USER MOD reduce.3.24.130724 H: found=0, std=0, add=851, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 852 hydrogens (5 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 NoAdj-H: A 10 CSP H2 : A 10 CSP N : A 9 PHE C :(H bumps) USER MOD NoAdj-H: A 10 CSP H : A 10 CSP N : A 9 PHE C :(H bumps) USER MOD Set 1.1: A 15 SER OG : rot 37:sc= 0.299 USER MOD Set 1.2: A 59 GLN : amide:sc= 0.866 K(o=1.3,f=-3.3!) USER MOD Set 1.3: A 84 TYR OH : rot 180:sc= 0.115 USER MOD Set 2.1: A 5 HIS : no HD1:sc= 0.254 K(o=0.58,f=0) USER MOD Set 2.2: A 7 TYR OH : rot 76:sc= 0.322 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 146:sc= 0.0547 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0556) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot -117:sc= 0.186 USER MOD Single : A 17 SER OG : rot -84:sc= 0.595 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -164:sc= -0.0123 (180deg=-0.205) USER MOD Single : A 23 MET CE :methyl 152:sc= 0 (180deg=-0.00251) USER MOD Single : A 26 GLN : amide:sc= -0.0664 K(o=-0.066,f=-1.4!) USER MOD Single : A 29 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.131) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -176:sc= 0.098 (180deg=0.0949) USER MOD Single : A 49 GLN : amide:sc= 0.102 X(o=0.1,f=-0.18) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 83:sc= 0.00685 USER MOD Single : A 63 MET CE :methyl -119:sc= 0 (180deg=-1.67!) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0398) USER MOD Single : A 106 ASN : amide:sc= -0.65 K(o=-0.65,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.054 17.774 9.890 1.00 0.00 N ATOM 2 CA MET A 1 -8.284 16.603 10.333 1.00 0.00 C ATOM 3 C MET A 1 -7.113 16.390 9.371 1.00 0.00 C ATOM 4 O MET A 1 -7.306 16.583 8.172 1.00 0.00 O ATOM 5 CB MET A 1 -9.197 15.375 10.350 1.00 0.00 C ATOM 6 CG MET A 1 -8.514 14.121 10.900 1.00 0.00 C ATOM 7 SD MET A 1 -7.861 14.331 12.597 1.00 0.00 S ATOM 8 CE MET A 1 -7.016 12.779 12.807 1.00 0.00 C ATOM 0 H1 MET A 1 -10.062 17.625 10.098 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.718 18.621 10.392 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.927 17.906 8.866 1.00 0.00 H new ATOM 0 HA MET A 1 -7.895 16.762 11.339 1.00 0.00 H new ATOM 0 HB2 MET A 1 -10.078 15.594 10.953 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.545 15.176 9.337 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.226 13.296 10.893 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.696 13.842 10.236 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.559 12.744 13.796 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.729 11.960 12.707 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.242 12.680 12.046 1.00 0.00 H new ATOM 20 N GLU A 2 -5.953 16.040 9.921 1.00 0.00 N ATOM 21 CA GLU A 2 -4.714 15.818 9.162 1.00 0.00 C ATOM 22 C GLU A 2 -4.397 14.322 9.129 1.00 0.00 C ATOM 23 O GLU A 2 -4.256 13.693 10.176 1.00 0.00 O ATOM 24 CB GLU A 2 -3.628 16.626 9.875 1.00 0.00 C ATOM 25 CG GLU A 2 -2.241 16.493 9.242 1.00 0.00 C ATOM 26 CD GLU A 2 -1.253 17.418 9.955 1.00 0.00 C ATOM 27 OE1 GLU A 2 -0.785 17.016 11.042 1.00 0.00 O ATOM 28 OE2 GLU A 2 -0.994 18.496 9.378 1.00 0.00 O ATOM 0 H GLU A 2 -5.840 15.899 10.925 1.00 0.00 H new ATOM 0 HA GLU A 2 -4.794 16.141 8.124 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -3.915 17.677 9.880 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -3.574 16.305 10.915 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -1.899 15.460 9.309 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -2.289 16.745 8.183 1.00 0.00 H new ATOM 35 N LYS A 3 -4.637 13.735 7.959 1.00 0.00 N ATOM 36 CA LYS A 3 -4.370 12.308 7.726 1.00 0.00 C ATOM 37 C LYS A 3 -3.612 12.090 6.415 1.00 0.00 C ATOM 38 O LYS A 3 -3.720 12.885 5.482 1.00 0.00 O ATOM 39 CB LYS A 3 -5.671 11.509 7.643 1.00 0.00 C ATOM 40 CG LYS A 3 -6.309 11.307 9.019 1.00 0.00 C ATOM 41 CD LYS A 3 -7.451 10.293 8.927 1.00 0.00 C ATOM 42 CE LYS A 3 -8.076 10.019 10.296 1.00 0.00 C ATOM 43 NZ LYS A 3 -9.154 9.028 10.162 1.00 0.00 N ATOM 0 H LYS A 3 -5.018 14.225 7.150 1.00 0.00 H new ATOM 0 HA LYS A 3 -3.769 11.966 8.569 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -6.374 12.027 6.990 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -5.472 10.538 7.190 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.559 10.958 9.728 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -6.686 12.258 9.396 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -8.216 10.667 8.246 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -7.077 9.361 8.505 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -7.316 9.652 10.986 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -8.470 10.944 10.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -9.575 8.845 11.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -9.884 9.394 9.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.766 8.143 9.778 1.00 0.00 H new ATOM 57 N LYS A 4 -2.865 10.989 6.418 1.00 0.00 N ATOM 58 CA LYS A 4 -2.169 10.474 5.230 1.00 0.00 C ATOM 59 C LYS A 4 -2.922 9.280 4.639 1.00 0.00 C ATOM 60 O LYS A 4 -3.591 8.529 5.346 1.00 0.00 O ATOM 61 CB LYS A 4 -0.738 10.059 5.577 1.00 0.00 C ATOM 62 CG LYS A 4 0.306 11.173 5.478 1.00 0.00 C ATOM 63 CD LYS A 4 0.141 12.278 6.523 1.00 0.00 C ATOM 64 CE LYS A 4 1.259 13.320 6.451 1.00 0.00 C ATOM 65 NZ LYS A 4 1.223 14.061 5.181 1.00 0.00 N ATOM 0 H LYS A 4 -2.721 10.419 7.252 1.00 0.00 H new ATOM 0 HA LYS A 4 -2.135 11.274 4.490 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -0.728 9.663 6.592 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -0.442 9.246 4.914 1.00 0.00 H new ATOM 0 HG2 LYS A 4 1.299 10.736 5.581 1.00 0.00 H new ATOM 0 HG3 LYS A 4 0.255 11.617 4.484 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -0.821 12.770 6.379 1.00 0.00 H new ATOM 0 HD3 LYS A 4 0.125 11.834 7.518 1.00 0.00 H new ATOM 0 HE2 LYS A 4 1.162 14.017 7.283 1.00 0.00 H new ATOM 0 HE3 LYS A 4 2.225 12.827 6.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 1.915 14.836 5.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 1.457 13.419 4.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 0.271 14.453 5.035 1.00 0.00 H new ATOM 79 N HIS A 5 -2.823 9.161 3.318 1.00 0.00 N ATOM 80 CA HIS A 5 -3.461 8.089 2.540 1.00 0.00 C ATOM 81 C HIS A 5 -2.441 7.075 2.017 1.00 0.00 C ATOM 82 O HIS A 5 -1.440 7.416 1.388 1.00 0.00 O ATOM 83 CB HIS A 5 -4.268 8.672 1.378 1.00 0.00 C ATOM 84 CG HIS A 5 -5.524 9.409 1.848 1.00 0.00 C ATOM 85 ND1 HIS A 5 -6.742 8.883 1.945 1.00 0.00 N ATOM 86 CD2 HIS A 5 -5.623 10.782 2.041 1.00 0.00 C ATOM 87 CE1 HIS A 5 -7.547 9.924 2.138 1.00 0.00 C ATOM 88 NE2 HIS A 5 -6.906 11.087 2.213 1.00 0.00 N ATOM 0 H HIS A 5 -2.290 9.814 2.744 1.00 0.00 H new ATOM 0 HA HIS A 5 -4.136 7.562 3.214 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -3.639 9.358 0.811 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -4.555 7.868 0.700 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -4.800 11.481 2.050 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -8.620 9.834 2.226 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -7.310 12.011 2.368 1.00 0.00 H new ATOM 96 N ILE A 6 -2.660 5.834 2.443 1.00 0.00 N ATOM 97 CA ILE A 6 -1.836 4.671 2.083 1.00 0.00 C ATOM 98 C ILE A 6 -2.770 3.673 1.395 1.00 0.00 C ATOM 99 O ILE A 6 -3.657 3.083 2.011 1.00 0.00 O ATOM 100 CB ILE A 6 -1.172 4.080 3.329 1.00 0.00 C ATOM 101 CG1 ILE A 6 -0.317 5.124 4.051 1.00 0.00 C ATOM 102 CG2 ILE A 6 -0.326 2.862 2.951 1.00 0.00 C ATOM 103 CD1 ILE A 6 0.069 4.749 5.483 1.00 0.00 C ATOM 0 H ILE A 6 -3.434 5.597 3.064 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.023 4.944 1.411 1.00 0.00 H new ATOM 0 HB ILE A 6 -1.959 3.764 4.013 1.00 0.00 H new ATOM 0 HG12 ILE A 6 0.593 5.291 3.475 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -0.860 6.069 4.070 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.141 2.451 3.846 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -0.963 2.105 2.494 1.00 0.00 H new ATOM 0 HG23 ILE A 6 0.447 3.161 2.244 1.00 0.00 H new ATOM 0 HD11 ILE A 6 0.673 5.545 5.917 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -0.833 4.612 6.079 1.00 0.00 H new ATOM 0 HD13 ILE A 6 0.642 3.822 5.474 1.00 0.00 H new ATOM 115 N TYR A 7 -2.574 3.544 0.086 1.00 0.00 N ATOM 116 CA TYR A 7 -3.391 2.647 -0.744 1.00 0.00 C ATOM 117 C TYR A 7 -2.571 1.497 -1.333 1.00 0.00 C ATOM 118 O TYR A 7 -1.537 1.688 -1.972 1.00 0.00 O ATOM 119 CB TYR A 7 -4.104 3.401 -1.869 1.00 0.00 C ATOM 120 CG TYR A 7 -5.058 4.518 -1.438 1.00 0.00 C ATOM 121 CD1 TYR A 7 -5.876 4.409 -0.320 1.00 0.00 C ATOM 122 CD2 TYR A 7 -5.101 5.636 -2.263 1.00 0.00 C ATOM 123 CE1 TYR A 7 -6.758 5.440 -0.019 1.00 0.00 C ATOM 124 CE2 TYR A 7 -5.976 6.673 -1.963 1.00 0.00 C ATOM 125 CZ TYR A 7 -6.800 6.555 -0.849 1.00 0.00 C ATOM 126 OH TYR A 7 -7.809 7.455 -0.707 1.00 0.00 O ATOM 0 H TYR A 7 -1.854 4.050 -0.430 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.143 2.225 -0.077 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -3.348 3.831 -2.525 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.667 2.680 -2.461 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -5.827 3.532 0.309 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -4.460 5.698 -3.130 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.401 5.376 0.846 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -6.015 7.555 -2.584 1.00 0.00 H new ATOM 0 HH TYR A 7 -7.648 8.004 0.088 1.00 0.00 H new ATOM 136 N LEU A 8 -3.083 0.301 -1.057 1.00 0.00 N ATOM 137 CA LEU A 8 -2.498 -0.980 -1.477 1.00 0.00 C ATOM 138 C LEU A 8 -3.247 -1.502 -2.704 1.00 0.00 C ATOM 139 O LEU A 8 -4.476 -1.487 -2.763 1.00 0.00 O ATOM 140 CB LEU A 8 -2.556 -2.016 -0.352 1.00 0.00 C ATOM 141 CG LEU A 8 -1.545 -1.787 0.773 1.00 0.00 C ATOM 142 CD1 LEU A 8 -1.988 -0.669 1.720 1.00 0.00 C ATOM 143 CD2 LEU A 8 -1.352 -3.076 1.575 1.00 0.00 C ATOM 0 H LEU A 8 -3.942 0.187 -0.519 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.450 -0.814 -1.725 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.560 -2.017 0.073 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.389 -3.006 -0.777 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.605 -1.489 0.308 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.242 -0.539 2.504 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.093 0.261 1.161 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.945 -0.932 2.170 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.631 -2.903 2.374 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.305 -3.382 2.007 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -0.983 -3.862 0.917 1.00 0.00 H new ATOM 155 N PHE A 9 -2.448 -1.809 -3.722 1.00 0.00 N ATOM 156 CA PHE A 9 -2.938 -2.295 -5.020 1.00 0.00 C ATOM 157 C PHE A 9 -2.303 -3.629 -5.417 1.00 0.00 C ATOM 158 O PHE A 9 -1.121 -3.886 -5.193 1.00 0.00 O ATOM 159 CB PHE A 9 -2.696 -1.261 -6.122 1.00 0.00 C ATOM 160 CG PHE A 9 -3.533 0.005 -5.929 1.00 0.00 C ATOM 161 CD1 PHE A 9 -4.831 0.065 -6.425 1.00 0.00 C ATOM 162 CD2 PHE A 9 -2.940 1.126 -5.361 1.00 0.00 C ATOM 163 CE1 PHE A 9 -5.552 1.249 -6.326 1.00 0.00 C ATOM 164 CE2 PHE A 9 -3.649 2.319 -5.285 1.00 0.00 C ATOM 165 CZ PHE A 9 -4.947 2.376 -5.781 1.00 0.00 C ATOM 0 H PHE A 9 -1.432 -1.729 -3.675 1.00 0.00 H new ATOM 0 HA PHE A 9 -4.010 -2.454 -4.906 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -1.639 -0.995 -6.141 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -2.931 -1.704 -7.090 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -5.277 -0.805 -6.885 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -1.931 1.070 -4.980 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -6.575 1.293 -6.670 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -3.196 3.195 -4.844 1.00 0.00 H new ATOM 0 HZ PHE A 9 -5.492 3.308 -5.742 1.00 0.00 H new HETATM 175 N CSP A 10 -3.207 -4.498 -5.861 1.00 0.00 N HETATM 176 CA CSP A 10 -2.911 -5.828 -6.412 1.00 0.00 C HETATM 177 CB CSP A 10 -2.789 -6.866 -5.295 1.00 0.00 C HETATM 178 SG CSP A 10 -4.394 -7.324 -4.543 1.00 0.00 S HETATM 179 C CSP A 10 -4.017 -6.220 -7.395 1.00 0.00 C HETATM 180 O CSP A 10 -5.073 -5.589 -7.401 1.00 0.00 O HETATM 181 P CSP A 10 -3.936 -9.350 -4.031 1.00 0.00 P HETATM 182 O1P CSP A 10 -5.241 -10.048 -3.997 1.00 0.00 O HETATM 183 O2P CSP A 10 -3.008 -9.288 -2.881 1.00 0.00 O HETATM 184 O3P CSP A 10 -3.056 -9.930 -5.248 1.00 0.00 O HETATM 0 HB3 CSP A 10 -2.315 -7.763 -5.694 1.00 0.00 H new HETATM 0 HB2 CSP A 10 -2.131 -6.476 -4.518 1.00 0.00 H new HETATM 0 HA CSP A 10 -1.956 -5.794 -6.936 1.00 0.00 H new ATOM 190 N SER A 11 -3.861 -7.376 -8.033 1.00 0.00 N ATOM 191 CA SER A 11 -4.739 -7.816 -9.127 1.00 0.00 C ATOM 192 C SER A 11 -6.232 -7.838 -8.791 1.00 0.00 C ATOM 193 O SER A 11 -7.059 -7.300 -9.526 1.00 0.00 O ATOM 194 CB SER A 11 -4.307 -9.205 -9.602 1.00 0.00 C ATOM 195 OG SER A 11 -2.935 -9.208 -10.004 1.00 0.00 O ATOM 0 H SER A 11 -3.121 -8.041 -7.809 1.00 0.00 H new ATOM 0 HA SER A 11 -4.624 -7.068 -9.912 1.00 0.00 H new ATOM 0 HB2 SER A 11 -4.456 -9.929 -8.801 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.934 -9.519 -10.436 1.00 0.00 H new ATOM 0 HG SER A 11 -2.683 -10.107 -10.301 1.00 0.00 H new ATOM 201 N ALA A 12 -6.584 -8.435 -7.656 1.00 0.00 N ATOM 202 CA ALA A 12 -7.996 -8.593 -7.279 1.00 0.00 C ATOM 203 C ALA A 12 -8.453 -7.834 -6.031 1.00 0.00 C ATOM 204 O ALA A 12 -9.653 -7.641 -5.845 1.00 0.00 O ATOM 205 CB ALA A 12 -8.285 -10.089 -7.135 1.00 0.00 C ATOM 0 H ALA A 12 -5.921 -8.817 -6.982 1.00 0.00 H new ATOM 0 HA ALA A 12 -8.576 -8.134 -8.080 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -9.329 -10.233 -6.855 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -8.091 -10.590 -8.084 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -7.641 -10.511 -6.364 1.00 0.00 H new ATOM 211 N GLY A 13 -7.502 -7.362 -5.230 1.00 0.00 N ATOM 212 CA GLY A 13 -7.767 -6.697 -3.946 1.00 0.00 C ATOM 213 C GLY A 13 -8.339 -7.652 -2.896 1.00 0.00 C ATOM 214 O GLY A 13 -9.268 -7.297 -2.172 1.00 0.00 O ATOM 0 H GLY A 13 -6.509 -7.429 -5.453 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -6.842 -6.261 -3.569 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -8.466 -5.876 -4.104 1.00 0.00 H new ATOM 218 N MET A 14 -7.739 -8.835 -2.790 1.00 0.00 N ATOM 219 CA MET A 14 -8.242 -9.908 -1.922 1.00 0.00 C ATOM 220 C MET A 14 -7.316 -10.287 -0.764 1.00 0.00 C ATOM 221 O MET A 14 -7.630 -9.934 0.372 1.00 0.00 O ATOM 222 CB MET A 14 -8.646 -11.130 -2.749 1.00 0.00 C ATOM 223 CG MET A 14 -9.879 -10.845 -3.608 1.00 0.00 C ATOM 224 SD MET A 14 -11.339 -10.315 -2.640 1.00 0.00 S ATOM 225 CE MET A 14 -12.452 -9.893 -3.964 1.00 0.00 C ATOM 0 H MET A 14 -6.891 -9.081 -3.301 1.00 0.00 H new ATOM 0 HA MET A 14 -9.128 -9.499 -1.436 1.00 0.00 H new ATOM 0 HB2 MET A 14 -7.816 -11.427 -3.390 1.00 0.00 H new ATOM 0 HB3 MET A 14 -8.851 -11.969 -2.084 1.00 0.00 H new ATOM 0 HG2 MET A 14 -9.634 -10.070 -4.334 1.00 0.00 H new ATOM 0 HG3 MET A 14 -10.134 -11.742 -4.172 1.00 0.00 H new ATOM 0 HE1 MET A 14 -13.398 -9.548 -3.548 1.00 0.00 H new ATOM 0 HE2 MET A 14 -12.012 -9.102 -4.571 1.00 0.00 H new ATOM 0 HE3 MET A 14 -12.628 -10.771 -4.585 1.00 0.00 H new ATOM 235 N SER A 15 -6.181 -10.936 -1.011 1.00 0.00 N ATOM 236 CA SER A 15 -5.247 -11.326 0.055 1.00 0.00 C ATOM 237 C SER A 15 -4.562 -10.156 0.765 1.00 0.00 C ATOM 238 O SER A 15 -4.205 -10.268 1.936 1.00 0.00 O ATOM 239 CB SER A 15 -4.210 -12.332 -0.449 1.00 0.00 C ATOM 240 OG SER A 15 -3.688 -11.940 -1.721 1.00 0.00 O ATOM 0 H SER A 15 -5.879 -11.207 -1.947 1.00 0.00 H new ATOM 0 HA SER A 15 -5.873 -11.802 0.810 1.00 0.00 H new ATOM 0 HB2 SER A 15 -3.397 -12.413 0.272 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.665 -13.319 -0.528 1.00 0.00 H new ATOM 0 HG SER A 15 -3.592 -10.965 -1.749 1.00 0.00 H new ATOM 246 N THR A 16 -4.565 -8.986 0.133 1.00 0.00 N ATOM 247 CA THR A 16 -4.180 -7.700 0.731 1.00 0.00 C ATOM 248 C THR A 16 -5.028 -7.276 1.932 1.00 0.00 C ATOM 249 O THR A 16 -4.503 -6.645 2.848 1.00 0.00 O ATOM 250 CB THR A 16 -4.276 -6.571 -0.298 1.00 0.00 C ATOM 251 OG1 THR A 16 -5.403 -6.818 -1.142 1.00 0.00 O ATOM 252 CG2 THR A 16 -2.969 -6.389 -1.073 1.00 0.00 C ATOM 0 H THR A 16 -4.844 -8.898 -0.844 1.00 0.00 H new ATOM 0 HA THR A 16 -3.158 -7.862 1.073 1.00 0.00 H new ATOM 0 HB THR A 16 -4.430 -5.620 0.212 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.098 -6.951 -2.064 1.00 0.00 H new ATOM 0 HG21 THR A 16 -3.082 -5.578 -1.792 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.164 -6.148 -0.378 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.728 -7.311 -1.602 1.00 0.00 H new ATOM 260 N SER A 17 -6.291 -7.692 1.983 1.00 0.00 N ATOM 261 CA SER A 17 -7.239 -7.272 3.026 1.00 0.00 C ATOM 262 C SER A 17 -6.813 -7.641 4.448 1.00 0.00 C ATOM 263 O SER A 17 -7.014 -6.859 5.376 1.00 0.00 O ATOM 264 CB SER A 17 -8.634 -7.847 2.769 1.00 0.00 C ATOM 265 OG SER A 17 -8.638 -9.256 3.011 1.00 0.00 O ATOM 0 H SER A 17 -6.693 -8.334 1.300 1.00 0.00 H new ATOM 0 HA SER A 17 -7.253 -6.184 2.963 1.00 0.00 H new ATOM 0 HB2 SER A 17 -9.362 -7.357 3.415 1.00 0.00 H new ATOM 0 HB3 SER A 17 -8.935 -7.646 1.741 1.00 0.00 H new ATOM 0 HG SER A 17 -8.319 -9.726 2.213 1.00 0.00 H new ATOM 271 N LEU A 18 -6.155 -8.787 4.599 1.00 0.00 N ATOM 272 CA LEU A 18 -5.614 -9.246 5.887 1.00 0.00 C ATOM 273 C LEU A 18 -4.492 -8.332 6.383 1.00 0.00 C ATOM 274 O LEU A 18 -4.516 -7.880 7.527 1.00 0.00 O ATOM 275 CB LEU A 18 -5.161 -10.705 5.796 1.00 0.00 C ATOM 276 CG LEU A 18 -4.474 -11.222 7.061 1.00 0.00 C ATOM 277 CD1 LEU A 18 -5.417 -11.313 8.263 1.00 0.00 C ATOM 278 CD2 LEU A 18 -3.853 -12.594 6.792 1.00 0.00 C ATOM 0 H LEU A 18 -5.978 -9.432 3.829 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.414 -9.193 6.626 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.027 -11.331 5.583 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.477 -10.811 4.954 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.701 -10.497 7.316 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -4.869 -11.686 9.128 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.818 -10.324 8.486 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.237 -11.993 8.032 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.365 -12.956 7.697 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.633 -13.295 6.495 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.117 -12.510 5.992 1.00 0.00 H new ATOM 290 N LEU A 19 -3.574 -7.999 5.480 1.00 0.00 N ATOM 291 CA LEU A 19 -2.478 -7.061 5.764 1.00 0.00 C ATOM 292 C LEU A 19 -3.005 -5.667 6.111 1.00 0.00 C ATOM 293 O LEU A 19 -2.683 -5.149 7.178 1.00 0.00 O ATOM 294 CB LEU A 19 -1.528 -7.023 4.566 1.00 0.00 C ATOM 295 CG LEU A 19 -0.269 -6.199 4.844 1.00 0.00 C ATOM 296 CD1 LEU A 19 0.656 -6.870 5.862 1.00 0.00 C ATOM 297 CD2 LEU A 19 0.488 -5.959 3.536 1.00 0.00 C ATOM 0 H LEU A 19 -3.564 -8.369 4.529 1.00 0.00 H new ATOM 0 HA LEU A 19 -1.930 -7.409 6.640 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.241 -8.041 4.301 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.050 -6.604 3.705 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.589 -5.250 5.274 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.534 -6.245 6.023 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.125 -7.001 6.805 1.00 0.00 H new ATOM 0 HD13 LEU A 19 0.968 -7.843 5.484 1.00 0.00 H new ATOM 0 HD21 LEU A 19 1.384 -5.372 3.737 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.772 -6.916 3.099 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -0.152 -5.417 2.839 1.00 0.00 H new ATOM 309 N VAL A 20 -3.994 -5.197 5.356 1.00 0.00 N ATOM 310 CA VAL A 20 -4.662 -3.905 5.571 1.00 0.00 C ATOM 311 C VAL A 20 -5.351 -3.872 6.936 1.00 0.00 C ATOM 312 O VAL A 20 -5.263 -2.876 7.653 1.00 0.00 O ATOM 313 CB VAL A 20 -5.663 -3.654 4.441 1.00 0.00 C ATOM 314 CG1 VAL A 20 -6.525 -2.404 4.633 1.00 0.00 C ATOM 315 CG2 VAL A 20 -4.921 -3.465 3.116 1.00 0.00 C ATOM 0 H VAL A 20 -4.366 -5.711 4.558 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.916 -3.110 5.562 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.312 -4.529 4.443 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.207 -2.299 3.789 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -7.100 -2.496 5.554 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -5.883 -1.525 4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.641 -3.287 2.318 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.248 -2.611 3.194 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.344 -4.362 2.891 1.00 0.00 H new ATOM 325 N SER A 21 -6.032 -4.963 7.277 1.00 0.00 N ATOM 326 CA SER A 21 -6.736 -5.113 8.558 1.00 0.00 C ATOM 327 C SER A 21 -5.795 -5.013 9.760 1.00 0.00 C ATOM 328 O SER A 21 -6.027 -4.248 10.695 1.00 0.00 O ATOM 329 CB SER A 21 -7.468 -6.457 8.586 1.00 0.00 C ATOM 330 OG SER A 21 -8.195 -6.595 9.809 1.00 0.00 O ATOM 0 H SER A 21 -6.114 -5.778 6.670 1.00 0.00 H new ATOM 0 HA SER A 21 -7.448 -4.292 8.636 1.00 0.00 H new ATOM 0 HB2 SER A 21 -8.150 -6.526 7.739 1.00 0.00 H new ATOM 0 HB3 SER A 21 -6.752 -7.272 8.486 1.00 0.00 H new ATOM 0 HG SER A 21 -8.661 -7.457 9.817 1.00 0.00 H new ATOM 336 N LYS A 22 -4.657 -5.694 9.651 1.00 0.00 N ATOM 337 CA LYS A 22 -3.573 -5.637 10.642 1.00 0.00 C ATOM 338 C LYS A 22 -2.900 -4.265 10.728 1.00 0.00 C ATOM 339 O LYS A 22 -2.576 -3.800 11.819 1.00 0.00 O ATOM 340 CB LYS A 22 -2.516 -6.699 10.333 1.00 0.00 C ATOM 341 CG LYS A 22 -2.974 -8.098 10.749 1.00 0.00 C ATOM 342 CD LYS A 22 -1.913 -9.136 10.378 1.00 0.00 C ATOM 343 CE LYS A 22 -2.080 -10.458 11.129 1.00 0.00 C ATOM 344 NZ LYS A 22 -1.726 -10.272 12.544 1.00 0.00 N ATOM 0 H LYS A 22 -4.454 -6.310 8.864 1.00 0.00 H new ATOM 0 HA LYS A 22 -4.037 -5.830 11.609 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -2.295 -6.692 9.266 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -1.590 -6.451 10.852 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -3.158 -8.124 11.823 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -3.917 -8.340 10.259 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.958 -9.326 9.306 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.924 -8.728 10.588 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.109 -10.808 11.044 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.445 -11.224 10.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -1.576 -11.200 12.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -0.854 -9.710 12.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -2.498 -9.774 13.032 1.00 0.00 H new ATOM 358 N MET A 23 -2.720 -3.637 9.569 1.00 0.00 N ATOM 359 CA MET A 23 -2.165 -2.280 9.455 1.00 0.00 C ATOM 360 C MET A 23 -3.084 -1.239 10.098 1.00 0.00 C ATOM 361 O MET A 23 -2.606 -0.346 10.795 1.00 0.00 O ATOM 362 CB MET A 23 -1.933 -1.875 7.998 1.00 0.00 C ATOM 363 CG MET A 23 -0.754 -2.586 7.332 1.00 0.00 C ATOM 364 SD MET A 23 -0.519 -2.130 5.575 1.00 0.00 S ATOM 365 CE MET A 23 0.188 -0.503 5.714 1.00 0.00 C ATOM 0 H MET A 23 -2.956 -4.056 8.669 1.00 0.00 H new ATOM 0 HA MET A 23 -1.210 -2.306 9.980 1.00 0.00 H new ATOM 0 HB2 MET A 23 -2.838 -2.081 7.426 1.00 0.00 H new ATOM 0 HB3 MET A 23 -1.766 -0.799 7.953 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.157 -2.355 7.883 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.904 -3.663 7.402 1.00 0.00 H new ATOM 0 HE1 MET A 23 0.819 -0.305 4.847 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.610 0.238 5.759 1.00 0.00 H new ATOM 0 HE3 MET A 23 0.789 -0.444 6.621 1.00 0.00 H new ATOM 375 N ARG A 24 -4.390 -1.394 9.898 1.00 0.00 N ATOM 376 CA ARG A 24 -5.422 -0.551 10.519 1.00 0.00 C ATOM 377 C ARG A 24 -5.513 -0.745 12.034 1.00 0.00 C ATOM 378 O ARG A 24 -5.471 0.242 12.767 1.00 0.00 O ATOM 379 CB ARG A 24 -6.807 -0.808 9.923 1.00 0.00 C ATOM 380 CG ARG A 24 -7.061 0.002 8.650 1.00 0.00 C ATOM 381 CD ARG A 24 -8.532 -0.105 8.243 1.00 0.00 C ATOM 382 NE ARG A 24 -8.833 0.815 7.136 1.00 0.00 N ATOM 383 CZ ARG A 24 -9.535 1.955 7.192 1.00 0.00 C ATOM 384 NH1 ARG A 24 -10.073 2.401 8.335 1.00 0.00 N ATOM 385 NH2 ARG A 24 -9.689 2.680 6.076 1.00 0.00 N ATOM 0 H ARG A 24 -4.773 -2.119 9.291 1.00 0.00 H new ATOM 0 HA ARG A 24 -5.112 0.473 10.309 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -6.911 -1.870 9.700 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -7.568 -0.562 10.663 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -6.797 1.046 8.815 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.425 -0.364 7.844 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -8.758 -1.128 7.944 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -9.169 0.125 9.097 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.465 0.556 6.221 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -9.954 1.868 9.197 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -10.602 3.273 8.344 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.275 2.362 5.200 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.221 3.550 6.102 1.00 0.00 H new ATOM 399 N ALA A 25 -5.431 -1.995 12.480 1.00 0.00 N ATOM 400 CA ALA A 25 -5.503 -2.332 13.909 1.00 0.00 C ATOM 401 C ALA A 25 -4.312 -1.796 14.706 1.00 0.00 C ATOM 402 O ALA A 25 -4.450 -1.299 15.823 1.00 0.00 O ATOM 403 CB ALA A 25 -5.592 -3.855 14.030 1.00 0.00 C ATOM 0 H ALA A 25 -5.313 -2.803 11.869 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.385 -1.855 14.336 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.647 -4.134 15.082 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -6.484 -4.209 13.514 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -4.709 -4.308 13.580 1.00 0.00 H new ATOM 409 N GLN A 26 -3.133 -1.872 14.094 1.00 0.00 N ATOM 410 CA GLN A 26 -1.902 -1.316 14.674 1.00 0.00 C ATOM 411 C GLN A 26 -1.815 0.204 14.525 1.00 0.00 C ATOM 412 O GLN A 26 -1.314 0.863 15.434 1.00 0.00 O ATOM 413 CB GLN A 26 -0.673 -1.999 14.071 1.00 0.00 C ATOM 414 CG GLN A 26 -0.523 -3.469 14.469 1.00 0.00 C ATOM 415 CD GLN A 26 -0.063 -3.672 15.914 1.00 0.00 C ATOM 416 OE1 GLN A 26 -0.749 -3.385 16.894 1.00 0.00 O ATOM 417 NE2 GLN A 26 1.094 -4.295 16.115 1.00 0.00 N ATOM 0 H GLN A 26 -2.998 -2.317 13.186 1.00 0.00 H new ATOM 0 HA GLN A 26 -1.930 -1.520 15.744 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.728 -1.931 12.985 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.220 -1.456 14.380 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -1.479 -3.974 14.327 1.00 0.00 H new ATOM 0 HG3 GLN A 26 0.192 -3.946 13.799 1.00 0.00 H new ATOM 0 HE21 GLN A 26 1.683 -4.545 15.321 1.00 0.00 H new ATOM 0 HE22 GLN A 26 1.392 -4.523 17.063 1.00 0.00 H new ATOM 426 N ALA A 27 -2.424 0.749 13.475 1.00 0.00 N ATOM 427 CA ALA A 27 -2.572 2.202 13.305 1.00 0.00 C ATOM 428 C ALA A 27 -3.484 2.803 14.377 1.00 0.00 C ATOM 429 O ALA A 27 -3.198 3.899 14.856 1.00 0.00 O ATOM 430 CB ALA A 27 -3.144 2.528 11.924 1.00 0.00 C ATOM 0 H ALA A 27 -2.830 0.202 12.716 1.00 0.00 H new ATOM 0 HA ALA A 27 -1.578 2.639 13.404 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -3.246 3.608 11.818 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -2.472 2.150 11.153 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -4.122 2.059 11.815 1.00 0.00 H new ATOM 436 N GLU A 28 -4.500 2.052 14.792 1.00 0.00 N ATOM 437 CA GLU A 28 -5.400 2.449 15.884 1.00 0.00 C ATOM 438 C GLU A 28 -4.709 2.361 17.246 1.00 0.00 C ATOM 439 O GLU A 28 -4.785 3.300 18.037 1.00 0.00 O ATOM 440 CB GLU A 28 -6.647 1.562 15.904 1.00 0.00 C ATOM 441 CG GLU A 28 -7.594 1.847 14.737 1.00 0.00 C ATOM 442 CD GLU A 28 -8.944 1.145 14.901 1.00 0.00 C ATOM 443 OE1 GLU A 28 -9.052 0.007 14.396 1.00 0.00 O ATOM 444 OE2 GLU A 28 -9.868 1.814 15.412 1.00 0.00 O ATOM 0 H GLU A 28 -4.728 1.146 14.382 1.00 0.00 H new ATOM 0 HA GLU A 28 -5.685 3.485 15.701 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -6.344 0.515 15.873 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.179 1.712 16.843 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -7.753 2.922 14.655 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -7.129 1.522 13.806 1.00 0.00 H new ATOM 451 N LYS A 29 -3.929 1.302 17.446 1.00 0.00 N ATOM 452 CA LYS A 29 -3.172 1.106 18.691 1.00 0.00 C ATOM 453 C LYS A 29 -2.128 2.206 18.891 1.00 0.00 C ATOM 454 O LYS A 29 -2.002 2.752 19.986 1.00 0.00 O ATOM 455 CB LYS A 29 -2.517 -0.277 18.689 1.00 0.00 C ATOM 456 CG LYS A 29 -1.793 -0.509 20.017 1.00 0.00 C ATOM 457 CD LYS A 29 -1.128 -1.881 20.142 1.00 0.00 C ATOM 458 CE LYS A 29 -0.245 -1.960 21.389 1.00 0.00 C ATOM 459 NZ LYS A 29 -1.020 -1.720 22.615 1.00 0.00 N ATOM 0 H LYS A 29 -3.801 0.558 16.760 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.867 1.166 19.528 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.273 -1.047 18.537 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.812 -0.354 17.861 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -1.033 0.262 20.142 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.507 -0.389 20.832 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -1.893 -2.656 20.186 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.526 -2.078 19.255 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.225 -2.942 21.441 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.557 -1.226 21.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.430 -1.930 23.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.321 -0.725 22.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.858 -2.335 22.622 1.00 0.00 H new ATOM 473 N TYR A 30 -1.315 2.421 17.861 1.00 0.00 N ATOM 474 CA TYR A 30 -0.207 3.387 17.896 1.00 0.00 C ATOM 475 C TYR A 30 -0.616 4.784 17.424 1.00 0.00 C ATOM 476 O TYR A 30 0.244 5.571 17.031 1.00 0.00 O ATOM 477 CB TYR A 30 0.962 2.835 17.079 1.00 0.00 C ATOM 478 CG TYR A 30 1.565 1.562 17.678 1.00 0.00 C ATOM 479 CD1 TYR A 30 2.206 1.604 18.911 1.00 0.00 C ATOM 480 CD2 TYR A 30 1.395 0.362 16.997 1.00 0.00 C ATOM 481 CE1 TYR A 30 2.647 0.422 19.496 1.00 0.00 C ATOM 482 CE2 TYR A 30 1.829 -0.824 17.577 1.00 0.00 C ATOM 483 CZ TYR A 30 2.453 -0.776 18.818 1.00 0.00 C ATOM 484 OH TYR A 30 2.803 -1.940 19.429 1.00 0.00 O ATOM 0 H TYR A 30 -1.402 1.930 16.971 1.00 0.00 H new ATOM 0 HA TYR A 30 0.100 3.513 18.934 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.622 2.626 16.065 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.738 3.597 17.005 1.00 0.00 H new ATOM 0 HD1 TYR A 30 2.360 2.549 19.411 1.00 0.00 H new ATOM 0 HD2 TYR A 30 0.928 0.351 16.023 1.00 0.00 H new ATOM 0 HE1 TYR A 30 3.132 0.435 20.461 1.00 0.00 H new ATOM 0 HE2 TYR A 30 1.684 -1.767 17.072 1.00 0.00 H new ATOM 0 HH TYR A 30 2.608 -2.694 18.834 1.00 0.00 H new ATOM 494 N GLU A 31 -1.911 5.073 17.514 1.00 0.00 N ATOM 495 CA GLU A 31 -2.571 6.328 17.125 1.00 0.00 C ATOM 496 C GLU A 31 -1.894 7.089 15.984 1.00 0.00 C ATOM 497 O GLU A 31 -1.463 8.238 16.064 1.00 0.00 O ATOM 498 CB GLU A 31 -2.871 7.195 18.350 1.00 0.00 C ATOM 499 CG GLU A 31 -1.665 7.476 19.248 1.00 0.00 C ATOM 500 CD GLU A 31 -2.015 8.416 20.403 1.00 0.00 C ATOM 501 OE1 GLU A 31 -2.472 7.896 21.444 1.00 0.00 O ATOM 502 OE2 GLU A 31 -1.789 9.634 20.239 1.00 0.00 O ATOM 0 H GLU A 31 -2.577 4.395 17.885 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.526 6.039 16.687 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -3.284 8.146 18.012 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.642 6.705 18.944 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.285 6.536 19.648 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.865 7.916 18.653 1.00 0.00 H new ATOM 509 N VAL A 32 -1.892 6.400 14.846 1.00 0.00 N ATOM 510 CA VAL A 32 -1.321 6.873 13.576 1.00 0.00 C ATOM 511 C VAL A 32 -2.495 7.317 12.701 1.00 0.00 C ATOM 512 O VAL A 32 -3.248 6.472 12.220 1.00 0.00 O ATOM 513 CB VAL A 32 -0.502 5.775 12.895 1.00 0.00 C ATOM 514 CG1 VAL A 32 0.247 6.314 11.675 1.00 0.00 C ATOM 515 CG2 VAL A 32 0.528 5.119 13.816 1.00 0.00 C ATOM 0 H VAL A 32 -2.299 5.467 14.774 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.634 7.702 13.746 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.237 5.025 12.603 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.819 5.509 11.214 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -0.469 6.709 10.954 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.925 7.109 11.986 1.00 0.00 H new ATOM 0 HG21 VAL A 32 1.071 4.351 13.266 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.229 5.873 14.173 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.019 4.665 14.666 1.00 0.00 H new ATOM 525 N PRO A 33 -2.667 8.617 12.477 1.00 0.00 N ATOM 526 CA PRO A 33 -3.780 9.134 11.668 1.00 0.00 C ATOM 527 C PRO A 33 -3.570 8.912 10.169 1.00 0.00 C ATOM 528 O PRO A 33 -3.076 9.755 9.422 1.00 0.00 O ATOM 529 CB PRO A 33 -3.891 10.609 12.059 1.00 0.00 C ATOM 530 CG PRO A 33 -2.465 10.990 12.462 1.00 0.00 C ATOM 531 CD PRO A 33 -1.917 9.715 13.105 1.00 0.00 C ATOM 0 HA PRO A 33 -4.712 8.604 11.865 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -4.247 11.217 11.228 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -4.591 10.753 12.882 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -1.871 11.290 11.598 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -2.456 11.827 13.161 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.846 9.613 12.928 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -2.062 9.724 14.185 1.00 0.00 H new ATOM 539 N VAL A 34 -4.047 7.750 9.731 1.00 0.00 N ATOM 540 CA VAL A 34 -3.914 7.256 8.353 1.00 0.00 C ATOM 541 C VAL A 34 -5.135 6.460 7.888 1.00 0.00 C ATOM 542 O VAL A 34 -5.896 5.905 8.679 1.00 0.00 O ATOM 543 CB VAL A 34 -2.653 6.417 8.137 1.00 0.00 C ATOM 544 CG1 VAL A 34 -1.387 7.276 8.173 1.00 0.00 C ATOM 545 CG2 VAL A 34 -2.507 5.272 9.142 1.00 0.00 C ATOM 0 H VAL A 34 -4.552 7.104 10.338 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.835 8.158 7.747 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.772 5.980 7.145 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.513 6.643 8.016 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.436 8.029 7.387 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.309 7.768 9.142 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.592 4.718 8.932 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.461 5.678 10.152 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -3.364 4.603 9.059 1.00 0.00 H new ATOM 555 N ILE A 35 -5.353 6.537 6.578 1.00 0.00 N ATOM 556 CA ILE A 35 -6.406 5.813 5.851 1.00 0.00 C ATOM 557 C ILE A 35 -5.734 4.756 4.973 1.00 0.00 C ATOM 558 O ILE A 35 -5.086 5.067 3.975 1.00 0.00 O ATOM 559 CB ILE A 35 -7.283 6.792 5.068 1.00 0.00 C ATOM 560 CG1 ILE A 35 -8.008 7.730 6.035 1.00 0.00 C ATOM 561 CG2 ILE A 35 -8.298 6.057 4.190 1.00 0.00 C ATOM 562 CD1 ILE A 35 -8.681 8.948 5.398 1.00 0.00 C ATOM 0 H ILE A 35 -4.785 7.124 5.967 1.00 0.00 H new ATOM 0 HA ILE A 35 -7.081 5.301 6.537 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.635 7.375 4.413 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -8.766 7.157 6.569 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -7.292 8.081 6.778 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.904 6.783 3.648 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.771 5.422 3.478 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -8.943 5.442 4.817 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.164 9.543 6.173 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.931 9.554 4.890 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -9.428 8.615 4.677 1.00 0.00 H new ATOM 574 N ILE A 36 -5.879 3.510 5.417 1.00 0.00 N ATOM 575 CA ILE A 36 -5.259 2.351 4.758 1.00 0.00 C ATOM 576 C ILE A 36 -6.356 1.490 4.128 1.00 0.00 C ATOM 577 O ILE A 36 -7.197 0.932 4.830 1.00 0.00 O ATOM 578 CB ILE A 36 -4.417 1.531 5.737 1.00 0.00 C ATOM 579 CG1 ILE A 36 -3.448 2.412 6.528 1.00 0.00 C ATOM 580 CG2 ILE A 36 -3.635 0.454 4.982 1.00 0.00 C ATOM 581 CD1 ILE A 36 -3.038 1.798 7.868 1.00 0.00 C ATOM 0 H ILE A 36 -6.428 3.270 6.242 1.00 0.00 H new ATOM 0 HA ILE A 36 -4.583 2.708 3.981 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.100 1.062 6.446 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.555 2.590 5.928 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.911 3.383 6.706 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.039 -0.124 5.688 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.332 -0.208 4.467 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.977 0.926 4.252 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.350 2.470 8.381 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -3.924 1.645 8.484 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -2.547 0.840 7.694 1.00 0.00 H new ATOM 593 N GLU A 37 -6.354 1.467 2.798 1.00 0.00 N ATOM 594 CA GLU A 37 -7.348 0.766 1.973 1.00 0.00 C ATOM 595 C GLU A 37 -6.693 -0.031 0.843 1.00 0.00 C ATOM 596 O GLU A 37 -5.611 0.305 0.365 1.00 0.00 O ATOM 597 CB GLU A 37 -8.330 1.753 1.337 1.00 0.00 C ATOM 598 CG GLU A 37 -9.154 2.566 2.336 1.00 0.00 C ATOM 599 CD GLU A 37 -10.166 3.459 1.614 1.00 0.00 C ATOM 600 OE1 GLU A 37 -9.731 4.374 0.882 1.00 0.00 O ATOM 601 OE2 GLU A 37 -11.373 3.208 1.818 1.00 0.00 O ATOM 0 H GLU A 37 -5.644 1.947 2.244 1.00 0.00 H new ATOM 0 HA GLU A 37 -7.872 0.086 2.644 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -7.772 2.441 0.701 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.011 1.201 0.689 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.677 1.892 3.015 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -8.491 3.180 2.945 1.00 0.00 H new ATOM 608 N ALA A 38 -7.385 -1.097 0.451 1.00 0.00 N ATOM 609 CA ALA A 38 -6.962 -1.968 -0.655 1.00 0.00 C ATOM 610 C ALA A 38 -7.981 -2.007 -1.796 1.00 0.00 C ATOM 611 O ALA A 38 -9.188 -2.024 -1.558 1.00 0.00 O ATOM 612 CB ALA A 38 -6.721 -3.391 -0.149 1.00 0.00 C ATOM 0 H ALA A 38 -8.259 -1.387 0.890 1.00 0.00 H new ATOM 0 HA ALA A 38 -6.037 -1.546 -1.047 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -6.408 -4.024 -0.979 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -5.941 -3.379 0.612 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -7.642 -3.785 0.281 1.00 0.00 H new ATOM 618 N PHE A 39 -7.449 -1.950 -3.014 1.00 0.00 N ATOM 619 CA PHE A 39 -8.220 -1.942 -4.265 1.00 0.00 C ATOM 620 C PHE A 39 -7.521 -2.708 -5.390 1.00 0.00 C ATOM 621 O PHE A 39 -6.299 -2.842 -5.349 1.00 0.00 O ATOM 622 CB PHE A 39 -8.453 -0.497 -4.710 1.00 0.00 C ATOM 623 CG PHE A 39 -9.319 0.319 -3.748 1.00 0.00 C ATOM 624 CD1 PHE A 39 -10.687 0.082 -3.675 1.00 0.00 C ATOM 625 CD2 PHE A 39 -8.728 1.291 -2.950 1.00 0.00 C ATOM 626 CE1 PHE A 39 -11.463 0.773 -2.752 1.00 0.00 C ATOM 627 CE2 PHE A 39 -9.503 1.999 -2.040 1.00 0.00 C ATOM 628 CZ PHE A 39 -10.865 1.735 -1.947 1.00 0.00 C ATOM 0 H PHE A 39 -6.442 -1.907 -3.168 1.00 0.00 H new ATOM 0 HA PHE A 39 -9.167 -2.443 -4.065 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -7.488 -0.002 -4.823 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -8.925 -0.502 -5.692 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -11.146 -0.639 -4.335 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -7.671 1.495 -3.037 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.519 0.565 -2.661 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -9.051 2.750 -1.409 1.00 0.00 H new ATOM 0 HZ PHE A 39 -11.467 2.285 -1.239 1.00 0.00 H new ATOM 638 N PRO A 40 -8.257 -3.228 -6.368 1.00 0.00 N ATOM 639 CA PRO A 40 -7.661 -3.780 -7.594 1.00 0.00 C ATOM 640 C PRO A 40 -6.895 -2.729 -8.401 1.00 0.00 C ATOM 641 O PRO A 40 -7.206 -1.539 -8.369 1.00 0.00 O ATOM 642 CB PRO A 40 -8.799 -4.402 -8.405 1.00 0.00 C ATOM 643 CG PRO A 40 -10.083 -3.905 -7.739 1.00 0.00 C ATOM 644 CD PRO A 40 -9.684 -3.573 -6.300 1.00 0.00 C ATOM 0 HA PRO A 40 -6.916 -4.533 -7.337 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -8.752 -4.094 -9.450 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.744 -5.491 -8.391 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -10.478 -3.027 -8.251 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -10.862 -4.667 -7.766 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -10.272 -2.743 -5.910 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -9.853 -4.422 -5.638 1.00 0.00 H new ATOM 652 N GLU A 41 -5.905 -3.226 -9.136 1.00 0.00 N ATOM 653 CA GLU A 41 -4.927 -2.447 -9.910 1.00 0.00 C ATOM 654 C GLU A 41 -5.535 -1.511 -10.957 1.00 0.00 C ATOM 655 O GLU A 41 -4.976 -0.457 -11.257 1.00 0.00 O ATOM 656 CB GLU A 41 -3.905 -3.390 -10.548 1.00 0.00 C ATOM 657 CG GLU A 41 -4.303 -4.081 -11.853 1.00 0.00 C ATOM 658 CD GLU A 41 -5.332 -5.209 -11.753 1.00 0.00 C ATOM 659 OE1 GLU A 41 -6.525 -4.890 -11.560 1.00 0.00 O ATOM 660 OE2 GLU A 41 -4.898 -6.360 -11.979 1.00 0.00 O ATOM 0 H GLU A 41 -5.750 -4.231 -9.216 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.438 -1.784 -9.197 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.993 -2.823 -10.732 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.659 -4.162 -9.819 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.695 -3.324 -12.532 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.401 -4.485 -12.312 1.00 0.00 H new ATOM 667 N THR A 42 -6.756 -1.823 -11.381 1.00 0.00 N ATOM 668 CA THR A 42 -7.568 -1.030 -12.316 1.00 0.00 C ATOM 669 C THR A 42 -7.841 0.397 -11.836 1.00 0.00 C ATOM 670 O THR A 42 -7.799 1.343 -12.621 1.00 0.00 O ATOM 671 CB THR A 42 -8.917 -1.713 -12.552 1.00 0.00 C ATOM 672 OG1 THR A 42 -9.540 -1.981 -11.293 1.00 0.00 O ATOM 673 CG2 THR A 42 -8.776 -2.991 -13.381 1.00 0.00 C ATOM 0 H THR A 42 -7.233 -2.671 -11.073 1.00 0.00 H new ATOM 0 HA THR A 42 -6.982 -0.969 -13.233 1.00 0.00 H new ATOM 0 HB THR A 42 -9.548 -1.037 -13.130 1.00 0.00 H new ATOM 0 HG1 THR A 42 -10.405 -2.417 -11.442 1.00 0.00 H new ATOM 0 HG21 THR A 42 -9.758 -3.442 -13.524 1.00 0.00 H new ATOM 0 HG22 THR A 42 -8.343 -2.749 -14.352 1.00 0.00 H new ATOM 0 HG23 THR A 42 -8.126 -3.693 -12.859 1.00 0.00 H new ATOM 681 N LEU A 43 -7.894 0.551 -10.516 1.00 0.00 N ATOM 682 CA LEU A 43 -8.201 1.826 -9.853 1.00 0.00 C ATOM 683 C LEU A 43 -6.965 2.571 -9.346 1.00 0.00 C ATOM 684 O LEU A 43 -7.049 3.499 -8.544 1.00 0.00 O ATOM 685 CB LEU A 43 -9.173 1.544 -8.706 1.00 0.00 C ATOM 686 CG LEU A 43 -10.511 0.986 -9.197 1.00 0.00 C ATOM 687 CD1 LEU A 43 -11.274 0.349 -8.033 1.00 0.00 C ATOM 688 CD2 LEU A 43 -11.383 2.072 -9.831 1.00 0.00 C ATOM 0 H LEU A 43 -7.723 -0.214 -9.863 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.649 2.489 -10.593 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.718 0.834 -8.015 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.349 2.464 -8.148 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.290 0.236 -9.957 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.224 -0.045 -8.393 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.682 -0.463 -7.610 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.460 1.100 -7.265 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -12.323 1.634 -10.166 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -11.587 2.850 -9.096 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -10.861 2.506 -10.684 1.00 0.00 H new ATOM 700 N ALA A 44 -5.819 2.221 -9.923 1.00 0.00 N ATOM 701 CA ALA A 44 -4.519 2.827 -9.600 1.00 0.00 C ATOM 702 C ALA A 44 -4.387 4.266 -10.102 1.00 0.00 C ATOM 703 O ALA A 44 -4.050 5.155 -9.322 1.00 0.00 O ATOM 704 CB ALA A 44 -3.374 1.978 -10.157 1.00 0.00 C ATOM 0 H ALA A 44 -5.760 1.498 -10.640 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.460 2.858 -8.512 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.421 2.444 -9.907 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.416 0.980 -9.721 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.469 1.905 -11.240 1.00 0.00 H new ATOM 710 N GLY A 45 -4.797 4.494 -11.347 1.00 0.00 N ATOM 711 CA GLY A 45 -4.821 5.826 -11.968 1.00 0.00 C ATOM 712 C GLY A 45 -5.919 6.742 -11.424 1.00 0.00 C ATOM 713 O GLY A 45 -5.796 7.962 -11.530 1.00 0.00 O ATOM 0 H GLY A 45 -5.127 3.753 -11.965 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.854 6.305 -11.816 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -4.955 5.713 -13.044 1.00 0.00 H new ATOM 717 N GLU A 46 -6.882 6.135 -10.736 1.00 0.00 N ATOM 718 CA GLU A 46 -8.069 6.850 -10.247 1.00 0.00 C ATOM 719 C GLU A 46 -7.942 7.284 -8.785 1.00 0.00 C ATOM 720 O GLU A 46 -7.832 8.470 -8.478 1.00 0.00 O ATOM 721 CB GLU A 46 -9.266 5.919 -10.453 1.00 0.00 C ATOM 722 CG GLU A 46 -10.543 6.654 -10.864 1.00 0.00 C ATOM 723 CD GLU A 46 -11.666 5.649 -11.126 1.00 0.00 C ATOM 724 OE1 GLU A 46 -11.713 5.142 -12.268 1.00 0.00 O ATOM 725 OE2 GLU A 46 -12.405 5.359 -10.161 1.00 0.00 O ATOM 0 H GLU A 46 -6.868 5.143 -10.501 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.193 7.778 -10.805 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -9.017 5.183 -11.217 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -9.453 5.370 -9.530 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.841 7.348 -10.078 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.358 7.247 -11.760 1.00 0.00 H new ATOM 732 N LYS A 47 -7.722 6.303 -7.914 1.00 0.00 N ATOM 733 CA LYS A 47 -7.594 6.511 -6.464 1.00 0.00 C ATOM 734 C LYS A 47 -6.186 6.891 -6.000 1.00 0.00 C ATOM 735 O LYS A 47 -6.040 7.705 -5.090 1.00 0.00 O ATOM 736 CB LYS A 47 -8.080 5.263 -5.724 1.00 0.00 C ATOM 737 CG LYS A 47 -9.609 5.206 -5.728 1.00 0.00 C ATOM 738 CD LYS A 47 -10.103 3.814 -5.326 1.00 0.00 C ATOM 739 CE LYS A 47 -11.617 3.801 -5.102 1.00 0.00 C ATOM 740 NZ LYS A 47 -11.941 4.444 -3.821 1.00 0.00 N ATOM 0 H LYS A 47 -7.625 5.327 -8.193 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.219 7.371 -6.222 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.675 4.369 -6.199 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.712 5.274 -4.698 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -10.007 5.951 -5.039 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.984 5.457 -6.720 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -9.843 3.096 -6.103 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.596 3.496 -4.415 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -12.118 4.323 -5.917 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.985 2.775 -5.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -12.963 4.371 -3.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -11.423 3.970 -3.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -11.667 5.447 -3.857 1.00 0.00 H new ATOM 754 N GLY A 48 -5.183 6.456 -6.757 1.00 0.00 N ATOM 755 CA GLY A 48 -3.769 6.777 -6.516 1.00 0.00 C ATOM 756 C GLY A 48 -3.445 8.268 -6.628 1.00 0.00 C ATOM 757 O GLY A 48 -2.452 8.739 -6.074 1.00 0.00 O ATOM 0 H GLY A 48 -5.327 5.859 -7.572 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -3.492 6.429 -5.521 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -3.155 6.227 -7.229 1.00 0.00 H new ATOM 761 N GLN A 49 -4.361 9.017 -7.235 1.00 0.00 N ATOM 762 CA GLN A 49 -4.297 10.480 -7.363 1.00 0.00 C ATOM 763 C GLN A 49 -4.272 11.223 -6.026 1.00 0.00 C ATOM 764 O GLN A 49 -3.687 12.299 -5.918 1.00 0.00 O ATOM 765 CB GLN A 49 -5.496 10.999 -8.160 1.00 0.00 C ATOM 766 CG GLN A 49 -5.450 10.580 -9.630 1.00 0.00 C ATOM 767 CD GLN A 49 -4.302 11.192 -10.435 1.00 0.00 C ATOM 768 OE1 GLN A 49 -3.794 12.285 -10.188 1.00 0.00 O ATOM 769 NE2 GLN A 49 -3.902 10.495 -11.495 1.00 0.00 N ATOM 0 H GLN A 49 -5.195 8.617 -7.666 1.00 0.00 H new ATOM 0 HA GLN A 49 -3.355 10.678 -7.875 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -6.416 10.628 -7.709 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -5.526 12.087 -8.097 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -5.373 9.494 -9.682 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -6.393 10.855 -10.102 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.324 9.589 -11.699 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -3.173 10.867 -12.104 1.00 0.00 H new ATOM 778 N ASN A 50 -4.848 10.599 -5.002 1.00 0.00 N ATOM 779 CA ASN A 50 -4.904 11.161 -3.645 1.00 0.00 C ATOM 780 C ASN A 50 -4.160 10.315 -2.610 1.00 0.00 C ATOM 781 O ASN A 50 -4.407 10.415 -1.409 1.00 0.00 O ATOM 782 CB ASN A 50 -6.371 11.332 -3.242 1.00 0.00 C ATOM 783 CG ASN A 50 -7.094 12.324 -4.155 1.00 0.00 C ATOM 784 OD1 ASN A 50 -6.807 13.519 -4.188 1.00 0.00 O ATOM 785 ND2 ASN A 50 -8.040 11.849 -4.960 1.00 0.00 N ATOM 0 H ASN A 50 -5.293 9.685 -5.085 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.396 12.125 -3.664 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.875 10.366 -3.282 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -6.427 11.679 -2.210 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -8.525 12.476 -5.602 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -8.281 10.858 -4.935 1.00 0.00 H new ATOM 792 N ALA A 51 -3.193 9.540 -3.093 1.00 0.00 N ATOM 793 CA ALA A 51 -2.313 8.742 -2.227 1.00 0.00 C ATOM 794 C ALA A 51 -1.008 9.481 -1.924 1.00 0.00 C ATOM 795 O ALA A 51 -0.447 10.162 -2.781 1.00 0.00 O ATOM 796 CB ALA A 51 -1.989 7.401 -2.889 1.00 0.00 C ATOM 0 H ALA A 51 -2.993 9.444 -4.089 1.00 0.00 H new ATOM 0 HA ALA A 51 -2.843 8.572 -1.290 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.337 6.821 -2.236 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.912 6.849 -3.063 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.487 7.577 -3.840 1.00 0.00 H new ATOM 802 N ASP A 52 -0.615 9.367 -0.658 1.00 0.00 N ATOM 803 CA ASP A 52 0.683 9.835 -0.152 1.00 0.00 C ATOM 804 C ASP A 52 1.760 8.758 -0.301 1.00 0.00 C ATOM 805 O ASP A 52 2.946 9.080 -0.253 1.00 0.00 O ATOM 806 CB ASP A 52 0.593 10.297 1.304 1.00 0.00 C ATOM 807 CG ASP A 52 -0.245 11.565 1.475 1.00 0.00 C ATOM 808 OD1 ASP A 52 0.352 12.663 1.424 1.00 0.00 O ATOM 809 OD2 ASP A 52 -1.440 11.398 1.802 1.00 0.00 O ATOM 0 H ASP A 52 -1.197 8.940 0.062 1.00 0.00 H new ATOM 0 HA ASP A 52 0.967 10.694 -0.760 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.162 9.498 1.907 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.598 10.477 1.686 1.00 0.00 H new ATOM 814 N VAL A 53 1.340 7.498 -0.379 1.00 0.00 N ATOM 815 CA VAL A 53 2.142 6.397 -0.930 1.00 0.00 C ATOM 816 C VAL A 53 1.215 5.306 -1.471 1.00 0.00 C ATOM 817 O VAL A 53 0.161 5.000 -0.915 1.00 0.00 O ATOM 818 CB VAL A 53 3.164 5.867 0.078 1.00 0.00 C ATOM 819 CG1 VAL A 53 2.523 5.190 1.291 1.00 0.00 C ATOM 820 CG2 VAL A 53 4.168 4.936 -0.606 1.00 0.00 C ATOM 0 H VAL A 53 0.418 7.203 -0.057 1.00 0.00 H new ATOM 0 HA VAL A 53 2.734 6.776 -1.763 1.00 0.00 H new ATOM 0 HB VAL A 53 3.696 6.737 0.464 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.303 4.837 1.965 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.888 5.905 1.813 1.00 0.00 H new ATOM 0 HG13 VAL A 53 1.921 4.344 0.960 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.885 4.571 0.129 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.639 4.091 -1.047 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.696 5.482 -1.388 1.00 0.00 H new ATOM 830 N VAL A 54 1.578 4.877 -2.676 1.00 0.00 N ATOM 831 CA VAL A 54 0.977 3.728 -3.370 1.00 0.00 C ATOM 832 C VAL A 54 1.906 2.540 -3.115 1.00 0.00 C ATOM 833 O VAL A 54 3.095 2.565 -3.427 1.00 0.00 O ATOM 834 CB VAL A 54 0.862 4.026 -4.866 1.00 0.00 C ATOM 835 CG1 VAL A 54 0.307 2.841 -5.660 1.00 0.00 C ATOM 836 CG2 VAL A 54 -0.048 5.227 -5.130 1.00 0.00 C ATOM 0 H VAL A 54 2.317 5.326 -3.216 1.00 0.00 H new ATOM 0 HA VAL A 54 -0.029 3.515 -3.007 1.00 0.00 H new ATOM 0 HB VAL A 54 1.879 4.238 -5.196 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.246 3.107 -6.715 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.966 1.981 -5.540 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -0.687 2.590 -5.291 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.107 5.410 -6.203 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.045 5.020 -4.742 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.359 6.108 -4.633 1.00 0.00 H new ATOM 846 N LEU A 55 1.321 1.536 -2.467 1.00 0.00 N ATOM 847 CA LEU A 55 2.017 0.273 -2.181 1.00 0.00 C ATOM 848 C LEU A 55 1.496 -0.858 -3.070 1.00 0.00 C ATOM 849 O LEU A 55 0.301 -0.988 -3.333 1.00 0.00 O ATOM 850 CB LEU A 55 1.882 -0.098 -0.703 1.00 0.00 C ATOM 851 CG LEU A 55 2.721 0.805 0.203 1.00 0.00 C ATOM 852 CD1 LEU A 55 2.295 0.577 1.655 1.00 0.00 C ATOM 853 CD2 LEU A 55 4.222 0.538 0.076 1.00 0.00 C ATOM 0 H LEU A 55 0.360 1.568 -2.126 1.00 0.00 H new ATOM 0 HA LEU A 55 3.074 0.417 -2.404 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.835 -0.031 -0.409 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.188 -1.135 -0.562 1.00 0.00 H new ATOM 0 HG LEU A 55 2.547 1.836 -0.106 1.00 0.00 H new ATOM 0 HD11 LEU A 55 2.886 1.215 2.312 1.00 0.00 H new ATOM 0 HD12 LEU A 55 1.238 0.820 1.767 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.457 -0.467 1.922 1.00 0.00 H new ATOM 0 HD21 LEU A 55 4.768 1.207 0.741 1.00 0.00 H new ATOM 0 HD22 LEU A 55 4.432 -0.496 0.349 1.00 0.00 H new ATOM 0 HD23 LEU A 55 4.537 0.713 -0.953 1.00 0.00 H new ATOM 865 N LEU A 56 2.473 -1.584 -3.605 1.00 0.00 N ATOM 866 CA LEU A 56 2.234 -2.698 -4.534 1.00 0.00 C ATOM 867 C LEU A 56 2.616 -4.043 -3.913 1.00 0.00 C ATOM 868 O LEU A 56 3.604 -4.168 -3.191 1.00 0.00 O ATOM 869 CB LEU A 56 3.070 -2.542 -5.806 1.00 0.00 C ATOM 870 CG LEU A 56 2.887 -1.204 -6.524 1.00 0.00 C ATOM 871 CD1 LEU A 56 3.892 -1.102 -7.673 1.00 0.00 C ATOM 872 CD2 LEU A 56 1.475 -1.028 -7.087 1.00 0.00 C ATOM 0 H LEU A 56 3.460 -1.420 -3.409 1.00 0.00 H new ATOM 0 HA LEU A 56 1.169 -2.676 -4.764 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.123 -2.662 -5.551 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.815 -3.348 -6.495 1.00 0.00 H new ATOM 0 HG LEU A 56 3.053 -0.418 -5.787 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.763 -0.149 -8.186 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.905 -1.167 -7.277 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.725 -1.918 -8.376 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.400 -0.062 -7.586 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.267 -1.823 -7.803 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.751 -1.073 -6.274 1.00 0.00 H new ATOM 884 N GLY A 57 1.764 -5.020 -4.211 1.00 0.00 N ATOM 885 CA GLY A 57 2.033 -6.440 -3.941 1.00 0.00 C ATOM 886 C GLY A 57 3.230 -6.922 -4.764 1.00 0.00 C ATOM 887 O GLY A 57 3.337 -6.534 -5.926 1.00 0.00 O ATOM 0 H GLY A 57 0.859 -4.853 -4.650 1.00 0.00 H new ATOM 0 HA2 GLY A 57 2.232 -6.583 -2.879 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.153 -7.036 -4.184 1.00 0.00 H new ATOM 891 N PRO A 58 4.062 -7.816 -4.236 1.00 0.00 N ATOM 892 CA PRO A 58 5.225 -8.335 -4.970 1.00 0.00 C ATOM 893 C PRO A 58 4.878 -9.034 -6.286 1.00 0.00 C ATOM 894 O PRO A 58 5.640 -8.982 -7.250 1.00 0.00 O ATOM 895 CB PRO A 58 5.943 -9.278 -4.003 1.00 0.00 C ATOM 896 CG PRO A 58 4.892 -9.619 -2.945 1.00 0.00 C ATOM 897 CD PRO A 58 4.034 -8.355 -2.868 1.00 0.00 C ATOM 0 HA PRO A 58 5.858 -7.504 -5.283 1.00 0.00 H new ATOM 0 HB2 PRO A 58 6.298 -10.174 -4.513 1.00 0.00 H new ATOM 0 HB3 PRO A 58 6.815 -8.799 -3.556 1.00 0.00 H new ATOM 0 HG2 PRO A 58 4.300 -10.488 -3.233 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.351 -9.851 -1.984 1.00 0.00 H new ATOM 0 HD2 PRO A 58 3.016 -8.583 -2.551 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.439 -7.642 -2.150 1.00 0.00 H new ATOM 905 N GLN A 59 3.666 -9.578 -6.359 1.00 0.00 N ATOM 906 CA GLN A 59 3.096 -10.195 -7.565 1.00 0.00 C ATOM 907 C GLN A 59 2.870 -9.228 -8.729 1.00 0.00 C ATOM 908 O GLN A 59 3.064 -9.610 -9.882 1.00 0.00 O ATOM 909 CB GLN A 59 1.801 -10.952 -7.261 1.00 0.00 C ATOM 910 CG GLN A 59 0.754 -10.190 -6.447 1.00 0.00 C ATOM 911 CD GLN A 59 0.873 -10.421 -4.939 1.00 0.00 C ATOM 912 OE1 GLN A 59 1.938 -10.645 -4.367 1.00 0.00 O ATOM 913 NE2 GLN A 59 -0.239 -10.211 -4.239 1.00 0.00 N ATOM 0 H GLN A 59 3.031 -9.605 -5.561 1.00 0.00 H new ATOM 0 HA GLN A 59 3.862 -10.899 -7.891 1.00 0.00 H new ATOM 0 HB2 GLN A 59 1.349 -11.253 -8.206 1.00 0.00 H new ATOM 0 HB3 GLN A 59 2.055 -11.866 -6.724 1.00 0.00 H new ATOM 0 HG2 GLN A 59 0.850 -9.124 -6.653 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.241 -10.490 -6.776 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.118 -10.026 -4.722 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -0.212 -10.235 -3.220 1.00 0.00 H new ATOM 922 N ILE A 60 2.631 -7.957 -8.418 1.00 0.00 N ATOM 923 CA ILE A 60 2.495 -6.915 -9.446 1.00 0.00 C ATOM 924 C ILE A 60 3.621 -5.883 -9.359 1.00 0.00 C ATOM 925 O ILE A 60 3.513 -4.748 -9.823 1.00 0.00 O ATOM 926 CB ILE A 60 1.122 -6.240 -9.434 1.00 0.00 C ATOM 927 CG1 ILE A 60 0.821 -5.524 -8.116 1.00 0.00 C ATOM 928 CG2 ILE A 60 0.027 -7.248 -9.791 1.00 0.00 C ATOM 929 CD1 ILE A 60 -0.059 -4.295 -8.356 1.00 0.00 C ATOM 0 H ILE A 60 2.526 -7.618 -7.462 1.00 0.00 H new ATOM 0 HA ILE A 60 2.581 -7.426 -10.405 1.00 0.00 H new ATOM 0 HB ILE A 60 1.140 -5.462 -10.198 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.320 -6.208 -7.431 1.00 0.00 H new ATOM 0 HG13 ILE A 60 1.754 -5.222 -7.639 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.943 -6.751 -9.778 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.214 -7.652 -10.786 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.029 -8.060 -9.064 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.261 -3.801 -7.406 1.00 0.00 H new ATOM 0 HD12 ILE A 60 0.456 -3.603 -9.022 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -1.000 -4.604 -8.811 1.00 0.00 H new ATOM 941 N ALA A 61 4.780 -6.345 -8.899 1.00 0.00 N ATOM 942 CA ALA A 61 5.985 -5.512 -8.781 1.00 0.00 C ATOM 943 C ALA A 61 6.606 -5.148 -10.131 1.00 0.00 C ATOM 944 O ALA A 61 7.173 -4.068 -10.290 1.00 0.00 O ATOM 945 CB ALA A 61 7.033 -6.234 -7.932 1.00 0.00 C ATOM 0 H ALA A 61 4.916 -7.309 -8.595 1.00 0.00 H new ATOM 0 HA ALA A 61 5.670 -4.582 -8.308 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.924 -5.612 -7.848 1.00 0.00 H new ATOM 0 HB2 ALA A 61 6.628 -6.424 -6.938 1.00 0.00 H new ATOM 0 HB3 ALA A 61 7.295 -7.181 -8.404 1.00 0.00 H new ATOM 951 N TYR A 62 6.417 -6.028 -11.111 1.00 0.00 N ATOM 952 CA TYR A 62 6.815 -5.772 -12.502 1.00 0.00 C ATOM 953 C TYR A 62 6.050 -4.608 -13.135 1.00 0.00 C ATOM 954 O TYR A 62 6.553 -3.958 -14.050 1.00 0.00 O ATOM 955 CB TYR A 62 6.671 -7.048 -13.334 1.00 0.00 C ATOM 956 CG TYR A 62 5.232 -7.447 -13.668 1.00 0.00 C ATOM 957 CD1 TYR A 62 4.444 -8.090 -12.720 1.00 0.00 C ATOM 958 CD2 TYR A 62 4.761 -7.177 -14.947 1.00 0.00 C ATOM 959 CE1 TYR A 62 3.140 -8.439 -13.052 1.00 0.00 C ATOM 960 CE2 TYR A 62 3.462 -7.535 -15.287 1.00 0.00 C ATOM 961 CZ TYR A 62 2.673 -8.164 -14.331 1.00 0.00 C ATOM 962 OH TYR A 62 1.403 -8.531 -14.653 1.00 0.00 O ATOM 0 H TYR A 62 5.984 -6.940 -10.968 1.00 0.00 H new ATOM 0 HA TYR A 62 7.863 -5.472 -12.489 1.00 0.00 H new ATOM 0 HB2 TYR A 62 7.221 -6.919 -14.266 1.00 0.00 H new ATOM 0 HB3 TYR A 62 7.144 -7.869 -12.795 1.00 0.00 H new ATOM 0 HD1 TYR A 62 4.839 -8.315 -11.740 1.00 0.00 H new ATOM 0 HD2 TYR A 62 5.399 -6.693 -15.671 1.00 0.00 H new ATOM 0 HE1 TYR A 62 2.499 -8.917 -12.326 1.00 0.00 H new ATOM 0 HE2 TYR A 62 3.074 -7.329 -16.273 1.00 0.00 H new ATOM 0 HH TYR A 62 0.775 -7.846 -14.340 1.00 0.00 H new ATOM 972 N MET A 63 4.877 -4.305 -12.586 1.00 0.00 N ATOM 973 CA MET A 63 4.035 -3.174 -13.003 1.00 0.00 C ATOM 974 C MET A 63 4.402 -1.848 -12.334 1.00 0.00 C ATOM 975 O MET A 63 3.780 -0.828 -12.625 1.00 0.00 O ATOM 976 CB MET A 63 2.584 -3.550 -12.692 1.00 0.00 C ATOM 977 CG MET A 63 2.037 -4.597 -13.664 1.00 0.00 C ATOM 978 SD MET A 63 0.486 -5.394 -13.109 1.00 0.00 S ATOM 979 CE MET A 63 -0.700 -4.096 -13.385 1.00 0.00 C ATOM 0 H MET A 63 4.472 -4.847 -11.823 1.00 0.00 H new ATOM 0 HA MET A 63 4.191 -3.003 -14.068 1.00 0.00 H new ATOM 0 HB2 MET A 63 2.520 -3.934 -11.674 1.00 0.00 H new ATOM 0 HB3 MET A 63 1.962 -2.656 -12.735 1.00 0.00 H new ATOM 0 HG2 MET A 63 1.864 -4.124 -14.631 1.00 0.00 H new ATOM 0 HG3 MET A 63 2.794 -5.366 -13.816 1.00 0.00 H new ATOM 0 HE1 MET A 63 -1.165 -3.820 -12.438 1.00 0.00 H new ATOM 0 HE2 MET A 63 -0.196 -3.227 -13.809 1.00 0.00 H new ATOM 0 HE3 MET A 63 -1.466 -4.445 -14.077 1.00 0.00 H new ATOM 989 N LEU A 64 5.490 -1.809 -11.570 1.00 0.00 N ATOM 990 CA LEU A 64 6.023 -0.564 -10.999 1.00 0.00 C ATOM 991 C LEU A 64 6.326 0.501 -12.055 1.00 0.00 C ATOM 992 O LEU A 64 5.678 1.542 -11.950 1.00 0.00 O ATOM 993 CB LEU A 64 7.206 -0.868 -10.077 1.00 0.00 C ATOM 994 CG LEU A 64 7.808 0.419 -9.511 1.00 0.00 C ATOM 995 CD1 LEU A 64 6.991 0.968 -8.340 1.00 0.00 C ATOM 996 CD2 LEU A 64 9.269 0.232 -9.099 1.00 0.00 C ATOM 0 H LEU A 64 6.032 -2.638 -11.326 1.00 0.00 H new ATOM 0 HA LEU A 64 5.241 -0.115 -10.387 1.00 0.00 H new ATOM 0 HB2 LEU A 64 6.878 -1.510 -9.259 1.00 0.00 H new ATOM 0 HB3 LEU A 64 7.969 -1.418 -10.628 1.00 0.00 H new ATOM 0 HG LEU A 64 7.775 1.152 -10.317 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.455 1.882 -7.970 1.00 0.00 H new ATOM 0 HD12 LEU A 64 5.977 1.186 -8.674 1.00 0.00 H new ATOM 0 HD13 LEU A 64 6.958 0.228 -7.540 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.658 1.170 -8.702 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.335 -0.541 -8.333 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.857 -0.066 -9.967 1.00 0.00 H new ATOM 1008 N PRO A 65 7.064 0.258 -13.134 1.00 0.00 N ATOM 1009 CA PRO A 65 7.298 1.284 -14.161 1.00 0.00 C ATOM 1010 C PRO A 65 6.025 1.769 -14.859 1.00 0.00 C ATOM 1011 O PRO A 65 5.907 2.953 -15.171 1.00 0.00 O ATOM 1012 CB PRO A 65 8.267 0.662 -15.168 1.00 0.00 C ATOM 1013 CG PRO A 65 8.098 -0.846 -14.971 1.00 0.00 C ATOM 1014 CD PRO A 65 7.793 -0.972 -13.477 1.00 0.00 C ATOM 0 HA PRO A 65 7.704 2.179 -13.689 1.00 0.00 H new ATOM 0 HB2 PRO A 65 8.026 0.960 -16.188 1.00 0.00 H new ATOM 0 HB3 PRO A 65 9.294 0.976 -14.979 1.00 0.00 H new ATOM 0 HG2 PRO A 65 7.288 -1.244 -15.582 1.00 0.00 H new ATOM 0 HG3 PRO A 65 9.001 -1.391 -15.245 1.00 0.00 H new ATOM 0 HD2 PRO A 65 7.193 -1.858 -13.270 1.00 0.00 H new ATOM 0 HD3 PRO A 65 8.709 -1.064 -12.893 1.00 0.00 H new ATOM 1022 N GLU A 66 5.019 0.902 -14.926 1.00 0.00 N ATOM 1023 CA GLU A 66 3.749 1.189 -15.607 1.00 0.00 C ATOM 1024 C GLU A 66 2.793 2.034 -14.762 1.00 0.00 C ATOM 1025 O GLU A 66 2.168 2.971 -15.257 1.00 0.00 O ATOM 1026 CB GLU A 66 3.126 -0.156 -15.986 1.00 0.00 C ATOM 1027 CG GLU A 66 2.050 -0.037 -17.068 1.00 0.00 C ATOM 1028 CD GLU A 66 2.284 -1.077 -18.165 1.00 0.00 C ATOM 1029 OE1 GLU A 66 1.900 -2.245 -17.944 1.00 0.00 O ATOM 1030 OE2 GLU A 66 2.797 -0.645 -19.220 1.00 0.00 O ATOM 0 H GLU A 66 5.057 -0.028 -14.508 1.00 0.00 H new ATOM 0 HA GLU A 66 3.943 1.792 -16.494 1.00 0.00 H new ATOM 0 HB2 GLU A 66 3.911 -0.827 -16.335 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.690 -0.611 -15.097 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.063 -0.179 -16.627 1.00 0.00 H new ATOM 0 HG3 GLU A 66 2.066 0.965 -17.498 1.00 0.00 H new ATOM 1037 N ILE A 67 2.782 1.760 -13.460 1.00 0.00 N ATOM 1038 CA ILE A 67 2.009 2.501 -12.453 1.00 0.00 C ATOM 1039 C ILE A 67 2.709 3.803 -12.061 1.00 0.00 C ATOM 1040 O ILE A 67 2.043 4.803 -11.794 1.00 0.00 O ATOM 1041 CB ILE A 67 1.693 1.567 -11.283 1.00 0.00 C ATOM 1042 CG1 ILE A 67 0.684 0.534 -11.789 1.00 0.00 C ATOM 1043 CG2 ILE A 67 1.156 2.311 -10.058 1.00 0.00 C ATOM 1044 CD1 ILE A 67 0.345 -0.613 -10.835 1.00 0.00 C ATOM 0 H ILE A 67 3.325 0.995 -13.059 1.00 0.00 H new ATOM 0 HA ILE A 67 1.054 2.825 -12.866 1.00 0.00 H new ATOM 0 HB ILE A 67 2.611 1.086 -10.946 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -0.241 1.054 -12.039 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.069 0.106 -12.714 1.00 0.00 H new ATOM 0 HG21 ILE A 67 0.950 1.597 -9.260 1.00 0.00 H new ATOM 0 HG22 ILE A 67 1.898 3.033 -9.716 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.237 2.834 -10.324 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.379 -1.277 -11.307 1.00 0.00 H new ATOM 0 HD12 ILE A 67 1.251 -1.172 -10.601 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -0.079 -0.209 -9.916 1.00 0.00 H new ATOM 1056 N GLN A 68 4.037 3.819 -12.132 1.00 0.00 N ATOM 1057 CA GLN A 68 4.835 5.043 -11.972 1.00 0.00 C ATOM 1058 C GLN A 68 4.610 5.989 -13.153 1.00 0.00 C ATOM 1059 O GLN A 68 4.571 7.206 -12.981 1.00 0.00 O ATOM 1060 CB GLN A 68 6.314 4.663 -11.885 1.00 0.00 C ATOM 1061 CG GLN A 68 7.178 5.813 -11.363 1.00 0.00 C ATOM 1062 CD GLN A 68 7.906 5.390 -10.086 1.00 0.00 C ATOM 1063 OE1 GLN A 68 8.874 4.630 -10.094 1.00 0.00 O ATOM 1064 NE2 GLN A 68 7.474 5.921 -8.946 1.00 0.00 N ATOM 0 H GLN A 68 4.597 2.984 -12.302 1.00 0.00 H new ATOM 0 HA GLN A 68 4.528 5.555 -11.060 1.00 0.00 H new ATOM 0 HB2 GLN A 68 6.427 3.800 -11.229 1.00 0.00 H new ATOM 0 HB3 GLN A 68 6.669 4.363 -12.871 1.00 0.00 H new ATOM 0 HG2 GLN A 68 7.902 6.107 -12.123 1.00 0.00 H new ATOM 0 HG3 GLN A 68 6.554 6.684 -11.163 1.00 0.00 H new ATOM 0 HE21 GLN A 68 6.671 6.550 -8.948 1.00 0.00 H new ATOM 0 HE22 GLN A 68 7.946 5.699 -8.069 1.00 0.00 H new ATOM 1073 N ARG A 69 4.405 5.424 -14.340 1.00 0.00 N ATOM 1074 CA ARG A 69 4.007 6.167 -15.544 1.00 0.00 C ATOM 1075 C ARG A 69 2.649 6.842 -15.340 1.00 0.00 C ATOM 1076 O ARG A 69 2.450 7.986 -15.746 1.00 0.00 O ATOM 1077 CB ARG A 69 4.043 5.141 -16.679 1.00 0.00 C ATOM 1078 CG ARG A 69 3.550 5.586 -18.057 1.00 0.00 C ATOM 1079 CD ARG A 69 2.044 5.369 -18.219 1.00 0.00 C ATOM 1080 NE ARG A 69 1.717 5.113 -19.629 1.00 0.00 N ATOM 1081 CZ ARG A 69 1.422 3.915 -20.151 1.00 0.00 C ATOM 1082 NH1 ARG A 69 1.432 2.796 -19.414 1.00 0.00 N ATOM 1083 NH2 ARG A 69 1.092 3.830 -21.447 1.00 0.00 N ATOM 0 H ARG A 69 4.511 4.422 -14.500 1.00 0.00 H new ATOM 0 HA ARG A 69 4.675 6.995 -15.782 1.00 0.00 H new ATOM 0 HB2 ARG A 69 5.071 4.796 -16.786 1.00 0.00 H new ATOM 0 HB3 ARG A 69 3.448 4.281 -16.372 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.783 6.641 -18.203 1.00 0.00 H new ATOM 0 HG3 ARG A 69 4.082 5.032 -18.830 1.00 0.00 H new ATOM 0 HD2 ARG A 69 1.722 4.528 -17.605 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.503 6.247 -17.866 1.00 0.00 H new ATOM 0 HE ARG A 69 1.714 5.913 -20.262 1.00 0.00 H new ATOM 0 HH11 ARG A 69 1.669 2.840 -18.423 1.00 0.00 H new ATOM 0 HH12 ARG A 69 1.202 1.900 -19.844 1.00 0.00 H new ATOM 0 HH21 ARG A 69 1.068 4.671 -22.023 1.00 0.00 H new ATOM 0 HH22 ARG A 69 0.865 2.924 -21.857 1.00 0.00 H new ATOM 1097 N LEU A 70 1.713 6.106 -14.746 1.00 0.00 N ATOM 1098 CA LEU A 70 0.376 6.605 -14.394 1.00 0.00 C ATOM 1099 C LEU A 70 0.412 7.683 -13.309 1.00 0.00 C ATOM 1100 O LEU A 70 -0.362 8.639 -13.338 1.00 0.00 O ATOM 1101 CB LEU A 70 -0.476 5.439 -13.890 1.00 0.00 C ATOM 1102 CG LEU A 70 -0.953 4.516 -15.014 1.00 0.00 C ATOM 1103 CD1 LEU A 70 -1.473 3.200 -14.433 1.00 0.00 C ATOM 1104 CD2 LEU A 70 -2.081 5.162 -15.821 1.00 0.00 C ATOM 0 H LEU A 70 1.859 5.130 -14.489 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.047 7.052 -15.293 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.102 4.858 -13.171 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -1.342 5.833 -13.358 1.00 0.00 H new ATOM 0 HG LEU A 70 -0.100 4.332 -15.668 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -1.809 2.552 -15.243 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.674 2.705 -13.881 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -2.307 3.403 -13.761 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -2.398 4.482 -16.612 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.924 5.372 -15.163 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.725 6.092 -16.264 1.00 0.00 H new ATOM 1116 N LEU A 71 1.251 7.445 -12.305 1.00 0.00 N ATOM 1117 CA LEU A 71 1.409 8.300 -11.119 1.00 0.00 C ATOM 1118 C LEU A 71 2.871 8.724 -10.966 1.00 0.00 C ATOM 1119 O LEU A 71 3.581 8.195 -10.111 1.00 0.00 O ATOM 1120 CB LEU A 71 0.927 7.517 -9.896 1.00 0.00 C ATOM 1121 CG LEU A 71 -0.501 6.982 -10.016 1.00 0.00 C ATOM 1122 CD1 LEU A 71 -0.725 5.843 -9.019 1.00 0.00 C ATOM 1123 CD2 LEU A 71 -1.552 8.071 -9.795 1.00 0.00 C ATOM 0 H LEU A 71 1.861 6.628 -12.288 1.00 0.00 H new ATOM 0 HA LEU A 71 0.815 9.208 -11.222 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.603 6.680 -9.725 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.989 8.161 -9.019 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.618 6.612 -11.035 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.745 5.471 -9.115 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.023 5.035 -9.226 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.566 6.210 -8.005 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.548 7.640 -9.891 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.434 8.494 -8.797 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.424 8.857 -10.539 1.00 0.00 H new ATOM 1135 N PRO A 72 3.347 9.681 -11.758 1.00 0.00 N ATOM 1136 CA PRO A 72 4.748 10.121 -11.689 1.00 0.00 C ATOM 1137 C PRO A 72 5.067 11.140 -10.593 1.00 0.00 C ATOM 1138 O PRO A 72 6.222 11.288 -10.197 1.00 0.00 O ATOM 1139 CB PRO A 72 5.049 10.688 -13.078 1.00 0.00 C ATOM 1140 CG PRO A 72 3.696 11.224 -13.550 1.00 0.00 C ATOM 1141 CD PRO A 72 2.686 10.249 -12.942 1.00 0.00 C ATOM 0 HA PRO A 72 5.377 9.274 -11.415 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.800 11.477 -13.035 1.00 0.00 H new ATOM 0 HB3 PRO A 72 5.432 9.920 -13.750 1.00 0.00 H new ATOM 0 HG2 PRO A 72 3.527 12.243 -13.204 1.00 0.00 H new ATOM 0 HG3 PRO A 72 3.630 11.242 -14.638 1.00 0.00 H new ATOM 0 HD2 PRO A 72 1.763 10.761 -12.668 1.00 0.00 H new ATOM 0 HD3 PRO A 72 2.418 9.468 -13.654 1.00 0.00 H new ATOM 1149 N ASN A 73 4.010 11.679 -9.991 1.00 0.00 N ATOM 1150 CA ASN A 73 4.148 12.637 -8.885 1.00 0.00 C ATOM 1151 C ASN A 73 3.809 12.036 -7.519 1.00 0.00 C ATOM 1152 O ASN A 73 3.517 12.750 -6.561 1.00 0.00 O ATOM 1153 CB ASN A 73 3.282 13.867 -9.167 1.00 0.00 C ATOM 1154 CG ASN A 73 3.735 14.626 -10.416 1.00 0.00 C ATOM 1155 OD1 ASN A 73 4.917 14.855 -10.665 1.00 0.00 O ATOM 1156 ND2 ASN A 73 2.795 15.044 -11.259 1.00 0.00 N ATOM 0 H ASN A 73 3.045 11.472 -10.247 1.00 0.00 H new ATOM 0 HA ASN A 73 5.198 12.924 -8.832 1.00 0.00 H new ATOM 0 HB2 ASN A 73 2.244 13.557 -9.290 1.00 0.00 H new ATOM 0 HB3 ASN A 73 3.315 14.536 -8.307 1.00 0.00 H new ATOM 0 HD21 ASN A 73 3.057 15.550 -12.105 1.00 0.00 H new ATOM 0 HD22 ASN A 73 1.812 14.858 -11.060 1.00 0.00 H new ATOM 1163 N LYS A 74 3.757 10.708 -7.465 1.00 0.00 N ATOM 1164 CA LYS A 74 3.436 9.964 -6.239 1.00 0.00 C ATOM 1165 C LYS A 74 4.519 8.917 -5.969 1.00 0.00 C ATOM 1166 O LYS A 74 5.001 8.308 -6.922 1.00 0.00 O ATOM 1167 CB LYS A 74 2.096 9.240 -6.388 1.00 0.00 C ATOM 1168 CG LYS A 74 0.889 10.131 -6.685 1.00 0.00 C ATOM 1169 CD LYS A 74 0.646 11.195 -5.612 1.00 0.00 C ATOM 1170 CE LYS A 74 -0.610 12.010 -5.923 1.00 0.00 C ATOM 1171 NZ LYS A 74 -0.724 13.089 -4.931 1.00 0.00 N ATOM 0 H LYS A 74 3.936 10.110 -8.272 1.00 0.00 H new ATOM 0 HA LYS A 74 3.381 10.675 -5.414 1.00 0.00 H new ATOM 0 HB2 LYS A 74 2.188 8.506 -7.188 1.00 0.00 H new ATOM 0 HB3 LYS A 74 1.899 8.687 -5.470 1.00 0.00 H new ATOM 0 HG2 LYS A 74 1.036 10.622 -7.647 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -0.000 9.508 -6.777 1.00 0.00 H new ATOM 0 HD2 LYS A 74 0.542 10.717 -4.638 1.00 0.00 H new ATOM 0 HD3 LYS A 74 1.509 11.859 -5.551 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.553 12.425 -6.929 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.493 11.372 -5.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -1.575 13.654 -5.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -0.795 12.678 -3.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 0.117 13.699 -4.984 1.00 0.00 H new ATOM 1185 N PRO A 75 4.946 8.754 -4.720 1.00 0.00 N ATOM 1186 CA PRO A 75 5.854 7.665 -4.333 1.00 0.00 C ATOM 1187 C PRO A 75 5.125 6.321 -4.385 1.00 0.00 C ATOM 1188 O PRO A 75 4.028 6.146 -3.856 1.00 0.00 O ATOM 1189 CB PRO A 75 6.351 8.013 -2.928 1.00 0.00 C ATOM 1190 CG PRO A 75 5.263 8.935 -2.374 1.00 0.00 C ATOM 1191 CD PRO A 75 4.733 9.682 -3.600 1.00 0.00 C ATOM 0 HA PRO A 75 6.699 7.566 -5.015 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.470 7.121 -2.313 1.00 0.00 H new ATOM 0 HB3 PRO A 75 7.320 8.511 -2.958 1.00 0.00 H new ATOM 0 HG2 PRO A 75 4.473 8.367 -1.883 1.00 0.00 H new ATOM 0 HG3 PRO A 75 5.667 9.625 -1.633 1.00 0.00 H new ATOM 0 HD2 PRO A 75 3.678 9.931 -3.487 1.00 0.00 H new ATOM 0 HD3 PRO A 75 5.267 10.619 -3.755 1.00 0.00 H new ATOM 1199 N VAL A 76 5.666 5.496 -5.277 1.00 0.00 N ATOM 1200 CA VAL A 76 5.100 4.172 -5.575 1.00 0.00 C ATOM 1201 C VAL A 76 6.188 3.144 -5.260 1.00 0.00 C ATOM 1202 O VAL A 76 7.220 3.108 -5.929 1.00 0.00 O ATOM 1203 CB VAL A 76 4.649 4.092 -7.035 1.00 0.00 C ATOM 1204 CG1 VAL A 76 3.928 2.773 -7.318 1.00 0.00 C ATOM 1205 CG2 VAL A 76 3.711 5.227 -7.452 1.00 0.00 C ATOM 0 H VAL A 76 6.504 5.719 -5.814 1.00 0.00 H new ATOM 0 HA VAL A 76 4.213 3.977 -4.972 1.00 0.00 H new ATOM 0 HB VAL A 76 5.569 4.172 -7.614 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.619 2.744 -8.363 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.601 1.940 -7.115 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.050 2.694 -6.678 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.434 5.104 -8.499 1.00 0.00 H new ATOM 0 HG22 VAL A 76 2.814 5.203 -6.834 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.217 6.184 -7.321 1.00 0.00 H new ATOM 1215 N GLU A 77 5.921 2.389 -4.198 1.00 0.00 N ATOM 1216 CA GLU A 77 6.870 1.424 -3.624 1.00 0.00 C ATOM 1217 C GLU A 77 6.230 0.043 -3.463 1.00 0.00 C ATOM 1218 O GLU A 77 5.026 -0.109 -3.266 1.00 0.00 O ATOM 1219 CB GLU A 77 7.316 1.953 -2.260 1.00 0.00 C ATOM 1220 CG GLU A 77 8.729 1.537 -1.844 1.00 0.00 C ATOM 1221 CD GLU A 77 9.805 2.201 -2.706 1.00 0.00 C ATOM 1222 OE1 GLU A 77 10.164 3.360 -2.407 1.00 0.00 O ATOM 1223 OE2 GLU A 77 10.256 1.525 -3.656 1.00 0.00 O ATOM 0 H GLU A 77 5.031 2.426 -3.702 1.00 0.00 H new ATOM 0 HA GLU A 77 7.723 1.314 -4.294 1.00 0.00 H new ATOM 0 HB2 GLU A 77 7.261 3.042 -2.272 1.00 0.00 H new ATOM 0 HB3 GLU A 77 6.612 1.607 -1.503 1.00 0.00 H new ATOM 0 HG2 GLU A 77 8.890 1.800 -0.799 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.824 0.454 -1.919 1.00 0.00 H new ATOM 1230 N VAL A 78 7.074 -0.971 -3.633 1.00 0.00 N ATOM 1231 CA VAL A 78 6.686 -2.383 -3.499 1.00 0.00 C ATOM 1232 C VAL A 78 6.945 -2.853 -2.067 1.00 0.00 C ATOM 1233 O VAL A 78 7.971 -2.545 -1.461 1.00 0.00 O ATOM 1234 CB VAL A 78 7.456 -3.235 -4.510 1.00 0.00 C ATOM 1235 CG1 VAL A 78 7.073 -4.715 -4.445 1.00 0.00 C ATOM 1236 CG2 VAL A 78 7.245 -2.766 -5.951 1.00 0.00 C ATOM 0 H VAL A 78 8.057 -0.840 -3.870 1.00 0.00 H new ATOM 0 HA VAL A 78 5.622 -2.492 -3.709 1.00 0.00 H new ATOM 0 HB VAL A 78 8.502 -3.113 -4.230 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.649 -5.273 -5.183 1.00 0.00 H new ATOM 0 HG12 VAL A 78 7.287 -5.103 -3.449 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.009 -4.825 -4.656 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.813 -3.404 -6.628 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.186 -2.824 -6.201 1.00 0.00 H new ATOM 0 HG23 VAL A 78 7.586 -1.736 -6.052 1.00 0.00 H new ATOM 1246 N ILE A 79 5.979 -3.591 -1.528 1.00 0.00 N ATOM 1247 CA ILE A 79 6.074 -4.258 -0.221 1.00 0.00 C ATOM 1248 C ILE A 79 7.067 -5.415 -0.343 1.00 0.00 C ATOM 1249 O ILE A 79 6.988 -6.221 -1.269 1.00 0.00 O ATOM 1250 CB ILE A 79 4.699 -4.771 0.213 1.00 0.00 C ATOM 1251 CG1 ILE A 79 3.687 -3.627 0.294 1.00 0.00 C ATOM 1252 CG2 ILE A 79 4.766 -5.483 1.566 1.00 0.00 C ATOM 1253 CD1 ILE A 79 2.240 -4.086 0.098 1.00 0.00 C ATOM 0 H ILE A 79 5.085 -3.749 -1.994 1.00 0.00 H new ATOM 0 HA ILE A 79 6.420 -3.554 0.535 1.00 0.00 H new ATOM 0 HB ILE A 79 4.374 -5.486 -0.543 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.778 -3.138 1.264 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.930 -2.881 -0.463 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.772 -5.834 1.842 1.00 0.00 H new ATOM 0 HG22 ILE A 79 5.444 -6.333 1.496 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.130 -4.790 2.324 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.573 -3.227 0.167 1.00 0.00 H new ATOM 0 HD12 ILE A 79 2.135 -4.549 -0.883 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.980 -4.810 0.870 1.00 0.00 H new ATOM 1265 N ASP A 80 7.958 -5.491 0.642 1.00 0.00 N ATOM 1266 CA ASP A 80 8.918 -6.596 0.782 1.00 0.00 C ATOM 1267 C ASP A 80 8.193 -7.937 0.919 1.00 0.00 C ATOM 1268 O ASP A 80 7.271 -8.115 1.714 1.00 0.00 O ATOM 1269 CB ASP A 80 9.831 -6.352 1.985 1.00 0.00 C ATOM 1270 CG ASP A 80 10.832 -7.488 2.201 1.00 0.00 C ATOM 1271 OD1 ASP A 80 11.770 -7.595 1.381 1.00 0.00 O ATOM 1272 OD2 ASP A 80 10.546 -8.338 3.072 1.00 0.00 O ATOM 0 H ASP A 80 8.039 -4.785 1.374 1.00 0.00 H new ATOM 0 HA ASP A 80 9.530 -6.636 -0.119 1.00 0.00 H new ATOM 0 HB2 ASP A 80 10.373 -5.417 1.842 1.00 0.00 H new ATOM 0 HB3 ASP A 80 9.222 -6.234 2.881 1.00 0.00 H new ATOM 1277 N SER A 81 8.616 -8.851 0.052 1.00 0.00 N ATOM 1278 CA SER A 81 8.009 -10.181 -0.106 1.00 0.00 C ATOM 1279 C SER A 81 7.959 -11.002 1.184 1.00 0.00 C ATOM 1280 O SER A 81 6.985 -11.705 1.449 1.00 0.00 O ATOM 1281 CB SER A 81 8.767 -10.980 -1.168 1.00 0.00 C ATOM 1282 OG SER A 81 8.777 -10.250 -2.398 1.00 0.00 O ATOM 0 H SER A 81 9.404 -8.692 -0.575 1.00 0.00 H new ATOM 0 HA SER A 81 6.978 -9.999 -0.408 1.00 0.00 H new ATOM 0 HB2 SER A 81 9.788 -11.168 -0.836 1.00 0.00 H new ATOM 0 HB3 SER A 81 8.295 -11.952 -1.313 1.00 0.00 H new ATOM 0 HG SER A 81 9.264 -10.761 -3.078 1.00 0.00 H new ATOM 1288 N LEU A 82 8.989 -10.868 2.014 1.00 0.00 N ATOM 1289 CA LEU A 82 9.095 -11.592 3.289 1.00 0.00 C ATOM 1290 C LEU A 82 8.242 -10.964 4.393 1.00 0.00 C ATOM 1291 O LEU A 82 7.638 -11.697 5.175 1.00 0.00 O ATOM 1292 CB LEU A 82 10.586 -11.675 3.621 1.00 0.00 C ATOM 1293 CG LEU A 82 10.880 -12.434 4.917 1.00 0.00 C ATOM 1294 CD1 LEU A 82 10.350 -13.869 4.912 1.00 0.00 C ATOM 1295 CD2 LEU A 82 12.387 -12.477 5.179 1.00 0.00 C ATOM 0 H LEU A 82 9.780 -10.253 1.826 1.00 0.00 H new ATOM 0 HA LEU A 82 8.686 -12.599 3.204 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.107 -12.163 2.797 1.00 0.00 H new ATOM 0 HB3 LEU A 82 10.989 -10.666 3.701 1.00 0.00 H new ATOM 0 HG LEU A 82 10.362 -11.888 5.705 1.00 0.00 H new ATOM 0 HD11 LEU A 82 10.592 -14.350 5.860 1.00 0.00 H new ATOM 0 HD12 LEU A 82 9.268 -13.857 4.777 1.00 0.00 H new ATOM 0 HD13 LEU A 82 10.811 -14.424 4.095 1.00 0.00 H new ATOM 0 HD21 LEU A 82 12.580 -13.020 6.104 1.00 0.00 H new ATOM 0 HD22 LEU A 82 12.886 -12.981 4.351 1.00 0.00 H new ATOM 0 HD23 LEU A 82 12.770 -11.460 5.268 1.00 0.00 H new ATOM 1307 N LEU A 83 8.132 -9.639 4.436 1.00 0.00 N ATOM 1308 CA LEU A 83 7.187 -8.936 5.315 1.00 0.00 C ATOM 1309 C LEU A 83 5.730 -9.306 5.032 1.00 0.00 C ATOM 1310 O LEU A 83 4.911 -9.410 5.944 1.00 0.00 O ATOM 1311 CB LEU A 83 7.298 -7.415 5.196 1.00 0.00 C ATOM 1312 CG LEU A 83 8.561 -6.832 5.833 1.00 0.00 C ATOM 1313 CD1 LEU A 83 8.569 -5.315 5.634 1.00 0.00 C ATOM 1314 CD2 LEU A 83 8.653 -7.134 7.330 1.00 0.00 C ATOM 0 H LEU A 83 8.697 -9.014 3.861 1.00 0.00 H new ATOM 0 HA LEU A 83 7.463 -9.256 6.320 1.00 0.00 H new ATOM 0 HB2 LEU A 83 7.275 -7.141 4.141 1.00 0.00 H new ATOM 0 HB3 LEU A 83 6.425 -6.960 5.663 1.00 0.00 H new ATOM 0 HG LEU A 83 9.418 -7.298 5.346 1.00 0.00 H new ATOM 0 HD11 LEU A 83 9.467 -4.893 6.086 1.00 0.00 H new ATOM 0 HD12 LEU A 83 8.558 -5.088 4.568 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.687 -4.881 6.106 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.567 -6.698 7.734 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.791 -6.706 7.841 1.00 0.00 H new ATOM 0 HD23 LEU A 83 8.667 -8.213 7.483 1.00 0.00 H new ATOM 1326 N TYR A 84 5.457 -9.526 3.749 1.00 0.00 N ATOM 1327 CA TYR A 84 4.169 -10.002 3.224 1.00 0.00 C ATOM 1328 C TYR A 84 3.895 -11.445 3.653 1.00 0.00 C ATOM 1329 O TYR A 84 2.775 -11.765 4.050 1.00 0.00 O ATOM 1330 CB TYR A 84 4.176 -9.887 1.699 1.00 0.00 C ATOM 1331 CG TYR A 84 2.784 -9.917 1.065 1.00 0.00 C ATOM 1332 CD1 TYR A 84 2.227 -11.136 0.696 1.00 0.00 C ATOM 1333 CD2 TYR A 84 2.162 -8.714 0.749 1.00 0.00 C ATOM 1334 CE1 TYR A 84 1.019 -11.153 0.009 1.00 0.00 C ATOM 1335 CE2 TYR A 84 0.954 -8.722 0.063 1.00 0.00 C ATOM 1336 CZ TYR A 84 0.408 -9.946 -0.308 1.00 0.00 C ATOM 1337 OH TYR A 84 -0.710 -10.031 -1.077 1.00 0.00 O ATOM 0 H TYR A 84 6.148 -9.374 3.015 1.00 0.00 H new ATOM 0 HA TYR A 84 3.371 -9.383 3.633 1.00 0.00 H new ATOM 0 HB2 TYR A 84 4.672 -8.958 1.417 1.00 0.00 H new ATOM 0 HB3 TYR A 84 4.769 -10.703 1.286 1.00 0.00 H new ATOM 0 HD1 TYR A 84 2.728 -12.061 0.941 1.00 0.00 H new ATOM 0 HD2 TYR A 84 2.616 -7.777 1.036 1.00 0.00 H new ATOM 0 HE1 TYR A 84 0.562 -12.090 -0.274 1.00 0.00 H new ATOM 0 HE2 TYR A 84 0.450 -7.798 -0.177 1.00 0.00 H new ATOM 0 HH TYR A 84 -1.063 -9.132 -1.242 1.00 0.00 H new ATOM 1347 N GLY A 85 4.934 -12.275 3.650 1.00 0.00 N ATOM 1348 CA GLY A 85 4.905 -13.668 4.118 1.00 0.00 C ATOM 1349 C GLY A 85 4.617 -13.775 5.617 1.00 0.00 C ATOM 1350 O GLY A 85 3.752 -14.538 6.046 1.00 0.00 O ATOM 0 H GLY A 85 5.854 -11.992 3.311 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.144 -14.218 3.565 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.862 -14.141 3.900 1.00 0.00 H new ATOM 1354 N LYS A 86 5.339 -12.969 6.390 1.00 0.00 N ATOM 1355 CA LYS A 86 5.153 -12.824 7.841 1.00 0.00 C ATOM 1356 C LYS A 86 3.774 -12.264 8.195 1.00 0.00 C ATOM 1357 O LYS A 86 3.246 -12.521 9.276 1.00 0.00 O ATOM 1358 CB LYS A 86 6.194 -11.853 8.403 1.00 0.00 C ATOM 1359 CG LYS A 86 7.640 -12.345 8.312 1.00 0.00 C ATOM 1360 CD LYS A 86 8.574 -11.278 8.886 1.00 0.00 C ATOM 1361 CE LYS A 86 10.040 -11.685 8.733 1.00 0.00 C ATOM 1362 NZ LYS A 86 10.891 -10.664 9.361 1.00 0.00 N ATOM 0 H LYS A 86 6.088 -12.383 6.022 1.00 0.00 H new ATOM 0 HA LYS A 86 5.258 -13.820 8.270 1.00 0.00 H new ATOM 0 HB2 LYS A 86 6.112 -10.906 7.870 1.00 0.00 H new ATOM 0 HB3 LYS A 86 5.958 -11.653 9.448 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.754 -13.279 8.863 1.00 0.00 H new ATOM 0 HG3 LYS A 86 7.901 -12.553 7.274 1.00 0.00 H new ATOM 0 HD2 LYS A 86 8.402 -10.329 8.377 1.00 0.00 H new ATOM 0 HD3 LYS A 86 8.346 -11.120 9.940 1.00 0.00 H new ATOM 0 HE2 LYS A 86 10.211 -12.656 9.199 1.00 0.00 H new ATOM 0 HE3 LYS A 86 10.293 -11.789 7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 11.890 -10.935 9.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 10.733 -9.747 8.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 10.653 -10.587 10.371 1.00 0.00 H new ATOM 1376 N VAL A 87 3.239 -11.478 7.265 1.00 0.00 N ATOM 1377 CA VAL A 87 2.033 -10.646 7.382 1.00 0.00 C ATOM 1378 C VAL A 87 2.181 -9.745 8.610 1.00 0.00 C ATOM 1379 O VAL A 87 1.437 -9.799 9.588 1.00 0.00 O ATOM 1380 CB VAL A 87 0.727 -11.443 7.420 1.00 0.00 C ATOM 1381 CG1 VAL A 87 -0.462 -10.533 7.106 1.00 0.00 C ATOM 1382 CG2 VAL A 87 0.692 -12.628 6.452 1.00 0.00 C ATOM 0 H VAL A 87 3.663 -11.396 6.341 1.00 0.00 H new ATOM 0 HA VAL A 87 1.956 -10.043 6.477 1.00 0.00 H new ATOM 0 HB VAL A 87 0.665 -11.843 8.432 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.383 -11.115 7.137 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -0.513 -9.733 7.845 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -0.338 -10.102 6.112 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.266 -13.141 6.539 1.00 0.00 H new ATOM 0 HG22 VAL A 87 0.819 -12.268 5.431 1.00 0.00 H new ATOM 0 HG23 VAL A 87 1.498 -13.320 6.695 1.00 0.00 H new ATOM 1392 N ASP A 88 3.213 -8.913 8.501 1.00 0.00 N ATOM 1393 CA ASP A 88 3.617 -7.969 9.553 1.00 0.00 C ATOM 1394 C ASP A 88 3.110 -6.565 9.216 1.00 0.00 C ATOM 1395 O ASP A 88 3.711 -5.782 8.483 1.00 0.00 O ATOM 1396 CB ASP A 88 5.135 -8.009 9.741 1.00 0.00 C ATOM 1397 CG ASP A 88 5.618 -7.124 10.892 1.00 0.00 C ATOM 1398 OD1 ASP A 88 4.782 -6.672 11.705 1.00 0.00 O ATOM 1399 OD2 ASP A 88 6.828 -6.813 10.874 1.00 0.00 O ATOM 0 H ASP A 88 3.804 -8.871 7.671 1.00 0.00 H new ATOM 0 HA ASP A 88 3.166 -8.260 10.502 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.446 -9.037 9.925 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.619 -7.691 8.817 1.00 0.00 H new ATOM 1404 N GLY A 89 1.920 -6.323 9.758 1.00 0.00 N ATOM 1405 CA GLY A 89 1.177 -5.068 9.570 1.00 0.00 C ATOM 1406 C GLY A 89 1.938 -3.836 10.065 1.00 0.00 C ATOM 1407 O GLY A 89 1.975 -2.809 9.388 1.00 0.00 O ATOM 0 H GLY A 89 1.433 -6.997 10.348 1.00 0.00 H new ATOM 0 HA2 GLY A 89 0.948 -4.944 8.512 1.00 0.00 H new ATOM 0 HA3 GLY A 89 0.225 -5.135 10.097 1.00 0.00 H new ATOM 1411 N LEU A 90 2.638 -4.009 11.182 1.00 0.00 N ATOM 1412 CA LEU A 90 3.456 -2.953 11.797 1.00 0.00 C ATOM 1413 C LEU A 90 4.719 -2.663 10.984 1.00 0.00 C ATOM 1414 O LEU A 90 5.096 -1.505 10.806 1.00 0.00 O ATOM 1415 CB LEU A 90 3.782 -3.401 13.223 1.00 0.00 C ATOM 1416 CG LEU A 90 4.510 -2.319 14.024 1.00 0.00 C ATOM 1417 CD1 LEU A 90 3.654 -1.069 14.239 1.00 0.00 C ATOM 1418 CD2 LEU A 90 4.948 -2.879 15.378 1.00 0.00 C ATOM 0 H LEU A 90 2.658 -4.891 11.695 1.00 0.00 H new ATOM 0 HA LEU A 90 2.904 -2.013 11.817 1.00 0.00 H new ATOM 0 HB2 LEU A 90 2.859 -3.669 13.736 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.399 -4.299 13.186 1.00 0.00 H new ATOM 0 HG LEU A 90 5.381 -2.021 13.440 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.220 -0.335 14.813 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.382 -0.644 13.273 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.749 -1.337 14.785 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.465 -2.103 15.942 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.072 -3.210 15.935 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.619 -3.723 15.222 1.00 0.00 H new ATOM 1430 N GLY A 91 5.346 -3.721 10.478 1.00 0.00 N ATOM 1431 CA GLY A 91 6.537 -3.671 9.617 1.00 0.00 C ATOM 1432 C GLY A 91 6.291 -2.913 8.311 1.00 0.00 C ATOM 1433 O GLY A 91 7.022 -1.984 7.971 1.00 0.00 O ATOM 0 H GLY A 91 5.032 -4.674 10.659 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.353 -3.195 10.160 1.00 0.00 H new ATOM 0 HA3 GLY A 91 6.857 -4.687 9.388 1.00 0.00 H new ATOM 1437 N VAL A 92 5.158 -3.218 7.685 1.00 0.00 N ATOM 1438 CA VAL A 92 4.714 -2.576 6.439 1.00 0.00 C ATOM 1439 C VAL A 92 4.231 -1.148 6.700 1.00 0.00 C ATOM 1440 O VAL A 92 4.473 -0.255 5.890 1.00 0.00 O ATOM 1441 CB VAL A 92 3.641 -3.425 5.755 1.00 0.00 C ATOM 1442 CG1 VAL A 92 3.163 -2.820 4.433 1.00 0.00 C ATOM 1443 CG2 VAL A 92 4.171 -4.821 5.421 1.00 0.00 C ATOM 0 H VAL A 92 4.510 -3.927 8.029 1.00 0.00 H new ATOM 0 HA VAL A 92 5.564 -2.507 5.760 1.00 0.00 H new ATOM 0 HB VAL A 92 2.817 -3.468 6.467 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.402 -3.464 3.992 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.740 -1.832 4.617 1.00 0.00 H new ATOM 0 HG13 VAL A 92 4.006 -2.732 3.747 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.386 -5.402 4.936 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.026 -4.735 4.750 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.479 -5.323 6.339 1.00 0.00 H new ATOM 1453 N LEU A 93 3.649 -0.907 7.872 1.00 0.00 N ATOM 1454 CA LEU A 93 3.231 0.440 8.287 1.00 0.00 C ATOM 1455 C LEU A 93 4.427 1.388 8.402 1.00 0.00 C ATOM 1456 O LEU A 93 4.419 2.498 7.871 1.00 0.00 O ATOM 1457 CB LEU A 93 2.533 0.416 9.649 1.00 0.00 C ATOM 1458 CG LEU A 93 1.105 0.965 9.645 1.00 0.00 C ATOM 1459 CD1 LEU A 93 0.536 0.870 11.062 1.00 0.00 C ATOM 1460 CD2 LEU A 93 1.016 2.419 9.177 1.00 0.00 C ATOM 0 H LEU A 93 3.452 -1.632 8.562 1.00 0.00 H new ATOM 0 HA LEU A 93 2.544 0.792 7.518 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.512 -0.611 10.013 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.128 0.993 10.357 1.00 0.00 H new ATOM 0 HG LEU A 93 0.534 0.364 8.938 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.482 1.259 11.072 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.530 -0.172 11.383 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.154 1.455 11.742 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.024 2.745 9.198 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.608 3.051 9.839 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.400 2.498 8.160 1.00 0.00 H new ATOM 1472 N LYS A 94 5.489 0.883 9.023 1.00 0.00 N ATOM 1473 CA LYS A 94 6.767 1.592 9.185 1.00 0.00 C ATOM 1474 C LYS A 94 7.497 1.820 7.860 1.00 0.00 C ATOM 1475 O LYS A 94 8.112 2.870 7.684 1.00 0.00 O ATOM 1476 CB LYS A 94 7.679 0.805 10.129 1.00 0.00 C ATOM 1477 CG LYS A 94 7.255 0.999 11.586 1.00 0.00 C ATOM 1478 CD LYS A 94 8.031 0.081 12.532 1.00 0.00 C ATOM 1479 CE LYS A 94 7.706 0.376 13.998 1.00 0.00 C ATOM 1480 NZ LYS A 94 8.382 -0.615 14.849 1.00 0.00 N ATOM 0 H LYS A 94 5.491 -0.049 9.438 1.00 0.00 H new ATOM 0 HA LYS A 94 6.531 2.572 9.601 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.645 -0.254 9.874 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.711 1.131 10.000 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.415 2.038 11.876 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.187 0.802 11.683 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.792 -0.959 12.308 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.101 0.205 12.364 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.032 1.382 14.260 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.629 0.338 14.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.165 -0.421 15.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.050 -1.569 14.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.410 -0.557 14.700 1.00 0.00 H new ATOM 1494 N ALA A 95 7.356 0.872 6.937 1.00 0.00 N ATOM 1495 CA ALA A 95 7.925 0.971 5.585 1.00 0.00 C ATOM 1496 C ALA A 95 7.181 1.977 4.704 1.00 0.00 C ATOM 1497 O ALA A 95 7.796 2.777 4.000 1.00 0.00 O ATOM 1498 CB ALA A 95 7.883 -0.417 4.943 1.00 0.00 C ATOM 0 H ALA A 95 6.842 0.007 7.102 1.00 0.00 H new ATOM 0 HA ALA A 95 8.950 1.332 5.671 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.301 -0.366 3.938 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.467 -1.114 5.544 1.00 0.00 H new ATOM 0 HB3 ALA A 95 6.850 -0.762 4.889 1.00 0.00 H new ATOM 1504 N ALA A 96 5.871 2.058 4.916 1.00 0.00 N ATOM 1505 CA ALA A 96 4.987 3.021 4.243 1.00 0.00 C ATOM 1506 C ALA A 96 5.237 4.451 4.725 1.00 0.00 C ATOM 1507 O ALA A 96 5.456 5.366 3.932 1.00 0.00 O ATOM 1508 CB ALA A 96 3.533 2.626 4.509 1.00 0.00 C ATOM 0 H ALA A 96 5.380 1.449 5.570 1.00 0.00 H new ATOM 0 HA ALA A 96 5.197 2.996 3.174 1.00 0.00 H new ATOM 0 HB1 ALA A 96 2.867 3.334 4.014 1.00 0.00 H new ATOM 0 HB2 ALA A 96 3.351 1.624 4.120 1.00 0.00 H new ATOM 0 HB3 ALA A 96 3.343 2.639 5.582 1.00 0.00 H new ATOM 1514 N VAL A 97 5.395 4.592 6.038 1.00 0.00 N ATOM 1515 CA VAL A 97 5.754 5.852 6.705 1.00 0.00 C ATOM 1516 C VAL A 97 7.159 6.298 6.298 1.00 0.00 C ATOM 1517 O VAL A 97 7.412 7.490 6.126 1.00 0.00 O ATOM 1518 CB VAL A 97 5.544 5.577 8.196 1.00 0.00 C ATOM 1519 CG1 VAL A 97 6.558 6.210 9.151 1.00 0.00 C ATOM 1520 CG2 VAL A 97 4.156 6.075 8.602 1.00 0.00 C ATOM 0 H VAL A 97 5.275 3.816 6.690 1.00 0.00 H new ATOM 0 HA VAL A 97 5.139 6.704 6.414 1.00 0.00 H new ATOM 0 HB VAL A 97 5.670 4.499 8.295 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.306 5.945 10.178 1.00 0.00 H new ATOM 0 HG12 VAL A 97 7.557 5.843 8.916 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.535 7.294 9.040 1.00 0.00 H new ATOM 0 HG21 VAL A 97 3.997 5.883 9.663 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.084 7.146 8.412 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.397 5.551 8.021 1.00 0.00 H new ATOM 1530 N ALA A 98 8.048 5.323 6.128 1.00 0.00 N ATOM 1531 CA ALA A 98 9.429 5.559 5.681 1.00 0.00 C ATOM 1532 C ALA A 98 9.482 6.094 4.248 1.00 0.00 C ATOM 1533 O ALA A 98 10.266 6.996 3.958 1.00 0.00 O ATOM 1534 CB ALA A 98 10.225 4.255 5.757 1.00 0.00 C ATOM 0 H ALA A 98 7.835 4.340 6.296 1.00 0.00 H new ATOM 0 HA ALA A 98 9.864 6.310 6.341 1.00 0.00 H new ATOM 0 HB1 ALA A 98 11.248 4.433 5.425 1.00 0.00 H new ATOM 0 HB2 ALA A 98 10.235 3.894 6.785 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.760 3.507 5.115 1.00 0.00 H new ATOM 1540 N ALA A 99 8.568 5.615 3.409 1.00 0.00 N ATOM 1541 CA ALA A 99 8.413 6.078 2.022 1.00 0.00 C ATOM 1542 C ALA A 99 7.843 7.494 1.930 1.00 0.00 C ATOM 1543 O ALA A 99 8.322 8.301 1.135 1.00 0.00 O ATOM 1544 CB ALA A 99 7.511 5.099 1.268 1.00 0.00 C ATOM 0 H ALA A 99 7.904 4.886 3.670 1.00 0.00 H new ATOM 0 HA ALA A 99 9.405 6.111 1.570 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.390 5.435 0.238 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.964 4.107 1.276 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.535 5.056 1.752 1.00 0.00 H new ATOM 1550 N ILE A 100 6.957 7.835 2.862 1.00 0.00 N ATOM 1551 CA ILE A 100 6.399 9.189 2.989 1.00 0.00 C ATOM 1552 C ILE A 100 7.488 10.140 3.490 1.00 0.00 C ATOM 1553 O ILE A 100 7.638 11.249 2.980 1.00 0.00 O ATOM 1554 CB ILE A 100 5.178 9.163 3.911 1.00 0.00 C ATOM 1555 CG1 ILE A 100 4.084 8.254 3.347 1.00 0.00 C ATOM 1556 CG2 ILE A 100 4.611 10.571 4.103 1.00 0.00 C ATOM 1557 CD1 ILE A 100 3.006 7.850 4.355 1.00 0.00 C ATOM 0 H ILE A 100 6.600 7.179 3.557 1.00 0.00 H new ATOM 0 HA ILE A 100 6.062 9.553 2.019 1.00 0.00 H new ATOM 0 HB ILE A 100 5.506 8.772 4.874 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.606 8.760 2.508 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.549 7.351 2.951 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.744 10.527 4.762 1.00 0.00 H new ATOM 0 HG22 ILE A 100 5.372 11.212 4.547 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.312 10.978 3.137 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.274 7.207 3.867 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.466 7.312 5.184 1.00 0.00 H new ATOM 0 HD13 ILE A 100 2.509 8.743 4.734 1.00 0.00 H new ATOM 1569 N LYS A 101 8.253 9.693 4.483 1.00 0.00 N ATOM 1570 CA LYS A 101 9.400 10.442 5.016 1.00 0.00 C ATOM 1571 C LYS A 101 10.473 10.705 3.957 1.00 0.00 C ATOM 1572 O LYS A 101 10.951 11.832 3.842 1.00 0.00 O ATOM 1573 CB LYS A 101 10.068 9.706 6.179 1.00 0.00 C ATOM 1574 CG LYS A 101 9.272 9.738 7.486 1.00 0.00 C ATOM 1575 CD LYS A 101 10.129 9.270 8.664 1.00 0.00 C ATOM 1576 CE LYS A 101 11.089 10.365 9.134 1.00 0.00 C ATOM 1577 NZ LYS A 101 12.039 9.822 10.115 1.00 0.00 N ATOM 0 H LYS A 101 8.098 8.797 4.946 1.00 0.00 H new ATOM 0 HA LYS A 101 8.986 11.391 5.357 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.230 8.667 5.891 1.00 0.00 H new ATOM 0 HB3 LYS A 101 11.050 10.145 6.355 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.914 10.750 7.673 1.00 0.00 H new ATOM 0 HG3 LYS A 101 8.393 9.100 7.396 1.00 0.00 H new ATOM 0 HD2 LYS A 101 9.482 8.974 9.490 1.00 0.00 H new ATOM 0 HD3 LYS A 101 10.698 8.387 8.372 1.00 0.00 H new ATOM 0 HE2 LYS A 101 11.630 10.774 8.281 1.00 0.00 H new ATOM 0 HE3 LYS A 101 10.526 11.186 9.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 12.685 10.575 10.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 11.518 9.452 10.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 12.588 9.054 9.679 1.00 0.00 H new ATOM 1591 N LYS A 102 10.759 9.705 3.128 1.00 0.00 N ATOM 1592 CA LYS A 102 11.763 9.786 2.058 1.00 0.00 C ATOM 1593 C LYS A 102 11.337 10.782 0.977 1.00 0.00 C ATOM 1594 O LYS A 102 12.150 11.561 0.482 1.00 0.00 O ATOM 1595 CB LYS A 102 11.915 8.368 1.503 1.00 0.00 C ATOM 1596 CG LYS A 102 13.076 8.257 0.513 1.00 0.00 C ATOM 1597 CD LYS A 102 13.288 6.786 0.148 1.00 0.00 C ATOM 1598 CE LYS A 102 14.426 6.590 -0.855 1.00 0.00 C ATOM 1599 NZ LYS A 102 14.018 7.078 -2.180 1.00 0.00 N ATOM 0 H LYS A 102 10.295 8.798 3.177 1.00 0.00 H new ATOM 0 HA LYS A 102 12.718 10.152 2.435 1.00 0.00 H new ATOM 0 HB2 LYS A 102 12.074 7.672 2.327 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.989 8.071 1.010 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.862 8.839 -0.383 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.984 8.670 0.952 1.00 0.00 H new ATOM 0 HD2 LYS A 102 13.504 6.218 1.053 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.366 6.382 -0.270 1.00 0.00 H new ATOM 0 HE2 LYS A 102 15.314 7.125 -0.519 1.00 0.00 H new ATOM 0 HE3 LYS A 102 14.693 5.535 -0.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.763 6.864 -2.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.135 6.609 -2.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 13.867 8.106 -2.140 1.00 0.00 H new ATOM 1613 N ALA A 103 10.050 10.717 0.647 1.00 0.00 N ATOM 1614 CA ALA A 103 9.385 11.630 -0.293 1.00 0.00 C ATOM 1615 C ALA A 103 9.402 13.079 0.200 1.00 0.00 C ATOM 1616 O ALA A 103 9.567 13.999 -0.599 1.00 0.00 O ATOM 1617 CB ALA A 103 7.940 11.195 -0.543 1.00 0.00 C ATOM 0 H ALA A 103 9.421 10.013 1.032 1.00 0.00 H new ATOM 0 HA ALA A 103 9.947 11.582 -1.226 1.00 0.00 H new ATOM 0 HB1 ALA A 103 7.468 11.886 -1.242 1.00 0.00 H new ATOM 0 HB2 ALA A 103 7.930 10.190 -0.964 1.00 0.00 H new ATOM 0 HB3 ALA A 103 7.391 11.199 0.398 1.00 0.00 H new ATOM 1623 N ALA A 104 9.166 13.263 1.496 1.00 0.00 N ATOM 1624 CA ALA A 104 9.283 14.562 2.174 1.00 0.00 C ATOM 1625 C ALA A 104 10.713 15.103 2.129 1.00 0.00 C ATOM 1626 O ALA A 104 10.876 16.308 1.939 1.00 0.00 O ATOM 1627 CB ALA A 104 8.814 14.381 3.619 1.00 0.00 C ATOM 0 H ALA A 104 8.884 12.506 2.119 1.00 0.00 H new ATOM 0 HA ALA A 104 8.662 15.296 1.660 1.00 0.00 H new ATOM 0 HB1 ALA A 104 8.890 15.331 4.148 1.00 0.00 H new ATOM 0 HB2 ALA A 104 7.777 14.044 3.626 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.440 13.639 4.114 1.00 0.00 H new ATOM 1633 N ALA A 105 11.663 14.218 2.420 1.00 0.00 N ATOM 1634 CA ALA A 105 13.127 14.312 2.327 1.00 0.00 C ATOM 1635 C ALA A 105 13.766 13.692 3.571 1.00 0.00 C ATOM 1636 O ALA A 105 13.797 14.276 4.653 1.00 0.00 O ATOM 1637 CB ALA A 105 13.714 15.708 2.112 1.00 0.00 C ATOM 0 H ALA A 105 11.395 13.299 2.772 1.00 0.00 H new ATOM 0 HA ALA A 105 13.368 13.763 1.416 1.00 0.00 H new ATOM 0 HB1 ALA A 105 14.801 15.642 2.061 1.00 0.00 H new ATOM 0 HB2 ALA A 105 13.331 16.124 1.180 1.00 0.00 H new ATOM 0 HB3 ALA A 105 13.429 16.354 2.942 1.00 0.00 H new ATOM 1643 N ASN A 106 14.114 12.419 3.401 1.00 0.00 N ATOM 1644 CA ASN A 106 14.870 11.614 4.371 1.00 0.00 C ATOM 1645 C ASN A 106 15.700 10.558 3.638 1.00 0.00 C ATOM 1646 O ASN A 106 15.548 10.450 2.402 1.00 0.00 O ATOM 1647 CB ASN A 106 13.956 10.898 5.368 1.00 0.00 C ATOM 1648 CG ASN A 106 13.420 11.804 6.478 1.00 0.00 C ATOM 1649 OD1 ASN A 106 12.267 12.232 6.514 1.00 0.00 O ATOM 1650 ND2 ASN A 106 14.212 11.980 7.532 1.00 0.00 N ATOM 1651 OXT ASN A 106 16.421 9.819 4.343 1.00 0.00 O ATOM 0 H ASN A 106 13.872 11.898 2.558 1.00 0.00 H new ATOM 0 HA ASN A 106 15.512 12.302 4.921 1.00 0.00 H new ATOM 0 HB2 ASN A 106 13.114 10.465 4.828 1.00 0.00 H new ATOM 0 HB3 ASN A 106 14.504 10.071 5.820 1.00 0.00 H new ATOM 0 HD21 ASN A 106 13.862 12.465 8.358 1.00 0.00 H new ATOM 0 HD22 ASN A 106 15.170 11.630 7.514 1.00 0.00 H new TER 1658 ASN A 106