USER MOD reduce.3.24.130724 H: found=0, std=0, add=1107, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1106 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 43 LYS NZ :NH3+ -123:sc= 1.34 (180deg=-0.00031) USER MOD Set 1.2: A 51 TYR OH : rot 60:sc= 1.02 USER MOD Set 2.1: A 25 GLN : amide:sc= -0.715 X(o=-0.27,f=-0.11) USER MOD Set 2.2: A 58 SER OG : rot -80:sc= 0.444 USER MOD Single : A 1 MET CE :methyl -140:sc= -0.129 (180deg=-0.642) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0.972 (180deg=0.972) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 169:sc= -0.0342 (180deg=-0.287) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -179:sc= 2.04 (180deg=1.91) USER MOD Single : A 28 LYS NZ :NH3+ -158:sc= -0.0852 (180deg=-0.501) USER MOD Single : A 29 LYS NZ :NH3+ -177:sc= 0.835 (180deg=0.83) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -4.48! C(o=-4.5!,f=-5.3!) USER MOD Single : A 47 MET CE :methyl -154:sc= 0 (180deg=-0.23) USER MOD Single : A 50 CYS SG : rot 26:sc= 1.25 USER MOD Single : A 52 LYS NZ :NH3+ -145:sc= 1.39! (180deg=0.0176!) USER MOD Single : A 54 LYS NZ :NH3+ -167:sc= -0.009 (180deg=-0.143) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 157:sc= 0.0256 USER MOD Single : A 65 GLN : amide:sc= -1.31! K(o=-1.3!,f=-0.0069) USER MOD Single : A 70 LYS NZ :NH3+ -177:sc= 0.956 (180deg=0.924) USER MOD Single : A 77 SER OG : rot 140:sc= -0.0306 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 173:sc= 1.25 (180deg=1.13) USER MOD Single : B 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 GLN : amide:sc= -0.891 K(o=-0.89,f=-0.0036) USER MOD Single : B 49 THR OG1 : rot -164:sc= 1.2 USER MOD Single : B 52 SER OG : rot 180:sc= 0.253 USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 ASN : amide:sc= -0.202 K(o=-0.2,f=-1.4) USER MOD Single : B 70 LYS NZ :NH3+ -135:sc= -0.138 (180deg=-0.56) USER MOD Single : B 75 THR OG1 : rot -62:sc= 1.03 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.711 15.542 -4.418 1.00 0.00 N ATOM 2 CA MET A 1 6.473 14.159 -4.823 1.00 0.00 C ATOM 3 C MET A 1 7.764 13.585 -5.363 1.00 0.00 C ATOM 4 O MET A 1 8.187 13.926 -6.464 1.00 0.00 O ATOM 5 CB MET A 1 5.365 14.091 -5.884 1.00 0.00 C ATOM 6 CG MET A 1 5.011 12.684 -6.348 1.00 0.00 C ATOM 7 SD MET A 1 3.683 12.665 -7.584 1.00 0.00 S ATOM 8 CE MET A 1 2.322 13.396 -6.657 1.00 0.00 C ATOM 0 H1 MET A 1 5.831 15.951 -4.044 1.00 0.00 H new ATOM 0 H2 MET A 1 7.445 15.567 -3.681 1.00 0.00 H new ATOM 0 H3 MET A 1 7.027 16.095 -5.240 1.00 0.00 H new ATOM 0 HA MET A 1 6.144 13.575 -3.963 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.468 14.563 -5.483 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.674 14.677 -6.750 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.899 12.211 -6.768 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.709 12.088 -5.487 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.397 12.870 -6.893 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.524 13.314 -5.589 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.221 14.447 -6.927 1.00 0.00 H new ATOM 18 N ALA A 2 8.394 12.740 -4.590 1.00 0.00 N ATOM 19 CA ALA A 2 9.673 12.184 -4.960 1.00 0.00 C ATOM 20 C ALA A 2 9.529 10.781 -5.515 1.00 0.00 C ATOM 21 O ALA A 2 10.295 10.371 -6.368 1.00 0.00 O ATOM 22 CB ALA A 2 10.604 12.174 -3.760 1.00 0.00 C ATOM 0 H ALA A 2 8.039 12.418 -3.690 1.00 0.00 H new ATOM 0 HA ALA A 2 10.097 12.813 -5.743 1.00 0.00 H new ATOM 0 HB1 ALA A 2 11.567 11.753 -4.050 1.00 0.00 H new ATOM 0 HB2 ALA A 2 10.747 13.194 -3.402 1.00 0.00 H new ATOM 0 HB3 ALA A 2 10.167 11.569 -2.966 1.00 0.00 H new ATOM 28 N TYR A 3 8.535 10.061 -5.053 1.00 0.00 N ATOM 29 CA TYR A 3 8.365 8.667 -5.441 1.00 0.00 C ATOM 30 C TYR A 3 7.311 8.485 -6.508 1.00 0.00 C ATOM 31 O TYR A 3 6.388 9.293 -6.622 1.00 0.00 O ATOM 32 CB TYR A 3 8.055 7.791 -4.211 1.00 0.00 C ATOM 33 CG TYR A 3 9.258 7.534 -3.316 1.00 0.00 C ATOM 34 CD1 TYR A 3 9.822 8.546 -2.548 1.00 0.00 C ATOM 35 CD2 TYR A 3 9.845 6.279 -3.268 1.00 0.00 C ATOM 36 CE1 TYR A 3 10.934 8.308 -1.760 1.00 0.00 C ATOM 37 CE2 TYR A 3 10.956 6.034 -2.491 1.00 0.00 C ATOM 38 CZ TYR A 3 11.497 7.049 -1.738 1.00 0.00 C ATOM 39 OH TYR A 3 12.615 6.808 -0.973 1.00 0.00 O ATOM 0 H TYR A 3 7.827 10.411 -4.407 1.00 0.00 H new ATOM 0 HA TYR A 3 9.311 8.343 -5.874 1.00 0.00 H new ATOM 0 HB2 TYR A 3 7.273 8.272 -3.623 1.00 0.00 H new ATOM 0 HB3 TYR A 3 7.656 6.835 -4.550 1.00 0.00 H new ATOM 0 HD1 TYR A 3 9.385 9.534 -2.567 1.00 0.00 H new ATOM 0 HD2 TYR A 3 9.422 5.476 -3.853 1.00 0.00 H new ATOM 0 HE1 TYR A 3 11.359 9.103 -1.166 1.00 0.00 H new ATOM 0 HE2 TYR A 3 11.400 5.050 -2.474 1.00 0.00 H new ATOM 0 HH TYR A 3 12.882 5.870 -1.070 1.00 0.00 H new ATOM 49 N PHE A 4 7.503 7.477 -7.340 1.00 0.00 N ATOM 50 CA PHE A 4 6.501 7.095 -8.338 1.00 0.00 C ATOM 51 C PHE A 4 5.505 6.133 -7.675 1.00 0.00 C ATOM 52 O PHE A 4 5.701 5.748 -6.521 1.00 0.00 O ATOM 53 CB PHE A 4 7.153 6.404 -9.553 1.00 0.00 C ATOM 54 CG PHE A 4 8.225 7.205 -10.239 1.00 0.00 C ATOM 55 CD1 PHE A 4 7.909 8.293 -11.035 1.00 0.00 C ATOM 56 CD2 PHE A 4 9.555 6.853 -10.096 1.00 0.00 C ATOM 57 CE1 PHE A 4 8.904 9.015 -11.668 1.00 0.00 C ATOM 58 CE2 PHE A 4 10.549 7.565 -10.719 1.00 0.00 C ATOM 59 CZ PHE A 4 10.229 8.647 -11.506 1.00 0.00 C ATOM 0 H PHE A 4 8.345 6.902 -7.350 1.00 0.00 H new ATOM 0 HA PHE A 4 5.996 7.992 -8.697 1.00 0.00 H new ATOM 0 HB2 PHE A 4 7.581 5.456 -9.227 1.00 0.00 H new ATOM 0 HB3 PHE A 4 6.375 6.169 -10.279 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.876 8.580 -11.163 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.816 6.003 -9.483 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.649 9.863 -12.286 1.00 0.00 H new ATOM 0 HE2 PHE A 4 11.582 7.276 -10.592 1.00 0.00 H new ATOM 0 HZ PHE A 4 11.010 9.209 -11.997 1.00 0.00 H new ATOM 69 N LEU A 5 4.473 5.717 -8.386 1.00 0.00 N ATOM 70 CA LEU A 5 3.484 4.824 -7.814 1.00 0.00 C ATOM 71 C LEU A 5 3.515 3.480 -8.545 1.00 0.00 C ATOM 72 O LEU A 5 3.718 3.442 -9.757 1.00 0.00 O ATOM 73 CB LEU A 5 2.104 5.478 -7.918 1.00 0.00 C ATOM 74 CG LEU A 5 0.920 4.698 -7.363 1.00 0.00 C ATOM 75 CD1 LEU A 5 1.104 4.415 -5.874 1.00 0.00 C ATOM 76 CD2 LEU A 5 -0.356 5.478 -7.605 1.00 0.00 C ATOM 0 H LEU A 5 4.299 5.982 -9.355 1.00 0.00 H new ATOM 0 HA LEU A 5 3.707 4.640 -6.763 1.00 0.00 H new ATOM 0 HB2 LEU A 5 2.146 6.439 -7.405 1.00 0.00 H new ATOM 0 HB3 LEU A 5 1.908 5.687 -8.970 1.00 0.00 H new ATOM 0 HG LEU A 5 0.856 3.739 -7.877 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.245 3.857 -5.501 1.00 0.00 H new ATOM 0 HD12 LEU A 5 2.011 3.829 -5.724 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.188 5.357 -5.332 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.204 4.920 -7.208 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.292 6.445 -7.106 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.491 5.631 -8.676 1.00 0.00 H new ATOM 88 N ASP A 6 3.349 2.395 -7.815 1.00 0.00 N ATOM 89 CA ASP A 6 3.361 1.045 -8.399 1.00 0.00 C ATOM 90 C ASP A 6 2.342 0.179 -7.688 1.00 0.00 C ATOM 91 O ASP A 6 2.022 0.430 -6.525 1.00 0.00 O ATOM 92 CB ASP A 6 4.734 0.391 -8.234 1.00 0.00 C ATOM 93 CG ASP A 6 5.343 -0.048 -9.529 1.00 0.00 C ATOM 94 OD1 ASP A 6 4.758 -0.875 -10.215 1.00 0.00 O ATOM 95 OD2 ASP A 6 6.439 0.427 -9.880 1.00 0.00 O ATOM 0 H ASP A 6 3.202 2.411 -6.806 1.00 0.00 H new ATOM 0 HA ASP A 6 3.125 1.134 -9.459 1.00 0.00 H new ATOM 0 HB2 ASP A 6 5.407 1.095 -7.745 1.00 0.00 H new ATOM 0 HB3 ASP A 6 4.640 -0.472 -7.574 1.00 0.00 H new ATOM 100 N PHE A 7 1.827 -0.815 -8.371 1.00 0.00 N ATOM 101 CA PHE A 7 0.859 -1.760 -7.792 1.00 0.00 C ATOM 102 C PHE A 7 1.041 -3.163 -8.329 1.00 0.00 C ATOM 103 O PHE A 7 1.365 -3.348 -9.493 1.00 0.00 O ATOM 104 CB PHE A 7 -0.594 -1.343 -8.079 1.00 0.00 C ATOM 105 CG PHE A 7 -1.167 -0.286 -7.186 1.00 0.00 C ATOM 106 CD1 PHE A 7 -1.051 1.052 -7.502 1.00 0.00 C ATOM 107 CD2 PHE A 7 -1.864 -0.641 -6.044 1.00 0.00 C ATOM 108 CE1 PHE A 7 -1.609 2.017 -6.694 1.00 0.00 C ATOM 109 CE2 PHE A 7 -2.429 0.326 -5.233 1.00 0.00 C ATOM 110 CZ PHE A 7 -2.299 1.656 -5.560 1.00 0.00 C ATOM 0 H PHE A 7 2.057 -1.005 -9.346 1.00 0.00 H new ATOM 0 HA PHE A 7 1.050 -1.744 -6.719 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -0.652 -0.990 -9.109 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -1.225 -2.229 -8.010 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -0.516 1.346 -8.393 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -1.968 -1.684 -5.784 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -1.505 3.061 -6.951 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -2.971 0.038 -4.345 1.00 0.00 H new ATOM 0 HZ PHE A 7 -2.737 2.414 -4.928 1.00 0.00 H new ATOM 120 N ASP A 8 0.862 -4.130 -7.457 1.00 0.00 N ATOM 121 CA ASP A 8 0.788 -5.557 -7.826 1.00 0.00 C ATOM 122 C ASP A 8 -0.472 -5.779 -8.683 1.00 0.00 C ATOM 123 O ASP A 8 -1.499 -5.110 -8.454 1.00 0.00 O ATOM 124 CB ASP A 8 0.735 -6.406 -6.523 1.00 0.00 C ATOM 125 CG ASP A 8 0.252 -7.839 -6.709 1.00 0.00 C ATOM 126 OD1 ASP A 8 -0.971 -8.048 -6.673 1.00 0.00 O ATOM 127 OD2 ASP A 8 1.075 -8.759 -6.850 1.00 0.00 O ATOM 0 H ASP A 8 0.761 -3.963 -6.456 1.00 0.00 H new ATOM 0 HA ASP A 8 1.661 -5.859 -8.404 1.00 0.00 H new ATOM 0 HB2 ASP A 8 1.731 -6.428 -6.081 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.080 -5.907 -5.808 1.00 0.00 H new ATOM 132 N GLU A 9 -0.405 -6.688 -9.665 1.00 0.00 N ATOM 133 CA GLU A 9 -1.535 -6.936 -10.582 1.00 0.00 C ATOM 134 C GLU A 9 -2.838 -7.322 -9.879 1.00 0.00 C ATOM 135 O GLU A 9 -3.937 -7.008 -10.366 1.00 0.00 O ATOM 136 CB GLU A 9 -1.222 -7.976 -11.662 1.00 0.00 C ATOM 137 CG GLU A 9 -0.236 -7.529 -12.724 1.00 0.00 C ATOM 138 CD GLU A 9 -0.319 -8.406 -13.950 1.00 0.00 C ATOM 139 OE1 GLU A 9 -1.337 -8.295 -14.690 1.00 0.00 O ATOM 140 OE2 GLU A 9 0.592 -9.217 -14.208 1.00 0.00 O ATOM 0 H GLU A 9 0.416 -7.265 -9.848 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.685 -5.967 -11.059 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.830 -8.871 -11.179 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -2.154 -8.260 -12.151 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.439 -6.494 -13.000 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.776 -7.559 -12.320 1.00 0.00 H new ATOM 147 N ARG A 10 -2.732 -7.961 -8.752 1.00 0.00 N ATOM 148 CA ARG A 10 -3.894 -8.414 -8.033 1.00 0.00 C ATOM 149 C ARG A 10 -4.396 -7.279 -7.176 1.00 0.00 C ATOM 150 O ARG A 10 -5.604 -7.075 -7.048 1.00 0.00 O ATOM 151 CB ARG A 10 -3.525 -9.609 -7.183 1.00 0.00 C ATOM 152 CG ARG A 10 -2.866 -10.709 -7.986 1.00 0.00 C ATOM 153 CD ARG A 10 -2.255 -11.744 -7.094 1.00 0.00 C ATOM 154 NE ARG A 10 -3.244 -12.438 -6.278 1.00 0.00 N ATOM 155 CZ ARG A 10 -2.953 -13.327 -5.342 1.00 0.00 C ATOM 156 NH1 ARG A 10 -1.676 -13.610 -5.053 1.00 0.00 N ATOM 157 NH2 ARG A 10 -3.939 -13.927 -4.685 1.00 0.00 N ATOM 0 H ARG A 10 -1.843 -8.184 -8.303 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.681 -8.717 -8.724 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.851 -9.291 -6.387 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -4.422 -10.001 -6.704 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -3.603 -11.178 -8.638 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -2.097 -10.281 -8.630 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -1.718 -12.471 -7.703 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -1.521 -11.269 -6.443 1.00 0.00 H new ATOM 0 HE ARG A 10 -4.228 -12.224 -6.440 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -0.923 -13.140 -5.555 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -1.457 -14.296 -4.331 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -4.909 -13.701 -4.904 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -3.726 -14.614 -3.962 1.00 0.00 H new ATOM 171 N ALA A 11 -3.453 -6.509 -6.640 1.00 0.00 N ATOM 172 CA ALA A 11 -3.744 -5.326 -5.823 1.00 0.00 C ATOM 173 C ALA A 11 -4.542 -4.304 -6.626 1.00 0.00 C ATOM 174 O ALA A 11 -5.354 -3.555 -6.075 1.00 0.00 O ATOM 175 CB ALA A 11 -2.457 -4.704 -5.296 1.00 0.00 C ATOM 0 H ALA A 11 -2.456 -6.687 -6.759 1.00 0.00 H new ATOM 0 HA ALA A 11 -4.345 -5.640 -4.970 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -2.697 -3.828 -4.693 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.925 -5.432 -4.683 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.827 -4.406 -6.134 1.00 0.00 H new ATOM 181 N LEU A 12 -4.312 -4.298 -7.940 1.00 0.00 N ATOM 182 CA LEU A 12 -5.064 -3.463 -8.876 1.00 0.00 C ATOM 183 C LEU A 12 -6.558 -3.757 -8.739 1.00 0.00 C ATOM 184 O LEU A 12 -7.385 -2.859 -8.568 1.00 0.00 O ATOM 185 CB LEU A 12 -4.652 -3.771 -10.332 1.00 0.00 C ATOM 186 CG LEU A 12 -3.193 -3.561 -10.755 1.00 0.00 C ATOM 187 CD1 LEU A 12 -3.000 -4.042 -12.182 1.00 0.00 C ATOM 188 CD2 LEU A 12 -2.799 -2.112 -10.662 1.00 0.00 C ATOM 0 H LEU A 12 -3.597 -4.874 -8.385 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.851 -2.419 -8.645 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.905 -4.812 -10.532 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.275 -3.160 -10.986 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.560 -4.134 -10.077 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.962 -3.891 -12.480 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.245 -5.102 -12.245 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.654 -3.478 -12.848 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.759 -1.997 -10.969 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -3.438 -1.519 -11.316 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.914 -1.769 -9.634 1.00 0.00 H new ATOM 200 N LYS A 13 -6.871 -5.028 -8.735 1.00 0.00 N ATOM 201 CA LYS A 13 -8.250 -5.496 -8.739 1.00 0.00 C ATOM 202 C LYS A 13 -8.857 -5.292 -7.379 1.00 0.00 C ATOM 203 O LYS A 13 -10.061 -5.074 -7.245 1.00 0.00 O ATOM 204 CB LYS A 13 -8.288 -6.976 -9.109 1.00 0.00 C ATOM 205 CG LYS A 13 -7.386 -7.320 -10.280 1.00 0.00 C ATOM 206 CD LYS A 13 -7.720 -6.512 -11.519 1.00 0.00 C ATOM 207 CE LYS A 13 -6.660 -6.720 -12.569 1.00 0.00 C ATOM 208 NZ LYS A 13 -6.555 -8.140 -12.952 1.00 0.00 N ATOM 0 H LYS A 13 -6.179 -5.778 -8.729 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.822 -4.930 -9.474 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -7.992 -7.569 -8.243 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -9.313 -7.257 -9.352 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -6.348 -7.141 -10.001 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -7.477 -8.382 -10.506 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -8.693 -6.812 -11.908 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -7.790 -5.454 -11.266 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -6.894 -6.120 -13.449 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -5.699 -6.371 -12.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -5.958 -8.228 -13.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -6.130 -8.680 -12.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -7.503 -8.515 -13.157 1.00 0.00 H new ATOM 222 N GLU A 14 -8.003 -5.324 -6.384 1.00 0.00 N ATOM 223 CA GLU A 14 -8.394 -5.152 -5.021 1.00 0.00 C ATOM 224 C GLU A 14 -9.032 -3.798 -4.781 1.00 0.00 C ATOM 225 O GLU A 14 -10.060 -3.713 -4.115 1.00 0.00 O ATOM 226 CB GLU A 14 -7.223 -5.393 -4.094 1.00 0.00 C ATOM 227 CG GLU A 14 -6.733 -6.835 -4.125 1.00 0.00 C ATOM 228 CD GLU A 14 -5.700 -7.164 -3.075 1.00 0.00 C ATOM 229 OE1 GLU A 14 -4.644 -6.518 -3.014 1.00 0.00 O ATOM 230 OE2 GLU A 14 -5.929 -8.111 -2.292 1.00 0.00 O ATOM 0 H GLU A 14 -7.002 -5.473 -6.510 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.157 -5.898 -4.798 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.404 -4.730 -4.371 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -7.512 -5.134 -3.075 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -7.588 -7.499 -3.997 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.312 -7.042 -5.109 1.00 0.00 H new ATOM 237 N TRP A 15 -8.463 -2.738 -5.348 1.00 0.00 N ATOM 238 CA TRP A 15 -9.080 -1.431 -5.162 1.00 0.00 C ATOM 239 C TRP A 15 -10.366 -1.312 -5.974 1.00 0.00 C ATOM 240 O TRP A 15 -11.269 -0.564 -5.613 1.00 0.00 O ATOM 241 CB TRP A 15 -8.132 -0.218 -5.428 1.00 0.00 C ATOM 242 CG TRP A 15 -7.882 0.203 -6.876 1.00 0.00 C ATOM 243 CD1 TRP A 15 -8.783 0.749 -7.758 1.00 0.00 C ATOM 244 CD2 TRP A 15 -6.637 0.195 -7.568 1.00 0.00 C ATOM 245 NE1 TRP A 15 -8.169 1.062 -8.934 1.00 0.00 N ATOM 246 CE2 TRP A 15 -6.865 0.730 -8.853 1.00 0.00 C ATOM 247 CE3 TRP A 15 -5.363 -0.212 -7.241 1.00 0.00 C ATOM 248 CZ2 TRP A 15 -5.867 0.864 -9.792 1.00 0.00 C ATOM 249 CZ3 TRP A 15 -4.374 -0.077 -8.183 1.00 0.00 C ATOM 250 CH2 TRP A 15 -4.630 0.456 -9.442 1.00 0.00 C ATOM 0 H TRP A 15 -7.615 -2.753 -5.915 1.00 0.00 H new ATOM 0 HA TRP A 15 -9.319 -1.377 -4.100 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -8.537 0.643 -4.897 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -7.166 -0.446 -4.977 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.831 0.908 -7.549 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.624 1.481 -9.746 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.147 -0.627 -6.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.067 1.279 -10.769 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.370 -0.393 -7.940 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -3.822 0.545 -10.153 1.00 0.00 H new ATOM 261 N ARG A 16 -10.448 -2.057 -7.064 1.00 0.00 N ATOM 262 CA ARG A 16 -11.612 -1.981 -7.949 1.00 0.00 C ATOM 263 C ARG A 16 -12.841 -2.569 -7.266 1.00 0.00 C ATOM 264 O ARG A 16 -13.944 -2.024 -7.368 1.00 0.00 O ATOM 265 CB ARG A 16 -11.381 -2.742 -9.261 1.00 0.00 C ATOM 266 CG ARG A 16 -10.078 -2.440 -9.979 1.00 0.00 C ATOM 267 CD ARG A 16 -9.927 -1.001 -10.406 1.00 0.00 C ATOM 268 NE ARG A 16 -10.885 -0.561 -11.418 1.00 0.00 N ATOM 269 CZ ARG A 16 -10.545 0.134 -12.521 1.00 0.00 C ATOM 270 NH1 ARG A 16 -9.270 0.204 -12.905 1.00 0.00 N ATOM 271 NH2 ARG A 16 -11.485 0.686 -13.269 1.00 0.00 N ATOM 0 H ARG A 16 -9.731 -2.719 -7.361 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.769 -0.926 -8.172 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -11.419 -3.811 -9.051 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -12.207 -2.521 -9.938 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -9.246 -2.703 -9.325 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -10.005 -3.078 -10.860 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -10.028 -0.363 -9.528 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -8.918 -0.855 -10.792 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.869 -0.794 -11.281 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -8.547 -0.270 -12.363 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -9.017 0.731 -13.741 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -12.467 0.586 -13.011 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -11.229 1.212 -14.104 1.00 0.00 H new ATOM 285 N LYS A 17 -12.642 -3.662 -6.545 1.00 0.00 N ATOM 286 CA LYS A 17 -13.745 -4.383 -5.911 1.00 0.00 C ATOM 287 C LYS A 17 -14.200 -3.779 -4.583 1.00 0.00 C ATOM 288 O LYS A 17 -15.183 -4.234 -3.999 1.00 0.00 O ATOM 289 CB LYS A 17 -13.445 -5.901 -5.802 1.00 0.00 C ATOM 290 CG LYS A 17 -12.146 -6.288 -5.070 1.00 0.00 C ATOM 291 CD LYS A 17 -12.204 -6.119 -3.546 1.00 0.00 C ATOM 292 CE LYS A 17 -13.217 -7.052 -2.891 1.00 0.00 C ATOM 293 NZ LYS A 17 -13.190 -6.931 -1.418 1.00 0.00 N ATOM 0 H LYS A 17 -11.723 -4.074 -6.382 1.00 0.00 H new ATOM 0 HA LYS A 17 -14.600 -4.264 -6.576 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -14.281 -6.379 -5.292 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -13.407 -6.316 -6.809 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.909 -7.327 -5.300 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -11.329 -5.681 -5.460 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -11.216 -6.308 -3.125 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -12.460 -5.086 -3.308 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -14.217 -6.821 -3.258 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -13.003 -8.082 -3.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -13.890 -7.579 -1.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -12.242 -7.176 -1.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -13.419 -5.954 -1.146 1.00 0.00 H new ATOM 307 N LEU A 18 -13.494 -2.791 -4.097 1.00 0.00 N ATOM 308 CA LEU A 18 -13.903 -2.135 -2.870 1.00 0.00 C ATOM 309 C LEU A 18 -14.577 -0.798 -3.164 1.00 0.00 C ATOM 310 O LEU A 18 -14.635 -0.377 -4.328 1.00 0.00 O ATOM 311 CB LEU A 18 -12.739 -2.045 -1.840 1.00 0.00 C ATOM 312 CG LEU A 18 -11.409 -1.420 -2.298 1.00 0.00 C ATOM 313 CD1 LEU A 18 -11.485 0.084 -2.435 1.00 0.00 C ATOM 314 CD2 LEU A 18 -10.284 -1.813 -1.367 1.00 0.00 C ATOM 0 H LEU A 18 -12.643 -2.422 -4.521 1.00 0.00 H new ATOM 0 HA LEU A 18 -14.658 -2.754 -2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -13.097 -1.475 -0.982 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -12.528 -3.054 -1.487 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.203 -1.817 -3.292 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.519 0.469 -2.760 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.246 0.344 -3.171 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -11.745 0.524 -1.473 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.353 -1.360 -1.709 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -10.508 -1.464 -0.359 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -10.179 -2.898 -1.361 1.00 0.00 H new ATOM 326 N GLY A 19 -15.096 -0.158 -2.139 1.00 0.00 N ATOM 327 CA GLY A 19 -15.814 1.095 -2.291 1.00 0.00 C ATOM 328 C GLY A 19 -15.011 2.193 -2.944 1.00 0.00 C ATOM 329 O GLY A 19 -13.819 2.366 -2.655 1.00 0.00 O ATOM 0 H GLY A 19 -15.034 -0.489 -1.176 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.712 0.917 -2.882 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -16.141 1.435 -1.308 1.00 0.00 H new ATOM 333 N SER A 20 -15.666 2.937 -3.816 1.00 0.00 N ATOM 334 CA SER A 20 -15.054 4.024 -4.543 1.00 0.00 C ATOM 335 C SER A 20 -14.456 5.063 -3.585 1.00 0.00 C ATOM 336 O SER A 20 -13.303 5.465 -3.742 1.00 0.00 O ATOM 337 CB SER A 20 -16.100 4.651 -5.459 1.00 0.00 C ATOM 338 OG SER A 20 -16.669 3.652 -6.307 1.00 0.00 O ATOM 0 H SER A 20 -16.651 2.798 -4.039 1.00 0.00 H new ATOM 0 HA SER A 20 -14.231 3.641 -5.146 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.882 5.122 -4.863 1.00 0.00 H new ATOM 0 HB3 SER A 20 -15.643 5.435 -6.063 1.00 0.00 H new ATOM 0 HG SER A 20 -17.341 4.062 -6.891 1.00 0.00 H new ATOM 344 N THR A 21 -15.197 5.410 -2.541 1.00 0.00 N ATOM 345 CA THR A 21 -14.750 6.399 -1.587 1.00 0.00 C ATOM 346 C THR A 21 -13.553 5.854 -0.788 1.00 0.00 C ATOM 347 O THR A 21 -12.671 6.601 -0.371 1.00 0.00 O ATOM 348 CB THR A 21 -15.906 6.790 -0.639 1.00 0.00 C ATOM 349 OG1 THR A 21 -17.068 7.121 -1.440 1.00 0.00 O ATOM 350 CG2 THR A 21 -15.531 8.002 0.211 1.00 0.00 C ATOM 0 H THR A 21 -16.115 5.015 -2.338 1.00 0.00 H new ATOM 0 HA THR A 21 -14.432 7.292 -2.124 1.00 0.00 H new ATOM 0 HB THR A 21 -16.115 5.952 0.025 1.00 0.00 H new ATOM 0 HG1 THR A 21 -17.811 7.370 -0.851 1.00 0.00 H new ATOM 0 HG21 THR A 21 -16.362 8.256 0.869 1.00 0.00 H new ATOM 0 HG22 THR A 21 -14.652 7.768 0.811 1.00 0.00 H new ATOM 0 HG23 THR A 21 -15.311 8.849 -0.439 1.00 0.00 H new ATOM 358 N VAL A 22 -13.505 4.543 -0.631 1.00 0.00 N ATOM 359 CA VAL A 22 -12.413 3.902 0.065 1.00 0.00 C ATOM 360 C VAL A 22 -11.126 4.019 -0.757 1.00 0.00 C ATOM 361 O VAL A 22 -10.084 4.410 -0.227 1.00 0.00 O ATOM 362 CB VAL A 22 -12.714 2.406 0.391 1.00 0.00 C ATOM 363 CG1 VAL A 22 -11.522 1.740 1.067 1.00 0.00 C ATOM 364 CG2 VAL A 22 -13.944 2.283 1.283 1.00 0.00 C ATOM 0 H VAL A 22 -14.217 3.901 -0.980 1.00 0.00 H new ATOM 0 HA VAL A 22 -12.286 4.418 1.017 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.908 1.898 -0.554 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -11.761 0.699 1.282 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -10.657 1.785 0.405 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.294 2.260 1.998 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.135 1.231 1.497 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.771 2.818 2.217 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.807 2.712 0.774 1.00 0.00 H new ATOM 374 N ARG A 23 -11.216 3.743 -2.061 1.00 0.00 N ATOM 375 CA ARG A 23 -10.025 3.786 -2.903 1.00 0.00 C ATOM 376 C ARG A 23 -9.531 5.231 -3.057 1.00 0.00 C ATOM 377 O ARG A 23 -8.336 5.478 -3.154 1.00 0.00 O ATOM 378 CB ARG A 23 -10.239 3.158 -4.307 1.00 0.00 C ATOM 379 CG ARG A 23 -10.892 4.089 -5.314 1.00 0.00 C ATOM 380 CD ARG A 23 -10.841 3.548 -6.717 1.00 0.00 C ATOM 381 NE ARG A 23 -10.994 4.631 -7.678 1.00 0.00 N ATOM 382 CZ ARG A 23 -11.124 4.499 -8.995 1.00 0.00 C ATOM 383 NH1 ARG A 23 -11.452 3.331 -9.540 1.00 0.00 N ATOM 384 NH2 ARG A 23 -10.996 5.558 -9.763 1.00 0.00 N ATOM 0 H ARG A 23 -12.079 3.494 -2.544 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.273 3.182 -2.395 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -9.274 2.836 -4.699 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -10.855 2.265 -4.203 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -11.931 4.255 -5.030 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -10.394 5.058 -5.284 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -9.893 3.036 -6.883 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -11.631 2.811 -6.860 1.00 0.00 H new ATOM 0 HE ARG A 23 -11.002 5.581 -7.306 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.609 2.517 -8.946 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -11.547 3.249 -10.552 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -10.799 6.468 -9.348 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -11.094 5.469 -10.774 1.00 0.00 H new ATOM 398 N GLU A 24 -10.462 6.180 -3.062 1.00 0.00 N ATOM 399 CA GLU A 24 -10.114 7.571 -3.214 1.00 0.00 C ATOM 400 C GLU A 24 -9.376 8.088 -1.987 1.00 0.00 C ATOM 401 O GLU A 24 -8.446 8.873 -2.114 1.00 0.00 O ATOM 402 CB GLU A 24 -11.336 8.422 -3.549 1.00 0.00 C ATOM 403 CG GLU A 24 -12.018 8.042 -4.873 1.00 0.00 C ATOM 404 CD GLU A 24 -11.126 8.193 -6.094 1.00 0.00 C ATOM 405 OE1 GLU A 24 -10.680 9.324 -6.382 1.00 0.00 O ATOM 406 OE2 GLU A 24 -10.872 7.193 -6.800 1.00 0.00 O ATOM 0 H GLU A 24 -11.461 6.001 -2.962 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.432 7.654 -4.061 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.061 8.333 -2.740 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.036 9.469 -3.594 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.359 7.009 -4.811 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.904 8.663 -5.004 1.00 0.00 H new ATOM 413 N GLN A 25 -9.759 7.606 -0.805 1.00 0.00 N ATOM 414 CA GLN A 25 -9.045 7.953 0.425 1.00 0.00 C ATOM 415 C GLN A 25 -7.632 7.409 0.365 1.00 0.00 C ATOM 416 O GLN A 25 -6.678 8.074 0.768 1.00 0.00 O ATOM 417 CB GLN A 25 -9.741 7.388 1.639 1.00 0.00 C ATOM 418 CG GLN A 25 -11.100 7.968 1.911 1.00 0.00 C ATOM 419 CD GLN A 25 -11.748 7.281 3.075 1.00 0.00 C ATOM 420 OE1 GLN A 25 -11.588 7.687 4.231 1.00 0.00 O ATOM 421 NE2 GLN A 25 -12.487 6.256 2.793 1.00 0.00 N ATOM 0 H GLN A 25 -10.553 6.979 -0.672 1.00 0.00 H new ATOM 0 HA GLN A 25 -9.027 9.040 0.509 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -9.840 6.310 1.515 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -9.110 7.552 2.512 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -11.011 9.035 2.116 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -11.728 7.865 1.026 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -12.592 5.954 1.824 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -12.964 5.750 3.539 1.00 0.00 H new ATOM 430 N LEU A 26 -7.500 6.207 -0.185 1.00 0.00 N ATOM 431 CA LEU A 26 -6.202 5.582 -0.366 1.00 0.00 C ATOM 432 C LEU A 26 -5.341 6.422 -1.295 1.00 0.00 C ATOM 433 O LEU A 26 -4.163 6.544 -1.095 1.00 0.00 O ATOM 434 CB LEU A 26 -6.350 4.159 -0.909 1.00 0.00 C ATOM 435 CG LEU A 26 -7.072 3.162 0.003 1.00 0.00 C ATOM 436 CD1 LEU A 26 -7.241 1.834 -0.701 1.00 0.00 C ATOM 437 CD2 LEU A 26 -6.301 2.970 1.303 1.00 0.00 C ATOM 0 H LEU A 26 -8.285 5.645 -0.514 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.712 5.521 0.606 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.886 4.207 -1.857 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.355 3.769 -1.125 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.057 3.564 0.239 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -7.755 1.135 -0.041 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.828 1.975 -1.609 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.261 1.433 -0.961 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -6.829 2.259 1.938 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.304 2.588 1.082 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.217 3.925 1.821 1.00 0.00 H new ATOM 449 N LYS A 27 -5.969 7.036 -2.283 1.00 0.00 N ATOM 450 CA LYS A 27 -5.288 7.930 -3.217 1.00 0.00 C ATOM 451 C LYS A 27 -4.798 9.213 -2.522 1.00 0.00 C ATOM 452 O LYS A 27 -3.791 9.804 -2.926 1.00 0.00 O ATOM 453 CB LYS A 27 -6.201 8.261 -4.398 1.00 0.00 C ATOM 454 CG LYS A 27 -6.464 7.076 -5.319 1.00 0.00 C ATOM 455 CD LYS A 27 -7.563 7.368 -6.338 1.00 0.00 C ATOM 456 CE LYS A 27 -7.278 8.598 -7.183 1.00 0.00 C ATOM 457 NZ LYS A 27 -8.378 8.866 -8.119 1.00 0.00 N ATOM 0 H LYS A 27 -6.967 6.932 -2.464 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.406 7.411 -3.594 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.153 8.632 -4.017 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.753 9.068 -4.978 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -5.545 6.815 -5.844 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -6.747 6.209 -4.721 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.683 6.504 -6.992 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.509 7.505 -5.814 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.130 9.462 -6.535 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.351 8.454 -7.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.148 9.701 -8.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -8.513 8.043 -8.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -9.253 9.043 -7.585 1.00 0.00 H new ATOM 471 N LYS A 28 -5.509 9.646 -1.488 1.00 0.00 N ATOM 472 CA LYS A 28 -5.079 10.809 -0.702 1.00 0.00 C ATOM 473 C LYS A 28 -3.882 10.431 0.155 1.00 0.00 C ATOM 474 O LYS A 28 -2.927 11.199 0.317 1.00 0.00 O ATOM 475 CB LYS A 28 -6.207 11.370 0.199 1.00 0.00 C ATOM 476 CG LYS A 28 -7.189 12.408 -0.415 1.00 0.00 C ATOM 477 CD LYS A 28 -8.051 11.895 -1.573 1.00 0.00 C ATOM 478 CE LYS A 28 -7.323 11.917 -2.909 1.00 0.00 C ATOM 479 NZ LYS A 28 -6.977 13.287 -3.325 1.00 0.00 N ATOM 0 H LYS A 28 -6.379 9.218 -1.172 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.809 11.594 -1.408 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.796 10.527 0.559 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.740 11.828 1.071 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.849 12.769 0.374 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.613 13.264 -0.765 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.372 10.876 -1.357 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.952 12.504 -1.646 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -6.414 11.319 -2.837 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -7.950 11.454 -3.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -6.834 13.312 -4.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -7.749 13.934 -3.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.102 13.584 -2.847 1.00 0.00 H new ATOM 493 N LYS A 29 -3.925 9.253 0.706 1.00 0.00 N ATOM 494 CA LYS A 29 -2.858 8.767 1.509 1.00 0.00 C ATOM 495 C LYS A 29 -1.598 8.564 0.660 1.00 0.00 C ATOM 496 O LYS A 29 -0.487 8.838 1.091 1.00 0.00 O ATOM 497 CB LYS A 29 -3.276 7.477 2.189 1.00 0.00 C ATOM 498 CG LYS A 29 -2.515 7.202 3.441 1.00 0.00 C ATOM 499 CD LYS A 29 -2.821 8.275 4.471 1.00 0.00 C ATOM 500 CE LYS A 29 -1.954 8.156 5.704 1.00 0.00 C ATOM 501 NZ LYS A 29 -2.188 9.270 6.625 1.00 0.00 N ATOM 0 H LYS A 29 -4.707 8.606 0.606 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.623 9.502 2.279 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -4.340 7.524 2.421 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -3.137 6.647 1.497 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -2.783 6.221 3.833 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -1.446 7.180 3.231 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -2.676 9.258 4.022 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.870 8.208 4.760 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.163 7.213 6.209 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.904 8.136 5.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.544 9.190 7.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.014 10.170 6.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.172 9.243 6.960 1.00 0.00 H new ATOM 515 N LEU A 30 -1.794 8.136 -0.550 1.00 0.00 N ATOM 516 CA LEU A 30 -0.710 7.925 -1.465 1.00 0.00 C ATOM 517 C LEU A 30 -0.091 9.246 -1.908 1.00 0.00 C ATOM 518 O LEU A 30 1.101 9.316 -2.144 1.00 0.00 O ATOM 519 CB LEU A 30 -1.145 7.085 -2.669 1.00 0.00 C ATOM 520 CG LEU A 30 -1.573 5.635 -2.375 1.00 0.00 C ATOM 521 CD1 LEU A 30 -2.070 4.956 -3.638 1.00 0.00 C ATOM 522 CD2 LEU A 30 -0.428 4.834 -1.765 1.00 0.00 C ATOM 0 H LEU A 30 -2.714 7.922 -0.934 1.00 0.00 H new ATOM 0 HA LEU A 30 0.057 7.362 -0.934 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.976 7.594 -3.158 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.322 7.060 -3.383 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.387 5.671 -1.652 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.367 3.933 -3.408 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.927 5.503 -4.032 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.274 4.944 -4.382 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.761 3.815 -1.569 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.412 4.814 -2.459 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.115 5.300 -0.830 1.00 0.00 H new ATOM 534 N VAL A 31 -0.880 10.313 -1.956 1.00 0.00 N ATOM 535 CA VAL A 31 -0.333 11.586 -2.390 1.00 0.00 C ATOM 536 C VAL A 31 0.605 12.168 -1.318 1.00 0.00 C ATOM 537 O VAL A 31 1.502 12.946 -1.632 1.00 0.00 O ATOM 538 CB VAL A 31 -1.421 12.637 -2.849 1.00 0.00 C ATOM 539 CG1 VAL A 31 -2.169 13.274 -1.694 1.00 0.00 C ATOM 540 CG2 VAL A 31 -0.822 13.701 -3.761 1.00 0.00 C ATOM 0 H VAL A 31 -1.869 10.322 -1.708 1.00 0.00 H new ATOM 0 HA VAL A 31 0.247 11.374 -3.288 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.158 12.069 -3.417 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.900 13.984 -2.081 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.682 12.501 -1.122 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.464 13.795 -1.047 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.599 14.406 -4.057 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.032 14.233 -3.230 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.406 13.226 -4.650 1.00 0.00 H new ATOM 550 N GLU A 32 0.440 11.746 -0.050 1.00 0.00 N ATOM 551 CA GLU A 32 1.341 12.234 0.984 1.00 0.00 C ATOM 552 C GLU A 32 2.527 11.288 1.088 1.00 0.00 C ATOM 553 O GLU A 32 3.650 11.691 1.407 1.00 0.00 O ATOM 554 CB GLU A 32 0.647 12.404 2.373 1.00 0.00 C ATOM 555 CG GLU A 32 0.162 11.112 3.029 1.00 0.00 C ATOM 556 CD GLU A 32 -0.327 11.302 4.450 1.00 0.00 C ATOM 557 OE1 GLU A 32 0.510 11.408 5.368 1.00 0.00 O ATOM 558 OE2 GLU A 32 -1.557 11.306 4.689 1.00 0.00 O ATOM 0 H GLU A 32 -0.280 11.096 0.264 1.00 0.00 H new ATOM 0 HA GLU A 32 1.674 13.231 0.694 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.345 12.895 3.051 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -0.205 13.073 2.254 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.644 10.690 2.429 1.00 0.00 H new ATOM 0 HG3 GLU A 32 0.975 10.386 3.027 1.00 0.00 H new ATOM 565 N VAL A 33 2.281 10.041 0.732 1.00 0.00 N ATOM 566 CA VAL A 33 3.263 9.003 0.857 1.00 0.00 C ATOM 567 C VAL A 33 4.340 9.137 -0.226 1.00 0.00 C ATOM 568 O VAL A 33 5.506 8.862 0.011 1.00 0.00 O ATOM 569 CB VAL A 33 2.594 7.593 0.830 1.00 0.00 C ATOM 570 CG1 VAL A 33 2.509 6.968 -0.554 1.00 0.00 C ATOM 571 CG2 VAL A 33 3.254 6.688 1.789 1.00 0.00 C ATOM 0 H VAL A 33 1.389 9.728 0.348 1.00 0.00 H new ATOM 0 HA VAL A 33 3.753 9.113 1.824 1.00 0.00 H new ATOM 0 HB VAL A 33 1.559 7.746 1.136 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.032 5.991 -0.483 1.00 0.00 H new ATOM 0 HG12 VAL A 33 1.922 7.612 -1.209 1.00 0.00 H new ATOM 0 HG13 VAL A 33 3.513 6.853 -0.963 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.774 5.710 1.756 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.307 6.585 1.526 1.00 0.00 H new ATOM 0 HG23 VAL A 33 3.170 7.100 2.795 1.00 0.00 H new ATOM 581 N LEU A 34 3.945 9.639 -1.393 1.00 0.00 N ATOM 582 CA LEU A 34 4.865 9.813 -2.511 1.00 0.00 C ATOM 583 C LEU A 34 5.847 10.944 -2.251 1.00 0.00 C ATOM 584 O LEU A 34 6.772 11.177 -3.038 1.00 0.00 O ATOM 585 CB LEU A 34 4.109 10.056 -3.819 1.00 0.00 C ATOM 586 CG LEU A 34 3.182 8.932 -4.289 1.00 0.00 C ATOM 587 CD1 LEU A 34 2.462 9.337 -5.560 1.00 0.00 C ATOM 588 CD2 LEU A 34 3.957 7.654 -4.526 1.00 0.00 C ATOM 0 H LEU A 34 2.988 9.934 -1.588 1.00 0.00 H new ATOM 0 HA LEU A 34 5.431 8.887 -2.609 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.516 10.964 -3.707 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.839 10.248 -4.605 1.00 0.00 H new ATOM 0 HG LEU A 34 2.448 8.753 -3.503 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.807 8.527 -5.881 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.868 10.231 -5.372 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.193 9.544 -6.342 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.275 6.871 -4.859 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.715 7.825 -5.291 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.440 7.344 -3.599 1.00 0.00 H new ATOM 600 N GLU A 35 5.638 11.660 -1.174 1.00 0.00 N ATOM 601 CA GLU A 35 6.535 12.702 -0.789 1.00 0.00 C ATOM 602 C GLU A 35 7.570 12.109 0.165 1.00 0.00 C ATOM 603 O GLU A 35 8.767 12.290 -0.011 1.00 0.00 O ATOM 604 CB GLU A 35 5.776 13.842 -0.114 1.00 0.00 C ATOM 605 CG GLU A 35 6.593 15.111 0.048 1.00 0.00 C ATOM 606 CD GLU A 35 6.913 15.763 -1.278 1.00 0.00 C ATOM 607 OE1 GLU A 35 7.893 15.368 -1.950 1.00 0.00 O ATOM 608 OE2 GLU A 35 6.176 16.677 -1.696 1.00 0.00 O ATOM 0 H GLU A 35 4.843 11.532 -0.548 1.00 0.00 H new ATOM 0 HA GLU A 35 7.030 13.112 -1.669 1.00 0.00 H new ATOM 0 HB2 GLU A 35 4.884 14.068 -0.698 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.439 13.510 0.868 1.00 0.00 H new ATOM 0 HG2 GLU A 35 6.045 15.816 0.673 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.522 14.878 0.569 1.00 0.00 H new ATOM 615 N SER A 36 7.094 11.352 1.128 1.00 0.00 N ATOM 616 CA SER A 36 7.937 10.728 2.120 1.00 0.00 C ATOM 617 C SER A 36 7.206 9.513 2.694 1.00 0.00 C ATOM 618 O SER A 36 6.298 9.650 3.515 1.00 0.00 O ATOM 619 CB SER A 36 8.315 11.731 3.236 1.00 0.00 C ATOM 620 OG SER A 36 9.255 11.168 4.158 1.00 0.00 O ATOM 0 H SER A 36 6.101 11.151 1.245 1.00 0.00 H new ATOM 0 HA SER A 36 8.867 10.402 1.654 1.00 0.00 H new ATOM 0 HB2 SER A 36 8.738 12.631 2.789 1.00 0.00 H new ATOM 0 HB3 SER A 36 7.416 12.034 3.773 1.00 0.00 H new ATOM 0 HG SER A 36 9.472 11.829 4.848 1.00 0.00 H new ATOM 626 N PRO A 37 7.563 8.307 2.235 1.00 0.00 N ATOM 627 CA PRO A 37 6.907 7.073 2.655 1.00 0.00 C ATOM 628 C PRO A 37 7.570 6.423 3.874 1.00 0.00 C ATOM 629 O PRO A 37 7.258 5.294 4.250 1.00 0.00 O ATOM 630 CB PRO A 37 7.070 6.192 1.422 1.00 0.00 C ATOM 631 CG PRO A 37 8.371 6.617 0.817 1.00 0.00 C ATOM 632 CD PRO A 37 8.607 8.052 1.225 1.00 0.00 C ATOM 0 HA PRO A 37 5.876 7.236 2.969 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.085 5.136 1.690 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.245 6.332 0.724 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.184 5.980 1.166 1.00 0.00 H new ATOM 0 HG3 PRO A 37 8.338 6.526 -0.269 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.606 8.191 1.638 1.00 0.00 H new ATOM 0 HD3 PRO A 37 8.516 8.729 0.376 1.00 0.00 H new ATOM 640 N ARG A 38 8.466 7.137 4.508 1.00 0.00 N ATOM 641 CA ARG A 38 9.165 6.577 5.633 1.00 0.00 C ATOM 642 C ARG A 38 8.503 6.992 6.937 1.00 0.00 C ATOM 643 O ARG A 38 8.924 7.938 7.609 1.00 0.00 O ATOM 644 CB ARG A 38 10.658 6.913 5.608 1.00 0.00 C ATOM 645 CG ARG A 38 11.355 6.485 4.320 1.00 0.00 C ATOM 646 CD ARG A 38 12.857 6.676 4.401 1.00 0.00 C ATOM 647 NE ARG A 38 13.473 5.772 5.382 1.00 0.00 N ATOM 648 CZ ARG A 38 14.692 5.919 5.914 1.00 0.00 C ATOM 649 NH1 ARG A 38 15.419 7.001 5.642 1.00 0.00 N ATOM 650 NH2 ARG A 38 15.177 4.983 6.727 1.00 0.00 N ATOM 0 H ARG A 38 8.725 8.094 4.268 1.00 0.00 H new ATOM 0 HA ARG A 38 9.099 5.491 5.560 1.00 0.00 H new ATOM 0 HB2 ARG A 38 10.783 7.988 5.740 1.00 0.00 H new ATOM 0 HB3 ARG A 38 11.146 6.429 6.454 1.00 0.00 H new ATOM 0 HG2 ARG A 38 11.132 5.437 4.117 1.00 0.00 H new ATOM 0 HG3 ARG A 38 10.960 7.062 3.484 1.00 0.00 H new ATOM 0 HD2 ARG A 38 13.298 6.502 3.420 1.00 0.00 H new ATOM 0 HD3 ARG A 38 13.077 7.709 4.671 1.00 0.00 H new ATOM 0 HE ARG A 38 12.926 4.965 5.682 1.00 0.00 H new ATOM 0 HH11 ARG A 38 15.047 7.723 5.025 1.00 0.00 H new ATOM 0 HH12 ARG A 38 16.348 7.107 6.051 1.00 0.00 H new ATOM 0 HH21 ARG A 38 14.620 4.156 6.943 1.00 0.00 H new ATOM 0 HH22 ARG A 38 16.106 5.092 7.134 1.00 0.00 H new ATOM 664 N ILE A 39 7.414 6.332 7.233 1.00 0.00 N ATOM 665 CA ILE A 39 6.644 6.584 8.431 1.00 0.00 C ATOM 666 C ILE A 39 6.910 5.462 9.434 1.00 0.00 C ATOM 667 O ILE A 39 6.377 4.368 9.295 1.00 0.00 O ATOM 668 CB ILE A 39 5.119 6.625 8.121 1.00 0.00 C ATOM 669 CG1 ILE A 39 4.830 7.566 6.933 1.00 0.00 C ATOM 670 CG2 ILE A 39 4.339 7.073 9.361 1.00 0.00 C ATOM 671 CD1 ILE A 39 3.372 7.612 6.508 1.00 0.00 C ATOM 0 H ILE A 39 7.029 5.594 6.644 1.00 0.00 H new ATOM 0 HA ILE A 39 6.943 7.550 8.838 1.00 0.00 H new ATOM 0 HB ILE A 39 4.795 5.621 7.848 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.151 8.574 7.197 1.00 0.00 H new ATOM 0 HG13 ILE A 39 5.434 7.252 6.082 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.274 7.098 9.131 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.518 6.372 10.176 1.00 0.00 H new ATOM 0 HG23 ILE A 39 4.669 8.068 9.659 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.259 8.297 5.668 1.00 0.00 H new ATOM 0 HD12 ILE A 39 3.049 6.615 6.209 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.761 7.957 7.342 1.00 0.00 H new ATOM 683 N GLU A 40 7.725 5.744 10.433 1.00 0.00 N ATOM 684 CA GLU A 40 8.143 4.755 11.445 1.00 0.00 C ATOM 685 C GLU A 40 6.940 4.076 12.111 1.00 0.00 C ATOM 686 O GLU A 40 6.921 2.875 12.303 1.00 0.00 O ATOM 687 CB GLU A 40 9.058 5.399 12.521 1.00 0.00 C ATOM 688 CG GLU A 40 8.375 6.392 13.490 1.00 0.00 C ATOM 689 CD GLU A 40 7.826 7.641 12.835 1.00 0.00 C ATOM 690 OE1 GLU A 40 6.718 7.599 12.255 1.00 0.00 O ATOM 691 OE2 GLU A 40 8.481 8.686 12.904 1.00 0.00 O ATOM 0 H GLU A 40 8.127 6.670 10.578 1.00 0.00 H new ATOM 0 HA GLU A 40 8.713 3.989 10.919 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.509 4.600 13.110 1.00 0.00 H new ATOM 0 HB3 GLU A 40 9.871 5.919 12.014 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.560 5.878 14.000 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.095 6.686 14.254 1.00 0.00 H new ATOM 698 N ALA A 41 5.926 4.860 12.361 1.00 0.00 N ATOM 699 CA ALA A 41 4.715 4.433 13.038 1.00 0.00 C ATOM 700 C ALA A 41 3.859 3.518 12.167 1.00 0.00 C ATOM 701 O ALA A 41 2.837 2.983 12.613 1.00 0.00 O ATOM 702 CB ALA A 41 3.920 5.655 13.458 1.00 0.00 C ATOM 0 H ALA A 41 5.912 5.844 12.094 1.00 0.00 H new ATOM 0 HA ALA A 41 5.005 3.856 13.916 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.009 5.339 13.967 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.520 6.265 14.133 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.659 6.240 12.576 1.00 0.00 H new ATOM 708 N ASN A 42 4.237 3.380 10.917 1.00 0.00 N ATOM 709 CA ASN A 42 3.524 2.530 9.984 1.00 0.00 C ATOM 710 C ASN A 42 4.393 1.373 9.538 1.00 0.00 C ATOM 711 O ASN A 42 3.991 0.596 8.716 1.00 0.00 O ATOM 712 CB ASN A 42 3.002 3.322 8.754 1.00 0.00 C ATOM 713 CG ASN A 42 1.801 4.247 9.036 1.00 0.00 C ATOM 714 OD1 ASN A 42 0.980 4.502 8.165 1.00 0.00 O ATOM 715 ND2 ASN A 42 1.680 4.743 10.239 1.00 0.00 N ATOM 0 H ASN A 42 5.047 3.853 10.516 1.00 0.00 H new ATOM 0 HA ASN A 42 2.656 2.135 10.511 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.819 3.924 8.355 1.00 0.00 H new ATOM 0 HB3 ASN A 42 2.720 2.612 7.977 1.00 0.00 H new ATOM 0 HD21 ASN A 42 0.893 5.352 10.463 1.00 0.00 H new ATOM 0 HD22 ASN A 42 2.373 4.521 10.954 1.00 0.00 H new ATOM 722 N LYS A 43 5.580 1.261 10.101 1.00 0.00 N ATOM 723 CA LYS A 43 6.496 0.170 9.757 1.00 0.00 C ATOM 724 C LYS A 43 5.919 -1.207 10.155 1.00 0.00 C ATOM 725 O LYS A 43 5.177 -1.315 11.137 1.00 0.00 O ATOM 726 CB LYS A 43 7.862 0.409 10.408 1.00 0.00 C ATOM 727 CG LYS A 43 8.724 1.436 9.699 1.00 0.00 C ATOM 728 CD LYS A 43 10.017 1.666 10.450 1.00 0.00 C ATOM 729 CE LYS A 43 10.907 2.721 9.793 1.00 0.00 C ATOM 730 NZ LYS A 43 11.430 2.306 8.472 1.00 0.00 N ATOM 0 H LYS A 43 5.941 1.909 10.801 1.00 0.00 H new ATOM 0 HA LYS A 43 6.622 0.159 8.674 1.00 0.00 H new ATOM 0 HB2 LYS A 43 7.708 0.731 11.438 1.00 0.00 H new ATOM 0 HB3 LYS A 43 8.403 -0.537 10.447 1.00 0.00 H new ATOM 0 HG2 LYS A 43 8.942 1.097 8.686 1.00 0.00 H new ATOM 0 HG3 LYS A 43 8.178 2.375 9.610 1.00 0.00 H new ATOM 0 HD2 LYS A 43 9.789 1.975 11.470 1.00 0.00 H new ATOM 0 HD3 LYS A 43 10.565 0.726 10.516 1.00 0.00 H new ATOM 0 HE2 LYS A 43 10.339 3.644 9.677 1.00 0.00 H new ATOM 0 HE3 LYS A 43 11.745 2.943 10.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 12.469 2.345 8.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 11.122 1.334 8.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 11.067 2.947 7.738 1.00 0.00 H new ATOM 744 N LEU A 44 6.250 -2.231 9.390 1.00 0.00 N ATOM 745 CA LEU A 44 5.731 -3.572 9.618 1.00 0.00 C ATOM 746 C LEU A 44 6.767 -4.436 10.379 1.00 0.00 C ATOM 747 O LEU A 44 7.982 -4.184 10.299 1.00 0.00 O ATOM 748 CB LEU A 44 5.375 -4.199 8.258 1.00 0.00 C ATOM 749 CG LEU A 44 4.624 -5.532 8.270 1.00 0.00 C ATOM 750 CD1 LEU A 44 3.271 -5.380 8.934 1.00 0.00 C ATOM 751 CD2 LEU A 44 4.457 -6.057 6.856 1.00 0.00 C ATOM 0 H LEU A 44 6.884 -2.160 8.594 1.00 0.00 H new ATOM 0 HA LEU A 44 4.835 -3.522 10.237 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.774 -3.479 7.703 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.301 -4.339 7.700 1.00 0.00 H new ATOM 0 HG LEU A 44 5.211 -6.249 8.844 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.755 -6.340 8.931 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.406 -5.043 9.962 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.678 -4.647 8.387 1.00 0.00 H new ATOM 0 HD21 LEU A 44 3.921 -7.006 6.881 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.892 -5.336 6.265 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.438 -6.206 6.405 1.00 0.00 H new ATOM 763 N ARG A 45 6.285 -5.460 11.089 1.00 0.00 N ATOM 764 CA ARG A 45 7.127 -6.336 11.922 1.00 0.00 C ATOM 765 C ARG A 45 8.037 -7.227 11.075 1.00 0.00 C ATOM 766 O ARG A 45 7.592 -8.203 10.491 1.00 0.00 O ATOM 767 CB ARG A 45 6.241 -7.213 12.844 1.00 0.00 C ATOM 768 CG ARG A 45 7.008 -8.286 13.630 1.00 0.00 C ATOM 769 CD ARG A 45 6.078 -9.182 14.445 1.00 0.00 C ATOM 770 NE ARG A 45 5.428 -8.461 15.546 1.00 0.00 N ATOM 771 CZ ARG A 45 4.320 -8.864 16.204 1.00 0.00 C ATOM 772 NH1 ARG A 45 3.703 -10.008 15.876 1.00 0.00 N ATOM 773 NH2 ARG A 45 3.864 -8.140 17.205 1.00 0.00 N ATOM 0 H ARG A 45 5.296 -5.709 11.105 1.00 0.00 H new ATOM 0 HA ARG A 45 7.763 -5.694 12.531 1.00 0.00 H new ATOM 0 HB2 ARG A 45 5.721 -6.566 13.550 1.00 0.00 H new ATOM 0 HB3 ARG A 45 5.478 -7.701 12.237 1.00 0.00 H new ATOM 0 HG2 ARG A 45 7.584 -8.899 12.937 1.00 0.00 H new ATOM 0 HG3 ARG A 45 7.722 -7.804 14.298 1.00 0.00 H new ATOM 0 HD2 ARG A 45 5.315 -9.601 13.789 1.00 0.00 H new ATOM 0 HD3 ARG A 45 6.647 -10.020 14.849 1.00 0.00 H new ATOM 0 HE ARG A 45 5.850 -7.580 15.839 1.00 0.00 H new ATOM 0 HH11 ARG A 45 4.070 -10.587 15.120 1.00 0.00 H new ATOM 0 HH12 ARG A 45 2.867 -10.300 16.382 1.00 0.00 H new ATOM 0 HH21 ARG A 45 4.347 -7.284 17.477 1.00 0.00 H new ATOM 0 HH22 ARG A 45 3.028 -8.436 17.709 1.00 0.00 H new ATOM 787 N GLY A 46 9.295 -6.890 10.996 1.00 0.00 N ATOM 788 CA GLY A 46 10.209 -7.715 10.239 1.00 0.00 C ATOM 789 C GLY A 46 10.441 -7.188 8.857 1.00 0.00 C ATOM 790 O GLY A 46 11.339 -7.636 8.150 1.00 0.00 O ATOM 0 H GLY A 46 9.709 -6.068 11.435 1.00 0.00 H new ATOM 0 HA2 GLY A 46 11.161 -7.776 10.766 1.00 0.00 H new ATOM 0 HA3 GLY A 46 9.813 -8.729 10.177 1.00 0.00 H new ATOM 794 N MET A 47 9.639 -6.242 8.467 1.00 0.00 N ATOM 795 CA MET A 47 9.757 -5.637 7.173 1.00 0.00 C ATOM 796 C MET A 47 9.929 -4.143 7.361 1.00 0.00 C ATOM 797 O MET A 47 8.947 -3.409 7.471 1.00 0.00 O ATOM 798 CB MET A 47 8.522 -5.919 6.311 1.00 0.00 C ATOM 799 CG MET A 47 8.256 -7.380 5.968 1.00 0.00 C ATOM 800 SD MET A 47 9.527 -8.111 4.920 1.00 0.00 S ATOM 801 CE MET A 47 8.798 -9.725 4.613 1.00 0.00 C ATOM 0 H MET A 47 8.882 -5.867 9.039 1.00 0.00 H new ATOM 0 HA MET A 47 10.619 -6.059 6.657 1.00 0.00 H new ATOM 0 HB2 MET A 47 7.647 -5.524 6.828 1.00 0.00 H new ATOM 0 HB3 MET A 47 8.621 -5.362 5.380 1.00 0.00 H new ATOM 0 HG2 MET A 47 8.182 -7.955 6.891 1.00 0.00 H new ATOM 0 HG3 MET A 47 7.292 -7.458 5.466 1.00 0.00 H new ATOM 0 HE1 MET A 47 9.587 -10.446 4.399 1.00 0.00 H new ATOM 0 HE2 MET A 47 8.242 -10.047 5.494 1.00 0.00 H new ATOM 0 HE3 MET A 47 8.122 -9.663 3.760 1.00 0.00 H new ATOM 811 N PRO A 48 11.177 -3.669 7.478 1.00 0.00 N ATOM 812 CA PRO A 48 11.469 -2.246 7.702 1.00 0.00 C ATOM 813 C PRO A 48 11.100 -1.371 6.508 1.00 0.00 C ATOM 814 O PRO A 48 10.880 -0.160 6.654 1.00 0.00 O ATOM 815 CB PRO A 48 12.992 -2.222 7.918 1.00 0.00 C ATOM 816 CG PRO A 48 13.369 -3.633 8.211 1.00 0.00 C ATOM 817 CD PRO A 48 12.415 -4.472 7.432 1.00 0.00 C ATOM 0 HA PRO A 48 10.892 -1.848 8.537 1.00 0.00 H new ATOM 0 HB2 PRO A 48 13.509 -1.852 7.033 1.00 0.00 H new ATOM 0 HB3 PRO A 48 13.262 -1.563 8.743 1.00 0.00 H new ATOM 0 HG2 PRO A 48 14.399 -3.833 7.915 1.00 0.00 H new ATOM 0 HG3 PRO A 48 13.297 -3.845 9.278 1.00 0.00 H new ATOM 0 HD2 PRO A 48 12.757 -4.633 6.410 1.00 0.00 H new ATOM 0 HD3 PRO A 48 12.278 -5.456 7.881 1.00 0.00 H new ATOM 825 N ASP A 49 11.014 -1.991 5.340 1.00 0.00 N ATOM 826 CA ASP A 49 10.728 -1.275 4.097 1.00 0.00 C ATOM 827 C ASP A 49 9.271 -1.429 3.729 1.00 0.00 C ATOM 828 O ASP A 49 8.817 -0.889 2.718 1.00 0.00 O ATOM 829 CB ASP A 49 11.574 -1.806 2.925 1.00 0.00 C ATOM 830 CG ASP A 49 13.043 -1.901 3.228 1.00 0.00 C ATOM 831 OD1 ASP A 49 13.754 -0.877 3.167 1.00 0.00 O ATOM 832 OD2 ASP A 49 13.521 -3.023 3.527 1.00 0.00 O ATOM 0 H ASP A 49 11.139 -2.997 5.223 1.00 0.00 H new ATOM 0 HA ASP A 49 10.974 -0.227 4.270 1.00 0.00 H new ATOM 0 HB2 ASP A 49 11.207 -2.793 2.642 1.00 0.00 H new ATOM 0 HB3 ASP A 49 11.432 -1.154 2.063 1.00 0.00 H new ATOM 837 N CYS A 50 8.540 -2.168 4.524 1.00 0.00 N ATOM 838 CA CYS A 50 7.148 -2.385 4.260 1.00 0.00 C ATOM 839 C CYS A 50 6.346 -1.647 5.302 1.00 0.00 C ATOM 840 O CYS A 50 6.704 -1.636 6.488 1.00 0.00 O ATOM 841 CB CYS A 50 6.817 -3.879 4.253 1.00 0.00 C ATOM 842 SG CYS A 50 5.143 -4.291 3.714 1.00 0.00 S ATOM 0 H CYS A 50 8.892 -2.630 5.363 1.00 0.00 H new ATOM 0 HA CYS A 50 6.895 -2.004 3.271 1.00 0.00 H new ATOM 0 HB2 CYS A 50 7.527 -4.390 3.603 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.965 -4.273 5.258 1.00 0.00 H new ATOM 0 HG CYS A 50 4.694 -3.351 2.936 1.00 0.00 H new ATOM 848 N TYR A 51 5.310 -0.998 4.866 1.00 0.00 N ATOM 849 CA TYR A 51 4.505 -0.189 5.722 1.00 0.00 C ATOM 850 C TYR A 51 3.050 -0.544 5.525 1.00 0.00 C ATOM 851 O TYR A 51 2.660 -1.052 4.464 1.00 0.00 O ATOM 852 CB TYR A 51 4.730 1.308 5.429 1.00 0.00 C ATOM 853 CG TYR A 51 6.152 1.809 5.647 1.00 0.00 C ATOM 854 CD1 TYR A 51 7.186 1.473 4.783 1.00 0.00 C ATOM 855 CD2 TYR A 51 6.451 2.604 6.719 1.00 0.00 C ATOM 856 CE1 TYR A 51 8.470 1.922 4.998 1.00 0.00 C ATOM 857 CE2 TYR A 51 7.730 3.052 6.934 1.00 0.00 C ATOM 858 CZ TYR A 51 8.730 2.712 6.076 1.00 0.00 C ATOM 859 OH TYR A 51 10.006 3.154 6.318 1.00 0.00 O ATOM 0 H TYR A 51 4.998 -1.017 3.895 1.00 0.00 H new ATOM 0 HA TYR A 51 4.789 -0.379 6.757 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.448 1.505 4.395 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.057 1.890 6.059 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.979 0.848 3.927 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.667 2.884 7.408 1.00 0.00 H new ATOM 0 HE1 TYR A 51 9.263 1.650 4.318 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.944 3.677 7.788 1.00 0.00 H new ATOM 0 HH TYR A 51 10.318 3.686 5.556 1.00 0.00 H new ATOM 869 N LYS A 52 2.277 -0.276 6.523 1.00 0.00 N ATOM 870 CA LYS A 52 0.877 -0.543 6.547 1.00 0.00 C ATOM 871 C LYS A 52 0.162 0.738 6.939 1.00 0.00 C ATOM 872 O LYS A 52 0.532 1.396 7.916 1.00 0.00 O ATOM 873 CB LYS A 52 0.571 -1.656 7.575 1.00 0.00 C ATOM 874 CG LYS A 52 1.050 -1.303 8.977 1.00 0.00 C ATOM 875 CD LYS A 52 0.656 -2.298 10.031 1.00 0.00 C ATOM 876 CE LYS A 52 1.075 -1.753 11.378 1.00 0.00 C ATOM 877 NZ LYS A 52 0.733 -2.643 12.493 1.00 0.00 N ATOM 0 H LYS A 52 2.618 0.154 7.383 1.00 0.00 H new ATOM 0 HA LYS A 52 0.538 -0.879 5.567 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.503 -1.840 7.597 1.00 0.00 H new ATOM 0 HB3 LYS A 52 1.047 -2.583 7.255 1.00 0.00 H new ATOM 0 HG2 LYS A 52 2.136 -1.213 8.966 1.00 0.00 H new ATOM 0 HG3 LYS A 52 0.652 -0.325 9.249 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.420 -2.469 10.009 1.00 0.00 H new ATOM 0 HD3 LYS A 52 1.135 -3.259 9.844 1.00 0.00 H new ATOM 0 HE2 LYS A 52 2.152 -1.582 11.375 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.599 -0.785 11.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.476 -2.074 13.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.071 -3.244 12.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.551 -3.242 12.723 1.00 0.00 H new ATOM 891 N ILE A 53 -0.804 1.114 6.182 1.00 0.00 N ATOM 892 CA ILE A 53 -1.566 2.291 6.494 1.00 0.00 C ATOM 893 C ILE A 53 -3.016 1.888 6.585 1.00 0.00 C ATOM 894 O ILE A 53 -3.432 0.969 5.900 1.00 0.00 O ATOM 895 CB ILE A 53 -1.402 3.396 5.424 1.00 0.00 C ATOM 896 CG1 ILE A 53 0.081 3.682 5.155 1.00 0.00 C ATOM 897 CG2 ILE A 53 -2.082 4.659 5.913 1.00 0.00 C ATOM 898 CD1 ILE A 53 0.325 4.695 4.058 1.00 0.00 C ATOM 0 H ILE A 53 -1.095 0.627 5.334 1.00 0.00 H new ATOM 0 HA ILE A 53 -1.205 2.704 7.436 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.859 3.057 4.494 1.00 0.00 H new ATOM 0 HG12 ILE A 53 0.544 4.040 6.075 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.578 2.749 4.890 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.972 5.444 5.165 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.141 4.461 6.078 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -1.623 4.981 6.848 1.00 0.00 H new ATOM 0 HD11 ILE A 53 1.398 4.841 3.930 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.106 4.332 3.125 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.141 5.643 4.328 1.00 0.00 H new ATOM 910 N LYS A 54 -3.772 2.538 7.424 1.00 0.00 N ATOM 911 CA LYS A 54 -5.143 2.179 7.610 1.00 0.00 C ATOM 912 C LYS A 54 -6.058 3.388 7.706 1.00 0.00 C ATOM 913 O LYS A 54 -5.709 4.421 8.296 1.00 0.00 O ATOM 914 CB LYS A 54 -5.261 1.227 8.800 1.00 0.00 C ATOM 915 CG LYS A 54 -4.474 1.683 10.021 1.00 0.00 C ATOM 916 CD LYS A 54 -4.148 0.511 10.925 1.00 0.00 C ATOM 917 CE LYS A 54 -5.379 -0.073 11.598 1.00 0.00 C ATOM 918 NZ LYS A 54 -5.971 0.870 12.561 1.00 0.00 N ATOM 0 H LYS A 54 -3.456 3.324 7.992 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.492 1.650 6.723 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -6.312 1.126 9.072 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -4.912 0.239 8.501 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -3.552 2.169 9.703 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.051 2.424 10.574 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -3.655 -0.266 10.341 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.440 0.833 11.689 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -6.119 -0.333 10.841 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.110 -0.996 12.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -6.664 0.371 13.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -5.222 1.268 13.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -6.446 1.639 12.047 1.00 0.00 H new ATOM 932 N LEU A 55 -7.194 3.261 7.066 1.00 0.00 N ATOM 933 CA LEU A 55 -8.208 4.279 7.032 1.00 0.00 C ATOM 934 C LEU A 55 -9.120 4.081 8.214 1.00 0.00 C ATOM 935 O LEU A 55 -9.781 3.041 8.325 1.00 0.00 O ATOM 936 CB LEU A 55 -9.030 4.166 5.743 1.00 0.00 C ATOM 937 CG LEU A 55 -8.268 4.280 4.426 1.00 0.00 C ATOM 938 CD1 LEU A 55 -9.211 4.051 3.261 1.00 0.00 C ATOM 939 CD2 LEU A 55 -7.587 5.639 4.305 1.00 0.00 C ATOM 0 H LEU A 55 -7.443 2.423 6.541 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.738 5.262 7.067 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.547 3.207 5.754 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.796 4.941 5.760 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.492 3.515 4.408 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.659 4.134 2.325 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -9.649 3.056 3.337 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.004 4.798 3.282 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.051 5.694 3.358 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.339 6.427 4.343 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.884 5.768 5.128 1.00 0.00 H new ATOM 951 N ARG A 56 -9.201 5.080 9.045 1.00 0.00 N ATOM 952 CA ARG A 56 -9.955 5.009 10.282 1.00 0.00 C ATOM 953 C ARG A 56 -11.456 4.952 10.015 1.00 0.00 C ATOM 954 O ARG A 56 -12.198 4.273 10.722 1.00 0.00 O ATOM 955 CB ARG A 56 -9.625 6.190 11.231 1.00 0.00 C ATOM 956 CG ARG A 56 -8.171 6.268 11.741 1.00 0.00 C ATOM 957 CD ARG A 56 -7.177 6.735 10.679 1.00 0.00 C ATOM 958 NE ARG A 56 -5.799 6.784 11.192 1.00 0.00 N ATOM 959 CZ ARG A 56 -4.849 7.658 10.800 1.00 0.00 C ATOM 960 NH1 ARG A 56 -5.135 8.641 9.951 1.00 0.00 N ATOM 961 NH2 ARG A 56 -3.619 7.559 11.284 1.00 0.00 N ATOM 0 H ARG A 56 -8.744 5.979 8.890 1.00 0.00 H new ATOM 0 HA ARG A 56 -9.655 4.086 10.778 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.857 7.121 10.713 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -10.288 6.132 12.094 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.129 6.949 12.591 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.868 5.286 12.104 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.220 6.063 9.822 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.466 7.724 10.323 1.00 0.00 H new ATOM 0 HE ARG A 56 -5.540 6.100 11.903 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -6.083 8.741 9.588 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.407 9.295 9.663 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -3.392 6.823 11.952 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -2.900 8.219 10.988 1.00 0.00 H new ATOM 975 N SER A 57 -11.885 5.638 8.981 1.00 0.00 N ATOM 976 CA SER A 57 -13.289 5.708 8.620 1.00 0.00 C ATOM 977 C SER A 57 -13.781 4.404 7.957 1.00 0.00 C ATOM 978 O SER A 57 -14.929 3.992 8.136 1.00 0.00 O ATOM 979 CB SER A 57 -13.479 6.879 7.659 1.00 0.00 C ATOM 980 OG SER A 57 -12.872 8.051 8.192 1.00 0.00 O ATOM 0 H SER A 57 -11.271 6.167 8.362 1.00 0.00 H new ATOM 0 HA SER A 57 -13.876 5.849 9.528 1.00 0.00 H new ATOM 0 HB2 SER A 57 -13.039 6.640 6.691 1.00 0.00 H new ATOM 0 HB3 SER A 57 -14.542 7.054 7.492 1.00 0.00 H new ATOM 0 HG SER A 57 -12.997 8.797 7.569 1.00 0.00 H new ATOM 986 N SER A 58 -12.907 3.755 7.231 1.00 0.00 N ATOM 987 CA SER A 58 -13.300 2.606 6.451 1.00 0.00 C ATOM 988 C SER A 58 -12.960 1.268 7.135 1.00 0.00 C ATOM 989 O SER A 58 -13.720 0.296 7.031 1.00 0.00 O ATOM 990 CB SER A 58 -12.639 2.712 5.084 1.00 0.00 C ATOM 991 OG SER A 58 -12.878 3.996 4.532 1.00 0.00 O ATOM 0 H SER A 58 -11.919 4.001 7.163 1.00 0.00 H new ATOM 0 HA SER A 58 -14.385 2.609 6.350 1.00 0.00 H new ATOM 0 HB2 SER A 58 -11.567 2.539 5.174 1.00 0.00 H new ATOM 0 HB3 SER A 58 -13.031 1.942 4.420 1.00 0.00 H new ATOM 0 HG SER A 58 -13.777 4.022 4.142 1.00 0.00 H new ATOM 997 N GLY A 59 -11.833 1.212 7.830 1.00 0.00 N ATOM 998 CA GLY A 59 -11.412 -0.038 8.438 1.00 0.00 C ATOM 999 C GLY A 59 -10.572 -0.861 7.482 1.00 0.00 C ATOM 1000 O GLY A 59 -10.226 -2.017 7.755 1.00 0.00 O ATOM 0 H GLY A 59 -11.206 2.001 7.984 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -10.839 0.170 9.342 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.289 -0.611 8.741 1.00 0.00 H new ATOM 1004 N TYR A 60 -10.247 -0.255 6.367 1.00 0.00 N ATOM 1005 CA TYR A 60 -9.442 -0.869 5.339 1.00 0.00 C ATOM 1006 C TYR A 60 -7.996 -0.492 5.538 1.00 0.00 C ATOM 1007 O TYR A 60 -7.695 0.462 6.249 1.00 0.00 O ATOM 1008 CB TYR A 60 -9.911 -0.434 3.941 1.00 0.00 C ATOM 1009 CG TYR A 60 -11.227 -1.044 3.496 1.00 0.00 C ATOM 1010 CD1 TYR A 60 -12.433 -0.651 4.051 1.00 0.00 C ATOM 1011 CD2 TYR A 60 -11.254 -2.009 2.504 1.00 0.00 C ATOM 1012 CE1 TYR A 60 -13.625 -1.203 3.637 1.00 0.00 C ATOM 1013 CE2 TYR A 60 -12.439 -2.568 2.082 1.00 0.00 C ATOM 1014 CZ TYR A 60 -13.624 -2.163 2.651 1.00 0.00 C ATOM 1015 OH TYR A 60 -14.810 -2.727 2.236 1.00 0.00 O ATOM 0 H TYR A 60 -10.540 0.696 6.144 1.00 0.00 H new ATOM 0 HA TYR A 60 -9.551 -1.951 5.412 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.006 0.652 3.926 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.141 -0.697 3.216 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -12.439 0.103 4.824 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -10.327 -2.330 2.052 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -14.555 -0.884 4.084 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -12.438 -3.321 1.308 1.00 0.00 H new ATOM 0 HH TYR A 60 -14.631 -3.386 1.533 1.00 0.00 H new ATOM 1025 N ARG A 61 -7.118 -1.230 4.932 1.00 0.00 N ATOM 1026 CA ARG A 61 -5.709 -0.964 5.005 1.00 0.00 C ATOM 1027 C ARG A 61 -5.071 -1.124 3.642 1.00 0.00 C ATOM 1028 O ARG A 61 -5.712 -1.574 2.688 1.00 0.00 O ATOM 1029 CB ARG A 61 -4.976 -1.844 6.063 1.00 0.00 C ATOM 1030 CG ARG A 61 -5.327 -3.326 6.035 1.00 0.00 C ATOM 1031 CD ARG A 61 -6.459 -3.635 7.008 1.00 0.00 C ATOM 1032 NE ARG A 61 -5.995 -3.524 8.410 1.00 0.00 N ATOM 1033 CZ ARG A 61 -6.753 -3.306 9.505 1.00 0.00 C ATOM 1034 NH1 ARG A 61 -8.049 -3.007 9.396 1.00 0.00 N ATOM 1035 NH2 ARG A 61 -6.193 -3.362 10.720 1.00 0.00 N ATOM 0 H ARG A 61 -7.359 -2.044 4.366 1.00 0.00 H new ATOM 0 HA ARG A 61 -5.601 0.069 5.335 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -3.901 -1.740 5.916 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -5.201 -1.453 7.055 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -5.620 -3.615 5.026 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -4.448 -3.917 6.293 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -7.287 -2.947 6.839 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -6.838 -4.641 6.824 1.00 0.00 H new ATOM 0 HE ARG A 61 -4.992 -3.623 8.565 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -8.481 -2.940 8.475 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -8.607 -2.845 10.234 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -5.199 -3.569 10.814 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -6.761 -3.198 11.551 1.00 0.00 H new ATOM 1049 N LEU A 62 -3.851 -0.733 3.554 1.00 0.00 N ATOM 1050 CA LEU A 62 -3.074 -0.832 2.369 1.00 0.00 C ATOM 1051 C LEU A 62 -1.660 -1.172 2.793 1.00 0.00 C ATOM 1052 O LEU A 62 -1.087 -0.518 3.669 1.00 0.00 O ATOM 1053 CB LEU A 62 -3.180 0.496 1.556 1.00 0.00 C ATOM 1054 CG LEU A 62 -2.400 0.625 0.225 1.00 0.00 C ATOM 1055 CD1 LEU A 62 -2.998 1.743 -0.613 1.00 0.00 C ATOM 1056 CD2 LEU A 62 -0.934 0.949 0.476 1.00 0.00 C ATOM 0 H LEU A 62 -3.345 -0.318 4.337 1.00 0.00 H new ATOM 0 HA LEU A 62 -3.432 -1.615 1.701 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.234 0.665 1.337 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.856 1.308 2.207 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.473 -0.329 -0.297 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.447 1.831 -1.549 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.043 1.518 -0.827 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -2.934 2.683 -0.065 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.412 1.034 -0.477 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.857 1.892 1.017 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.482 0.153 1.068 1.00 0.00 H new ATOM 1068 N VAL A 63 -1.139 -2.214 2.219 1.00 0.00 N ATOM 1069 CA VAL A 63 0.179 -2.710 2.536 1.00 0.00 C ATOM 1070 C VAL A 63 1.065 -2.401 1.358 1.00 0.00 C ATOM 1071 O VAL A 63 0.712 -2.746 0.237 1.00 0.00 O ATOM 1072 CB VAL A 63 0.153 -4.254 2.722 1.00 0.00 C ATOM 1073 CG1 VAL A 63 1.468 -4.771 3.288 1.00 0.00 C ATOM 1074 CG2 VAL A 63 -1.032 -4.698 3.572 1.00 0.00 C ATOM 0 H VAL A 63 -1.621 -2.758 1.503 1.00 0.00 H new ATOM 0 HA VAL A 63 0.535 -2.247 3.456 1.00 0.00 H new ATOM 0 HB VAL A 63 0.027 -4.696 1.733 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.413 -5.853 3.405 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.281 -4.520 2.607 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.653 -4.310 4.259 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -1.016 -5.783 3.680 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -0.968 -4.235 4.556 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -1.961 -4.395 3.088 1.00 0.00 H new ATOM 1084 N TYR A 64 2.181 -1.754 1.577 1.00 0.00 N ATOM 1085 CA TYR A 64 3.065 -1.415 0.482 1.00 0.00 C ATOM 1086 C TYR A 64 4.514 -1.559 0.905 1.00 0.00 C ATOM 1087 O TYR A 64 4.800 -1.833 2.065 1.00 0.00 O ATOM 1088 CB TYR A 64 2.800 0.016 -0.035 1.00 0.00 C ATOM 1089 CG TYR A 64 3.213 1.130 0.908 1.00 0.00 C ATOM 1090 CD1 TYR A 64 2.385 1.555 1.928 1.00 0.00 C ATOM 1091 CD2 TYR A 64 4.438 1.762 0.757 1.00 0.00 C ATOM 1092 CE1 TYR A 64 2.770 2.572 2.770 1.00 0.00 C ATOM 1093 CE2 TYR A 64 4.823 2.774 1.593 1.00 0.00 C ATOM 1094 CZ TYR A 64 3.991 3.176 2.594 1.00 0.00 C ATOM 1095 OH TYR A 64 4.382 4.189 3.427 1.00 0.00 O ATOM 0 H TYR A 64 2.501 -1.451 2.497 1.00 0.00 H new ATOM 0 HA TYR A 64 2.863 -2.110 -0.333 1.00 0.00 H new ATOM 0 HB2 TYR A 64 3.327 0.147 -0.980 1.00 0.00 H new ATOM 0 HB3 TYR A 64 1.736 0.117 -0.247 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.423 1.083 2.066 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.101 1.449 -0.036 1.00 0.00 H new ATOM 0 HE1 TYR A 64 2.115 2.894 3.566 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.782 3.252 1.460 1.00 0.00 H new ATOM 0 HH TYR A 64 5.360 4.253 3.427 1.00 0.00 H new ATOM 1105 N GLN A 65 5.395 -1.374 -0.026 1.00 0.00 N ATOM 1106 CA GLN A 65 6.803 -1.435 0.192 1.00 0.00 C ATOM 1107 C GLN A 65 7.457 -0.223 -0.440 1.00 0.00 C ATOM 1108 O GLN A 65 7.050 0.229 -1.522 1.00 0.00 O ATOM 1109 CB GLN A 65 7.375 -2.729 -0.390 1.00 0.00 C ATOM 1110 CG GLN A 65 8.900 -2.833 -0.332 1.00 0.00 C ATOM 1111 CD GLN A 65 9.416 -4.158 -0.832 1.00 0.00 C ATOM 1112 OE1 GLN A 65 10.502 -4.250 -1.401 1.00 0.00 O ATOM 1113 NE2 GLN A 65 8.681 -5.197 -0.576 1.00 0.00 N ATOM 0 H GLN A 65 5.143 -1.169 -0.993 1.00 0.00 H new ATOM 0 HA GLN A 65 7.008 -1.431 1.263 1.00 0.00 H new ATOM 0 HB2 GLN A 65 6.945 -3.575 0.147 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.057 -2.817 -1.429 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.337 -2.031 -0.927 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.231 -2.684 0.696 1.00 0.00 H new ATOM 0 HE21 GLN A 65 7.785 -5.084 -0.102 1.00 0.00 H new ATOM 0 HE22 GLN A 65 9.000 -6.127 -0.849 1.00 0.00 H new ATOM 1122 N VAL A 66 8.433 0.297 0.234 1.00 0.00 N ATOM 1123 CA VAL A 66 9.167 1.450 -0.223 1.00 0.00 C ATOM 1124 C VAL A 66 10.409 0.985 -0.945 1.00 0.00 C ATOM 1125 O VAL A 66 11.335 0.446 -0.330 1.00 0.00 O ATOM 1126 CB VAL A 66 9.571 2.379 0.955 1.00 0.00 C ATOM 1127 CG1 VAL A 66 10.341 3.601 0.463 1.00 0.00 C ATOM 1128 CG2 VAL A 66 8.347 2.822 1.698 1.00 0.00 C ATOM 0 H VAL A 66 8.753 -0.068 1.131 1.00 0.00 H new ATOM 0 HA VAL A 66 8.524 2.022 -0.892 1.00 0.00 H new ATOM 0 HB VAL A 66 10.222 1.812 1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 66 10.608 4.229 1.313 1.00 0.00 H new ATOM 0 HG12 VAL A 66 11.248 3.278 -0.049 1.00 0.00 H new ATOM 0 HG13 VAL A 66 9.718 4.170 -0.227 1.00 0.00 H new ATOM 0 HG21 VAL A 66 8.638 3.473 2.523 1.00 0.00 H new ATOM 0 HG22 VAL A 66 7.688 3.366 1.021 1.00 0.00 H new ATOM 0 HG23 VAL A 66 7.824 1.950 2.091 1.00 0.00 H new ATOM 1138 N ILE A 67 10.414 1.139 -2.232 1.00 0.00 N ATOM 1139 CA ILE A 67 11.542 0.754 -3.021 1.00 0.00 C ATOM 1140 C ILE A 67 12.338 2.008 -3.327 1.00 0.00 C ATOM 1141 O ILE A 67 11.930 2.815 -4.148 1.00 0.00 O ATOM 1142 CB ILE A 67 11.089 0.098 -4.349 1.00 0.00 C ATOM 1143 CG1 ILE A 67 10.102 -1.048 -4.078 1.00 0.00 C ATOM 1144 CG2 ILE A 67 12.293 -0.425 -5.110 1.00 0.00 C ATOM 1145 CD1 ILE A 67 9.582 -1.723 -5.331 1.00 0.00 C ATOM 0 H ILE A 67 9.639 1.534 -2.764 1.00 0.00 H new ATOM 0 HA ILE A 67 12.143 0.028 -2.474 1.00 0.00 H new ATOM 0 HB ILE A 67 10.586 0.854 -4.952 1.00 0.00 H new ATOM 0 HG12 ILE A 67 10.591 -1.794 -3.452 1.00 0.00 H new ATOM 0 HG13 ILE A 67 9.257 -0.659 -3.510 1.00 0.00 H new ATOM 0 HG21 ILE A 67 11.963 -0.884 -6.042 1.00 0.00 H new ATOM 0 HG22 ILE A 67 12.970 0.400 -5.332 1.00 0.00 H new ATOM 0 HG23 ILE A 67 12.812 -1.167 -4.504 1.00 0.00 H new ATOM 0 HD11 ILE A 67 8.892 -2.520 -5.055 1.00 0.00 H new ATOM 0 HD12 ILE A 67 9.063 -0.991 -5.950 1.00 0.00 H new ATOM 0 HD13 ILE A 67 10.417 -2.144 -5.891 1.00 0.00 H new ATOM 1157 N ASP A 68 13.450 2.188 -2.674 1.00 0.00 N ATOM 1158 CA ASP A 68 14.222 3.412 -2.859 1.00 0.00 C ATOM 1159 C ASP A 68 15.126 3.325 -4.081 1.00 0.00 C ATOM 1160 O ASP A 68 15.518 4.354 -4.643 1.00 0.00 O ATOM 1161 CB ASP A 68 15.035 3.787 -1.607 1.00 0.00 C ATOM 1162 CG ASP A 68 16.174 2.842 -1.313 1.00 0.00 C ATOM 1163 OD1 ASP A 68 15.960 1.826 -0.627 1.00 0.00 O ATOM 1164 OD2 ASP A 68 17.310 3.105 -1.748 1.00 0.00 O ATOM 0 H ASP A 68 13.850 1.521 -2.014 1.00 0.00 H new ATOM 0 HA ASP A 68 13.498 4.209 -3.027 1.00 0.00 H new ATOM 0 HB2 ASP A 68 15.434 4.794 -1.733 1.00 0.00 H new ATOM 0 HB3 ASP A 68 14.367 3.814 -0.746 1.00 0.00 H new ATOM 1169 N GLU A 69 15.434 2.107 -4.512 1.00 0.00 N ATOM 1170 CA GLU A 69 16.284 1.900 -5.691 1.00 0.00 C ATOM 1171 C GLU A 69 15.573 2.329 -6.984 1.00 0.00 C ATOM 1172 O GLU A 69 16.163 2.957 -7.852 1.00 0.00 O ATOM 1173 CB GLU A 69 16.772 0.442 -5.792 1.00 0.00 C ATOM 1174 CG GLU A 69 15.654 -0.583 -5.792 1.00 0.00 C ATOM 1175 CD GLU A 69 16.110 -1.979 -6.082 1.00 0.00 C ATOM 1176 OE1 GLU A 69 16.625 -2.656 -5.171 1.00 0.00 O ATOM 1177 OE2 GLU A 69 15.905 -2.446 -7.216 1.00 0.00 O ATOM 0 H GLU A 69 15.112 1.247 -4.068 1.00 0.00 H new ATOM 0 HA GLU A 69 17.160 2.536 -5.565 1.00 0.00 H new ATOM 0 HB2 GLU A 69 17.356 0.327 -6.705 1.00 0.00 H new ATOM 0 HB3 GLU A 69 17.441 0.235 -4.957 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.160 -0.567 -4.820 1.00 0.00 H new ATOM 0 HG3 GLU A 69 14.909 -0.293 -6.533 1.00 0.00 H new ATOM 1184 N LYS A 70 14.296 2.010 -7.083 1.00 0.00 N ATOM 1185 CA LYS A 70 13.506 2.348 -8.264 1.00 0.00 C ATOM 1186 C LYS A 70 12.705 3.617 -8.002 1.00 0.00 C ATOM 1187 O LYS A 70 12.080 4.177 -8.905 1.00 0.00 O ATOM 1188 CB LYS A 70 12.576 1.180 -8.642 1.00 0.00 C ATOM 1189 CG LYS A 70 13.304 -0.106 -9.039 1.00 0.00 C ATOM 1190 CD LYS A 70 12.326 -1.217 -9.400 1.00 0.00 C ATOM 1191 CE LYS A 70 13.044 -2.483 -9.887 1.00 0.00 C ATOM 1192 NZ LYS A 70 13.858 -3.148 -8.832 1.00 0.00 N ATOM 0 H LYS A 70 13.777 1.515 -6.358 1.00 0.00 H new ATOM 0 HA LYS A 70 14.178 2.527 -9.103 1.00 0.00 H new ATOM 0 HB2 LYS A 70 11.920 0.966 -7.798 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.939 1.492 -9.469 1.00 0.00 H new ATOM 0 HG2 LYS A 70 13.958 0.093 -9.888 1.00 0.00 H new ATOM 0 HG3 LYS A 70 13.940 -0.433 -8.216 1.00 0.00 H new ATOM 0 HD2 LYS A 70 11.716 -1.459 -8.530 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.648 -0.864 -10.177 1.00 0.00 H new ATOM 0 HE2 LYS A 70 12.304 -3.189 -10.262 1.00 0.00 H new ATOM 0 HE3 LYS A 70 13.691 -2.224 -10.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.355 -3.965 -9.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 14.553 -2.474 -8.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.235 -3.470 -8.064 1.00 0.00 H new ATOM 1206 N VAL A 71 12.785 4.067 -6.749 1.00 0.00 N ATOM 1207 CA VAL A 71 12.086 5.243 -6.212 1.00 0.00 C ATOM 1208 C VAL A 71 10.592 5.132 -6.474 1.00 0.00 C ATOM 1209 O VAL A 71 10.027 5.883 -7.259 1.00 0.00 O ATOM 1210 CB VAL A 71 12.604 6.605 -6.768 1.00 0.00 C ATOM 1211 CG1 VAL A 71 12.173 7.738 -5.861 1.00 0.00 C ATOM 1212 CG2 VAL A 71 14.097 6.611 -6.935 1.00 0.00 C ATOM 0 H VAL A 71 13.363 3.604 -6.048 1.00 0.00 H new ATOM 0 HA VAL A 71 12.295 5.243 -5.142 1.00 0.00 H new ATOM 0 HB VAL A 71 12.163 6.746 -7.755 1.00 0.00 H new ATOM 0 HG11 VAL A 71 12.541 8.683 -6.260 1.00 0.00 H new ATOM 0 HG12 VAL A 71 11.085 7.766 -5.806 1.00 0.00 H new ATOM 0 HG13 VAL A 71 12.583 7.581 -4.863 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.416 7.578 -7.324 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.572 6.434 -5.970 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.388 5.825 -7.632 1.00 0.00 H new ATOM 1222 N VAL A 72 9.962 4.195 -5.842 1.00 0.00 N ATOM 1223 CA VAL A 72 8.587 3.945 -6.098 1.00 0.00 C ATOM 1224 C VAL A 72 7.914 3.301 -4.877 1.00 0.00 C ATOM 1225 O VAL A 72 8.569 2.611 -4.071 1.00 0.00 O ATOM 1226 CB VAL A 72 8.443 3.049 -7.369 1.00 0.00 C ATOM 1227 CG1 VAL A 72 9.027 1.659 -7.173 1.00 0.00 C ATOM 1228 CG2 VAL A 72 7.025 2.986 -7.859 1.00 0.00 C ATOM 0 H VAL A 72 10.385 3.588 -5.140 1.00 0.00 H new ATOM 0 HA VAL A 72 8.080 4.892 -6.285 1.00 0.00 H new ATOM 0 HB VAL A 72 9.034 3.532 -8.147 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.900 1.079 -8.087 1.00 0.00 H new ATOM 0 HG12 VAL A 72 10.089 1.740 -6.939 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.512 1.160 -6.352 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.974 2.352 -8.744 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.388 2.571 -7.078 1.00 0.00 H new ATOM 0 HG23 VAL A 72 6.682 3.989 -8.111 1.00 0.00 H new ATOM 1238 N VAL A 73 6.651 3.586 -4.716 1.00 0.00 N ATOM 1239 CA VAL A 73 5.831 3.025 -3.684 1.00 0.00 C ATOM 1240 C VAL A 73 5.042 1.882 -4.293 1.00 0.00 C ATOM 1241 O VAL A 73 4.056 2.099 -4.988 1.00 0.00 O ATOM 1242 CB VAL A 73 4.870 4.102 -3.101 1.00 0.00 C ATOM 1243 CG1 VAL A 73 3.906 3.514 -2.084 1.00 0.00 C ATOM 1244 CG2 VAL A 73 5.673 5.222 -2.473 1.00 0.00 C ATOM 0 H VAL A 73 6.150 4.237 -5.321 1.00 0.00 H new ATOM 0 HA VAL A 73 6.451 2.663 -2.864 1.00 0.00 H new ATOM 0 HB VAL A 73 4.274 4.496 -3.924 1.00 0.00 H new ATOM 0 HG11 VAL A 73 3.254 4.300 -1.703 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.302 2.741 -2.560 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.469 3.078 -1.259 1.00 0.00 H new ATOM 0 HG21 VAL A 73 4.995 5.972 -2.067 1.00 0.00 H new ATOM 0 HG22 VAL A 73 6.292 4.820 -1.671 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.311 5.680 -3.229 1.00 0.00 H new ATOM 1254 N PHE A 74 5.517 0.691 -4.079 1.00 0.00 N ATOM 1255 CA PHE A 74 4.923 -0.489 -4.656 1.00 0.00 C ATOM 1256 C PHE A 74 3.938 -1.121 -3.695 1.00 0.00 C ATOM 1257 O PHE A 74 4.318 -1.724 -2.703 1.00 0.00 O ATOM 1258 CB PHE A 74 6.027 -1.471 -5.090 1.00 0.00 C ATOM 1259 CG PHE A 74 5.563 -2.844 -5.511 1.00 0.00 C ATOM 1260 CD1 PHE A 74 4.496 -3.015 -6.379 1.00 0.00 C ATOM 1261 CD2 PHE A 74 6.211 -3.970 -5.033 1.00 0.00 C ATOM 1262 CE1 PHE A 74 4.090 -4.274 -6.748 1.00 0.00 C ATOM 1263 CE2 PHE A 74 5.807 -5.229 -5.405 1.00 0.00 C ATOM 1264 CZ PHE A 74 4.742 -5.379 -6.262 1.00 0.00 C ATOM 0 H PHE A 74 6.333 0.504 -3.496 1.00 0.00 H new ATOM 0 HA PHE A 74 4.358 -0.210 -5.545 1.00 0.00 H new ATOM 0 HB2 PHE A 74 6.577 -1.025 -5.919 1.00 0.00 H new ATOM 0 HB3 PHE A 74 6.730 -1.584 -4.265 1.00 0.00 H new ATOM 0 HD1 PHE A 74 3.979 -2.150 -6.769 1.00 0.00 H new ATOM 0 HD2 PHE A 74 7.046 -3.857 -4.358 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.255 -4.395 -7.423 1.00 0.00 H new ATOM 0 HE2 PHE A 74 6.324 -6.098 -5.026 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.419 -6.368 -6.553 1.00 0.00 H new ATOM 1274 N VAL A 75 2.686 -0.944 -3.978 1.00 0.00 N ATOM 1275 CA VAL A 75 1.636 -1.485 -3.169 1.00 0.00 C ATOM 1276 C VAL A 75 1.477 -2.975 -3.436 1.00 0.00 C ATOM 1277 O VAL A 75 1.331 -3.412 -4.581 1.00 0.00 O ATOM 1278 CB VAL A 75 0.305 -0.747 -3.395 1.00 0.00 C ATOM 1279 CG1 VAL A 75 -0.779 -1.287 -2.472 1.00 0.00 C ATOM 1280 CG2 VAL A 75 0.489 0.754 -3.200 1.00 0.00 C ATOM 0 H VAL A 75 2.359 -0.414 -4.786 1.00 0.00 H new ATOM 0 HA VAL A 75 1.914 -1.342 -2.125 1.00 0.00 H new ATOM 0 HB VAL A 75 -0.014 -0.922 -4.422 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -1.710 -0.749 -2.651 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.929 -2.348 -2.669 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.475 -1.150 -1.434 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.462 1.261 -3.363 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.835 0.949 -2.185 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.226 1.126 -3.912 1.00 0.00 H new ATOM 1290 N ILE A 76 1.527 -3.720 -2.373 1.00 0.00 N ATOM 1291 CA ILE A 76 1.479 -5.157 -2.386 1.00 0.00 C ATOM 1292 C ILE A 76 0.029 -5.645 -2.304 1.00 0.00 C ATOM 1293 O ILE A 76 -0.376 -6.552 -3.030 1.00 0.00 O ATOM 1294 CB ILE A 76 2.233 -5.711 -1.141 1.00 0.00 C ATOM 1295 CG1 ILE A 76 3.666 -5.138 -1.039 1.00 0.00 C ATOM 1296 CG2 ILE A 76 2.260 -7.237 -1.146 1.00 0.00 C ATOM 1297 CD1 ILE A 76 4.591 -5.532 -2.166 1.00 0.00 C ATOM 0 H ILE A 76 1.606 -3.331 -1.434 1.00 0.00 H new ATOM 0 HA ILE A 76 1.939 -5.506 -3.311 1.00 0.00 H new ATOM 0 HB ILE A 76 1.682 -5.383 -0.259 1.00 0.00 H new ATOM 0 HG12 ILE A 76 3.605 -4.050 -1.002 1.00 0.00 H new ATOM 0 HG13 ILE A 76 4.106 -5.465 -0.097 1.00 0.00 H new ATOM 0 HG21 ILE A 76 2.793 -7.594 -0.265 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.239 -7.619 -1.132 1.00 0.00 H new ATOM 0 HG23 ILE A 76 2.767 -7.589 -2.044 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.571 -5.082 -2.006 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.690 -6.617 -2.193 1.00 0.00 H new ATOM 0 HD13 ILE A 76 4.181 -5.181 -3.113 1.00 0.00 H new ATOM 1309 N SER A 77 -0.738 -5.069 -1.392 1.00 0.00 N ATOM 1310 CA SER A 77 -2.098 -5.517 -1.148 1.00 0.00 C ATOM 1311 C SER A 77 -2.996 -4.338 -0.792 1.00 0.00 C ATOM 1312 O SER A 77 -2.552 -3.396 -0.126 1.00 0.00 O ATOM 1313 CB SER A 77 -2.088 -6.520 0.011 1.00 0.00 C ATOM 1314 OG SER A 77 -1.143 -7.554 -0.231 1.00 0.00 O ATOM 0 H SER A 77 -0.440 -4.288 -0.807 1.00 0.00 H new ATOM 0 HA SER A 77 -2.487 -5.987 -2.051 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.844 -6.007 0.941 1.00 0.00 H new ATOM 0 HB3 SER A 77 -3.082 -6.950 0.136 1.00 0.00 H new ATOM 0 HG SER A 77 -0.677 -7.773 0.603 1.00 0.00 H new ATOM 1320 N VAL A 78 -4.229 -4.382 -1.240 1.00 0.00 N ATOM 1321 CA VAL A 78 -5.205 -3.339 -0.945 1.00 0.00 C ATOM 1322 C VAL A 78 -6.484 -3.982 -0.382 1.00 0.00 C ATOM 1323 O VAL A 78 -7.030 -4.908 -0.975 1.00 0.00 O ATOM 1324 CB VAL A 78 -5.581 -2.535 -2.230 1.00 0.00 C ATOM 1325 CG1 VAL A 78 -6.585 -1.449 -1.914 1.00 0.00 C ATOM 1326 CG2 VAL A 78 -4.356 -1.931 -2.894 1.00 0.00 C ATOM 0 H VAL A 78 -4.592 -5.139 -1.820 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.761 -2.658 -0.219 1.00 0.00 H new ATOM 0 HB VAL A 78 -6.031 -3.241 -2.928 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.830 -0.904 -2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.490 -1.898 -1.505 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.159 -0.761 -1.183 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.659 -1.380 -3.784 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.862 -1.253 -2.198 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.666 -2.726 -3.177 1.00 0.00 H new ATOM 1336 N GLY A 79 -6.941 -3.536 0.764 1.00 0.00 N ATOM 1337 CA GLY A 79 -8.175 -4.049 1.276 1.00 0.00 C ATOM 1338 C GLY A 79 -8.091 -4.353 2.735 1.00 0.00 C ATOM 1339 O GLY A 79 -7.276 -3.783 3.443 1.00 0.00 O ATOM 0 H GLY A 79 -6.483 -2.833 1.345 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.969 -3.323 1.102 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.445 -4.954 0.732 1.00 0.00 H new ATOM 1343 N LYS A 80 -8.918 -5.229 3.198 1.00 0.00 N ATOM 1344 CA LYS A 80 -8.878 -5.610 4.582 1.00 0.00 C ATOM 1345 C LYS A 80 -8.102 -6.884 4.728 1.00 0.00 C ATOM 1346 O LYS A 80 -7.984 -7.658 3.777 1.00 0.00 O ATOM 1347 CB LYS A 80 -10.270 -5.784 5.171 1.00 0.00 C ATOM 1348 CG LYS A 80 -11.108 -4.518 5.191 1.00 0.00 C ATOM 1349 CD LYS A 80 -12.424 -4.736 5.914 1.00 0.00 C ATOM 1350 CE LYS A 80 -12.213 -5.000 7.406 1.00 0.00 C ATOM 1351 NZ LYS A 80 -13.472 -5.319 8.100 1.00 0.00 N ATOM 0 H LYS A 80 -9.633 -5.699 2.643 1.00 0.00 H new ATOM 0 HA LYS A 80 -8.389 -4.806 5.133 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -10.800 -6.546 4.600 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -10.175 -6.158 6.190 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -10.551 -3.719 5.680 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -11.302 -4.192 4.169 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -13.059 -3.860 5.786 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -12.950 -5.579 5.466 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -11.512 -5.826 7.531 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -11.758 -4.123 7.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -13.279 -5.490 9.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -14.133 -4.522 8.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -13.894 -6.171 7.679 1.00 0.00 H new ATOM 1365 N ALA A 81 -7.581 -7.100 5.884 1.00 0.00 N ATOM 1366 CA ALA A 81 -6.826 -8.280 6.168 1.00 0.00 C ATOM 1367 C ALA A 81 -7.205 -8.762 7.529 1.00 0.00 C ATOM 1368 O ALA A 81 -7.952 -8.072 8.247 1.00 0.00 O ATOM 1369 CB ALA A 81 -5.331 -7.994 6.108 1.00 0.00 C ATOM 0 H ALA A 81 -7.665 -6.458 6.672 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.047 -9.044 5.423 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.777 -8.907 6.328 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -5.068 -7.641 5.111 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -5.077 -7.230 6.843 1.00 0.00 H new ATOM 1375 N GLU A 82 -6.726 -9.917 7.890 1.00 0.00 N ATOM 1376 CA GLU A 82 -6.969 -10.438 9.192 1.00 0.00 C ATOM 1377 C GLU A 82 -6.160 -9.660 10.217 1.00 0.00 C ATOM 1378 O GLU A 82 -4.940 -9.762 10.291 1.00 0.00 O ATOM 1379 CB GLU A 82 -6.685 -11.930 9.261 1.00 0.00 C ATOM 1380 CG GLU A 82 -6.834 -12.500 10.651 1.00 0.00 C ATOM 1381 CD GLU A 82 -8.187 -12.247 11.236 1.00 0.00 C ATOM 1382 OE1 GLU A 82 -9.155 -12.893 10.805 1.00 0.00 O ATOM 1383 OE2 GLU A 82 -8.304 -11.368 12.112 1.00 0.00 O ATOM 0 H GLU A 82 -6.160 -10.517 7.290 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.027 -10.315 9.424 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.362 -12.454 8.586 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.672 -12.117 8.905 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -6.651 -13.574 10.620 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.074 -12.065 11.301 1.00 0.00 H new ATOM 1390 N ALA A 83 -6.853 -8.861 10.960 1.00 0.00 N ATOM 1391 CA ALA A 83 -6.248 -8.030 11.955 1.00 0.00 C ATOM 1392 C ALA A 83 -7.115 -8.004 13.178 1.00 0.00 C ATOM 1393 O ALA A 83 -6.890 -7.222 14.104 1.00 0.00 O ATOM 1394 CB ALA A 83 -6.124 -6.635 11.406 1.00 0.00 C ATOM 0 H ALA A 83 -7.866 -8.764 10.895 1.00 0.00 H new ATOM 0 HA ALA A 83 -5.264 -8.420 12.217 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.664 -5.989 12.154 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.504 -6.651 10.509 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -7.114 -6.253 11.156 1.00 0.00 H new ATOM 1400 N SER A 84 -8.074 -8.872 13.210 1.00 0.00 N ATOM 1401 CA SER A 84 -9.033 -8.838 14.252 1.00 0.00 C ATOM 1402 C SER A 84 -8.789 -9.957 15.263 1.00 0.00 C ATOM 1403 O SER A 84 -8.801 -9.715 16.471 1.00 0.00 O ATOM 1404 CB SER A 84 -10.439 -8.917 13.651 1.00 0.00 C ATOM 1405 OG SER A 84 -10.613 -7.920 12.624 1.00 0.00 O ATOM 0 H SER A 84 -8.209 -9.613 12.522 1.00 0.00 H new ATOM 0 HA SER A 84 -8.938 -7.898 14.795 1.00 0.00 H new ATOM 0 HB2 SER A 84 -10.605 -9.910 13.233 1.00 0.00 H new ATOM 0 HB3 SER A 84 -11.183 -8.773 14.434 1.00 0.00 H new ATOM 0 HG SER A 84 -11.517 -7.988 12.252 1.00 0.00 H new ATOM 1411 N GLU A 85 -8.512 -11.164 14.789 1.00 0.00 N ATOM 1412 CA GLU A 85 -8.390 -12.278 15.723 1.00 0.00 C ATOM 1413 C GLU A 85 -7.370 -13.352 15.331 1.00 0.00 C ATOM 1414 O GLU A 85 -7.386 -14.449 15.885 1.00 0.00 O ATOM 1415 CB GLU A 85 -9.762 -12.887 15.994 1.00 0.00 C ATOM 1416 CG GLU A 85 -10.497 -13.384 14.772 1.00 0.00 C ATOM 1417 CD GLU A 85 -11.870 -13.874 15.121 1.00 0.00 C ATOM 1418 OE1 GLU A 85 -11.987 -14.925 15.772 1.00 0.00 O ATOM 1419 OE2 GLU A 85 -12.871 -13.215 14.758 1.00 0.00 O ATOM 0 H GLU A 85 -8.372 -11.394 13.805 1.00 0.00 H new ATOM 0 HA GLU A 85 -7.985 -11.849 16.639 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -9.642 -13.718 16.689 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -10.381 -12.141 16.492 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -10.571 -12.581 14.039 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -9.929 -14.189 14.306 1.00 0.00 H new ATOM 1426 N VAL A 86 -6.437 -13.026 14.444 1.00 0.00 N ATOM 1427 CA VAL A 86 -5.363 -13.982 14.066 1.00 0.00 C ATOM 1428 C VAL A 86 -4.555 -14.436 15.306 1.00 0.00 C ATOM 1429 O VAL A 86 -4.204 -15.610 15.459 1.00 0.00 O ATOM 1430 CB VAL A 86 -4.402 -13.383 12.976 1.00 0.00 C ATOM 1431 CG1 VAL A 86 -3.846 -12.027 13.392 1.00 0.00 C ATOM 1432 CG2 VAL A 86 -3.261 -14.345 12.645 1.00 0.00 C ATOM 0 H VAL A 86 -6.388 -12.124 13.970 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.854 -14.854 13.634 1.00 0.00 H new ATOM 0 HB VAL A 86 -5.001 -13.239 12.077 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.187 -11.649 12.611 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.668 -11.328 13.543 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.285 -12.133 14.320 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.616 -13.898 11.888 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.680 -14.543 13.545 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -3.672 -15.280 12.265 1.00 0.00 H new ATOM 1442 N TYR A 87 -4.366 -13.525 16.233 1.00 0.00 N ATOM 1443 CA TYR A 87 -3.570 -13.794 17.412 1.00 0.00 C ATOM 1444 C TYR A 87 -4.331 -14.554 18.481 1.00 0.00 C ATOM 1445 O TYR A 87 -3.790 -14.834 19.547 1.00 0.00 O ATOM 1446 CB TYR A 87 -2.968 -12.515 17.979 1.00 0.00 C ATOM 1447 CG TYR A 87 -3.949 -11.428 18.397 1.00 0.00 C ATOM 1448 CD1 TYR A 87 -4.459 -10.513 17.474 1.00 0.00 C ATOM 1449 CD2 TYR A 87 -4.328 -11.294 19.720 1.00 0.00 C ATOM 1450 CE1 TYR A 87 -5.316 -9.502 17.872 1.00 0.00 C ATOM 1451 CE2 TYR A 87 -5.184 -10.299 20.121 1.00 0.00 C ATOM 1452 CZ TYR A 87 -5.676 -9.403 19.201 1.00 0.00 C ATOM 1453 OH TYR A 87 -6.520 -8.390 19.619 1.00 0.00 O ATOM 0 H TYR A 87 -4.756 -12.583 16.194 1.00 0.00 H new ATOM 0 HA TYR A 87 -2.757 -14.443 17.087 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -2.362 -12.779 18.846 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -2.293 -12.096 17.233 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -4.180 -10.595 16.434 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -3.942 -11.987 20.453 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -5.700 -8.797 17.149 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -5.471 -10.220 21.159 1.00 0.00 H new ATOM 0 HH TYR A 87 -6.671 -8.468 20.584 1.00 0.00 H new ATOM 1463 N SER A 88 -5.566 -14.881 18.212 1.00 0.00 N ATOM 1464 CA SER A 88 -6.343 -15.653 19.135 1.00 0.00 C ATOM 1465 C SER A 88 -6.083 -17.146 18.871 1.00 0.00 C ATOM 1466 O SER A 88 -6.371 -18.006 19.706 1.00 0.00 O ATOM 1467 CB SER A 88 -7.810 -15.299 18.963 1.00 0.00 C ATOM 1468 OG SER A 88 -7.994 -13.879 19.022 1.00 0.00 O ATOM 0 H SER A 88 -6.055 -14.622 17.355 1.00 0.00 H new ATOM 0 HA SER A 88 -6.061 -15.433 20.165 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.172 -15.679 18.008 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.400 -15.781 19.742 1.00 0.00 H new ATOM 0 HG SER A 88 -8.944 -13.667 18.908 1.00 0.00 H new ATOM 1474 N GLU A 89 -5.517 -17.423 17.699 1.00 0.00 N ATOM 1475 CA GLU A 89 -5.141 -18.767 17.307 1.00 0.00 C ATOM 1476 C GLU A 89 -3.762 -19.078 17.871 1.00 0.00 C ATOM 1477 O GLU A 89 -3.501 -20.177 18.380 1.00 0.00 O ATOM 1478 CB GLU A 89 -5.063 -18.855 15.776 1.00 0.00 C ATOM 1479 CG GLU A 89 -4.574 -20.202 15.259 1.00 0.00 C ATOM 1480 CD GLU A 89 -4.126 -20.145 13.826 1.00 0.00 C ATOM 1481 OE1 GLU A 89 -2.995 -19.687 13.564 1.00 0.00 O ATOM 1482 OE2 GLU A 89 -4.876 -20.570 12.932 1.00 0.00 O ATOM 0 H GLU A 89 -5.308 -16.714 16.996 1.00 0.00 H new ATOM 0 HA GLU A 89 -5.881 -19.473 17.685 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -6.050 -18.654 15.360 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -4.397 -18.073 15.410 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -3.747 -20.547 15.880 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -5.374 -20.936 15.356 1.00 0.00 H new ATOM 1489 N ALA A 90 -2.893 -18.091 17.780 1.00 0.00 N ATOM 1490 CA ALA A 90 -1.507 -18.232 18.145 1.00 0.00 C ATOM 1491 C ALA A 90 -1.289 -18.257 19.653 1.00 0.00 C ATOM 1492 O ALA A 90 -1.085 -17.208 20.305 1.00 0.00 O ATOM 1493 CB ALA A 90 -0.682 -17.150 17.487 1.00 0.00 C ATOM 0 H ALA A 90 -3.138 -17.159 17.446 1.00 0.00 H new ATOM 0 HA ALA A 90 -1.174 -19.203 17.779 1.00 0.00 H new ATOM 0 HB1 ALA A 90 0.364 -17.267 17.770 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -0.776 -17.229 16.404 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -1.039 -16.172 17.812 1.00 0.00 H new ATOM 1499 N VAL A 91 -1.372 -19.437 20.204 1.00 0.00 N ATOM 1500 CA VAL A 91 -1.121 -19.659 21.600 1.00 0.00 C ATOM 1501 C VAL A 91 0.347 -19.948 21.826 1.00 0.00 C ATOM 1502 O VAL A 91 0.985 -20.645 21.047 1.00 0.00 O ATOM 1503 CB VAL A 91 -1.998 -20.790 22.207 1.00 0.00 C ATOM 1504 CG1 VAL A 91 -3.449 -20.343 22.305 1.00 0.00 C ATOM 1505 CG2 VAL A 91 -1.915 -22.060 21.371 1.00 0.00 C ATOM 0 H VAL A 91 -1.619 -20.282 19.689 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.399 -18.742 22.119 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.616 -21.004 23.205 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.049 -21.146 22.732 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.516 -19.462 22.943 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -3.823 -20.100 21.310 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -2.539 -22.833 21.820 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -2.265 -21.853 20.360 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.881 -22.404 21.334 1.00 0.00 H new ATOM 1515 N LYS A 92 0.868 -19.422 22.882 1.00 0.00 N ATOM 1516 CA LYS A 92 2.269 -19.540 23.194 1.00 0.00 C ATOM 1517 C LYS A 92 2.468 -20.364 24.458 1.00 0.00 C ATOM 1518 O LYS A 92 3.526 -20.371 25.065 1.00 0.00 O ATOM 1519 CB LYS A 92 2.957 -18.144 23.282 1.00 0.00 C ATOM 1520 CG LYS A 92 2.225 -17.066 24.118 1.00 0.00 C ATOM 1521 CD LYS A 92 1.016 -16.422 23.392 1.00 0.00 C ATOM 1522 CE LYS A 92 1.418 -15.653 22.129 1.00 0.00 C ATOM 1523 NZ LYS A 92 0.246 -15.024 21.453 1.00 0.00 N ATOM 0 H LYS A 92 0.334 -18.889 23.568 1.00 0.00 H new ATOM 0 HA LYS A 92 2.757 -20.071 22.377 1.00 0.00 H new ATOM 0 HB2 LYS A 92 3.955 -18.281 23.700 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.085 -17.762 22.269 1.00 0.00 H new ATOM 0 HG2 LYS A 92 1.880 -17.515 25.049 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.935 -16.283 24.385 1.00 0.00 H new ATOM 0 HD2 LYS A 92 0.302 -17.201 23.125 1.00 0.00 H new ATOM 0 HD3 LYS A 92 0.506 -15.744 24.077 1.00 0.00 H new ATOM 0 HE2 LYS A 92 2.141 -14.881 22.391 1.00 0.00 H new ATOM 0 HE3 LYS A 92 1.914 -16.332 21.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.578 -14.419 20.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.376 -15.766 21.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.282 -14.447 22.139 1.00 0.00 H new ATOM 1537 N ARG A 93 1.423 -21.085 24.821 1.00 0.00 N ATOM 1538 CA ARG A 93 1.448 -21.994 25.964 1.00 0.00 C ATOM 1539 C ARG A 93 1.823 -23.403 25.523 1.00 0.00 C ATOM 1540 O ARG A 93 2.011 -24.293 26.345 1.00 0.00 O ATOM 1541 CB ARG A 93 0.084 -22.000 26.686 1.00 0.00 C ATOM 1542 CG ARG A 93 -1.109 -22.261 25.768 1.00 0.00 C ATOM 1543 CD ARG A 93 -2.433 -22.264 26.524 1.00 0.00 C ATOM 1544 NE ARG A 93 -2.559 -23.423 27.411 1.00 0.00 N ATOM 1545 CZ ARG A 93 -3.619 -23.700 28.181 1.00 0.00 C ATOM 1546 NH1 ARG A 93 -4.627 -22.835 28.277 1.00 0.00 N ATOM 1547 NH2 ARG A 93 -3.659 -24.841 28.869 1.00 0.00 N ATOM 0 H ARG A 93 0.528 -21.060 24.333 1.00 0.00 H new ATOM 0 HA ARG A 93 2.205 -21.639 26.663 1.00 0.00 H new ATOM 0 HB2 ARG A 93 0.102 -22.761 27.466 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -0.056 -21.039 27.182 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -1.139 -21.498 24.990 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -0.977 -23.221 25.268 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -2.517 -21.349 27.110 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -3.257 -22.263 25.811 1.00 0.00 H new ATOM 0 HE ARG A 93 -1.774 -24.073 27.445 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -4.595 -21.955 27.762 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -5.431 -23.052 28.865 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -2.883 -25.501 28.808 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -4.465 -25.054 29.456 1.00 0.00 H new ATOM 1561 N ILE A 94 1.946 -23.592 24.226 1.00 0.00 N ATOM 1562 CA ILE A 94 2.248 -24.895 23.671 1.00 0.00 C ATOM 1563 C ILE A 94 3.675 -24.913 23.140 1.00 0.00 C ATOM 1564 O ILE A 94 4.392 -23.929 23.278 1.00 0.00 O ATOM 1565 CB ILE A 94 1.274 -25.275 22.524 1.00 0.00 C ATOM 1566 CG1 ILE A 94 1.353 -24.246 21.374 1.00 0.00 C ATOM 1567 CG2 ILE A 94 -0.147 -25.394 23.060 1.00 0.00 C ATOM 1568 CD1 ILE A 94 0.496 -24.593 20.174 1.00 0.00 C ATOM 0 H ILE A 94 1.840 -22.853 23.531 1.00 0.00 H new ATOM 0 HA ILE A 94 2.133 -25.626 24.472 1.00 0.00 H new ATOM 0 HB ILE A 94 1.570 -26.244 22.121 1.00 0.00 H new ATOM 0 HG12 ILE A 94 1.051 -23.270 21.753 1.00 0.00 H new ATOM 0 HG13 ILE A 94 2.390 -24.156 21.052 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.822 -25.661 22.246 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -0.182 -26.166 23.829 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -0.455 -24.440 23.489 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.608 -23.822 19.412 1.00 0.00 H new ATOM 0 HD12 ILE A 94 0.812 -25.554 19.767 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -0.549 -24.654 20.478 1.00 0.00 H new ATOM 1580 N LEU A 95 4.077 -26.007 22.544 1.00 0.00 N ATOM 1581 CA LEU A 95 5.390 -26.113 21.959 1.00 0.00 C ATOM 1582 C LEU A 95 5.243 -26.397 20.473 1.00 0.00 C ATOM 1583 O LEU A 95 5.045 -27.576 20.092 1.00 0.00 O ATOM 1584 CB LEU A 95 6.219 -27.198 22.662 1.00 0.00 C ATOM 1585 CG LEU A 95 7.641 -27.438 22.125 1.00 0.00 C ATOM 1586 CD1 LEU A 95 8.497 -26.186 22.254 1.00 0.00 C ATOM 1587 CD2 LEU A 95 8.291 -28.609 22.849 1.00 0.00 C ATOM 1588 OXT LEU A 95 5.263 -25.439 19.676 1.00 0.00 O ATOM 0 H LEU A 95 3.506 -26.847 22.451 1.00 0.00 H new ATOM 0 HA LEU A 95 5.926 -25.173 22.090 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.293 -26.938 23.718 1.00 0.00 H new ATOM 0 HB3 LEU A 95 5.670 -28.138 22.603 1.00 0.00 H new ATOM 0 HG LEU A 95 7.565 -27.682 21.065 1.00 0.00 H new ATOM 0 HD11 LEU A 95 9.496 -26.387 21.866 1.00 0.00 H new ATOM 0 HD12 LEU A 95 8.043 -25.375 21.685 1.00 0.00 H new ATOM 0 HD13 LEU A 95 8.566 -25.899 23.303 1.00 0.00 H new ATOM 0 HD21 LEU A 95 9.296 -28.766 22.458 1.00 0.00 H new ATOM 0 HD22 LEU A 95 8.347 -28.392 23.916 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.696 -29.509 22.693 1.00 0.00 H new TER 1600 LEU A 95 ATOM 1601 N LYS B 47 9.721 2.281 21.222 1.00 0.00 N ATOM 1602 CA LYS B 47 8.658 2.309 20.233 1.00 0.00 C ATOM 1603 C LYS B 47 9.219 2.135 18.860 1.00 0.00 C ATOM 1604 O LYS B 47 10.234 2.741 18.511 1.00 0.00 O ATOM 1605 CB LYS B 47 7.834 3.604 20.305 1.00 0.00 C ATOM 1606 CG LYS B 47 6.975 3.741 21.552 1.00 0.00 C ATOM 1607 CD LYS B 47 5.979 2.598 21.654 1.00 0.00 C ATOM 1608 CE LYS B 47 5.054 2.767 22.831 1.00 0.00 C ATOM 1609 NZ LYS B 47 4.172 1.603 23.001 1.00 0.00 N ATOM 0 HA LYS B 47 7.988 1.479 20.458 1.00 0.00 H new ATOM 0 HB2 LYS B 47 8.514 4.455 20.253 1.00 0.00 H new ATOM 0 HB3 LYS B 47 7.189 3.658 19.428 1.00 0.00 H new ATOM 0 HG2 LYS B 47 7.611 3.754 22.437 1.00 0.00 H new ATOM 0 HG3 LYS B 47 6.442 4.692 21.529 1.00 0.00 H new ATOM 0 HD2 LYS B 47 5.393 2.543 20.736 1.00 0.00 H new ATOM 0 HD3 LYS B 47 6.517 1.654 21.746 1.00 0.00 H new ATOM 0 HE2 LYS B 47 5.641 2.914 23.737 1.00 0.00 H new ATOM 0 HE3 LYS B 47 4.450 3.664 22.694 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 3.550 1.756 23.820 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 3.594 1.478 22.146 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 4.748 0.751 23.157 1.00 0.00 H new ATOM 1623 N GLN B 48 8.583 1.296 18.095 1.00 0.00 N ATOM 1624 CA GLN B 48 8.984 1.041 16.745 1.00 0.00 C ATOM 1625 C GLN B 48 7.885 1.450 15.804 1.00 0.00 C ATOM 1626 O GLN B 48 8.110 2.229 14.879 1.00 0.00 O ATOM 1627 CB GLN B 48 9.324 -0.435 16.535 1.00 0.00 C ATOM 1628 CG GLN B 48 10.493 -0.934 17.372 1.00 0.00 C ATOM 1629 CD GLN B 48 10.797 -2.405 17.151 1.00 0.00 C ATOM 1630 OE1 GLN B 48 11.941 -2.833 17.259 1.00 0.00 O ATOM 1631 NE2 GLN B 48 9.789 -3.194 16.881 1.00 0.00 N ATOM 0 H GLN B 48 7.765 0.766 18.395 1.00 0.00 H new ATOM 0 HA GLN B 48 9.880 1.626 16.540 1.00 0.00 H new ATOM 0 HB2 GLN B 48 8.444 -1.035 16.767 1.00 0.00 H new ATOM 0 HB3 GLN B 48 9.551 -0.597 15.481 1.00 0.00 H new ATOM 0 HG2 GLN B 48 11.380 -0.346 17.135 1.00 0.00 H new ATOM 0 HG3 GLN B 48 10.274 -0.769 18.427 1.00 0.00 H new ATOM 0 HE21 GLN B 48 8.848 -2.809 16.797 1.00 0.00 H new ATOM 0 HE22 GLN B 48 9.944 -4.194 16.754 1.00 0.00 H new ATOM 1640 N THR B 49 6.686 0.987 16.085 1.00 0.00 N ATOM 1641 CA THR B 49 5.551 1.201 15.221 1.00 0.00 C ATOM 1642 C THR B 49 4.266 0.807 15.962 1.00 0.00 C ATOM 1643 O THR B 49 4.335 0.176 17.024 1.00 0.00 O ATOM 1644 CB THR B 49 5.710 0.337 13.930 1.00 0.00 C ATOM 1645 OG1 THR B 49 4.639 0.563 13.007 1.00 0.00 O ATOM 1646 CG2 THR B 49 5.786 -1.151 14.260 1.00 0.00 C ATOM 0 H THR B 49 6.473 0.449 16.925 1.00 0.00 H new ATOM 0 HA THR B 49 5.495 2.253 14.941 1.00 0.00 H new ATOM 0 HB THR B 49 6.646 0.646 13.464 1.00 0.00 H new ATOM 0 HG1 THR B 49 4.618 -0.160 12.346 1.00 0.00 H new ATOM 0 HG21 THR B 49 5.896 -1.723 13.339 1.00 0.00 H new ATOM 0 HG22 THR B 49 6.643 -1.337 14.907 1.00 0.00 H new ATOM 0 HG23 THR B 49 4.873 -1.458 14.770 1.00 0.00 H new ATOM 1654 N LEU B 50 3.112 1.164 15.414 1.00 0.00 N ATOM 1655 CA LEU B 50 1.855 0.778 15.989 1.00 0.00 C ATOM 1656 C LEU B 50 1.515 -0.632 15.562 1.00 0.00 C ATOM 1657 O LEU B 50 0.715 -0.860 14.634 1.00 0.00 O ATOM 1658 CB LEU B 50 0.724 1.737 15.625 1.00 0.00 C ATOM 1659 CG LEU B 50 0.708 3.071 16.368 1.00 0.00 C ATOM 1660 CD1 LEU B 50 1.816 3.990 15.923 1.00 0.00 C ATOM 1661 CD2 LEU B 50 -0.630 3.720 16.235 1.00 0.00 C ATOM 0 H LEU B 50 3.033 1.725 14.566 1.00 0.00 H new ATOM 0 HA LEU B 50 1.961 0.820 17.073 1.00 0.00 H new ATOM 0 HB2 LEU B 50 0.778 1.941 14.556 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -0.225 1.232 15.806 1.00 0.00 H new ATOM 0 HG LEU B 50 0.890 2.864 17.423 1.00 0.00 H new ATOM 0 HD11 LEU B 50 1.760 4.924 16.482 1.00 0.00 H new ATOM 0 HD12 LEU B 50 2.779 3.514 16.107 1.00 0.00 H new ATOM 0 HD13 LEU B 50 1.711 4.197 14.858 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -0.628 4.670 16.769 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -0.846 3.897 15.181 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -1.394 3.068 16.657 1.00 0.00 H new ATOM 1673 N LEU B 51 2.183 -1.567 16.171 1.00 0.00 N ATOM 1674 CA LEU B 51 2.036 -2.953 15.839 1.00 0.00 C ATOM 1675 C LEU B 51 1.064 -3.700 16.731 1.00 0.00 C ATOM 1676 O LEU B 51 0.671 -3.230 17.815 1.00 0.00 O ATOM 1677 CB LEU B 51 3.410 -3.678 15.727 1.00 0.00 C ATOM 1678 CG LEU B 51 4.492 -3.403 16.806 1.00 0.00 C ATOM 1679 CD1 LEU B 51 4.026 -3.757 18.203 1.00 0.00 C ATOM 1680 CD2 LEU B 51 5.765 -4.163 16.471 1.00 0.00 C ATOM 0 H LEU B 51 2.852 -1.387 16.920 1.00 0.00 H new ATOM 0 HA LEU B 51 1.581 -2.965 14.849 1.00 0.00 H new ATOM 0 HB2 LEU B 51 3.217 -4.751 15.719 1.00 0.00 H new ATOM 0 HB3 LEU B 51 3.839 -3.424 14.758 1.00 0.00 H new ATOM 0 HG LEU B 51 4.689 -2.331 16.798 1.00 0.00 H new ATOM 0 HD11 LEU B 51 4.822 -3.545 18.917 1.00 0.00 H new ATOM 0 HD12 LEU B 51 3.146 -3.165 18.454 1.00 0.00 H new ATOM 0 HD13 LEU B 51 3.774 -4.817 18.245 1.00 0.00 H new ATOM 0 HD21 LEU B 51 6.519 -3.964 17.233 1.00 0.00 H new ATOM 0 HD22 LEU B 51 5.553 -5.232 16.440 1.00 0.00 H new ATOM 0 HD23 LEU B 51 6.137 -3.839 15.499 1.00 0.00 H new ATOM 1692 N SER B 52 0.674 -4.835 16.249 1.00 0.00 N ATOM 1693 CA SER B 52 -0.182 -5.750 16.901 1.00 0.00 C ATOM 1694 C SER B 52 0.144 -7.079 16.242 1.00 0.00 C ATOM 1695 O SER B 52 1.250 -7.250 15.739 1.00 0.00 O ATOM 1696 CB SER B 52 -1.665 -5.340 16.671 1.00 0.00 C ATOM 1697 OG SER B 52 -2.563 -6.232 17.333 1.00 0.00 O ATOM 0 H SER B 52 0.969 -5.161 15.329 1.00 0.00 H new ATOM 0 HA SER B 52 -0.045 -5.788 17.982 1.00 0.00 H new ATOM 0 HB2 SER B 52 -1.824 -4.325 17.036 1.00 0.00 H new ATOM 0 HB3 SER B 52 -1.880 -5.332 15.602 1.00 0.00 H new ATOM 0 HG SER B 52 -3.486 -5.947 17.171 1.00 0.00 H new ATOM 1703 N ASP B 53 -0.750 -8.007 16.241 1.00 0.00 N ATOM 1704 CA ASP B 53 -0.494 -9.228 15.551 1.00 0.00 C ATOM 1705 C ASP B 53 -1.107 -9.231 14.189 1.00 0.00 C ATOM 1706 O ASP B 53 -1.083 -10.229 13.492 1.00 0.00 O ATOM 1707 CB ASP B 53 -0.875 -10.438 16.344 1.00 0.00 C ATOM 1708 CG ASP B 53 0.176 -10.802 17.360 1.00 0.00 C ATOM 1709 OD1 ASP B 53 1.349 -10.995 16.979 1.00 0.00 O ATOM 1710 OD2 ASP B 53 -0.137 -10.861 18.568 1.00 0.00 O ATOM 0 H ASP B 53 -1.657 -7.948 16.705 1.00 0.00 H new ATOM 0 HA ASP B 53 0.587 -9.286 15.420 1.00 0.00 H new ATOM 0 HB2 ASP B 53 -1.822 -10.255 16.852 1.00 0.00 H new ATOM 0 HB3 ASP B 53 -1.033 -11.279 15.669 1.00 0.00 H new ATOM 1715 N GLU B 54 -1.625 -8.076 13.787 1.00 0.00 N ATOM 1716 CA GLU B 54 -2.107 -7.890 12.426 1.00 0.00 C ATOM 1717 C GLU B 54 -0.890 -7.967 11.513 1.00 0.00 C ATOM 1718 O GLU B 54 -0.935 -8.503 10.415 1.00 0.00 O ATOM 1719 CB GLU B 54 -2.797 -6.516 12.267 1.00 0.00 C ATOM 1720 CG GLU B 54 -1.884 -5.316 12.509 1.00 0.00 C ATOM 1721 CD GLU B 54 -2.522 -3.981 12.247 1.00 0.00 C ATOM 1722 OE1 GLU B 54 -3.610 -3.915 11.613 1.00 0.00 O ATOM 1723 OE2 GLU B 54 -1.940 -2.963 12.660 1.00 0.00 O ATOM 0 H GLU B 54 -1.721 -7.255 14.385 1.00 0.00 H new ATOM 0 HA GLU B 54 -2.842 -8.655 12.176 1.00 0.00 H new ATOM 0 HB2 GLU B 54 -3.209 -6.445 11.261 1.00 0.00 H new ATOM 0 HB3 GLU B 54 -3.637 -6.463 12.960 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -1.538 -5.342 13.542 1.00 0.00 H new ATOM 0 HG3 GLU B 54 -1.003 -5.413 11.875 1.00 0.00 H new ATOM 1730 N ASP B 55 0.217 -7.468 12.051 1.00 0.00 N ATOM 1731 CA ASP B 55 1.508 -7.434 11.411 1.00 0.00 C ATOM 1732 C ASP B 55 1.929 -8.822 11.052 1.00 0.00 C ATOM 1733 O ASP B 55 2.471 -9.050 9.997 1.00 0.00 O ATOM 1734 CB ASP B 55 2.535 -6.819 12.365 1.00 0.00 C ATOM 1735 CG ASP B 55 2.159 -5.423 12.783 1.00 0.00 C ATOM 1736 OD1 ASP B 55 1.254 -5.261 13.632 1.00 0.00 O ATOM 1737 OD2 ASP B 55 2.710 -4.466 12.250 1.00 0.00 O ATOM 0 H ASP B 55 0.230 -7.061 12.986 1.00 0.00 H new ATOM 0 HA ASP B 55 1.446 -6.831 10.505 1.00 0.00 H new ATOM 0 HB2 ASP B 55 2.629 -7.448 13.250 1.00 0.00 H new ATOM 0 HB3 ASP B 55 3.512 -6.801 11.882 1.00 0.00 H new ATOM 1742 N ALA B 56 1.604 -9.754 11.924 1.00 0.00 N ATOM 1743 CA ALA B 56 1.938 -11.162 11.732 1.00 0.00 C ATOM 1744 C ALA B 56 1.219 -11.763 10.512 1.00 0.00 C ATOM 1745 O ALA B 56 1.692 -12.742 9.927 1.00 0.00 O ATOM 1746 CB ALA B 56 1.609 -11.956 12.985 1.00 0.00 C ATOM 0 H ALA B 56 1.100 -9.563 12.790 1.00 0.00 H new ATOM 0 HA ALA B 56 3.009 -11.222 11.541 1.00 0.00 H new ATOM 0 HB1 ALA B 56 1.863 -13.004 12.828 1.00 0.00 H new ATOM 0 HB2 ALA B 56 2.183 -11.565 13.825 1.00 0.00 H new ATOM 0 HB3 ALA B 56 0.544 -11.869 13.202 1.00 0.00 H new ATOM 1752 N GLU B 57 0.103 -11.171 10.130 1.00 0.00 N ATOM 1753 CA GLU B 57 -0.666 -11.626 8.984 1.00 0.00 C ATOM 1754 C GLU B 57 -0.115 -10.944 7.738 1.00 0.00 C ATOM 1755 O GLU B 57 0.188 -11.587 6.742 1.00 0.00 O ATOM 1756 CB GLU B 57 -2.149 -11.259 9.183 1.00 0.00 C ATOM 1757 CG GLU B 57 -3.088 -11.620 8.028 1.00 0.00 C ATOM 1758 CD GLU B 57 -3.258 -13.112 7.811 1.00 0.00 C ATOM 1759 OE1 GLU B 57 -3.733 -13.808 8.726 1.00 0.00 O ATOM 1760 OE2 GLU B 57 -2.987 -13.605 6.682 1.00 0.00 O ATOM 0 H GLU B 57 -0.297 -10.361 10.604 1.00 0.00 H new ATOM 0 HA GLU B 57 -0.588 -12.708 8.876 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -2.508 -11.754 10.086 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -2.217 -10.186 9.359 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -4.066 -11.177 8.217 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -2.707 -11.171 7.111 1.00 0.00 H new ATOM 1767 N LEU B 58 0.076 -9.639 7.831 1.00 0.00 N ATOM 1768 CA LEU B 58 0.568 -8.850 6.705 1.00 0.00 C ATOM 1769 C LEU B 58 1.946 -9.292 6.230 1.00 0.00 C ATOM 1770 O LEU B 58 2.218 -9.258 5.040 1.00 0.00 O ATOM 1771 CB LEU B 58 0.560 -7.340 6.994 1.00 0.00 C ATOM 1772 CG LEU B 58 -0.798 -6.592 6.905 1.00 0.00 C ATOM 1773 CD1 LEU B 58 -1.855 -7.147 7.840 1.00 0.00 C ATOM 1774 CD2 LEU B 58 -0.596 -5.113 7.158 1.00 0.00 C ATOM 0 H LEU B 58 -0.102 -9.098 8.677 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.136 -9.040 5.895 1.00 0.00 H new ATOM 0 HB2 LEU B 58 0.960 -7.189 7.997 1.00 0.00 H new ATOM 0 HB3 LEU B 58 1.251 -6.863 6.300 1.00 0.00 H new ATOM 0 HG LEU B 58 -1.172 -6.747 5.893 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -2.777 -6.578 7.725 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -2.042 -8.193 7.598 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -1.507 -7.070 8.870 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -1.555 -4.598 7.093 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -0.173 -4.968 8.152 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.086 -4.706 6.411 1.00 0.00 H new ATOM 1786 N VAL B 59 2.797 -9.739 7.148 1.00 0.00 N ATOM 1787 CA VAL B 59 4.139 -10.180 6.779 1.00 0.00 C ATOM 1788 C VAL B 59 4.103 -11.438 5.922 1.00 0.00 C ATOM 1789 O VAL B 59 4.920 -11.586 5.014 1.00 0.00 O ATOM 1790 CB VAL B 59 5.104 -10.373 7.991 1.00 0.00 C ATOM 1791 CG1 VAL B 59 5.259 -9.089 8.754 1.00 0.00 C ATOM 1792 CG2 VAL B 59 4.677 -11.512 8.905 1.00 0.00 C ATOM 0 H VAL B 59 2.585 -9.806 8.144 1.00 0.00 H new ATOM 0 HA VAL B 59 4.550 -9.361 6.189 1.00 0.00 H new ATOM 0 HB VAL B 59 6.076 -10.654 7.585 1.00 0.00 H new ATOM 0 HG11 VAL B 59 5.935 -9.245 9.595 1.00 0.00 H new ATOM 0 HG12 VAL B 59 5.668 -8.322 8.096 1.00 0.00 H new ATOM 0 HG13 VAL B 59 4.286 -8.767 9.126 1.00 0.00 H new ATOM 0 HG21 VAL B 59 5.384 -11.601 9.730 1.00 0.00 H new ATOM 0 HG22 VAL B 59 3.682 -11.308 9.300 1.00 0.00 H new ATOM 0 HG23 VAL B 59 4.659 -12.444 8.341 1.00 0.00 H new ATOM 1802 N GLU B 60 3.137 -12.322 6.166 1.00 0.00 N ATOM 1803 CA GLU B 60 3.051 -13.512 5.363 1.00 0.00 C ATOM 1804 C GLU B 60 2.392 -13.216 4.025 1.00 0.00 C ATOM 1805 O GLU B 60 2.731 -13.822 3.029 1.00 0.00 O ATOM 1806 CB GLU B 60 2.412 -14.715 6.085 1.00 0.00 C ATOM 1807 CG GLU B 60 1.011 -14.506 6.610 1.00 0.00 C ATOM 1808 CD GLU B 60 0.417 -15.781 7.153 1.00 0.00 C ATOM 1809 OE1 GLU B 60 0.699 -16.131 8.319 1.00 0.00 O ATOM 1810 OE2 GLU B 60 -0.316 -16.478 6.411 1.00 0.00 O ATOM 0 H GLU B 60 2.428 -12.231 6.894 1.00 0.00 H new ATOM 0 HA GLU B 60 4.077 -13.827 5.172 1.00 0.00 H new ATOM 0 HB2 GLU B 60 2.398 -15.560 5.397 1.00 0.00 H new ATOM 0 HB3 GLU B 60 3.054 -14.994 6.921 1.00 0.00 H new ATOM 0 HG2 GLU B 60 1.027 -13.750 7.395 1.00 0.00 H new ATOM 0 HG3 GLU B 60 0.377 -14.122 5.810 1.00 0.00 H new ATOM 1817 N ILE B 61 1.497 -12.236 4.008 1.00 0.00 N ATOM 1818 CA ILE B 61 0.822 -11.829 2.775 1.00 0.00 C ATOM 1819 C ILE B 61 1.818 -11.173 1.795 1.00 0.00 C ATOM 1820 O ILE B 61 1.795 -11.440 0.584 1.00 0.00 O ATOM 1821 CB ILE B 61 -0.356 -10.840 3.056 1.00 0.00 C ATOM 1822 CG1 ILE B 61 -1.394 -11.486 3.989 1.00 0.00 C ATOM 1823 CG2 ILE B 61 -1.024 -10.412 1.749 1.00 0.00 C ATOM 1824 CD1 ILE B 61 -2.535 -10.565 4.382 1.00 0.00 C ATOM 0 H ILE B 61 1.219 -11.706 4.834 1.00 0.00 H new ATOM 0 HA ILE B 61 0.412 -12.733 2.325 1.00 0.00 H new ATOM 0 HB ILE B 61 0.054 -9.956 3.545 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -1.806 -12.369 3.500 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -0.890 -11.828 4.893 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -1.841 -9.724 1.966 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -0.292 -9.916 1.112 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -1.416 -11.290 1.236 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -3.222 -11.097 5.040 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -2.137 -9.693 4.902 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -3.067 -10.242 3.487 1.00 0.00 H new ATOM 1836 N VAL B 62 2.699 -10.338 2.324 1.00 0.00 N ATOM 1837 CA VAL B 62 3.666 -9.642 1.495 1.00 0.00 C ATOM 1838 C VAL B 62 4.714 -10.609 0.925 1.00 0.00 C ATOM 1839 O VAL B 62 4.917 -10.663 -0.307 1.00 0.00 O ATOM 1840 CB VAL B 62 4.319 -8.391 2.211 1.00 0.00 C ATOM 1841 CG1 VAL B 62 5.048 -8.767 3.483 1.00 0.00 C ATOM 1842 CG2 VAL B 62 5.256 -7.643 1.276 1.00 0.00 C ATOM 0 H VAL B 62 2.763 -10.128 3.320 1.00 0.00 H new ATOM 0 HA VAL B 62 3.112 -9.230 0.652 1.00 0.00 H new ATOM 0 HB VAL B 62 3.494 -7.733 2.484 1.00 0.00 H new ATOM 0 HG11 VAL B 62 5.477 -7.872 3.934 1.00 0.00 H new ATOM 0 HG12 VAL B 62 4.348 -9.226 4.181 1.00 0.00 H new ATOM 0 HG13 VAL B 62 5.844 -9.474 3.251 1.00 0.00 H new ATOM 0 HG21 VAL B 62 5.687 -6.790 1.799 1.00 0.00 H new ATOM 0 HG22 VAL B 62 6.054 -8.310 0.950 1.00 0.00 H new ATOM 0 HG23 VAL B 62 4.699 -7.292 0.407 1.00 0.00 H new ATOM 1852 N LYS B 63 5.315 -11.434 1.805 1.00 0.00 N ATOM 1853 CA LYS B 63 6.342 -12.391 1.387 1.00 0.00 C ATOM 1854 C LYS B 63 5.764 -13.384 0.382 1.00 0.00 C ATOM 1855 O LYS B 63 6.475 -13.888 -0.483 1.00 0.00 O ATOM 1856 CB LYS B 63 6.936 -13.131 2.592 1.00 0.00 C ATOM 1857 CG LYS B 63 5.958 -14.026 3.319 1.00 0.00 C ATOM 1858 CD LYS B 63 6.575 -14.676 4.546 1.00 0.00 C ATOM 1859 CE LYS B 63 7.765 -15.539 4.170 1.00 0.00 C ATOM 1860 NZ LYS B 63 8.329 -16.239 5.338 1.00 0.00 N ATOM 0 H LYS B 63 5.104 -11.452 2.803 1.00 0.00 H new ATOM 0 HA LYS B 63 7.147 -11.834 0.907 1.00 0.00 H new ATOM 0 HB2 LYS B 63 7.779 -13.734 2.254 1.00 0.00 H new ATOM 0 HB3 LYS B 63 7.330 -12.397 3.295 1.00 0.00 H new ATOM 0 HG2 LYS B 63 5.088 -13.442 3.619 1.00 0.00 H new ATOM 0 HG3 LYS B 63 5.603 -14.801 2.639 1.00 0.00 H new ATOM 0 HD2 LYS B 63 6.889 -13.905 5.250 1.00 0.00 H new ATOM 0 HD3 LYS B 63 5.827 -15.285 5.053 1.00 0.00 H new ATOM 0 HE2 LYS B 63 7.461 -16.270 3.421 1.00 0.00 H new ATOM 0 HE3 LYS B 63 8.535 -14.917 3.714 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 9.140 -16.817 5.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 8.643 -15.541 6.042 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 7.603 -16.853 5.759 1.00 0.00 H new ATOM 1874 N GLU B 64 4.467 -13.634 0.511 1.00 0.00 N ATOM 1875 CA GLU B 64 3.716 -14.486 -0.382 1.00 0.00 C ATOM 1876 C GLU B 64 3.673 -13.867 -1.762 1.00 0.00 C ATOM 1877 O GLU B 64 4.197 -14.414 -2.710 1.00 0.00 O ATOM 1878 CB GLU B 64 2.292 -14.617 0.134 1.00 0.00 C ATOM 1879 CG GLU B 64 1.386 -15.445 -0.728 1.00 0.00 C ATOM 1880 CD GLU B 64 1.754 -16.894 -0.717 1.00 0.00 C ATOM 1881 OE1 GLU B 64 1.466 -17.576 0.284 1.00 0.00 O ATOM 1882 OE2 GLU B 64 2.320 -17.382 -1.705 1.00 0.00 O ATOM 0 H GLU B 64 3.901 -13.237 1.260 1.00 0.00 H new ATOM 0 HA GLU B 64 4.193 -15.465 -0.431 1.00 0.00 H new ATOM 0 HB2 GLU B 64 2.321 -15.054 1.132 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.864 -13.620 0.235 1.00 0.00 H new ATOM 0 HG2 GLU B 64 0.358 -15.332 -0.383 1.00 0.00 H new ATOM 0 HG3 GLU B 64 1.422 -15.072 -1.751 1.00 0.00 H new ATOM 1889 N ARG B 65 3.094 -12.680 -1.856 1.00 0.00 N ATOM 1890 CA ARG B 65 2.935 -12.018 -3.143 1.00 0.00 C ATOM 1891 C ARG B 65 4.272 -11.638 -3.736 1.00 0.00 C ATOM 1892 O ARG B 65 4.386 -11.434 -4.928 1.00 0.00 O ATOM 1893 CB ARG B 65 2.011 -10.811 -3.061 1.00 0.00 C ATOM 1894 CG ARG B 65 0.591 -11.163 -2.657 1.00 0.00 C ATOM 1895 CD ARG B 65 -0.315 -9.956 -2.749 1.00 0.00 C ATOM 1896 NE ARG B 65 -1.669 -10.244 -2.255 1.00 0.00 N ATOM 1897 CZ ARG B 65 -2.720 -9.414 -2.388 1.00 0.00 C ATOM 1898 NH1 ARG B 65 -2.609 -8.286 -3.096 1.00 0.00 N ATOM 1899 NH2 ARG B 65 -3.876 -9.718 -1.820 1.00 0.00 N ATOM 0 H ARG B 65 2.728 -12.157 -1.061 1.00 0.00 H new ATOM 0 HA ARG B 65 2.462 -12.739 -3.810 1.00 0.00 H new ATOM 0 HB2 ARG B 65 2.419 -10.099 -2.343 1.00 0.00 H new ATOM 0 HB3 ARG B 65 1.992 -10.311 -4.030 1.00 0.00 H new ATOM 0 HG2 ARG B 65 0.212 -11.956 -3.301 1.00 0.00 H new ATOM 0 HG3 ARG B 65 0.585 -11.550 -1.638 1.00 0.00 H new ATOM 0 HD2 ARG B 65 0.114 -9.136 -2.173 1.00 0.00 H new ATOM 0 HD3 ARG B 65 -0.371 -9.623 -3.785 1.00 0.00 H new ATOM 0 HE ARG B 65 -1.822 -11.133 -1.779 1.00 0.00 H new ATOM 0 HH11 ARG B 65 -1.722 -8.048 -3.541 1.00 0.00 H new ATOM 0 HH12 ARG B 65 -3.411 -7.663 -3.192 1.00 0.00 H new ATOM 0 HH21 ARG B 65 -3.969 -10.580 -1.283 1.00 0.00 H new ATOM 0 HH22 ARG B 65 -4.674 -9.090 -1.920 1.00 0.00 H new ATOM 1913 N LEU B 66 5.300 -11.615 -2.905 1.00 0.00 N ATOM 1914 CA LEU B 66 6.642 -11.308 -3.392 1.00 0.00 C ATOM 1915 C LEU B 66 7.251 -12.427 -4.255 1.00 0.00 C ATOM 1916 O LEU B 66 8.324 -12.242 -4.827 1.00 0.00 O ATOM 1917 CB LEU B 66 7.613 -10.897 -2.272 1.00 0.00 C ATOM 1918 CG LEU B 66 7.366 -9.531 -1.613 1.00 0.00 C ATOM 1919 CD1 LEU B 66 8.395 -9.269 -0.532 1.00 0.00 C ATOM 1920 CD2 LEU B 66 7.387 -8.407 -2.648 1.00 0.00 C ATOM 0 H LEU B 66 5.238 -11.802 -1.904 1.00 0.00 H new ATOM 0 HA LEU B 66 6.502 -10.442 -4.039 1.00 0.00 H new ATOM 0 HB2 LEU B 66 7.580 -11.661 -1.495 1.00 0.00 H new ATOM 0 HB3 LEU B 66 8.624 -10.901 -2.679 1.00 0.00 H new ATOM 0 HG LEU B 66 6.376 -9.554 -1.157 1.00 0.00 H new ATOM 0 HD11 LEU B 66 8.205 -8.297 -0.076 1.00 0.00 H new ATOM 0 HD12 LEU B 66 8.329 -10.046 0.229 1.00 0.00 H new ATOM 0 HD13 LEU B 66 9.393 -9.275 -0.970 1.00 0.00 H new ATOM 0 HD21 LEU B 66 7.209 -7.453 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU B 66 8.359 -8.385 -3.141 1.00 0.00 H new ATOM 0 HD23 LEU B 66 6.608 -8.581 -3.390 1.00 0.00 H new ATOM 1932 N ARG B 67 6.596 -13.583 -4.355 1.00 0.00 N ATOM 1933 CA ARG B 67 7.123 -14.642 -5.223 1.00 0.00 C ATOM 1934 C ARG B 67 6.632 -14.489 -6.653 1.00 0.00 C ATOM 1935 O ARG B 67 7.239 -15.016 -7.576 1.00 0.00 O ATOM 1936 CB ARG B 67 6.908 -16.060 -4.658 1.00 0.00 C ATOM 1937 CG ARG B 67 5.471 -16.455 -4.386 1.00 0.00 C ATOM 1938 CD ARG B 67 5.404 -17.519 -3.296 1.00 0.00 C ATOM 1939 NE ARG B 67 6.064 -17.039 -2.061 1.00 0.00 N ATOM 1940 CZ ARG B 67 5.903 -17.513 -0.824 1.00 0.00 C ATOM 1941 NH1 ARG B 67 5.046 -18.492 -0.567 1.00 0.00 N ATOM 1942 NH2 ARG B 67 6.604 -16.974 0.165 1.00 0.00 N ATOM 0 H ARG B 67 5.730 -13.809 -3.866 1.00 0.00 H new ATOM 0 HA ARG B 67 8.205 -14.514 -5.246 1.00 0.00 H new ATOM 0 HB2 ARG B 67 7.335 -16.778 -5.359 1.00 0.00 H new ATOM 0 HB3 ARG B 67 7.471 -16.149 -3.729 1.00 0.00 H new ATOM 0 HG2 ARG B 67 4.899 -15.579 -4.082 1.00 0.00 H new ATOM 0 HG3 ARG B 67 5.013 -16.833 -5.300 1.00 0.00 H new ATOM 0 HD2 ARG B 67 4.364 -17.768 -3.086 1.00 0.00 H new ATOM 0 HD3 ARG B 67 5.887 -18.433 -3.642 1.00 0.00 H new ATOM 0 HE ARG B 67 6.714 -16.260 -2.167 1.00 0.00 H new ATOM 0 HH11 ARG B 67 4.494 -18.898 -1.323 1.00 0.00 H new ATOM 0 HH12 ARG B 67 4.939 -18.839 0.386 1.00 0.00 H new ATOM 0 HH21 ARG B 67 7.253 -16.210 -0.027 1.00 0.00 H new ATOM 0 HH22 ARG B 67 6.494 -17.323 1.117 1.00 0.00 H new ATOM 1956 N ASN B 68 5.556 -13.732 -6.834 1.00 0.00 N ATOM 1957 CA ASN B 68 5.039 -13.402 -8.166 1.00 0.00 C ATOM 1958 C ASN B 68 4.063 -12.214 -8.105 1.00 0.00 C ATOM 1959 O ASN B 68 2.843 -12.373 -8.073 1.00 0.00 O ATOM 1960 CB ASN B 68 4.440 -14.618 -8.954 1.00 0.00 C ATOM 1961 CG ASN B 68 3.215 -15.279 -8.322 1.00 0.00 C ATOM 1962 OD1 ASN B 68 3.049 -15.313 -7.098 1.00 0.00 O ATOM 1963 ND2 ASN B 68 2.355 -15.811 -9.158 1.00 0.00 N ATOM 0 H ASN B 68 5.016 -13.329 -6.068 1.00 0.00 H new ATOM 0 HA ASN B 68 5.909 -13.102 -8.750 1.00 0.00 H new ATOM 0 HB2 ASN B 68 4.172 -14.282 -9.956 1.00 0.00 H new ATOM 0 HB3 ASN B 68 5.219 -15.372 -9.068 1.00 0.00 H new ATOM 0 HD21 ASN B 68 1.517 -16.271 -8.803 1.00 0.00 H new ATOM 0 HD22 ASN B 68 2.525 -15.764 -10.163 1.00 0.00 H new ATOM 1970 N PRO B 69 4.606 -11.002 -7.999 1.00 0.00 N ATOM 1971 CA PRO B 69 3.802 -9.788 -7.925 1.00 0.00 C ATOM 1972 C PRO B 69 3.424 -9.217 -9.304 1.00 0.00 C ATOM 1973 O PRO B 69 2.242 -9.193 -9.671 1.00 0.00 O ATOM 1974 CB PRO B 69 4.704 -8.796 -7.177 1.00 0.00 C ATOM 1975 CG PRO B 69 6.063 -9.433 -7.079 1.00 0.00 C ATOM 1976 CD PRO B 69 6.030 -10.710 -7.882 1.00 0.00 C ATOM 0 HA PRO B 69 2.848 -9.985 -7.435 1.00 0.00 H new ATOM 0 HB2 PRO B 69 4.760 -7.847 -7.710 1.00 0.00 H new ATOM 0 HB3 PRO B 69 4.305 -8.582 -6.185 1.00 0.00 H new ATOM 0 HG2 PRO B 69 6.830 -8.760 -7.463 1.00 0.00 H new ATOM 0 HG3 PRO B 69 6.314 -9.642 -6.039 1.00 0.00 H new ATOM 0 HD2 PRO B 69 6.495 -10.582 -8.859 1.00 0.00 H new ATOM 0 HD3 PRO B 69 6.565 -11.515 -7.378 1.00 0.00 H new ATOM 1984 N LYS B 70 4.453 -8.823 -10.081 1.00 0.00 N ATOM 1985 CA LYS B 70 4.293 -8.142 -11.374 1.00 0.00 C ATOM 1986 C LYS B 70 3.733 -6.736 -11.172 1.00 0.00 C ATOM 1987 O LYS B 70 2.524 -6.533 -11.164 1.00 0.00 O ATOM 1988 CB LYS B 70 3.445 -8.923 -12.412 1.00 0.00 C ATOM 1989 CG LYS B 70 4.089 -10.164 -13.028 1.00 0.00 C ATOM 1990 CD LYS B 70 4.318 -11.294 -12.042 1.00 0.00 C ATOM 1991 CE LYS B 70 4.888 -12.518 -12.746 1.00 0.00 C ATOM 1992 NZ LYS B 70 4.013 -13.001 -13.847 1.00 0.00 N ATOM 0 H LYS B 70 5.428 -8.972 -9.822 1.00 0.00 H new ATOM 0 HA LYS B 70 5.294 -8.085 -11.801 1.00 0.00 H new ATOM 0 HB2 LYS B 70 2.514 -9.225 -11.933 1.00 0.00 H new ATOM 0 HB3 LYS B 70 3.181 -8.240 -13.219 1.00 0.00 H new ATOM 0 HG2 LYS B 70 3.456 -10.525 -13.838 1.00 0.00 H new ATOM 0 HG3 LYS B 70 5.044 -9.883 -13.471 1.00 0.00 H new ATOM 0 HD2 LYS B 70 5.003 -10.967 -11.260 1.00 0.00 H new ATOM 0 HD3 LYS B 70 3.378 -11.554 -11.555 1.00 0.00 H new ATOM 0 HE2 LYS B 70 5.872 -12.277 -13.148 1.00 0.00 H new ATOM 0 HE3 LYS B 70 5.028 -13.319 -12.020 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 3.925 -14.036 -13.792 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 3.072 -12.568 -13.758 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 4.430 -12.737 -14.763 1.00 0.00 H new ATOM 2006 N PRO B 71 4.606 -5.755 -10.944 1.00 0.00 N ATOM 2007 CA PRO B 71 4.183 -4.391 -10.710 1.00 0.00 C ATOM 2008 C PRO B 71 3.880 -3.602 -12.001 1.00 0.00 C ATOM 2009 O PRO B 71 4.478 -3.840 -13.078 1.00 0.00 O ATOM 2010 CB PRO B 71 5.362 -3.797 -9.956 1.00 0.00 C ATOM 2011 CG PRO B 71 6.550 -4.522 -10.466 1.00 0.00 C ATOM 2012 CD PRO B 71 6.077 -5.900 -10.854 1.00 0.00 C ATOM 0 HA PRO B 71 3.239 -4.347 -10.166 1.00 0.00 H new ATOM 0 HB2 PRO B 71 5.446 -2.725 -10.137 1.00 0.00 H new ATOM 0 HB3 PRO B 71 5.250 -3.931 -8.880 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.982 -4.005 -11.323 1.00 0.00 H new ATOM 0 HG3 PRO B 71 7.327 -4.579 -9.703 1.00 0.00 H new ATOM 0 HD2 PRO B 71 6.507 -6.218 -11.804 1.00 0.00 H new ATOM 0 HD3 PRO B 71 6.361 -6.645 -10.111 1.00 0.00 H new ATOM 2020 N VAL B 72 2.935 -2.709 -11.882 1.00 0.00 N ATOM 2021 CA VAL B 72 2.500 -1.828 -12.930 1.00 0.00 C ATOM 2022 C VAL B 72 2.691 -0.400 -12.423 1.00 0.00 C ATOM 2023 O VAL B 72 1.997 0.029 -11.491 1.00 0.00 O ATOM 2024 CB VAL B 72 0.994 -2.066 -13.275 1.00 0.00 C ATOM 2025 CG1 VAL B 72 0.535 -1.169 -14.416 1.00 0.00 C ATOM 2026 CG2 VAL B 72 0.738 -3.531 -13.617 1.00 0.00 C ATOM 0 H VAL B 72 2.424 -2.570 -11.010 1.00 0.00 H new ATOM 0 HA VAL B 72 3.077 -2.011 -13.836 1.00 0.00 H new ATOM 0 HB VAL B 72 0.413 -1.809 -12.389 1.00 0.00 H new ATOM 0 HG11 VAL B 72 -0.517 -1.361 -14.629 1.00 0.00 H new ATOM 0 HG12 VAL B 72 0.663 -0.125 -14.132 1.00 0.00 H new ATOM 0 HG13 VAL B 72 1.130 -1.378 -15.305 1.00 0.00 H new ATOM 0 HG21 VAL B 72 -0.317 -3.671 -13.853 1.00 0.00 H new ATOM 0 HG22 VAL B 72 1.343 -3.815 -14.478 1.00 0.00 H new ATOM 0 HG23 VAL B 72 1.005 -4.156 -12.764 1.00 0.00 H new ATOM 2036 N ARG B 73 3.655 0.304 -12.997 1.00 0.00 N ATOM 2037 CA ARG B 73 3.998 1.648 -12.557 1.00 0.00 C ATOM 2038 C ARG B 73 2.893 2.596 -12.994 1.00 0.00 C ATOM 2039 O ARG B 73 2.644 2.786 -14.195 1.00 0.00 O ATOM 2040 CB ARG B 73 5.383 2.061 -13.131 1.00 0.00 C ATOM 2041 CG ARG B 73 6.073 3.276 -12.465 1.00 0.00 C ATOM 2042 CD ARG B 73 5.380 4.601 -12.748 1.00 0.00 C ATOM 2043 NE ARG B 73 5.330 4.898 -14.185 1.00 0.00 N ATOM 2044 CZ ARG B 73 4.460 5.732 -14.778 1.00 0.00 C ATOM 2045 NH1 ARG B 73 3.525 6.360 -14.067 1.00 0.00 N ATOM 2046 NH2 ARG B 73 4.514 5.921 -16.084 1.00 0.00 N ATOM 0 H ARG B 73 4.218 -0.037 -13.776 1.00 0.00 H new ATOM 0 HA ARG B 73 4.080 1.687 -11.471 1.00 0.00 H new ATOM 0 HB2 ARG B 73 6.053 1.204 -13.055 1.00 0.00 H new ATOM 0 HB3 ARG B 73 5.262 2.277 -14.192 1.00 0.00 H new ATOM 0 HG2 ARG B 73 6.109 3.117 -11.387 1.00 0.00 H new ATOM 0 HG3 ARG B 73 7.104 3.333 -12.813 1.00 0.00 H new ATOM 0 HD2 ARG B 73 4.367 4.573 -12.348 1.00 0.00 H new ATOM 0 HD3 ARG B 73 5.905 5.403 -12.230 1.00 0.00 H new ATOM 0 HE ARG B 73 6.013 4.432 -14.783 1.00 0.00 H new ATOM 0 HH11 ARG B 73 3.464 6.210 -13.060 1.00 0.00 H new ATOM 0 HH12 ARG B 73 2.870 6.991 -14.530 1.00 0.00 H new ATOM 0 HH21 ARG B 73 5.216 5.434 -16.641 1.00 0.00 H new ATOM 0 HH22 ARG B 73 3.854 6.554 -16.535 1.00 0.00 H new ATOM 2060 N VAL B 74 2.244 3.180 -12.040 1.00 0.00 N ATOM 2061 CA VAL B 74 1.112 4.024 -12.291 1.00 0.00 C ATOM 2062 C VAL B 74 1.262 5.394 -11.618 1.00 0.00 C ATOM 2063 O VAL B 74 2.342 5.752 -11.095 1.00 0.00 O ATOM 2064 CB VAL B 74 -0.231 3.349 -11.845 1.00 0.00 C ATOM 2065 CG1 VAL B 74 -0.531 2.111 -12.677 1.00 0.00 C ATOM 2066 CG2 VAL B 74 -0.196 2.981 -10.375 1.00 0.00 C ATOM 0 H VAL B 74 2.484 3.086 -11.053 1.00 0.00 H new ATOM 0 HA VAL B 74 1.075 4.175 -13.370 1.00 0.00 H new ATOM 0 HB VAL B 74 -1.025 4.078 -12.006 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -1.468 1.666 -12.343 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -0.616 2.390 -13.727 1.00 0.00 H new ATOM 0 HG13 VAL B 74 0.276 1.388 -12.558 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -1.140 2.515 -10.094 1.00 0.00 H new ATOM 0 HG22 VAL B 74 0.621 2.283 -10.194 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -0.044 3.880 -9.778 1.00 0.00 H new ATOM 2076 N THR B 75 0.214 6.164 -11.727 1.00 0.00 N ATOM 2077 CA THR B 75 0.069 7.465 -11.138 1.00 0.00 C ATOM 2078 C THR B 75 -1.294 7.537 -10.447 1.00 0.00 C ATOM 2079 O THR B 75 -2.121 6.659 -10.645 1.00 0.00 O ATOM 2080 CB THR B 75 0.191 8.570 -12.219 1.00 0.00 C ATOM 2081 OG1 THR B 75 -0.592 8.222 -13.371 1.00 0.00 O ATOM 2082 CG2 THR B 75 1.638 8.802 -12.626 1.00 0.00 C ATOM 0 H THR B 75 -0.609 5.883 -12.260 1.00 0.00 H new ATOM 0 HA THR B 75 0.861 7.628 -10.407 1.00 0.00 H new ATOM 0 HB THR B 75 -0.187 9.497 -11.788 1.00 0.00 H new ATOM 0 HG1 THR B 75 -0.245 7.394 -13.764 1.00 0.00 H new ATOM 0 HG21 THR B 75 1.682 9.583 -13.385 1.00 0.00 H new ATOM 0 HG22 THR B 75 2.216 9.110 -11.755 1.00 0.00 H new ATOM 0 HG23 THR B 75 2.055 7.880 -13.031 1.00 0.00 H new ATOM 2090 N LEU B 76 -1.530 8.558 -9.656 1.00 0.00 N ATOM 2091 CA LEU B 76 -2.803 8.705 -8.951 1.00 0.00 C ATOM 2092 C LEU B 76 -3.842 9.274 -9.879 1.00 0.00 C ATOM 2093 O LEU B 76 -5.029 8.954 -9.785 1.00 0.00 O ATOM 2094 CB LEU B 76 -2.620 9.609 -7.743 1.00 0.00 C ATOM 2095 CG LEU B 76 -1.701 9.059 -6.680 1.00 0.00 C ATOM 2096 CD1 LEU B 76 -1.345 10.131 -5.673 1.00 0.00 C ATOM 2097 CD2 LEU B 76 -2.354 7.886 -5.978 1.00 0.00 C ATOM 0 H LEU B 76 -0.861 9.307 -9.478 1.00 0.00 H new ATOM 0 HA LEU B 76 -3.140 7.726 -8.610 1.00 0.00 H new ATOM 0 HB2 LEU B 76 -2.230 10.569 -8.080 1.00 0.00 H new ATOM 0 HB3 LEU B 76 -3.596 9.800 -7.297 1.00 0.00 H new ATOM 0 HG LEU B 76 -0.785 8.719 -7.163 1.00 0.00 H new ATOM 0 HD11 LEU B 76 -0.682 9.713 -4.916 1.00 0.00 H new ATOM 0 HD12 LEU B 76 -0.843 10.955 -6.181 1.00 0.00 H new ATOM 0 HD13 LEU B 76 -2.254 10.499 -5.196 1.00 0.00 H new ATOM 0 HD21 LEU B 76 -1.680 7.499 -5.214 1.00 0.00 H new ATOM 0 HD22 LEU B 76 -3.283 8.213 -5.511 1.00 0.00 H new ATOM 0 HD23 LEU B 76 -2.569 7.101 -6.704 1.00 0.00 H new ATOM 2109 N ASP B 77 -3.369 10.078 -10.807 1.00 0.00 N ATOM 2110 CA ASP B 77 -4.211 10.726 -11.804 1.00 0.00 C ATOM 2111 C ASP B 77 -4.923 9.703 -12.681 1.00 0.00 C ATOM 2112 O ASP B 77 -6.077 9.900 -13.067 1.00 0.00 O ATOM 2113 CB ASP B 77 -3.372 11.662 -12.674 1.00 0.00 C ATOM 2114 CG ASP B 77 -4.179 12.330 -13.764 1.00 0.00 C ATOM 2115 OD1 ASP B 77 -4.837 13.352 -13.501 1.00 0.00 O ATOM 2116 OD2 ASP B 77 -4.152 11.864 -14.917 1.00 0.00 O ATOM 0 H ASP B 77 -2.379 10.306 -10.896 1.00 0.00 H new ATOM 0 HA ASP B 77 -4.969 11.305 -11.275 1.00 0.00 H new ATOM 0 HB2 ASP B 77 -2.918 12.427 -12.044 1.00 0.00 H new ATOM 0 HB3 ASP B 77 -2.557 11.097 -13.126 1.00 0.00 H new ATOM 2121 N GLU B 78 -4.266 8.586 -12.941 1.00 0.00 N ATOM 2122 CA GLU B 78 -4.833 7.574 -13.814 1.00 0.00 C ATOM 2123 C GLU B 78 -5.708 6.595 -13.041 1.00 0.00 C ATOM 2124 O GLU B 78 -6.341 5.709 -13.646 1.00 0.00 O ATOM 2125 CB GLU B 78 -3.734 6.811 -14.548 1.00 0.00 C ATOM 2126 CG GLU B 78 -2.868 5.966 -13.642 1.00 0.00 C ATOM 2127 CD GLU B 78 -1.784 5.258 -14.377 1.00 0.00 C ATOM 2128 OE1 GLU B 78 -2.043 4.197 -14.951 1.00 0.00 O ATOM 2129 OE2 GLU B 78 -0.638 5.744 -14.363 1.00 0.00 O ATOM 0 H GLU B 78 -3.346 8.358 -12.563 1.00 0.00 H new ATOM 0 HA GLU B 78 -5.456 8.092 -14.543 1.00 0.00 H new ATOM 0 HB2 GLU B 78 -4.191 6.169 -15.301 1.00 0.00 H new ATOM 0 HB3 GLU B 78 -3.102 7.523 -15.078 1.00 0.00 H new ATOM 0 HG2 GLU B 78 -2.426 6.601 -12.874 1.00 0.00 H new ATOM 0 HG3 GLU B 78 -3.492 5.234 -13.130 1.00 0.00 H new ATOM 2136 N LEU B 79 -5.709 6.704 -11.720 1.00 0.00 N ATOM 2137 CA LEU B 79 -6.532 5.830 -10.912 1.00 0.00 C ATOM 2138 C LEU B 79 -7.970 6.313 -10.933 1.00 0.00 C ATOM 2139 O LEU B 79 -8.285 7.326 -10.262 1.00 0.00 O ATOM 2140 CB LEU B 79 -6.013 5.716 -9.474 1.00 0.00 C ATOM 2141 CG LEU B 79 -4.565 5.245 -9.303 1.00 0.00 C ATOM 2142 CD1 LEU B 79 -4.235 5.057 -7.840 1.00 0.00 C ATOM 2143 CD2 LEU B 79 -4.295 3.969 -10.084 1.00 0.00 C ATOM 2144 OXT LEU B 79 -8.797 5.698 -11.641 1.00 0.00 O ATOM 0 H LEU B 79 -5.155 7.381 -11.195 1.00 0.00 H new ATOM 0 HA LEU B 79 -6.484 4.830 -11.343 1.00 0.00 H new ATOM 0 HB2 LEU B 79 -6.113 6.691 -8.997 1.00 0.00 H new ATOM 0 HB3 LEU B 79 -6.661 5.028 -8.931 1.00 0.00 H new ATOM 0 HG LEU B 79 -3.916 6.021 -9.708 1.00 0.00 H new ATOM 0 HD11 LEU B 79 -3.202 4.722 -7.740 1.00 0.00 H new ATOM 0 HD12 LEU B 79 -4.362 6.003 -7.314 1.00 0.00 H new ATOM 0 HD13 LEU B 79 -4.902 4.310 -7.410 1.00 0.00 H new ATOM 0 HD21 LEU B 79 -3.258 3.666 -9.938 1.00 0.00 H new ATOM 0 HD22 LEU B 79 -4.957 3.179 -9.730 1.00 0.00 H new ATOM 0 HD23 LEU B 79 -4.476 4.146 -11.144 1.00 0.00 H new TER 2156 LEU B 79