74 6.717 18.561 -0.613 1.00 0.00 O ATOM 1182 CB GLU A 74 8.593 16.860 -2.122 1.00 0.00 C ATOM 1183 CG GLU A 74 9.961 17.260 -1.569 1.00 0.00 C ATOM 1184 CD GLU A 74 10.427 18.551 -2.244 1.00 0.00 C ATOM 1185 OE1 GLU A 74 10.255 18.663 -3.446 1.00 0.00 O ATOM 1186 OE2 GLU A 74 10.948 19.407 -1.547 1.00 0.00 O ATOM 0 H GLU A 74 6.120 16.168 -2.386 1.00 0.00 H new ATOM 0 HA GLU A 74 8.226 15.692 -0.345 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.705 16.058 -2.852 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.139 17.703 -2.642 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.901 17.402 -0.490 1.00 0.00 H new ATOM 0 HG3 GLU A 74 10.684 16.463 -1.746 1.00 0.00 H new ATOM 1193 N PHE A 75 7.611 17.567 1.127 1.00 0.00 N ATOM 1194 CA PHE A 75 7.276 18.704 2.018 1.00 0.00 C ATOM 1195 C PHE A 75 8.571 19.470 2.308 1.00 0.00 C ATOM 1196 O PHE A 75 9.634 19.031 1.916 1.00 0.00 O ATOM 1197 CB PHE A 75 6.682 18.149 3.318 1.00 0.00 C ATOM 1198 CG PHE A 75 5.183 18.353 3.328 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.624 19.535 2.823 1.00 0.00 C ATOM 1200 CD2 PHE A 75 4.348 17.352 3.843 1.00 0.00 C ATOM 1201 CE1 PHE A 75 3.236 19.716 2.834 1.00 0.00 C ATOM 1202 CE2 PHE A 75 2.960 17.534 3.854 1.00 0.00 C ATOM 1203 CZ PHE A 75 2.404 18.715 3.350 1.00 0.00 C ATOM 0 H PHE A 75 8.094 16.791 1.580 1.00 0.00 H new ATOM 0 HA PHE A 75 6.550 19.372 1.555 1.00 0.00 H new ATOM 0 HB2 PHE A 75 6.914 17.088 3.410 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.131 18.649 4.176 1.00 0.00 H new ATOM 0 HD1 PHE A 75 5.265 20.307 2.425 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.776 16.440 4.232 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.807 20.627 2.445 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.318 16.762 4.252 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.333 18.854 3.359 1.00 0.00 H new ATOM 1213 N PRO A 76 8.464 20.581 2.989 1.00 0.00 N ATOM 1214 CA PRO A 76 9.645 21.387 3.331 1.00 0.00 C ATOM 1215 C PRO A 76 10.722 20.486 3.935 1.00 0.00 C ATOM 1216 O PRO A 76 11.808 20.356 3.406 1.00 0.00 O ATOM 1217 CB PRO A 76 9.133 22.405 4.357 1.00 0.00 C ATOM 1218 CG PRO A 76 7.593 22.237 4.454 1.00 0.00 C ATOM 1219 CD PRO A 76 7.186 21.121 3.479 1.00 0.00 C ATOM 0 HA PRO A 76 10.094 21.879 2.468 1.00 0.00 H new ATOM 0 HB2 PRO A 76 9.599 22.238 5.328 1.00 0.00 H new ATOM 0 HB3 PRO A 76 9.389 23.419 4.051 1.00 0.00 H new ATOM 0 HG2 PRO A 76 7.299 21.982 5.472 1.00 0.00 H new ATOM 0 HG3 PRO A 76 7.089 23.170 4.201 1.00 0.00 H new ATOM 0 HD2 PRO A 76 6.595 20.353 3.978 1.00 0.00 H new ATOM 0 HD3 PRO A 76 6.579 21.509 2.661 1.00 0.00 H new ATOM 1227 N ASP A 77 10.421 19.848 5.029 1.00 0.00 N ATOM 1228 CA ASP A 77 11.413 18.936 5.660 1.00 0.00 C ATOM 1229 C ASP A 77 10.776 17.555 5.815 1.00 0.00 C ATOM 1230 O ASP A 77 10.790 16.969 6.879 1.00 0.00 O ATOM 1231 CB ASP A 77 11.806 19.480 7.035 1.00 0.00 C ATOM 1232 CG ASP A 77 13.091 20.299 6.912 1.00 0.00 C ATOM 1233 OD1 ASP A 77 13.025 21.389 6.367 1.00 0.00 O ATOM 1234 OD2 ASP A 77 14.120 19.824 7.365 1.00 0.00 O ATOM 0 H ASP A 77 9.527 19.919 5.516 1.00 0.00 H new ATOM 0 HA ASP A 77 12.305 18.866 5.038 1.00 0.00 H new ATOM 0 HB2 ASP A 77 11.004 20.100 7.435 1.00 0.00 H new ATOM 0 HB3 ASP A 77 11.952 18.657 7.735 1.00 0.00 H new ATOM 1239 N ARG A 78 10.205 17.038 4.759 1.00 0.00 N ATOM 1240 CA ARG A 78 9.551 15.703 4.843 1.00 0.00 C ATOM 1241 C ARG A 78 9.625 15.004 3.482 1.00 0.00 C ATOM 1242 O ARG A 78 8.727 15.110 2.670 1.00 0.00 O ATOM 1243 CB ARG A 78 8.087 15.892 5.242 1.00 0.00 C ATOM 1244 CG ARG A 78 7.818 15.173 6.566 1.00 0.00 C ATOM 1245 CD ARG A 78 7.413 13.724 6.293 1.00 0.00 C ATOM 1246 NE ARG A 78 6.107 13.434 6.952 1.00 0.00 N ATOM 1247 CZ ARG A 78 5.836 13.947 8.121 1.00 0.00 C ATOM 1248 NH1 ARG A 78 6.667 13.782 9.113 1.00 0.00 N ATOM 1249 NH2 ARG A 78 4.736 14.627 8.298 1.00 0.00 N ATOM 0 H ARG A 78 10.164 17.484 3.843 1.00 0.00 H new ATOM 0 HA ARG A 78 10.061 15.090 5.586 1.00 0.00 H new ATOM 0 HB2 ARG A 78 7.861 16.954 5.341 1.00 0.00 H new ATOM 0 HB3 ARG A 78 7.434 15.498 4.463 1.00 0.00 H new ATOM 0 HG2 ARG A 78 8.709 15.200 7.193 1.00 0.00 H new ATOM 0 HG3 ARG A 78 7.027 15.685 7.115 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.335 13.554 5.219 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.179 13.045 6.668 1.00 0.00 H new ATOM 0 HE ARG A 78 5.425 12.834 6.488 1.00 0.00 H new ATOM 0 HH11 ARG A 78 7.528 13.252 8.975 1.00 0.00 H new ATOM 0 HH12 ARG A 78 6.456 14.183 10.027 1.00 0.00 H new ATOM 0 HH21 ARG A 78 4.087 14.758 7.522 1.00 0.00 H new ATOM 0 HH22 ARG A 78 4.525 15.027 9.212 1.00 0.00 H new ATOM 1263 N HIS A 79 10.686 14.284 3.230 1.00 0.00 N ATOM 1264 CA HIS A 79 10.816 13.574 1.924 1.00 0.00 C ATOM 1265 C HIS A 79 10.215 12.172 2.046 1.00 0.00 C ATOM 1266 O HIS A 79 10.847 11.261 2.541 1.00 0.00 O ATOM 1267 CB HIS A 79 12.297 13.456 1.558 1.00 0.00 C ATOM 1268 CG HIS A 79 12.624 14.418 0.448 1.00 0.00 C ATOM 1269 ND1 HIS A 79 13.738 15.242 0.490 1.00 0.00 N ATOM 1270 CD2 HIS A 79 11.997 14.694 -0.741 1.00 0.00 C ATOM 1271 CE1 HIS A 79 13.746 15.969 -0.643 1.00 0.00 C ATOM 1272 NE2 HIS A 79 12.708 15.673 -1.428 1.00 0.00 N ATOM 0 H HIS A 79 11.468 14.157 3.872 1.00 0.00 H new ATOM 0 HA HIS A 79 10.289 14.133 1.151 1.00 0.00 H new ATOM 0 HB2 HIS A 79 12.915 13.669 2.430 1.00 0.00 H new ATOM 0 HB3 HIS A 79 12.524 12.436 1.247 1.00 0.00 H new ATOM 0 HD1 HIS A 79 14.426 15.289 1.242 1.00 0.00 H new ATOM 0 HD2 HIS A 79 11.090 14.223 -1.090 1.00 0.00 H new ATOM 0 HE1 HIS A 79 14.500 16.702 -0.887 1.00 0.00 H new ATOM 1280 N ILE A 80 8.999 11.990 1.604 1.00 0.00 N ATOM 1281 CA ILE A 80 8.372 10.641 1.706 1.00 0.00 C ATOM 1282 C ILE A 80 8.159 10.048 0.309 1.00 0.00 C ATOM 1283 O ILE A 80 8.169 10.740 -0.690 1.00 0.00 O ATOM 1284 CB ILE A 80 7.009 10.748 2.415 1.00 0.00 C ATOM 1285 CG1 ILE A 80 7.192 10.921 3.936 1.00 0.00 C ATOM 1286 CG2 ILE A 80 6.207 9.471 2.158 1.00 0.00 C ATOM 1287 CD1 ILE A 80 8.503 11.650 4.247 1.00 0.00 C ATOM 0 H ILE A 80 8.417 12.712 1.180 1.00 0.00 H new ATOM 0 HA ILE A 80 9.037 9.994 2.278 1.00 0.00 H new ATOM 0 HB ILE A 80 6.483 11.618 2.022 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.352 11.482 4.346 1.00 0.00 H new ATOM 0 HG13 ILE A 80 7.190 9.945 4.420 1.00 0.00 H new ATOM 0 HG21 ILE A 80 5.241 9.541 2.658 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.053 9.348 1.086 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.755 8.613 2.547 1.00 0.00 H new ATOM 0 HD11 ILE A 80 8.611 11.761 5.326 1.00 0.00 H new ATOM 0 HD12 ILE A 80 9.341 11.074 3.856 1.00 0.00 H new ATOM 0 HD13 ILE A 80 8.491 12.635 3.781 1.00 0.00 H new ATOM 1299 N THR A 81 7.934 8.765 0.253 1.00 0.00 N ATOM 1300 CA THR A 81 7.676 8.084 -1.046 1.00 0.00 C ATOM 1301 C THR A 81 6.789 6.873 -0.775 1.00 0.00 C ATOM 1302 O THR A 81 6.872 6.262 0.271 1.00 0.00 O ATOM 1303 CB THR A 81 8.991 7.613 -1.661 1.00 0.00 C ATOM 1304 OG1 THR A 81 10.032 8.505 -1.285 1.00 0.00 O ATOM 1305 CG2 THR A 81 8.864 7.584 -3.185 1.00 0.00 C ATOM 0 H THR A 81 7.918 8.150 1.066 1.00 0.00 H new ATOM 0 HA THR A 81 7.192 8.773 -1.737 1.00 0.00 H new ATOM 0 HB THR A 81 9.223 6.611 -1.301 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.785 8.409 -1.905 1.00 0.00 H new ATOM 0 HG21 THR A 81 9.804 7.247 -3.622 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.065 6.899 -3.471 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.632 8.585 -3.550 1.00 0.00 H new ATOM 1313 N LEU A 82 5.931 6.522 -1.688 1.00 0.00 N ATOM 1314 CA LEU A 82 5.047 5.352 -1.434 1.00 0.00 C ATOM 1315 C LEU A 82 4.995 4.435 -2.656 1.00 0.00 C ATOM 1316 O LEU A 82 4.003 4.380 -3.356 1.00 0.00 O ATOM 1317 CB LEU A 82 3.637 5.850 -1.113 1.00 0.00 C ATOM 1318 CG LEU A 82 2.993 4.929 -0.076 1.00 0.00 C ATOM 1319 CD1 LEU A 82 2.810 5.691 1.237 1.00 0.00 C ATOM 1320 CD2 LEU A 82 1.629 4.461 -0.590 1.00 0.00 C ATOM 0 H LEU A 82 5.803 6.986 -2.587 1.00 0.00 H new ATOM 0 HA LEU A 82 5.447 4.786 -0.593 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.678 6.871 -0.732 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.033 5.872 -2.020 1.00 0.00 H new ATOM 0 HG LEU A 82 3.634 4.064 0.093 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.351 5.036 1.977 1.00 0.00 H new ATOM 0 HD12 LEU A 82 3.781 6.026 1.602 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.167 6.555 1.070 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.168 3.804 0.148 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.987 5.326 -0.757 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.760 3.919 -1.527 1.00 0.00 H new ATOM 1332 N TRP A 83 6.040 3.696 -2.910 1.00 0.00 N ATOM 1333 CA TRP A 83 6.013 2.769 -4.080 1.00 0.00 C ATOM 1334 C TRP A 83 4.682 2.006 -4.068 1.00 0.00 C ATOM 1335 O TRP A 83 4.398 1.263 -3.150 1.00 0.00 O ATOM 1336 CB TRP A 83 7.159 1.760 -3.966 1.00 0.00 C ATOM 1337 CG TRP A 83 8.476 2.467 -3.975 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.066 3.030 -2.895 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.383 2.680 -5.095 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.279 3.570 -3.281 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.518 3.385 -4.627 1.00 0.00 C ATOM 1342 CE3 TRP A 83 9.332 2.336 -6.454 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.566 3.733 -5.479 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 10.384 2.686 -7.317 1.00 0.00 C ATOM 1345 CH2 TRP A 83 11.499 3.382 -6.830 1.00 0.00 C ATOM 0 H TRP A 83 6.903 3.692 -2.366 1.00 0.00 H new ATOM 0 HA TRP A 83 6.121 3.339 -5.003 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.055 1.183 -3.047 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.113 1.052 -4.794 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.657 3.054 -1.896 1.00 0.00 H new ATOM 0 HE1 TRP A 83 10.920 4.047 -2.647 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.478 1.798 -6.840 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.422 4.269 -5.098 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 10.333 2.417 -8.362 1.00 0.00 H new ATOM 0 HH2 TRP A 83 12.305 3.647 -7.498 1.00 0.00 H new ATOM 1356 N PHE A 84 3.863 2.178 -5.072 1.00 0.00 N ATOM 1357 CA PHE A 84 2.557 1.450 -5.095 1.00 0.00 C ATOM 1358 C PHE A 84 2.709 0.156 -5.883 1.00 0.00 C ATOM 1359 O PHE A 84 2.267 0.062 -7.003 1.00 0.00 O ATOM 1360 CB PHE A 84 1.489 2.304 -5.779 1.00 0.00 C ATOM 1361 CG PHE A 84 0.937 3.312 -4.800 1.00 0.00 C ATOM 1362 CD1 PHE A 84 1.651 4.481 -4.517 1.00 0.00 C ATOM 1363 CD2 PHE A 84 -0.292 3.072 -4.174 1.00 0.00 C ATOM 1364 CE1 PHE A 84 1.135 5.411 -3.606 1.00 0.00 C ATOM 1365 CE2 PHE A 84 -0.808 4.002 -3.264 1.00 0.00 C ATOM 1366 CZ PHE A 84 -0.093 5.171 -2.980 1.00 0.00 C ATOM 0 H PHE A 84 4.038 2.786 -5.872 1.00 0.00 H new ATOM 0 HA PHE A 84 2.260 1.238 -4.068 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.917 2.817 -6.641 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.686 1.668 -6.152 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.599 4.666 -5.000 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.842 2.169 -4.393 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.685 6.314 -3.387 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.757 3.818 -2.782 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.490 5.889 -2.277 1.00 0.00 H new ATOM 1376 N TRP A 85 3.304 -0.849 -5.314 1.00 0.00 N ATOM 1377 CA TRP A 85 3.448 -2.127 -6.059 1.00 0.00 C ATOM 1378 C TRP A 85 2.108 -2.871 -6.056 1.00 0.00 C ATOM 1379 O TRP A 85 1.870 -3.734 -5.235 1.00 0.00 O ATOM 1380 CB TRP A 85 4.513 -2.993 -5.385 1.00 0.00 C ATOM 1381 CG TRP A 85 5.852 -2.695 -5.983 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.698 -1.734 -5.547 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.511 -3.342 -7.111 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.835 -1.748 -6.335 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.767 -2.722 -7.313 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.146 -4.395 -7.969 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.630 -3.132 -8.330 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.012 -4.810 -8.994 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.252 -4.179 -9.173 1.00 0.00 C ATOM 0 H TRP A 85 3.695 -0.843 -4.372 1.00 0.00 H new ATOM 0 HA TRP A 85 3.747 -1.918 -7.086 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.530 -2.798 -4.313 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.273 -4.048 -5.513 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.516 -1.065 -4.719 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.626 -1.117 -6.210 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.194 -4.888 -7.839 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.584 -2.643 -8.464 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 6.722 -5.619 -9.648 1.00 0.00 H new ATOM 0 HH2 TRP A 85 8.914 -4.503 -9.962 1.00 0.00 H new ATOM 1400 N LEU A 86 1.223 -2.552 -6.964 1.00 0.00 N ATOM 1401 CA LEU A 86 -0.084 -3.266 -6.983 1.00 0.00 C ATOM 1402 C LEU A 86 0.140 -4.713 -7.418 1.00 0.00 C ATOM 1403 O LEU A 86 0.749 -4.982 -8.434 1.00 0.00 O ATOM 1404 CB LEU A 86 -1.045 -2.592 -7.965 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.833 -1.486 -7.259 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.414 -2.006 -5.940 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -0.904 -0.301 -6.983 1.00 0.00 C ATOM 0 H LEU A 86 1.347 -1.839 -7.682 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.517 -3.236 -5.983 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.486 -2.173 -8.802 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.732 -3.331 -8.378 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.655 -1.167 -7.901 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.972 -1.209 -5.449 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.081 -2.844 -6.142 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.603 -2.335 -5.290 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.462 0.489 -6.480 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.080 -0.625 -6.347 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.508 0.078 -7.925 1.00 0.00 H new ATOM 1419 N VAL A 87 -0.353 -5.643 -6.654 1.00 0.00 N ATOM 1420 CA VAL A 87 -0.177 -7.081 -7.017 1.00 0.00 C ATOM 1421 C VAL A 87 -1.553 -7.654 -7.388 1.00 0.00 C ATOM 1422 O VAL A 87 -2.551 -6.970 -7.289 1.00 0.00 O ATOM 1423 CB VAL A 87 0.453 -7.845 -5.825 1.00 0.00 C ATOM 1424 CG1 VAL A 87 1.132 -6.856 -4.869 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.614 -8.633 -5.051 1.00 0.00 C ATOM 0 H VAL A 87 -0.871 -5.474 -5.792 1.00 0.00 H new ATOM 0 HA VAL A 87 0.494 -7.188 -7.869 1.00 0.00 H new ATOM 0 HB VAL A 87 1.189 -8.543 -6.225 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.572 -7.401 -4.034 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.914 -6.314 -5.401 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.393 -6.149 -4.492 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.146 -9.160 -4.220 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.367 -7.945 -4.666 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.088 -9.354 -5.717 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.633 -8.888 -7.824 1.00 0.00 N ATOM 1436 CA GLU A 88 -2.976 -9.424 -8.195 1.00 0.00 C ATOM 1437 C GLU A 88 -3.039 -10.962 -8.145 1.00 0.00 C ATOM 1438 O GLU A 88 -3.930 -11.555 -8.720 1.00 0.00 O ATOM 1439 CB GLU A 88 -3.327 -8.948 -9.608 1.00 0.00 C ATOM 1440 CG GLU A 88 -3.543 -7.431 -9.602 1.00 0.00 C ATOM 1441 CD GLU A 88 -4.148 -6.993 -10.937 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -4.085 -7.768 -11.877 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -4.665 -5.889 -10.997 1.00 0.00 O ATOM 0 H GLU A 88 -0.849 -9.531 -7.936 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.693 -9.049 -7.464 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.526 -9.208 -10.300 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.227 -9.452 -9.959 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.205 -7.151 -8.782 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -2.595 -6.919 -9.436 1.00 0.00 H new ATOM 1450 N ARG A 89 -2.144 -11.627 -7.458 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.246 -13.122 -7.401 1.00 0.00 C ATOM 1452 C ARG A 89 -1.454 -13.684 -6.215 1.00 0.00 C ATOM 1453 O ARG A 89 -0.514 -14.427 -6.375 1.00 0.00 O ATOM 1454 CB ARG A 89 -1.757 -13.738 -8.721 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.229 -13.756 -8.781 1.00 0.00 C ATOM 1456 CD ARG A 89 0.272 -15.200 -8.671 1.00 0.00 C ATOM 1457 NE ARG A 89 0.290 -15.822 -10.027 1.00 0.00 N ATOM 1458 CZ ARG A 89 0.930 -16.941 -10.226 1.00 0.00 C ATOM 1459 NH1 ARG A 89 1.161 -17.747 -9.226 1.00 0.00 N ATOM 1460 NH2 ARG A 89 1.341 -17.256 -11.425 1.00 0.00 N ATOM 0 H ARG A 89 -1.365 -11.215 -6.945 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.293 -13.388 -7.258 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.141 -14.754 -8.817 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.151 -13.167 -9.562 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.114 -13.312 -9.715 1.00 0.00 H new ATOM 0 HG3 ARG A 89 0.184 -13.154 -7.971 1.00 0.00 H new ATOM 0 HD2 ARG A 89 1.272 -15.218 -8.237 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.375 -15.771 -8.005 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.199 -15.371 -10.800 1.00 0.00 H new ATOM 0 HH11 ARG A 89 0.841 -17.502 -8.289 1.00 0.00 H new ATOM 0 HH12 ARG A 89 1.661 -18.622 -9.381 1.00 0.00 H new ATOM 0 HH21 ARG A 89 1.162 -16.627 -12.207 1.00 0.00 H new ATOM 0 HH22 ARG A 89 1.841 -18.131 -11.579 1.00 0.00 H new ATOM 1474 N TRP A 90 -1.849 -13.358 -5.017 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.133 -13.898 -3.827 1.00 0.00 C ATOM 1476 C TRP A 90 -1.623 -15.320 -3.549 1.00 0.00 C ATOM 1477 O TRP A 90 -2.660 -15.728 -4.031 1.00 0.00 O ATOM 1478 CB TRP A 90 -1.420 -13.008 -2.608 1.00 0.00 C ATOM 1479 CG TRP A 90 -2.862 -13.142 -2.177 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -3.467 -14.297 -1.797 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -3.882 -12.103 -2.047 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -4.783 -14.037 -1.481 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -5.087 -12.705 -1.609 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -3.885 -10.716 -2.272 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -6.246 -11.964 -1.399 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -5.057 -9.967 -2.057 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -6.231 -10.589 -1.623 1.00 0.00 C ATOM 0 H TRP A 90 -2.635 -12.742 -4.810 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.060 -13.911 -4.019 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -0.762 -13.287 -1.785 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -1.203 -11.968 -2.852 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -2.992 -15.266 -1.750 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -5.451 -14.749 -1.187 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -2.986 -10.223 -2.611 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.150 -12.451 -1.065 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -5.049 -8.901 -2.229 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.125 -10.005 -1.462 1.00 0.00 H new ATOM 1498 N GLU A 91 -0.914 -16.072 -2.751 1.00 0.00 N ATOM 1499 CA GLU A 91 -1.393 -17.453 -2.434 1.00 0.00 C ATOM 1500 C GLU A 91 -2.324 -17.402 -1.215 1.00 0.00 C ATOM 1501 O GLU A 91 -2.100 -16.655 -0.289 1.00 0.00 O ATOM 1502 CB GLU A 91 -0.210 -18.389 -2.130 1.00 0.00 C ATOM 1503 CG GLU A 91 0.270 -18.197 -0.685 1.00 0.00 C ATOM 1504 CD GLU A 91 -0.165 -19.399 0.157 1.00 0.00 C ATOM 1505 OE1 GLU A 91 -0.957 -20.186 -0.335 1.00 0.00 O ATOM 1506 OE2 GLU A 91 0.300 -19.511 1.278 1.00 0.00 O ATOM 0 H GLU A 91 -0.036 -15.798 -2.309 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.929 -17.840 -3.301 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.510 -19.425 -2.285 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.608 -18.187 -2.821 1.00 0.00 H new ATOM 0 HG2 GLU A 91 1.355 -18.095 -0.661 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.146 -17.279 -0.271 1.00 0.00 H new ATOM 1513 N GLY A 92 -3.354 -18.206 -1.212 1.00 0.00 N ATOM 1514 CA GLY A 92 -4.305 -18.246 -0.055 1.00 0.00 C ATOM 1515 C GLY A 92 -4.561 -16.848 0.531 1.00 0.00 C ATOM 1516 O GLY A 92 -5.555 -16.217 0.235 1.00 0.00 O ATOM 0 H GLY A 92 -3.582 -18.847 -1.972 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.250 -18.682 -0.378 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.903 -18.896 0.722 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.696 -16.382 1.394 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.910 -15.050 2.038 1.00 0.00 C ATOM 1522 C GLU A 93 -2.942 -13.996 1.474 1.00 0.00 C ATOM 1523 O GLU A 93 -1.962 -14.332 0.841 1.00 0.00 O ATOM 1524 CB GLU A 93 -3.673 -15.208 3.541 1.00 0.00 C ATOM 1525 CG GLU A 93 -2.169 -15.200 3.840 1.00 0.00 C ATOM 1526 CD GLU A 93 -1.940 -15.552 5.310 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -2.341 -14.769 6.156 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -1.365 -16.597 5.566 1.00 0.00 O ATOM 0 H GLU A 93 -2.847 -16.868 1.682 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.926 -14.711 1.835 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.164 -14.399 4.082 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.117 -16.140 3.891 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.656 -15.917 3.199 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -1.749 -14.219 3.620 1.00 0.00 H new ATOM 1535 N PRO A 94 -3.250 -12.744 1.741 1.00 0.00 N ATOM 1536 CA PRO A 94 -2.423 -11.605 1.292 1.00 0.00 C ATOM 1537 C PRO A 94 -1.165 -11.496 2.164 1.00 0.00 C ATOM 1538 O PRO A 94 -0.792 -12.429 2.845 1.00 0.00 O ATOM 1539 CB PRO A 94 -3.310 -10.377 1.521 1.00 0.00 C ATOM 1540 CG PRO A 94 -4.479 -10.822 2.433 1.00 0.00 C ATOM 1541 CD PRO A 94 -4.456 -12.357 2.500 1.00 0.00 C ATOM 0 HA PRO A 94 -2.100 -11.708 0.256 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -2.741 -9.573 1.989 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -3.686 -9.992 0.573 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -4.372 -10.393 3.429 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -5.431 -10.470 2.035 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -4.406 -12.708 3.531 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -5.356 -12.787 2.060 1.00 0.00 H new ATOM 1549 N TRP A 95 -0.524 -10.353 2.169 1.00 0.00 N ATOM 1550 CA TRP A 95 0.691 -10.185 3.017 1.00 0.00 C ATOM 1551 C TRP A 95 1.321 -8.807 2.800 1.00 0.00 C ATOM 1552 O TRP A 95 2.487 -8.707 2.504 1.00 0.00 O ATOM 1553 CB TRP A 95 1.731 -11.257 2.670 1.00 0.00 C ATOM 1554 CG TRP A 95 2.269 -11.034 1.290 1.00 0.00 C ATOM 1555 CD1 TRP A 95 1.655 -10.327 0.311 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.523 -11.518 0.720 1.00 0.00 C ATOM 1557 NE1 TRP A 95 2.452 -10.351 -0.822 1.00 0.00 N ATOM 1558 CE2 TRP A 95 3.612 -11.075 -0.618 1.00 0.00 C ATOM 1559 CE3 TRP A 95 4.577 -12.297 1.234 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 4.712 -11.392 -1.420 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 5.682 -12.618 0.429 1.00 0.00 C ATOM 1562 CH2 TRP A 95 5.749 -12.168 -0.896 1.00 0.00 C ATOM 0 H TRP A 95 -0.790 -9.533 1.624 1.00 0.00 H new ATOM 0 HA TRP A 95 0.385 -10.283 4.059 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.546 -11.230 3.394 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.279 -12.247 2.736 1.00 0.00 H new ATOM 0 HD1 TRP A 95 0.702 -9.827 0.399 1.00 0.00 H new ATOM 0 HE1 TRP A 95 2.212 -9.890 -1.700 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.535 -12.650 2.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.760 -11.039 -2.440 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 6.485 -13.216 0.834 1.00 0.00 H new ATOM 0 HH2 TRP A 95 6.600 -12.420 -1.511 1.00 0.00 H new ATOM 1573 N GLY A 96 0.584 -7.739 2.944 1.00 0.00 N ATOM 1574 CA GLY A 96 1.217 -6.406 2.720 1.00 0.00 C ATOM 1575 C GLY A 96 0.741 -5.371 3.743 1.00 0.00 C ATOM 1576 O GLY A 96 1.141 -4.226 3.694 1.00 0.00 O ATOM 0 H GLY A 96 -0.403 -7.728 3.200 1.00 0.00 H new ATOM 0 HA2 GLY A 96 2.301 -6.504 2.779 1.00 0.00 H new ATOM 0 HA3 GLY A 96 0.983 -6.057 1.714 1.00 0.00 H new ATOM 1580 N LYS A 97 -0.109 -5.734 4.662 1.00 0.00 N ATOM 1581 CA LYS A 97 -0.585 -4.718 5.647 1.00 0.00 C ATOM 1582 C LYS A 97 0.477 -4.470 6.731 1.00 0.00 C ATOM 1583 O LYS A 97 0.703 -5.276 7.610 1.00 0.00 O ATOM 1584 CB LYS A 97 -1.918 -5.168 6.272 1.00 0.00 C ATOM 1585 CG LYS A 97 -1.689 -6.159 7.416 1.00 0.00 C ATOM 1586 CD LYS A 97 -0.860 -7.342 6.914 1.00 0.00 C ATOM 1587 CE LYS A 97 -0.906 -8.467 7.947 1.00 0.00 C ATOM 1588 NZ LYS A 97 -0.340 -7.982 9.237 1.00 0.00 N ATOM 0 H LYS A 97 -0.491 -6.673 4.775 1.00 0.00 H new ATOM 0 HA LYS A 97 -0.752 -3.777 5.124 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -2.460 -4.298 6.644 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.543 -5.630 5.508 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -1.174 -5.665 8.240 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -2.646 -6.511 7.803 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.249 -7.694 5.959 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.171 -7.032 6.743 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -1.934 -8.801 8.091 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.339 -9.327 7.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -0.167 -8.792 9.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 0.556 -7.485 9.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -1.013 -7.331 9.689 1.00 0.00 H new ATOM 1602 N GLU A 98 1.128 -3.339 6.679 1.00 0.00 N ATOM 1603 CA GLU A 98 2.155 -3.027 7.711 1.00 0.00 C ATOM 1604 C GLU A 98 1.460 -3.020 9.072 1.00 0.00 C ATOM 1605 O GLU A 98 1.301 -4.045 9.708 1.00 0.00 O ATOM 1606 CB GLU A 98 2.747 -1.651 7.429 1.00 0.00 C ATOM 1607 CG GLU A 98 4.132 -1.816 6.814 1.00 0.00 C ATOM 1608 CD GLU A 98 5.030 -2.593 7.776 1.00 0.00 C ATOM 1609 OE1 GLU A 98 4.548 -2.969 8.833 1.00 0.00 O ATOM 1610 OE2 GLU A 98 6.181 -2.802 7.439 1.00 0.00 O ATOM 0 H GLU A 98 0.993 -2.620 5.968 1.00 0.00 H new ATOM 0 HA GLU A 98 2.956 -3.766 7.698 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.099 -1.095 6.751 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.812 -1.074 8.352 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.058 -2.343 5.863 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.567 -0.839 6.604 1.00 0.00 H new ATOM 1617 N GLY A 99 0.995 -1.876 9.497 1.00 0.00 N ATOM 1618 CA GLY A 99 0.255 -1.792 10.776 1.00 0.00 C ATOM 1619 C GLY A 99 -1.222 -1.639 10.419 1.00 0.00 C ATOM 1620 O GLY A 99 -2.024 -1.145 11.185 1.00 0.00 O ATOM 0 H GLY A 99 1.101 -0.990 9.003 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.417 -2.687 11.377 1.00 0.00 H new ATOM 0 HA3 GLY A 99 0.600 -0.944 11.368 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.564 -2.056 9.228 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.962 -1.951 8.739 1.00 0.00 C ATOM 1626 C GLN A 100 -3.649 -3.310 8.886 1.00 0.00 C ATOM 1627 O GLN A 100 -3.033 -4.334 8.668 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.913 -1.580 7.252 1.00 0.00 C ATOM 1629 CG GLN A 100 -3.735 -0.320 6.983 1.00 0.00 C ATOM 1630 CD GLN A 100 -2.825 0.908 7.047 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -1.672 0.807 7.416 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -3.298 2.074 6.697 1.00 0.00 N ATOM 0 H GLN A 100 -0.914 -2.474 8.562 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.511 -1.201 9.308 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.879 -1.418 6.946 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -3.297 -2.406 6.653 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -4.208 -0.384 6.003 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -4.535 -0.231 7.718 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -4.266 2.160 6.387 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -2.699 2.899 6.734 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.912 -3.288 9.225 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.686 -4.525 9.367 1.00 0.00 C ATOM 1643 C PRO A 101 -5.618 -5.281 8.046 1.00 0.00 C ATOM 1644 O PRO A 101 -5.654 -6.493 8.004 1.00 0.00 O ATOM 1645 CB PRO A 101 -7.120 -4.063 9.655 1.00 0.00 C ATOM 1646 CG PRO A 101 -7.096 -2.518 9.777 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.660 -2.050 9.485 1.00 0.00 C ATOM 0 HA PRO A 101 -5.318 -5.183 10.154 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.791 -4.374 8.854 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.491 -4.515 10.575 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.796 -2.068 9.073 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -7.404 -2.208 10.776 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.628 -1.380 8.626 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -5.241 -1.504 10.330 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.508 -4.550 6.969 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.426 -5.184 5.628 1.00 0.00 C ATOM 1657 C GLY A 102 -6.605 -6.131 5.436 1.00 0.00 C ATOM 1658 O GLY A 102 -6.697 -7.161 6.070 1.00 0.00 O ATOM 0 H GLY A 102 -5.471 -3.531 6.965 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.432 -4.419 4.852 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.488 -5.731 5.530 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.517 -5.800 4.567 1.00 0.00 N ATOM 1663 CA GLU A 103 -8.681 -6.715 4.361 1.00 0.00 C ATOM 1664 C GLU A 103 -9.163 -6.653 2.910 1.00 0.00 C ATOM 1665 O GLU A 103 -9.325 -5.590 2.346 1.00 0.00 O ATOM 1666 CB GLU A 103 -9.827 -6.318 5.300 1.00 0.00 C ATOM 1667 CG GLU A 103 -10.016 -4.803 5.276 1.00 0.00 C ATOM 1668 CD GLU A 103 -10.734 -4.356 6.552 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -10.241 -4.664 7.624 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -11.762 -3.710 6.434 1.00 0.00 O ATOM 0 H GLU A 103 -7.512 -4.953 3.998 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.364 -7.734 4.583 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.748 -6.813 4.993 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.609 -6.650 6.315 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.049 -4.307 5.198 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.595 -4.512 4.400 1.00 0.00 H new ATOM 1677 N TRP A 104 -9.402 -7.789 2.300 1.00 0.00 N ATOM 1678 CA TRP A 104 -9.884 -7.785 0.890 1.00 0.00 C ATOM 1679 C TRP A 104 -11.004 -6.751 0.763 1.00 0.00 C ATOM 1680 O TRP A 104 -11.988 -6.803 1.474 1.00 0.00 O ATOM 1681 CB TRP A 104 -10.427 -9.168 0.514 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.427 -10.226 0.859 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -8.094 -10.141 0.641 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.656 -11.527 1.475 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.492 -11.309 1.078 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.413 -12.191 1.603 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.811 -12.188 1.932 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -8.319 -13.466 2.161 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -10.720 -13.472 2.494 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -9.476 -14.109 2.610 1.00 0.00 C ATOM 0 H TRP A 104 -9.284 -8.712 2.718 1.00 0.00 H new ATOM 0 HA TRP A 104 -9.059 -7.537 0.222 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -11.362 -9.355 1.041 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.650 -9.202 -0.552 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.583 -9.299 0.198 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.491 -11.494 1.019 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.774 -11.705 1.850 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.359 -13.953 2.246 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -11.613 -13.972 2.839 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -9.412 -15.095 3.046 1.00 0.00 H new ATOM 1701 N MET A 105 -10.865 -5.808 -0.125 1.00 0.00 N ATOM 1702 CA MET A 105 -11.932 -4.774 -0.272 1.00 0.00 C ATOM 1703 C MET A 105 -12.572 -4.885 -1.655 1.00 0.00 C ATOM 1704 O MET A 105 -11.949 -4.597 -2.647 1.00 0.00 O ATOM 1705 CB MET A 105 -11.320 -3.384 -0.102 1.00 0.00 C ATOM 1706 CG MET A 105 -12.387 -2.417 0.410 1.00 0.00 C ATOM 1707 SD MET A 105 -13.643 -2.174 -0.870 1.00 0.00 S ATOM 1708 CE MET A 105 -14.977 -1.638 0.229 1.00 0.00 C ATOM 0 H MET A 105 -10.067 -5.706 -0.752 1.00 0.00 H new ATOM 0 HA MET A 105 -12.695 -4.932 0.490 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.485 -3.425 0.598 1.00 0.00 H new ATOM 0 HB3 MET A 105 -10.921 -3.032 -1.053 1.00 0.00 H new ATOM 0 HG2 MET A 105 -12.847 -2.812 1.316 1.00 0.00 H new ATOM 0 HG3 MET A 105 -11.932 -1.462 0.674 1.00 0.00 H new ATOM 0 HE1 MET A 105 -15.937 -1.785 -0.266 1.00 0.00 H new ATOM 0 HE2 MET A 105 -14.949 -2.223 1.148 1.00 0.00 H new ATOM 0 HE3 MET A 105 -14.850 -0.582 0.467 1.00 0.00 H new ATOM 1718 N SER A 106 -13.811 -5.308 -1.726 1.00 0.00 N ATOM 1719 CA SER A 106 -14.481 -5.449 -3.056 1.00 0.00 C ATOM 1720 C SER A 106 -14.967 -4.085 -3.564 1.00 0.00 C ATOM 1721 O SER A 106 -16.147 -3.865 -3.749 1.00 0.00 O ATOM 1722 CB SER A 106 -15.676 -6.393 -2.925 1.00 0.00 C ATOM 1723 OG SER A 106 -16.449 -6.339 -4.118 1.00 0.00 O ATOM 0 H SER A 106 -14.386 -5.561 -0.922 1.00 0.00 H new ATOM 0 HA SER A 106 -13.761 -5.853 -3.768 1.00 0.00 H new ATOM 0 HB2 SER A 106 -15.332 -7.412 -2.747 1.00 0.00 H new ATOM 0 HB3 SER A 106 -16.287 -6.108 -2.069 1.00 0.00 H new ATOM 0 HG SER A 106 -16.885 -5.464 -4.186 1.00 0.00 H new ATOM 1729 N LEU A 107 -14.063 -3.176 -3.802 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.457 -1.828 -4.308 1.00 0.00 C ATOM 1731 C LEU A 107 -14.660 -1.880 -5.827 1.00 0.00 C ATOM 1732 O LEU A 107 -15.560 -1.266 -6.363 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.353 -0.824 -3.984 1.00 0.00 C ATOM 1734 CG LEU A 107 -12.041 -1.276 -4.626 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -11.929 -0.695 -6.035 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -10.869 -0.781 -3.779 1.00 0.00 C ATOM 0 H LEU A 107 -13.061 -3.309 -3.667 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.388 -1.524 -3.829 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -13.628 0.165 -4.352 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -13.231 -0.739 -2.904 1.00 0.00 H new ATOM 0 HG LEU A 107 -12.021 -2.364 -4.683 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -10.993 -1.019 -6.489 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -12.766 -1.044 -6.640 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -11.949 0.394 -5.982 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -9.931 -1.101 -4.233 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -10.893 0.307 -3.725 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -10.946 -1.196 -2.774 1.00 0.00 H new ATOM 1748 N VAL A 108 -13.805 -2.589 -6.515 1.00 0.00 N ATOM 1749 CA VAL A 108 -13.905 -2.685 -8.004 1.00 0.00 C ATOM 1750 C VAL A 108 -13.516 -1.335 -8.611 1.00 0.00 C ATOM 1751 O VAL A 108 -14.143 -0.327 -8.354 1.00 0.00 O ATOM 1752 CB VAL A 108 -15.339 -3.082 -8.415 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -15.710 -2.448 -9.761 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -15.415 -4.603 -8.548 1.00 0.00 C ATOM 0 H VAL A 108 -13.032 -3.113 -6.105 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.227 -3.454 -8.375 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.034 -2.728 -7.653 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.724 -2.740 -10.033 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.654 -1.362 -9.680 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -15.016 -2.790 -10.528 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -16.425 -4.893 -8.838 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -14.709 -4.938 -9.308 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -15.165 -5.065 -7.593 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.478 -1.310 -9.408 1.00 0.00 N ATOM 1765 CA GLY A 109 -12.039 -0.024 -10.021 1.00 0.00 C ATOM 1766 C GLY A 109 -12.106 1.070 -8.959 1.00 0.00 C ATOM 1767 O GLY A 109 -13.086 1.780 -8.847 1.00 0.00 O ATOM 0 H GLY A 109 -11.917 -2.124 -9.659 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.023 -0.116 -10.406 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.679 0.230 -10.866 1.00 0.00 H new ATOM 1771 N LEU A 110 -11.082 1.190 -8.163 1.00 0.00 N ATOM 1772 CA LEU A 110 -11.083 2.216 -7.086 1.00 0.00 C ATOM 1773 C LEU A 110 -11.576 3.562 -7.638 1.00 0.00 C ATOM 1774 O LEU A 110 -11.821 3.705 -8.820 1.00 0.00 O ATOM 1775 CB LEU A 110 -9.666 2.372 -6.542 1.00 0.00 C ATOM 1776 CG LEU A 110 -9.677 2.118 -5.039 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -8.497 1.224 -4.656 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -9.556 3.453 -4.311 1.00 0.00 C ATOM 0 H LEU A 110 -10.239 0.618 -8.213 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.752 1.898 -6.286 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -8.994 1.671 -7.037 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.291 3.374 -6.751 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.607 1.623 -4.759 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.510 1.046 -3.581 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -8.575 0.273 -5.183 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.564 1.715 -4.931 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -9.563 3.282 -3.234 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -8.623 3.939 -4.595 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -10.396 4.093 -4.582 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.745 4.547 -6.790 1.00 0.00 N ATOM 1791 CA ASN A 111 -12.249 5.870 -7.284 1.00 0.00 C ATOM 1792 C ASN A 111 -11.777 7.033 -6.401 1.00 0.00 C ATOM 1793 O ASN A 111 -12.135 8.168 -6.641 1.00 0.00 O ATOM 1794 CB ASN A 111 -13.778 5.840 -7.261 1.00 0.00 C ATOM 1795 CG ASN A 111 -14.321 6.628 -8.456 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -13.769 7.646 -8.826 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -15.385 6.202 -9.080 1.00 0.00 N ATOM 0 H ASN A 111 -11.559 4.496 -5.788 1.00 0.00 H new ATOM 0 HA ASN A 111 -11.860 6.028 -8.290 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -14.133 4.810 -7.299 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -14.147 6.270 -6.330 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -15.752 6.723 -9.877 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -15.850 5.348 -8.771 1.00 0.00 H new ATOM 1804 N ALA A 112 -11.016 6.773 -5.370 1.00 0.00 N ATOM 1805 CA ALA A 112 -10.569 7.874 -4.457 1.00 0.00 C ATOM 1806 C ALA A 112 -11.709 8.214 -3.489 1.00 0.00 C ATOM 1807 O ALA A 112 -11.485 8.570 -2.349 1.00 0.00 O ATOM 1808 CB ALA A 112 -10.179 9.120 -5.255 1.00 0.00 C ATOM 0 H ALA A 112 -10.682 5.843 -5.118 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.693 7.539 -3.901 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -9.858 9.905 -4.570 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.363 8.876 -5.935 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -11.038 9.468 -5.829 1.00 0.00 H new ATOM 1814 N ASP A 113 -12.933 8.081 -3.928 1.00 0.00 N ATOM 1815 CA ASP A 113 -14.089 8.361 -3.045 1.00 0.00 C ATOM 1816 C ASP A 113 -13.883 7.613 -1.734 1.00 0.00 C ATOM 1817 O ASP A 113 -14.389 7.988 -0.694 1.00 0.00 O ATOM 1818 CB ASP A 113 -15.349 7.839 -3.733 1.00 0.00 C ATOM 1819 CG ASP A 113 -16.505 8.816 -3.511 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -16.239 9.935 -3.102 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -17.636 8.429 -3.752 1.00 0.00 O ATOM 0 H ASP A 113 -13.177 7.786 -4.873 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.184 9.429 -2.851 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.166 7.715 -4.800 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.610 6.857 -3.338 1.00 0.00 H new ATOM 1826 N ASP A 114 -13.150 6.540 -1.792 1.00 0.00 N ATOM 1827 CA ASP A 114 -12.903 5.730 -0.573 1.00 0.00 C ATOM 1828 C ASP A 114 -11.447 5.905 -0.116 1.00 0.00 C ATOM 1829 O ASP A 114 -11.099 5.602 1.009 1.00 0.00 O ATOM 1830 CB ASP A 114 -13.169 4.265 -0.911 1.00 0.00 C ATOM 1831 CG ASP A 114 -14.614 3.912 -0.551 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.365 4.822 -0.239 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -14.945 2.738 -0.594 1.00 0.00 O ATOM 0 H ASP A 114 -12.708 6.187 -2.640 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.560 6.055 0.234 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.994 4.088 -1.972 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -12.479 3.623 -0.363 1.00 0.00 H new ATOM 1838 N PHE A 115 -10.594 6.388 -0.980 1.00 0.00 N ATOM 1839 CA PHE A 115 -9.164 6.579 -0.595 1.00 0.00 C ATOM 1840 C PHE A 115 -8.956 7.999 -0.050 1.00 0.00 C ATOM 1841 O PHE A 115 -9.562 8.937 -0.527 1.00 0.00 O ATOM 1842 CB PHE A 115 -8.274 6.388 -1.825 1.00 0.00 C ATOM 1843 CG PHE A 115 -7.512 5.085 -1.723 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -8.196 3.868 -1.789 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -6.119 5.096 -1.586 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -7.490 2.660 -1.717 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -5.413 3.889 -1.516 1.00 0.00 C ATOM 1848 CZ PHE A 115 -6.098 2.671 -1.580 1.00 0.00 C ATOM 0 H PHE A 115 -10.825 6.659 -1.936 1.00 0.00 H new ATOM 0 HA PHE A 115 -8.903 5.850 0.172 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -8.884 6.391 -2.728 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -7.575 7.220 -1.910 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -9.271 3.859 -1.896 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -5.589 6.036 -1.534 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -8.020 1.721 -1.767 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -4.338 3.898 -1.412 1.00 0.00 H new ATOM 0 HZ PHE A 115 -5.553 1.740 -1.524 1.00 0.00 H new ATOM 1858 N PRO A 116 -8.091 8.114 0.928 1.00 0.00 N ATOM 1859 CA PRO A 116 -7.772 9.413 1.548 1.00 0.00 C ATOM 1860 C PRO A 116 -7.086 10.330 0.522 1.00 0.00 C ATOM 1861 O PRO A 116 -6.190 9.903 -0.178 1.00 0.00 O ATOM 1862 CB PRO A 116 -6.800 9.074 2.687 1.00 0.00 C ATOM 1863 CG PRO A 116 -6.546 7.546 2.654 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.371 6.963 1.499 1.00 0.00 C ATOM 0 HA PRO A 116 -8.661 9.934 1.904 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -5.864 9.619 2.566 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.220 9.371 3.648 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.486 7.337 2.511 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -6.836 7.089 3.600 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -6.730 6.490 0.755 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -8.064 6.200 1.854 1.00 0.00 H new ATOM 1872 N PRO A 117 -7.524 11.564 0.462 1.00 0.00 N ATOM 1873 CA PRO A 117 -6.959 12.551 -0.477 1.00 0.00 C ATOM 1874 C PRO A 117 -5.465 12.768 -0.203 1.00 0.00 C ATOM 1875 O PRO A 117 -4.717 13.147 -1.081 1.00 0.00 O ATOM 1876 CB PRO A 117 -7.749 13.841 -0.217 1.00 0.00 C ATOM 1877 CG PRO A 117 -8.812 13.531 0.869 1.00 0.00 C ATOM 1878 CD PRO A 117 -8.614 12.073 1.314 1.00 0.00 C ATOM 0 HA PRO A 117 -7.039 12.222 -1.513 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -7.083 14.637 0.116 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -8.228 14.188 -1.133 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -8.702 14.208 1.716 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.817 13.677 0.473 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.351 12.014 2.370 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -9.526 11.491 1.180 1.00 0.00 H new ATOM 1886 N ALA A 118 -5.026 12.530 1.005 1.00 0.00 N ATOM 1887 CA ALA A 118 -3.580 12.721 1.327 1.00 0.00 C ATOM 1888 C ALA A 118 -2.731 12.152 0.189 1.00 0.00 C ATOM 1889 O ALA A 118 -1.804 12.781 -0.284 1.00 0.00 O ATOM 1890 CB ALA A 118 -3.244 11.985 2.626 1.00 0.00 C ATOM 0 H ALA A 118 -5.605 12.212 1.782 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.370 13.784 1.447 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -2.189 12.125 2.861 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -3.852 12.384 3.438 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.451 10.922 2.506 1.00 0.00 H new ATOM 1896 N ASN A 119 -3.050 10.969 -0.259 1.00 0.00 N ATOM 1897 CA ASN A 119 -2.278 10.355 -1.377 1.00 0.00 C ATOM 1898 C ASN A 119 -3.011 10.654 -2.682 1.00 0.00 C ATOM 1899 O ASN A 119 -3.309 9.777 -3.458 1.00 0.00 O ATOM 1900 CB ASN A 119 -2.190 8.840 -1.170 1.00 0.00 C ATOM 1901 CG ASN A 119 -0.782 8.471 -0.702 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.046 7.811 -1.409 1.00 0.00 O ATOM 1903 ND2 ASN A 119 -0.375 8.870 0.472 1.00 0.00 N ATOM 0 H ASN A 119 -3.815 10.399 0.102 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.268 10.764 -1.409 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -2.926 8.520 -0.432 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.424 8.321 -2.100 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.561 8.628 0.797 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.993 9.424 1.065 1.00 0.00 H new ATOM 1910 N GLU A 120 -3.317 11.897 -2.908 1.00 0.00 N ATOM 1911 CA GLU A 120 -4.050 12.301 -4.140 1.00 0.00 C ATOM 1912 C GLU A 120 -3.281 11.937 -5.426 1.00 0.00 C ATOM 1913 O GLU A 120 -3.877 11.476 -6.375 1.00 0.00 O ATOM 1914 CB GLU A 120 -4.250 13.812 -4.099 1.00 0.00 C ATOM 1915 CG GLU A 120 -5.733 14.134 -3.906 1.00 0.00 C ATOM 1916 CD GLU A 120 -6.071 15.429 -4.648 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -5.857 15.475 -5.848 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -6.538 16.354 -4.002 1.00 0.00 O ATOM 0 H GLU A 120 -3.086 12.667 -2.280 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.000 11.767 -4.162 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.666 14.243 -3.286 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -3.888 14.261 -5.024 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.346 13.315 -4.282 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -5.959 14.240 -2.845 1.00 0.00 H new ATOM 1925 N PRO A 121 -1.996 12.193 -5.444 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.162 11.933 -6.636 1.00 0.00 C ATOM 1927 C PRO A 121 -1.271 10.487 -7.136 1.00 0.00 C ATOM 1928 O PRO A 121 -1.174 10.236 -8.322 1.00 0.00 O ATOM 1929 CB PRO A 121 0.268 12.262 -6.189 1.00 0.00 C ATOM 1930 CG PRO A 121 0.187 12.897 -4.778 1.00 0.00 C ATOM 1931 CD PRO A 121 -1.263 12.756 -4.292 1.00 0.00 C ATOM 0 HA PRO A 121 -1.487 12.538 -7.482 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.879 11.360 -6.168 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.739 12.950 -6.891 1.00 0.00 H new ATOM 0 HG2 PRO A 121 0.872 12.397 -4.093 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.480 13.946 -4.812 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.327 12.100 -3.424 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.675 13.720 -3.994 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.458 9.534 -6.273 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.554 8.126 -6.758 1.00 0.00 C ATOM 1941 C VAL A 122 -3.022 7.682 -6.805 1.00 0.00 C ATOM 1942 O VAL A 122 -3.426 6.952 -7.687 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.749 7.223 -5.824 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -1.337 5.808 -5.815 1.00 0.00 C ATOM 1945 CG2 VAL A 122 0.702 7.160 -6.309 1.00 0.00 C ATOM 0 H VAL A 122 -1.548 9.661 -5.265 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.147 8.055 -7.767 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.790 7.632 -4.815 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.754 5.176 -5.146 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.370 5.846 -5.470 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.306 5.395 -6.823 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.280 6.517 -5.645 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.730 6.756 -7.321 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.130 8.162 -6.306 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.820 8.105 -5.868 1.00 0.00 N ATOM 1956 CA ILE A 123 -5.253 7.697 -5.881 1.00 0.00 C ATOM 1957 C ILE A 123 -5.883 8.234 -7.161 1.00 0.00 C ATOM 1958 O ILE A 123 -6.813 7.668 -7.699 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.962 8.263 -4.644 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -5.726 7.325 -3.450 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -7.469 8.373 -4.908 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -4.263 6.866 -3.430 1.00 0.00 C ATOM 0 H ILE A 123 -3.546 8.713 -5.096 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.347 6.611 -5.854 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.562 9.253 -4.424 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -5.968 7.838 -2.519 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.387 6.461 -3.519 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.965 8.776 -4.025 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.642 9.036 -5.755 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.872 7.385 -5.132 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -4.102 6.201 -2.581 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.035 6.336 -4.355 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -3.610 7.734 -3.340 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.356 9.311 -7.663 1.00 0.00 N ATOM 1975 CA ALA A 124 -5.887 9.883 -8.923 1.00 0.00 C ATOM 1976 C ALA A 124 -5.853 8.788 -9.984 1.00 0.00 C ATOM 1977 O ALA A 124 -6.702 8.699 -10.848 1.00 0.00 O ATOM 1978 CB ALA A 124 -4.988 11.039 -9.356 1.00 0.00 C ATOM 0 H ALA A 124 -4.575 9.822 -7.251 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.905 10.247 -8.787 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.369 11.468 -10.283 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.978 11.803 -8.579 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.974 10.671 -9.516 1.00 0.00 H new ATOM 1984 N LYS A 125 -4.851 7.962 -9.911 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.694 6.856 -10.892 1.00 0.00 C ATOM 1986 C LYS A 125 -5.601 5.673 -10.534 1.00 0.00 C ATOM 1987 O LYS A 125 -6.213 5.083 -11.400 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.236 6.414 -10.888 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.345 7.627 -11.162 1.00 0.00 C ATOM 1990 CD LYS A 125 -2.675 8.232 -12.532 1.00 0.00 C ATOM 1991 CE LYS A 125 -2.140 9.664 -12.595 1.00 0.00 C ATOM 1992 NZ LYS A 125 -0.653 9.635 -12.674 1.00 0.00 N ATOM 0 H LYS A 125 -4.121 8.007 -9.200 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.981 7.208 -11.883 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.980 5.969 -9.926 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -3.073 5.648 -11.647 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.488 8.375 -10.383 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.296 7.331 -11.131 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -2.230 7.630 -13.325 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -3.753 8.227 -12.694 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -2.551 10.179 -13.463 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -2.457 10.221 -11.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -0.305 10.558 -13.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -0.259 9.431 -11.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.355 8.896 -13.342 1.00 0.00 H new ATOM 2006 N LEU A 126 -5.714 5.311 -9.281 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.619 4.169 -8.949 1.00 0.00 C ATOM 2008 C LEU A 126 -8.023 4.553 -9.399 1.00 0.00 C ATOM 2009 O LEU A 126 -8.877 3.726 -9.643 1.00 0.00 O ATOM 2010 CB LEU A 126 -6.633 3.899 -7.444 1.00 0.00 C ATOM 2011 CG LEU A 126 -5.249 3.460 -6.919 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.162 3.565 -7.999 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -4.868 4.359 -5.746 1.00 0.00 C ATOM 0 H LEU A 126 -5.233 5.743 -8.492 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.270 3.267 -9.451 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -6.951 4.799 -6.918 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.367 3.124 -7.222 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.317 2.416 -6.614 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.206 3.246 -7.585 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.424 2.925 -8.842 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.084 4.598 -8.338 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.892 4.062 -5.362 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.827 5.396 -6.080 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.613 4.262 -4.956 1.00 0.00 H new ATOM 2025 N LYS A 127 -8.256 5.819 -9.528 1.00 0.00 N ATOM 2026 CA LYS A 127 -9.585 6.285 -9.993 1.00 0.00 C ATOM 2027 C LYS A 127 -9.849 5.641 -11.344 1.00 0.00 C ATOM 2028 O LYS A 127 -10.932 5.174 -11.636 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.543 7.794 -10.162 1.00 0.00 C ATOM 2030 CG LYS A 127 -9.007 8.425 -8.878 1.00 0.00 C ATOM 2031 CD LYS A 127 -9.924 9.579 -8.470 1.00 0.00 C ATOM 2032 CE LYS A 127 -9.101 10.851 -8.266 1.00 0.00 C ATOM 2033 NZ LYS A 127 -10.017 11.999 -8.016 1.00 0.00 N ATOM 0 H LYS A 127 -7.581 6.558 -9.331 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.365 6.019 -9.279 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.907 8.060 -11.006 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.540 8.176 -10.381 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -8.962 7.681 -8.083 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -7.991 8.788 -9.033 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.679 9.744 -9.238 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -10.453 9.327 -7.551 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.420 10.725 -7.424 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -8.488 11.046 -9.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -9.458 12.865 -7.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -10.650 12.122 -8.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -10.583 11.812 -7.164 1.00 0.00 H new ATOM 2047 N ARG A 128 -8.839 5.609 -12.160 1.00 0.00 N ATOM 2048 CA ARG A 128 -8.967 4.990 -13.500 1.00 0.00 C ATOM 2049 C ARG A 128 -8.874 3.472 -13.344 1.00 0.00 C ATOM 2050 O ARG A 128 -9.273 2.719 -14.209 1.00 0.00 O ATOM 2051 CB ARG A 128 -7.818 5.467 -14.395 1.00 0.00 C ATOM 2052 CG ARG A 128 -7.284 6.826 -13.927 1.00 0.00 C ATOM 2053 CD ARG A 128 -6.697 7.567 -15.131 1.00 0.00 C ATOM 2054 NE ARG A 128 -6.817 9.036 -14.925 1.00 0.00 N ATOM 2055 CZ ARG A 128 -6.139 9.855 -15.682 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -5.678 9.449 -16.834 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -5.921 11.080 -15.289 1.00 0.00 N ATOM 0 H ARG A 128 -7.917 5.992 -11.951 1.00 0.00 H new ATOM 0 HA ARG A 128 -9.920 5.270 -13.949 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -7.013 4.732 -14.382 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -8.163 5.543 -15.426 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -8.086 7.412 -13.478 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -6.522 6.688 -13.160 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -5.650 7.293 -15.263 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -7.221 7.274 -16.041 1.00 0.00 H new ATOM 0 HE ARG A 128 -7.427 9.402 -14.194 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -5.848 8.492 -17.142 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -5.148 10.089 -17.426 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -6.281 11.399 -14.389 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -5.391 11.719 -15.882 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.338 3.025 -12.237 1.00 0.00 N ATOM 2072 CA LEU A 129 -8.198 1.561 -11.995 1.00 0.00 C ATOM 2073 C LEU A 129 -9.445 0.827 -12.493 1.00 0.00 C ATOM 2074 O LEU A 129 -9.325 -0.337 -12.834 1.00 0.00 O ATOM 2075 CB LEU A 129 -8.027 1.318 -10.497 1.00 0.00 C ATOM 2076 CG LEU A 129 -6.998 0.220 -10.270 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -5.598 0.793 -10.500 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -7.109 -0.292 -8.834 1.00 0.00 C ATOM 2079 OXT LEU A 129 -10.498 1.444 -12.525 1.00 0.00 O ATOM 0 H LEU A 129 -7.989 3.619 -11.485 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.328 1.186 -12.534 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.708 2.236 -10.004 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.981 1.033 -10.054 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.178 -0.603 -10.962 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -4.854 0.012 -10.339 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -5.520 1.164 -11.522 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -5.421 1.612 -9.803 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -6.372 -1.079 -8.670 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.925 0.528 -8.140 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.109 -0.691 -8.666 1.00 0.00 H new TER 2091 LEU A 129 HETATM 2092 MG MG A 132 7.847 -4.133 6.470 1.00 0.00 MG HETATM 2093 PG APC A 130 5.573 -0.342 10.993 1.00 0.00 P HETATM 2094 O1G APC A 130 6.743 -0.417 12.095 1.00 0.00 O HETATM 2095 O2G APC A 130 4.570 -1.410 11.205 1.00 0.00 O HETATM 2096 O3G APC A 130 4.849 1.096 11.018 1.00 0.00 O HETATM 2097 PB APC A 130 7.502 0.182 8.848 1.00 0.00 P HETATM 2098 O1B APC A 130 8.694 0.190 9.932 1.00 0.00 O HETATM 2099 O2B APC A 130 7.891 -0.647 7.686 1.00 0.00 O HETATM 2100 O3B APC A 130 6.175 -0.451 9.504 1.00 0.00 O HETATM 2101 PA APC A 130 8.443 2.388 8.553 1.00 0.00 P HETATM 2102 O1A APC A 130 9.605 1.565 8.149 1.00 0.00 O HETATM 2103 O2A APC A 130 8.433 2.975 9.912 1.00 0.00 O HETATM 2104 C3A APC A 130 7.223 1.565 8.400 1.00 0.00 C HETATM 2105 O5' APC A 130 8.353 3.613 7.514 1.00 0.00 O HETATM 2106 C5' APC A 130 9.023 4.846 7.784 1.00 0.00 C HETATM 2107 C4' APC A 130 8.096 5.871 8.443 1.00 0.00 C HETATM 2108 O4' APC A 130 7.762 6.946 7.543 1.00 0.00 O HETATM 2109 C3' APC A 130 6.795 5.233 8.880 1.00 0.00 C HETATM 2110 O3' APC A 130 6.812 4.911 10.275 1.00 0.00 O HETATM 2111 C2' APC A 130 5.718 6.238 8.563 1.00 0.00 C HETATM 2112 O2' APC A 130 5.177 6.809 9.756 1.00 0.00 O HETATM 2113 C1' APC A 130 6.371 7.302 7.698 1.00 0.00 C HETATM 2114 N9 APC A 130 5.673 7.366 6.401 1.00 0.00 N HETATM 2115 C8 APC A 130 5.437 6.379 5.504 1.00 0.00 C HETATM 2116 N7 APC A 130 4.679 6.660 4.497 1.00 0.00 N HETATM 2117 C5 APC A 130 4.374 8.000 4.735 1.00 0.00 C HETATM 2118 C6 APC A 130 3.601 8.931 4.037 1.00 0.00 C HETATM 2119 N6 APC A 130 2.948 8.639 2.912 1.00 0.00 N HETATM 2120 N1 APC A 130 3.521 10.172 4.541 1.00 0.00 N HETATM 2121 C2 APC A 130 4.163 10.485 5.666 1.00 0.00 C HETATM 2122 N3 APC A 130 4.914 9.681 6.415 1.00 0.00 N HETATM 2123 C4 APC A 130 4.982 8.443 5.886 1.00 0.00 C HETATM 0 HO3' APC A 130 7.122 3.989 10.394 1.00 0.00 H new HETATM 0 HO2' APC A 130 5.536 6.338 10.536 1.00 0.00 H new HETATM 0 HN62 APC A 130 2.397 9.357 2.441 1.00 0.00 H new HETATM 0 HN61 APC A 130 2.999 7.698 2.522 1.00 0.00 H new HETATM 0 H5'2 APC A 130 9.877 4.659 8.434 1.00 0.00 H new HETATM 0 H5'1 APC A 130 9.415 5.257 6.853 1.00 0.00 H new HETATM 0 H3A2 APC A 130 6.901 1.563 7.359 1.00 0.00 H new HETATM 0 H3A1 APC A 130 6.408 1.991 8.985 1.00 0.00 H new HETATM 0 H8 APC A 130 5.870 5.386 5.627 1.00 0.00 H new HETATM 0 H4' APC A 130 8.642 6.259 9.303 1.00 0.00 H new HETATM 0 H3' APC A 130 6.624 4.290 8.361 1.00 0.00 H new HETATM 0 H2' APC A 130 4.883 5.766 8.045 1.00 0.00 H new HETATM 0 H2 APC A 130 4.062 11.514 6.011 1.00 0.00 H new HETATM 0 H1' APC A 130 6.306 8.290 8.154 1.00 0.00 H new HETATM 2139 CO CON A 131 8.815 -0.708 11.841 1.00 0.00 CO HETATM 2140 N1 CON A 131 10.889 -1.009 11.586 1.00 0.00 N HETATM 2141 N2 CON A 131 8.924 -1.604 13.750 1.00 0.00 N HETATM 2142 N3 CON A 131 9.195 1.182 12.704 1.00 0.00 N HETATM 2143 N4 CON A 131 8.436 -2.596 10.979 1.00 0.00 N HETATM 2156 O HOH A 133 9.315 -2.740 7.064 1.00 0.00 O HETATM 2159 O HOH A 134 7.931 -4.972 8.412 1.00 0.00 O