USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1094 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 137 ASN : amide:sc= -1.18 K(o=-1.5,f=-7.5!) USER MOD Set 1.2: A 144 THR OG1 : rot -170:sc= -0.315 USER MOD Set 2.1: A 45 SER OG : rot 89:sc= -0.978! USER MOD Set 2.2: A 143 THR OG1 : rot 180:sc= 0.997 USER MOD Set 3.1: A 81 LYS NZ :NH3+ -170:sc= -0.0169 (180deg=-0.0793) USER MOD Set 3.2: A 135 GLN : amide:sc= -1.54 X(o=-1.6,f=-2) USER MOD Set 4.1: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 131 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 27 SER OG : rot 170:sc= 1.04 USER MOD Set 5.2: A 30 HIS : no HD1:sc= -0.0373 K(o=1,f=-0.18) USER MOD Set 6.1: A 13 MET CE :methyl -126:sc= -2.04 (180deg=-4.6!) USER MOD Set 6.2: A 150 THR OG1 : rot 120:sc= 0.391 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -158:sc= -2.48 (180deg=-3.48!) USER MOD Single : A 17 ASN : amide:sc=-0.00878 K(o=-0.0088,f=-1.4) USER MOD Single : A 18 LYS NZ :NH3+ 156:sc= -0.421 (180deg=-1.76) USER MOD Single : A 21 CYS SG : rot 60:sc= 1.07 USER MOD Single : A 23 CYS SG : rot 180:sc= -0.345 USER MOD Single : A 25 ASN : amide:sc= -0.175 X(o=-0.17,f=-0.011) USER MOD Single : A 34 ASN : amide:sc= -3.9! C(o=-3.9!,f=-10!) USER MOD Single : A 35 CYS SG : rot -54:sc= 0.513 USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.0928 X(o=-0.093,f=0) USER MOD Single : A 58 ASN : amide:sc= -0.118 X(o=-0.12,f=0) USER MOD Single : A 59 GLN : amide:sc= -4.53! C(o=-4.5!,f=-6.4!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= -0.993 USER MOD Single : A 65 SER OG : rot 180:sc= -0.165 USER MOD Single : A 66 MET CE :methyl -156:sc= 0 (180deg=-0.239) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.413 K(o=-0.41,f=-2.3) USER MOD Single : A 73 ASN : amide:sc= -0.54 X(o=-0.54,f=-0.065) USER MOD Single : A 75 GLN : amide:sc= -2.92! K(o=-2.9!,f=-0.56) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -1.69 K(o=-1.7,f=-0.4) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl -173:sc= -3.66 (180deg=-4.12) USER MOD Single : A 98 SER OG : rot 93:sc=0.000357 USER MOD Single : A 101 THR OG1 : rot -120:sc= -0.0523 USER MOD Single : A 102 GLN : amide:sc= -5.26 K(o=-5.3,f=-13!) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.177 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0.189 X(o=0.19,f=-0.01) USER MOD Single : A 126 ASN : amide:sc= -2.43 K(o=-2.4,f=-6.7!) USER MOD Single : A 128 ASN : amide:sc= -1.43 X(o=-1.4,f=-1.6) USER MOD Single : A 129 SER OG : rot 37:sc= 0.276 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= -1.76 K(o=-1.8,f=-6.9!) USER MOD Single : A 147 SER OG : rot -137:sc= -0.0545 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.866 USER MOD Single : A 157 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 73 N TYR A 9 12.675 9.350 0.879 1.00 0.00 N ATOM 74 CA TYR A 9 11.762 8.677 1.795 1.00 0.00 C ATOM 75 C TYR A 9 12.123 7.201 1.937 1.00 0.00 C ATOM 76 O TYR A 9 13.127 6.741 1.393 1.00 0.00 O ATOM 77 CB TYR A 9 10.320 8.816 1.306 1.00 0.00 C ATOM 78 CG TYR A 9 9.942 10.231 0.928 1.00 0.00 C ATOM 79 CD1 TYR A 9 9.410 11.103 1.870 1.00 0.00 C ATOM 80 CD2 TYR A 9 10.119 10.695 -0.369 1.00 0.00 C ATOM 81 CE1 TYR A 9 9.063 12.396 1.529 1.00 0.00 C ATOM 82 CE2 TYR A 9 9.776 11.987 -0.718 1.00 0.00 C ATOM 83 CZ TYR A 9 9.248 12.833 0.234 1.00 0.00 C ATOM 84 OH TYR A 9 8.905 14.121 -0.109 1.00 0.00 O ATOM 0 HA TYR A 9 11.854 9.151 2.772 1.00 0.00 H new ATOM 0 HB2 TYR A 9 10.174 8.167 0.443 1.00 0.00 H new ATOM 0 HB3 TYR A 9 9.645 8.465 2.087 1.00 0.00 H new ATOM 0 HD1 TYR A 9 9.265 10.764 2.885 1.00 0.00 H new ATOM 0 HD2 TYR A 9 10.532 10.035 -1.117 1.00 0.00 H new ATOM 0 HE1 TYR A 9 8.649 13.061 2.272 1.00 0.00 H new ATOM 0 HE2 TYR A 9 9.921 12.332 -1.731 1.00 0.00 H new ATOM 0 HH TYR A 9 9.099 14.270 -1.058 1.00 0.00 H new ATOM 94 N MET A 10 11.296 6.464 2.671 1.00 0.00 N ATOM 95 CA MET A 10 11.526 5.040 2.883 1.00 0.00 C ATOM 96 C MET A 10 10.253 4.240 2.626 1.00 0.00 C ATOM 97 O MET A 10 9.145 4.727 2.854 1.00 0.00 O ATOM 98 CB MET A 10 12.021 4.788 4.309 1.00 0.00 C ATOM 99 CG MET A 10 12.716 5.988 4.932 1.00 0.00 C ATOM 100 SD MET A 10 13.693 5.550 6.382 1.00 0.00 S ATOM 101 CE MET A 10 12.524 4.535 7.284 1.00 0.00 C ATOM 0 H MET A 10 10.461 6.829 3.129 1.00 0.00 H new ATOM 0 HA MET A 10 12.289 4.712 2.178 1.00 0.00 H new ATOM 0 HB2 MET A 10 11.174 4.504 4.934 1.00 0.00 H new ATOM 0 HB3 MET A 10 12.709 3.943 4.302 1.00 0.00 H new ATOM 0 HG2 MET A 10 13.364 6.453 4.189 1.00 0.00 H new ATOM 0 HG3 MET A 10 11.969 6.730 5.213 1.00 0.00 H new ATOM 0 HE1 MET A 10 12.801 4.510 8.338 1.00 0.00 H new ATOM 0 HE2 MET A 10 11.523 4.955 7.182 1.00 0.00 H new ATOM 0 HE3 MET A 10 12.535 3.522 6.882 1.00 0.00 H new ATOM 111 N ASP A 11 10.418 3.010 2.150 1.00 0.00 N ATOM 112 CA ASP A 11 9.282 2.142 1.863 1.00 0.00 C ATOM 113 C ASP A 11 8.611 1.681 3.152 1.00 0.00 C ATOM 114 O ASP A 11 7.517 1.114 3.127 1.00 0.00 O ATOM 115 CB ASP A 11 9.733 0.931 1.046 1.00 0.00 C ATOM 116 CG ASP A 11 10.830 0.143 1.735 1.00 0.00 C ATOM 117 OD1 ASP A 11 11.151 0.466 2.898 1.00 0.00 O ATOM 118 OD2 ASP A 11 11.367 -0.796 1.112 1.00 0.00 O ATOM 0 H ASP A 11 11.328 2.592 1.955 1.00 0.00 H new ATOM 0 HA ASP A 11 8.557 2.713 1.282 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.878 0.278 0.867 1.00 0.00 H new ATOM 0 HB3 ASP A 11 10.088 1.266 0.071 1.00 0.00 H new ATOM 123 N LEU A 12 9.273 1.925 4.278 1.00 0.00 N ATOM 124 CA LEU A 12 8.740 1.534 5.579 1.00 0.00 C ATOM 125 C LEU A 12 8.493 0.030 5.636 1.00 0.00 C ATOM 126 O LEU A 12 7.718 -0.450 6.462 1.00 0.00 O ATOM 127 CB LEU A 12 7.441 2.288 5.868 1.00 0.00 C ATOM 128 CG LEU A 12 7.436 3.776 5.516 1.00 0.00 C ATOM 129 CD1 LEU A 12 6.020 4.330 5.562 1.00 0.00 C ATOM 130 CD2 LEU A 12 8.344 4.550 6.461 1.00 0.00 C ATOM 0 H LEU A 12 10.179 2.391 4.316 1.00 0.00 H new ATOM 0 HA LEU A 12 9.478 1.791 6.339 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.633 1.803 5.320 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.213 2.185 6.929 1.00 0.00 H new ATOM 0 HG LEU A 12 7.817 3.892 4.501 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.036 5.390 5.309 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.397 3.795 4.846 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.612 4.202 6.565 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.328 5.607 6.196 1.00 0.00 H new ATOM 0 HD22 LEU A 12 7.992 4.427 7.485 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.363 4.170 6.379 1.00 0.00 H new ATOM 142 N MET A 13 9.159 -0.708 4.753 1.00 0.00 N ATOM 143 CA MET A 13 9.013 -2.158 4.706 1.00 0.00 C ATOM 144 C MET A 13 9.360 -2.783 6.054 1.00 0.00 C ATOM 145 O MET A 13 8.579 -3.539 6.633 1.00 0.00 O ATOM 146 CB MET A 13 9.907 -2.746 3.613 1.00 0.00 C ATOM 147 CG MET A 13 9.223 -3.816 2.778 1.00 0.00 C ATOM 148 SD MET A 13 8.383 -3.138 1.334 1.00 0.00 S ATOM 149 CE MET A 13 6.714 -3.731 1.603 1.00 0.00 C ATOM 0 H MET A 13 9.804 -0.326 4.061 1.00 0.00 H new ATOM 0 HA MET A 13 7.972 -2.387 4.476 1.00 0.00 H new ATOM 0 HB2 MET A 13 10.240 -1.942 2.956 1.00 0.00 H new ATOM 0 HB3 MET A 13 10.798 -3.171 4.074 1.00 0.00 H new ATOM 0 HG2 MET A 13 9.964 -4.547 2.453 1.00 0.00 H new ATOM 0 HG3 MET A 13 8.501 -4.348 3.397 1.00 0.00 H new ATOM 0 HE1 MET A 13 6.374 -4.273 0.720 1.00 0.00 H new ATOM 0 HE2 MET A 13 6.699 -4.397 2.466 1.00 0.00 H new ATOM 0 HE3 MET A 13 6.052 -2.885 1.787 1.00 0.00 H new ATOM 159 N PRO A 14 10.558 -2.463 6.565 1.00 0.00 N ATOM 160 CA PRO A 14 11.034 -2.983 7.851 1.00 0.00 C ATOM 161 C PRO A 14 10.265 -2.402 9.032 1.00 0.00 C ATOM 162 O PRO A 14 10.473 -2.801 10.178 1.00 0.00 O ATOM 163 CB PRO A 14 12.497 -2.536 7.893 1.00 0.00 C ATOM 164 CG PRO A 14 12.552 -1.334 7.015 1.00 0.00 C ATOM 165 CD PRO A 14 11.539 -1.569 5.929 1.00 0.00 C ATOM 0 HA PRO A 14 10.901 -4.062 7.929 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.809 -2.298 8.910 1.00 0.00 H new ATOM 0 HB3 PRO A 14 13.161 -3.321 7.531 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.319 -0.429 7.577 1.00 0.00 H new ATOM 0 HG3 PRO A 14 13.550 -1.202 6.596 1.00 0.00 H new ATOM 0 HD2 PRO A 14 11.079 -0.637 5.600 1.00 0.00 H new ATOM 0 HD3 PRO A 14 11.991 -2.029 5.050 1.00 0.00 H new ATOM 173 N PHE A 15 9.374 -1.458 8.745 1.00 0.00 N ATOM 174 CA PHE A 15 8.574 -0.821 9.785 1.00 0.00 C ATOM 175 C PHE A 15 7.176 -1.431 9.845 1.00 0.00 C ATOM 176 O PHE A 15 6.377 -1.092 10.718 1.00 0.00 O ATOM 177 CB PHE A 15 8.475 0.685 9.532 1.00 0.00 C ATOM 178 CG PHE A 15 9.774 1.413 9.733 1.00 0.00 C ATOM 179 CD1 PHE A 15 10.811 1.269 8.826 1.00 0.00 C ATOM 180 CD2 PHE A 15 9.957 2.240 10.830 1.00 0.00 C ATOM 181 CE1 PHE A 15 12.007 1.938 9.008 1.00 0.00 C ATOM 182 CE2 PHE A 15 11.150 2.911 11.016 1.00 0.00 C ATOM 183 CZ PHE A 15 12.177 2.759 10.105 1.00 0.00 C ATOM 0 H PHE A 15 9.188 -1.118 7.802 1.00 0.00 H new ATOM 0 HA PHE A 15 9.067 -0.990 10.742 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.128 0.852 8.512 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.723 1.109 10.198 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.684 0.627 7.967 1.00 0.00 H new ATOM 0 HD2 PHE A 15 9.158 2.361 11.547 1.00 0.00 H new ATOM 0 HE1 PHE A 15 12.807 1.819 8.293 1.00 0.00 H new ATOM 0 HE2 PHE A 15 11.280 3.554 11.874 1.00 0.00 H new ATOM 0 HZ PHE A 15 13.111 3.281 10.250 1.00 0.00 H new ATOM 193 N ILE A 16 6.890 -2.331 8.911 1.00 0.00 N ATOM 194 CA ILE A 16 5.590 -2.988 8.858 1.00 0.00 C ATOM 195 C ILE A 16 5.593 -4.279 9.670 1.00 0.00 C ATOM 196 O ILE A 16 6.495 -5.105 9.539 1.00 0.00 O ATOM 197 CB ILE A 16 5.179 -3.308 7.408 1.00 0.00 C ATOM 198 CG1 ILE A 16 5.045 -2.018 6.597 1.00 0.00 C ATOM 199 CG2 ILE A 16 3.876 -4.092 7.387 1.00 0.00 C ATOM 200 CD1 ILE A 16 5.479 -2.162 5.155 1.00 0.00 C ATOM 0 H ILE A 16 7.540 -2.622 8.181 1.00 0.00 H new ATOM 0 HA ILE A 16 4.868 -2.293 9.287 1.00 0.00 H new ATOM 0 HB ILE A 16 5.956 -3.922 6.953 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.007 -1.688 6.624 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.640 -1.237 7.071 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.599 -4.310 6.356 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.005 -5.026 7.934 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.089 -3.502 7.857 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.357 -1.209 4.641 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.526 -2.462 5.118 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.867 -2.919 4.665 1.00 0.00 H new ATOM 212 N ASN A 17 4.575 -4.447 10.508 1.00 0.00 N ATOM 213 CA ASN A 17 4.459 -5.639 11.341 1.00 0.00 C ATOM 214 C ASN A 17 3.815 -6.784 10.565 1.00 0.00 C ATOM 215 O ASN A 17 2.592 -6.855 10.442 1.00 0.00 O ATOM 216 CB ASN A 17 3.638 -5.332 12.595 1.00 0.00 C ATOM 217 CG ASN A 17 3.694 -6.455 13.612 1.00 0.00 C ATOM 218 OD1 ASN A 17 4.640 -7.244 13.631 1.00 0.00 O ATOM 219 ND2 ASN A 17 2.679 -6.533 14.464 1.00 0.00 N ATOM 0 H ASN A 17 3.819 -3.773 10.628 1.00 0.00 H new ATOM 0 HA ASN A 17 5.462 -5.944 11.638 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.007 -4.413 13.051 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.601 -5.153 12.312 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.662 -7.268 15.171 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.916 -5.858 14.412 1.00 0.00 H new ATOM 226 N LYS A 18 4.646 -7.680 10.044 1.00 0.00 N ATOM 227 CA LYS A 18 4.160 -8.824 9.282 1.00 0.00 C ATOM 228 C LYS A 18 3.370 -9.776 10.175 1.00 0.00 C ATOM 229 O LYS A 18 2.543 -10.549 9.694 1.00 0.00 O ATOM 230 CB LYS A 18 5.331 -9.567 8.636 1.00 0.00 C ATOM 231 CG LYS A 18 6.086 -8.739 7.610 1.00 0.00 C ATOM 232 CD LYS A 18 5.347 -8.685 6.284 1.00 0.00 C ATOM 233 CE LYS A 18 4.500 -7.427 6.168 1.00 0.00 C ATOM 234 NZ LYS A 18 5.259 -6.302 5.555 1.00 0.00 N ATOM 0 H LYS A 18 5.661 -7.636 10.136 1.00 0.00 H new ATOM 0 HA LYS A 18 3.497 -8.453 8.500 1.00 0.00 H new ATOM 0 HB2 LYS A 18 6.024 -9.884 9.416 1.00 0.00 H new ATOM 0 HB3 LYS A 18 4.956 -10.471 8.156 1.00 0.00 H new ATOM 0 HG2 LYS A 18 6.227 -7.727 7.990 1.00 0.00 H new ATOM 0 HG3 LYS A 18 7.078 -9.164 7.457 1.00 0.00 H new ATOM 0 HD2 LYS A 18 6.065 -8.718 5.465 1.00 0.00 H new ATOM 0 HD3 LYS A 18 4.710 -9.564 6.185 1.00 0.00 H new ATOM 0 HE2 LYS A 18 3.616 -7.639 5.567 1.00 0.00 H new ATOM 0 HE3 LYS A 18 4.150 -7.132 7.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.594 -5.628 5.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 5.816 -5.818 6.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 5.898 -6.673 4.823 1.00 0.00 H new ATOM 248 N ALA A 19 3.631 -9.713 11.476 1.00 0.00 N ATOM 249 CA ALA A 19 2.941 -10.567 12.436 1.00 0.00 C ATOM 250 C ALA A 19 1.632 -9.933 12.893 1.00 0.00 C ATOM 251 O ALA A 19 0.967 -10.441 13.794 1.00 0.00 O ATOM 252 CB ALA A 19 3.839 -10.849 13.631 1.00 0.00 C ATOM 0 H ALA A 19 4.315 -9.080 11.890 1.00 0.00 H new ATOM 0 HA ALA A 19 2.704 -11.510 11.943 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.312 -11.487 14.340 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.745 -11.352 13.294 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.104 -9.910 14.116 1.00 0.00 H new ATOM 258 N GLY A 20 1.268 -8.819 12.265 1.00 0.00 N ATOM 259 CA GLY A 20 0.039 -8.134 12.622 1.00 0.00 C ATOM 260 C GLY A 20 -0.782 -7.745 11.408 1.00 0.00 C ATOM 261 O GLY A 20 -1.826 -7.105 11.536 1.00 0.00 O ATOM 0 H GLY A 20 1.802 -8.379 11.516 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.557 -8.778 13.269 1.00 0.00 H new ATOM 0 HA3 GLY A 20 0.279 -7.239 13.196 1.00 0.00 H new ATOM 265 N CYS A 21 -0.309 -8.130 10.228 1.00 0.00 N ATOM 266 CA CYS A 21 -1.005 -7.815 8.986 1.00 0.00 C ATOM 267 C CYS A 21 -2.185 -8.756 8.770 1.00 0.00 C ATOM 268 O CYS A 21 -2.180 -9.892 9.244 1.00 0.00 O ATOM 269 CB CYS A 21 -0.042 -7.905 7.801 1.00 0.00 C ATOM 270 SG CYS A 21 1.151 -6.549 7.714 1.00 0.00 S ATOM 0 H CYS A 21 0.553 -8.661 10.105 1.00 0.00 H new ATOM 0 HA CYS A 21 -1.385 -6.796 9.060 1.00 0.00 H new ATOM 0 HB2 CYS A 21 0.500 -8.849 7.858 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.620 -7.926 6.877 1.00 0.00 H new ATOM 0 HG CYS A 21 1.873 -6.537 8.795 1.00 0.00 H new ATOM 276 N GLU A 22 -3.196 -8.275 8.053 1.00 0.00 N ATOM 277 CA GLU A 22 -4.385 -9.074 7.778 1.00 0.00 C ATOM 278 C GLU A 22 -4.817 -8.922 6.322 1.00 0.00 C ATOM 279 O GLU A 22 -4.854 -7.814 5.787 1.00 0.00 O ATOM 280 CB GLU A 22 -5.529 -8.663 8.706 1.00 0.00 C ATOM 281 CG GLU A 22 -6.884 -9.204 8.280 1.00 0.00 C ATOM 282 CD GLU A 22 -7.665 -9.796 9.436 1.00 0.00 C ATOM 283 OE1 GLU A 22 -7.744 -9.142 10.497 1.00 0.00 O ATOM 284 OE2 GLU A 22 -8.199 -10.914 9.279 1.00 0.00 O ATOM 0 H GLU A 22 -3.216 -7.337 7.652 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.138 -10.120 7.959 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.309 -9.011 9.715 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.579 -7.575 8.748 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.465 -8.401 7.827 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.742 -9.966 7.514 1.00 0.00 H new ATOM 291 N CYS A 23 -5.141 -10.044 5.688 1.00 0.00 N ATOM 292 CA CYS A 23 -5.569 -10.037 4.293 1.00 0.00 C ATOM 293 C CYS A 23 -6.975 -10.610 4.153 1.00 0.00 C ATOM 294 O CYS A 23 -7.319 -11.604 4.796 1.00 0.00 O ATOM 295 CB CYS A 23 -4.590 -10.839 3.434 1.00 0.00 C ATOM 296 SG CYS A 23 -4.174 -12.463 4.110 1.00 0.00 S ATOM 0 H CYS A 23 -5.116 -10.969 6.117 1.00 0.00 H new ATOM 0 HA CYS A 23 -5.582 -9.003 3.947 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -5.018 -10.970 2.440 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -3.673 -10.262 3.313 1.00 0.00 H new ATOM 0 HG CYS A 23 -3.343 -13.065 3.312 1.00 0.00 H new ATOM 302 N LEU A 24 -7.785 -9.978 3.312 1.00 0.00 N ATOM 303 CA LEU A 24 -9.156 -10.424 3.088 1.00 0.00 C ATOM 304 C LEU A 24 -9.300 -11.074 1.716 1.00 0.00 C ATOM 305 O LEU A 24 -8.814 -10.549 0.715 1.00 0.00 O ATOM 306 CB LEU A 24 -10.123 -9.245 3.211 1.00 0.00 C ATOM 307 CG LEU A 24 -9.988 -8.395 4.475 1.00 0.00 C ATOM 308 CD1 LEU A 24 -11.176 -7.456 4.616 1.00 0.00 C ATOM 309 CD2 LEU A 24 -9.859 -9.283 5.704 1.00 0.00 C ATOM 0 H LEU A 24 -7.517 -9.155 2.773 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.399 -11.166 3.848 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.986 -8.597 2.345 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.142 -9.630 3.163 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.083 -7.793 4.390 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -11.063 -6.859 5.521 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.223 -6.796 3.750 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -12.095 -8.039 4.678 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.764 -8.661 6.594 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.745 -9.911 5.793 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.975 -9.914 5.606 1.00 0.00 H new ATOM 321 N ASN A 25 -9.974 -12.219 1.677 1.00 0.00 N ATOM 322 CA ASN A 25 -10.184 -12.940 0.427 1.00 0.00 C ATOM 323 C ASN A 25 -8.853 -13.346 -0.197 1.00 0.00 C ATOM 324 O ASN A 25 -8.712 -13.376 -1.419 1.00 0.00 O ATOM 325 CB ASN A 25 -10.979 -12.078 -0.556 1.00 0.00 C ATOM 326 CG ASN A 25 -11.804 -12.910 -1.519 1.00 0.00 C ATOM 327 OD1 ASN A 25 -12.729 -13.613 -1.114 1.00 0.00 O ATOM 328 ND2 ASN A 25 -11.470 -12.834 -2.802 1.00 0.00 N ATOM 0 H ASN A 25 -10.384 -12.667 2.496 1.00 0.00 H new ATOM 0 HA ASN A 25 -10.752 -13.844 0.649 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.638 -11.411 0.000 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.292 -11.448 -1.121 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -11.988 -13.372 -3.497 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -10.695 -12.238 -3.093 1.00 0.00 H new ATOM 335 N GLU A 26 -7.878 -13.659 0.652 1.00 0.00 N ATOM 336 CA GLU A 26 -6.558 -14.064 0.183 1.00 0.00 C ATOM 337 C GLU A 26 -6.599 -15.468 -0.412 1.00 0.00 C ATOM 338 O GLU A 26 -7.158 -16.390 0.182 1.00 0.00 O ATOM 339 CB GLU A 26 -5.547 -14.013 1.330 1.00 0.00 C ATOM 340 CG GLU A 26 -4.146 -14.438 0.926 1.00 0.00 C ATOM 341 CD GLU A 26 -3.557 -15.474 1.863 1.00 0.00 C ATOM 342 OE1 GLU A 26 -4.162 -16.558 2.003 1.00 0.00 O ATOM 343 OE2 GLU A 26 -2.493 -15.202 2.457 1.00 0.00 O ATOM 0 H GLU A 26 -7.978 -13.640 1.667 1.00 0.00 H new ATOM 0 HA GLU A 26 -6.248 -13.367 -0.596 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.510 -12.998 1.725 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -5.894 -14.657 2.138 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.171 -14.842 -0.086 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -3.497 -13.563 0.904 1.00 0.00 H new ATOM 350 N SER A 27 -6.003 -15.623 -1.590 1.00 0.00 N ATOM 351 CA SER A 27 -5.974 -16.914 -2.268 1.00 0.00 C ATOM 352 C SER A 27 -5.405 -17.995 -1.355 1.00 0.00 C ATOM 353 O SER A 27 -4.651 -17.705 -0.426 1.00 0.00 O ATOM 354 CB SER A 27 -5.142 -16.822 -3.549 1.00 0.00 C ATOM 355 OG SER A 27 -4.563 -18.075 -3.871 1.00 0.00 O ATOM 0 H SER A 27 -5.534 -14.871 -2.095 1.00 0.00 H new ATOM 0 HA SER A 27 -6.998 -17.184 -2.526 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.772 -16.486 -4.373 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.357 -16.076 -3.424 1.00 0.00 H new ATOM 0 HG SER A 27 -4.173 -18.034 -4.769 1.00 0.00 H new ATOM 361 N ASP A 28 -5.773 -19.243 -1.626 1.00 0.00 N ATOM 362 CA ASP A 28 -5.300 -20.369 -0.830 1.00 0.00 C ATOM 363 C ASP A 28 -3.870 -20.741 -1.210 1.00 0.00 C ATOM 364 O ASP A 28 -3.031 -20.984 -0.344 1.00 0.00 O ATOM 365 CB ASP A 28 -6.221 -21.576 -1.016 1.00 0.00 C ATOM 366 CG ASP A 28 -7.681 -21.228 -0.805 1.00 0.00 C ATOM 367 OD1 ASP A 28 -8.113 -21.167 0.365 1.00 0.00 O ATOM 368 OD2 ASP A 28 -8.392 -21.016 -1.810 1.00 0.00 O ATOM 0 H ASP A 28 -6.397 -19.500 -2.391 1.00 0.00 H new ATOM 0 HA ASP A 28 -5.312 -20.071 0.218 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -6.088 -21.979 -2.020 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.933 -22.361 -0.316 1.00 0.00 H new ATOM 373 N GLU A 29 -3.602 -20.784 -2.512 1.00 0.00 N ATOM 374 CA GLU A 29 -2.274 -21.128 -3.006 1.00 0.00 C ATOM 375 C GLU A 29 -1.369 -19.900 -3.037 1.00 0.00 C ATOM 376 O GLU A 29 -0.147 -20.012 -2.944 1.00 0.00 O ATOM 377 CB GLU A 29 -2.369 -21.741 -4.405 1.00 0.00 C ATOM 378 CG GLU A 29 -3.464 -22.786 -4.538 1.00 0.00 C ATOM 379 CD GLU A 29 -4.749 -22.216 -5.106 1.00 0.00 C ATOM 380 OE1 GLU A 29 -4.729 -21.748 -6.264 1.00 0.00 O ATOM 381 OE2 GLU A 29 -5.774 -22.238 -4.394 1.00 0.00 O ATOM 0 H GLU A 29 -4.286 -20.585 -3.242 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.840 -21.860 -2.325 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.547 -20.946 -5.130 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.412 -22.196 -4.659 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -3.114 -23.594 -5.181 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.666 -23.222 -3.560 1.00 0.00 H new ATOM 388 N HIS A 30 -1.980 -18.726 -3.170 1.00 0.00 N ATOM 389 CA HIS A 30 -1.230 -17.476 -3.214 1.00 0.00 C ATOM 390 C HIS A 30 -1.511 -16.631 -1.975 1.00 0.00 C ATOM 391 O HIS A 30 -2.659 -16.482 -1.560 1.00 0.00 O ATOM 392 CB HIS A 30 -1.586 -16.687 -4.475 1.00 0.00 C ATOM 393 CG HIS A 30 -1.562 -17.513 -5.724 1.00 0.00 C ATOM 394 ND1 HIS A 30 -2.591 -17.519 -6.642 1.00 0.00 N ATOM 395 CD2 HIS A 30 -0.624 -18.361 -6.207 1.00 0.00 C ATOM 396 CE1 HIS A 30 -2.288 -18.337 -7.634 1.00 0.00 C ATOM 397 NE2 HIS A 30 -1.099 -18.861 -7.394 1.00 0.00 N ATOM 0 H HIS A 30 -2.991 -18.615 -3.249 1.00 0.00 H new ATOM 0 HA HIS A 30 -0.168 -17.719 -3.234 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -2.579 -16.254 -4.355 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -0.887 -15.857 -4.584 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.322 -18.600 -5.744 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -2.907 -18.543 -8.495 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -0.613 -19.528 -7.993 1.00 0.00 H new ATOM 405 N GLY A 31 -0.453 -16.079 -1.388 1.00 0.00 N ATOM 406 CA GLY A 31 -0.606 -15.257 -0.203 1.00 0.00 C ATOM 407 C GLY A 31 -0.620 -13.775 -0.522 1.00 0.00 C ATOM 408 O GLY A 31 -0.237 -13.366 -1.618 1.00 0.00 O ATOM 0 H GLY A 31 0.508 -16.187 -1.713 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -1.533 -15.525 0.304 1.00 0.00 H new ATOM 0 HA3 GLY A 31 0.209 -15.469 0.490 1.00 0.00 H new ATOM 412 N PHE A 32 -1.063 -12.969 0.436 1.00 0.00 N ATOM 413 CA PHE A 32 -1.128 -11.524 0.251 1.00 0.00 C ATOM 414 C PHE A 32 0.152 -10.855 0.742 1.00 0.00 C ATOM 415 O PHE A 32 0.298 -9.635 0.662 1.00 0.00 O ATOM 416 CB PHE A 32 -2.336 -10.947 0.992 1.00 0.00 C ATOM 417 CG PHE A 32 -3.298 -10.220 0.096 1.00 0.00 C ATOM 418 CD1 PHE A 32 -2.904 -9.078 -0.584 1.00 0.00 C ATOM 419 CD2 PHE A 32 -4.595 -10.679 -0.068 1.00 0.00 C ATOM 420 CE1 PHE A 32 -3.788 -8.407 -1.408 1.00 0.00 C ATOM 421 CE2 PHE A 32 -5.482 -10.013 -0.891 1.00 0.00 C ATOM 422 CZ PHE A 32 -5.078 -8.876 -1.563 1.00 0.00 C ATOM 0 H PHE A 32 -1.383 -13.292 1.349 1.00 0.00 H new ATOM 0 HA PHE A 32 -1.236 -11.324 -0.815 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -2.863 -11.757 1.497 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -1.985 -10.264 1.766 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -1.896 -8.709 -0.469 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -4.916 -11.568 0.454 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.470 -7.517 -1.930 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.491 -10.381 -1.009 1.00 0.00 H new ATOM 0 HZ PHE A 32 -5.769 -8.355 -2.208 1.00 0.00 H new ATOM 432 N ASP A 33 1.077 -11.661 1.251 1.00 0.00 N ATOM 433 CA ASP A 33 2.345 -11.149 1.756 1.00 0.00 C ATOM 434 C ASP A 33 3.438 -11.267 0.698 1.00 0.00 C ATOM 435 O ASP A 33 4.437 -10.551 0.741 1.00 0.00 O ATOM 436 CB ASP A 33 2.758 -11.903 3.020 1.00 0.00 C ATOM 437 CG ASP A 33 1.712 -11.816 4.114 1.00 0.00 C ATOM 438 OD1 ASP A 33 0.604 -12.358 3.919 1.00 0.00 O ATOM 439 OD2 ASP A 33 2.000 -11.205 5.164 1.00 0.00 O ATOM 0 H ASP A 33 0.972 -12.673 1.325 1.00 0.00 H new ATOM 0 HA ASP A 33 2.212 -10.095 2.000 1.00 0.00 H new ATOM 0 HB2 ASP A 33 2.935 -12.950 2.773 1.00 0.00 H new ATOM 0 HB3 ASP A 33 3.700 -11.498 3.389 1.00 0.00 H new ATOM 444 N ASN A 34 3.241 -12.178 -0.250 1.00 0.00 N ATOM 445 CA ASN A 34 4.211 -12.391 -1.318 1.00 0.00 C ATOM 446 C ASN A 34 4.257 -11.192 -2.259 1.00 0.00 C ATOM 447 O ASN A 34 5.197 -11.037 -3.039 1.00 0.00 O ATOM 448 CB ASN A 34 3.865 -13.658 -2.104 1.00 0.00 C ATOM 449 CG ASN A 34 2.433 -13.655 -2.603 1.00 0.00 C ATOM 450 OD1 ASN A 34 1.877 -12.604 -2.921 1.00 0.00 O ATOM 451 ND2 ASN A 34 1.829 -14.835 -2.674 1.00 0.00 N ATOM 0 H ASN A 34 2.419 -12.780 -0.300 1.00 0.00 H new ATOM 0 HA ASN A 34 5.194 -12.510 -0.863 1.00 0.00 H new ATOM 0 HB2 ASN A 34 4.543 -13.752 -2.953 1.00 0.00 H new ATOM 0 HB3 ASN A 34 4.024 -14.530 -1.470 1.00 0.00 H new ATOM 0 HD21 ASN A 34 0.865 -14.896 -3.003 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.329 -15.681 -2.400 1.00 0.00 H new ATOM 458 N CYS A 35 3.236 -10.345 -2.180 1.00 0.00 N ATOM 459 CA CYS A 35 3.159 -9.159 -3.025 1.00 0.00 C ATOM 460 C CYS A 35 3.735 -7.942 -2.308 1.00 0.00 C ATOM 461 O CYS A 35 3.458 -6.801 -2.679 1.00 0.00 O ATOM 462 CB CYS A 35 1.709 -8.889 -3.430 1.00 0.00 C ATOM 463 SG CYS A 35 0.668 -8.281 -2.082 1.00 0.00 S ATOM 0 H CYS A 35 2.450 -10.458 -1.539 1.00 0.00 H new ATOM 0 HA CYS A 35 3.751 -9.343 -3.922 1.00 0.00 H new ATOM 0 HB2 CYS A 35 1.699 -8.160 -4.240 1.00 0.00 H new ATOM 0 HB3 CYS A 35 1.275 -9.808 -3.823 1.00 0.00 H new ATOM 0 HG CYS A 35 0.744 -9.097 -1.073 1.00 0.00 H new ATOM 469 N LEU A 36 4.536 -8.193 -1.279 1.00 0.00 N ATOM 470 CA LEU A 36 5.151 -7.118 -0.507 1.00 0.00 C ATOM 471 C LEU A 36 6.583 -6.868 -0.968 1.00 0.00 C ATOM 472 O LEU A 36 7.060 -5.733 -0.954 1.00 0.00 O ATOM 473 CB LEU A 36 5.135 -7.460 0.984 1.00 0.00 C ATOM 474 CG LEU A 36 3.786 -7.319 1.690 1.00 0.00 C ATOM 475 CD1 LEU A 36 3.737 -8.200 2.929 1.00 0.00 C ATOM 476 CD2 LEU A 36 3.526 -5.865 2.057 1.00 0.00 C ATOM 0 H LEU A 36 4.775 -9.132 -0.959 1.00 0.00 H new ATOM 0 HA LEU A 36 4.572 -6.209 -0.671 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.480 -8.487 1.105 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.857 -6.820 1.491 1.00 0.00 H new ATOM 0 HG LEU A 36 3.003 -7.646 1.006 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.770 -8.086 3.418 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.878 -9.242 2.641 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.529 -7.904 3.617 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.562 -5.783 2.559 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.313 -5.512 2.723 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.517 -5.257 1.152 1.00 0.00 H new ATOM 594 N LEU A 43 0.343 -12.421 -5.747 1.00 0.00 N ATOM 595 CA LEU A 43 -0.973 -12.517 -5.125 1.00 0.00 C ATOM 596 C LEU A 43 -2.079 -12.400 -6.169 1.00 0.00 C ATOM 597 O LEU A 43 -2.134 -11.427 -6.921 1.00 0.00 O ATOM 598 CB LEU A 43 -1.139 -11.426 -4.065 1.00 0.00 C ATOM 599 CG LEU A 43 -2.483 -11.397 -3.336 1.00 0.00 C ATOM 600 CD1 LEU A 43 -3.519 -10.644 -4.155 1.00 0.00 C ATOM 601 CD2 LEU A 43 -2.959 -12.812 -3.040 1.00 0.00 C ATOM 0 HA LEU A 43 -1.051 -13.494 -4.648 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.349 -11.545 -3.324 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.986 -10.458 -4.542 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.350 -10.874 -2.389 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.469 -10.634 -3.620 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.182 -9.620 -4.315 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.650 -11.137 -5.118 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.917 -12.773 -2.521 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.075 -13.360 -3.975 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.226 -13.318 -2.412 1.00 0.00 H new ATOM 613 N GLU A 44 -2.958 -13.396 -6.207 1.00 0.00 N ATOM 614 CA GLU A 44 -4.063 -13.403 -7.159 1.00 0.00 C ATOM 615 C GLU A 44 -5.401 -13.539 -6.438 1.00 0.00 C ATOM 616 O GLU A 44 -5.484 -14.143 -5.368 1.00 0.00 O ATOM 617 CB GLU A 44 -3.894 -14.546 -8.162 1.00 0.00 C ATOM 618 CG GLU A 44 -4.904 -14.514 -9.297 1.00 0.00 C ATOM 619 CD GLU A 44 -4.537 -15.451 -10.431 1.00 0.00 C ATOM 620 OE1 GLU A 44 -3.877 -16.477 -10.162 1.00 0.00 O ATOM 621 OE2 GLU A 44 -4.909 -15.159 -11.587 1.00 0.00 O ATOM 0 H GLU A 44 -2.927 -14.208 -5.590 1.00 0.00 H new ATOM 0 HA GLU A 44 -4.053 -12.454 -7.695 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.888 -14.505 -8.580 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.982 -15.496 -7.635 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -5.887 -14.784 -8.911 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.981 -13.497 -9.681 1.00 0.00 H new ATOM 628 N SER A 45 -6.446 -12.971 -7.031 1.00 0.00 N ATOM 629 CA SER A 45 -7.780 -13.024 -6.444 1.00 0.00 C ATOM 630 C SER A 45 -8.579 -14.192 -7.015 1.00 0.00 C ATOM 631 O SER A 45 -8.651 -14.374 -8.230 1.00 0.00 O ATOM 632 CB SER A 45 -8.524 -11.711 -6.696 1.00 0.00 C ATOM 633 OG SER A 45 -7.647 -10.716 -7.195 1.00 0.00 O ATOM 0 H SER A 45 -6.395 -12.469 -7.917 1.00 0.00 H new ATOM 0 HA SER A 45 -7.671 -13.171 -5.369 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.332 -11.878 -7.408 1.00 0.00 H new ATOM 0 HB3 SER A 45 -8.982 -11.365 -5.769 1.00 0.00 H new ATOM 0 HG SER A 45 -7.620 -10.764 -8.173 1.00 0.00 H new ATOM 639 N ASP A 46 -9.177 -14.981 -6.129 1.00 0.00 N ATOM 640 CA ASP A 46 -9.972 -16.131 -6.543 1.00 0.00 C ATOM 641 C ASP A 46 -11.447 -15.760 -6.656 1.00 0.00 C ATOM 642 O ASP A 46 -12.319 -16.630 -6.637 1.00 0.00 O ATOM 643 CB ASP A 46 -9.797 -17.282 -5.550 1.00 0.00 C ATOM 644 CG ASP A 46 -10.215 -18.618 -6.134 1.00 0.00 C ATOM 645 OD1 ASP A 46 -10.301 -18.722 -7.375 1.00 0.00 O ATOM 646 OD2 ASP A 46 -10.454 -19.558 -5.349 1.00 0.00 O ATOM 0 H ASP A 46 -9.126 -14.845 -5.119 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.621 -16.451 -7.524 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.754 -17.335 -5.239 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.386 -17.079 -4.655 1.00 0.00 H new ATOM 651 N CYS A 47 -11.719 -14.465 -6.772 1.00 0.00 N ATOM 652 CA CYS A 47 -13.089 -13.979 -6.886 1.00 0.00 C ATOM 653 C CYS A 47 -13.160 -12.766 -7.809 1.00 0.00 C ATOM 654 O CYS A 47 -13.798 -12.810 -8.861 1.00 0.00 O ATOM 655 CB CYS A 47 -13.641 -13.618 -5.507 1.00 0.00 C ATOM 656 SG CYS A 47 -15.408 -13.236 -5.495 1.00 0.00 S ATOM 0 H CYS A 47 -11.009 -13.733 -6.790 1.00 0.00 H new ATOM 0 HA CYS A 47 -13.697 -14.776 -7.315 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -13.455 -14.447 -4.825 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -13.092 -12.759 -5.121 1.00 0.00 H new ATOM 0 HG CYS A 47 -15.781 -12.945 -4.284 1.00 0.00 H new ATOM 662 N ASP A 48 -12.503 -11.684 -7.406 1.00 0.00 N ATOM 663 CA ASP A 48 -12.492 -10.458 -8.196 1.00 0.00 C ATOM 664 C ASP A 48 -11.656 -9.380 -7.514 1.00 0.00 C ATOM 665 O ASP A 48 -10.959 -9.648 -6.536 1.00 0.00 O ATOM 666 CB ASP A 48 -13.920 -9.953 -8.413 1.00 0.00 C ATOM 667 CG ASP A 48 -14.309 -9.928 -9.878 1.00 0.00 C ATOM 668 OD1 ASP A 48 -14.795 -10.962 -10.380 1.00 0.00 O ATOM 669 OD2 ASP A 48 -14.126 -8.874 -10.522 1.00 0.00 O ATOM 0 H ASP A 48 -11.971 -11.631 -6.537 1.00 0.00 H new ATOM 0 HA ASP A 48 -12.043 -10.682 -9.164 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -14.615 -10.591 -7.866 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -14.014 -8.950 -7.998 1.00 0.00 H new ATOM 674 N GLU A 49 -11.730 -8.160 -8.038 1.00 0.00 N ATOM 675 CA GLU A 49 -10.978 -7.043 -7.480 1.00 0.00 C ATOM 676 C GLU A 49 -11.674 -6.482 -6.243 1.00 0.00 C ATOM 677 O GLU A 49 -11.999 -5.297 -6.186 1.00 0.00 O ATOM 678 CB GLU A 49 -10.809 -5.940 -8.527 1.00 0.00 C ATOM 679 CG GLU A 49 -12.101 -5.570 -9.236 1.00 0.00 C ATOM 680 CD GLU A 49 -12.284 -6.318 -10.543 1.00 0.00 C ATOM 681 OE1 GLU A 49 -11.568 -7.318 -10.758 1.00 0.00 O ATOM 682 OE2 GLU A 49 -13.143 -5.904 -11.349 1.00 0.00 O ATOM 0 H GLU A 49 -12.303 -7.921 -8.847 1.00 0.00 H new ATOM 0 HA GLU A 49 -9.995 -7.411 -7.187 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.402 -5.052 -8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.078 -6.263 -9.268 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -12.945 -5.782 -8.579 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -12.110 -4.498 -9.431 1.00 0.00 H new ATOM 689 N GLN A 50 -11.898 -7.344 -5.256 1.00 0.00 N ATOM 690 CA GLN A 50 -12.556 -6.935 -4.021 1.00 0.00 C ATOM 691 C GLN A 50 -11.788 -7.438 -2.803 1.00 0.00 C ATOM 692 O GLN A 50 -12.384 -7.842 -1.803 1.00 0.00 O ATOM 693 CB GLN A 50 -13.992 -7.460 -3.985 1.00 0.00 C ATOM 694 CG GLN A 50 -14.916 -6.772 -4.977 1.00 0.00 C ATOM 695 CD GLN A 50 -15.875 -5.806 -4.308 1.00 0.00 C ATOM 696 OE1 GLN A 50 -16.811 -6.218 -3.623 1.00 0.00 O ATOM 697 NE2 GLN A 50 -15.645 -4.513 -4.505 1.00 0.00 N ATOM 0 H GLN A 50 -11.634 -8.329 -5.288 1.00 0.00 H new ATOM 0 HA GLN A 50 -12.574 -5.846 -3.992 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -13.984 -8.530 -4.191 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -14.392 -7.332 -2.979 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -14.318 -6.234 -5.712 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -15.486 -7.526 -5.520 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -14.857 -4.217 -5.081 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -16.257 -3.816 -4.081 1.00 0.00 H new ATOM 706 N LEU A 51 -10.463 -7.412 -2.893 1.00 0.00 N ATOM 707 CA LEU A 51 -9.612 -7.866 -1.798 1.00 0.00 C ATOM 708 C LEU A 51 -9.130 -6.687 -0.959 1.00 0.00 C ATOM 709 O LEU A 51 -8.950 -5.580 -1.469 1.00 0.00 O ATOM 710 CB LEU A 51 -8.413 -8.641 -2.346 1.00 0.00 C ATOM 711 CG LEU A 51 -8.706 -9.611 -3.491 1.00 0.00 C ATOM 712 CD1 LEU A 51 -7.951 -9.200 -4.746 1.00 0.00 C ATOM 713 CD2 LEU A 51 -8.345 -11.034 -3.091 1.00 0.00 C ATOM 0 H LEU A 51 -9.954 -7.081 -3.713 1.00 0.00 H new ATOM 0 HA LEU A 51 -10.202 -8.525 -1.161 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.667 -7.923 -2.687 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.964 -9.203 -1.527 1.00 0.00 H new ATOM 0 HG LEU A 51 -9.774 -9.576 -3.707 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.172 -9.902 -5.550 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.259 -8.198 -5.044 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -6.880 -9.205 -4.544 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.560 -11.710 -3.918 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.284 -11.085 -2.847 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.932 -11.327 -2.221 1.00 0.00 H new ATOM 725 N LEU A 52 -8.921 -6.932 0.330 1.00 0.00 N ATOM 726 CA LEU A 52 -8.457 -5.891 1.241 1.00 0.00 C ATOM 727 C LEU A 52 -7.070 -6.221 1.783 1.00 0.00 C ATOM 728 O LEU A 52 -6.690 -7.389 1.873 1.00 0.00 O ATOM 729 CB LEU A 52 -9.443 -5.722 2.398 1.00 0.00 C ATOM 730 CG LEU A 52 -10.373 -4.511 2.316 1.00 0.00 C ATOM 731 CD1 LEU A 52 -11.823 -4.941 2.469 1.00 0.00 C ATOM 732 CD2 LEU A 52 -10.004 -3.483 3.375 1.00 0.00 C ATOM 0 H LEU A 52 -9.065 -7.842 0.768 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.396 -4.956 0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.055 -6.622 2.461 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.875 -5.657 3.326 1.00 0.00 H new ATOM 0 HG LEU A 52 -10.254 -4.051 1.335 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.470 -4.066 2.408 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -12.081 -5.640 1.673 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.959 -5.426 3.436 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.676 -2.628 3.302 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.094 -3.932 4.364 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -8.977 -3.152 3.218 1.00 0.00 H new ATOM 744 N ILE A 53 -6.320 -5.186 2.146 1.00 0.00 N ATOM 745 CA ILE A 53 -4.977 -5.367 2.683 1.00 0.00 C ATOM 746 C ILE A 53 -4.765 -4.517 3.931 1.00 0.00 C ATOM 747 O ILE A 53 -4.769 -3.288 3.868 1.00 0.00 O ATOM 748 CB ILE A 53 -3.901 -5.006 1.641 1.00 0.00 C ATOM 749 CG1 ILE A 53 -4.121 -5.800 0.352 1.00 0.00 C ATOM 750 CG2 ILE A 53 -2.512 -5.269 2.202 1.00 0.00 C ATOM 751 CD1 ILE A 53 -4.707 -4.976 -0.773 1.00 0.00 C ATOM 0 H ILE A 53 -6.620 -4.213 2.078 1.00 0.00 H new ATOM 0 HA ILE A 53 -4.880 -6.421 2.943 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.982 -3.944 1.409 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -3.169 -6.220 0.026 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.785 -6.639 0.561 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.762 -5.009 1.454 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.359 -4.663 3.095 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.417 -6.324 2.459 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.836 -5.604 -1.655 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -5.674 -4.578 -0.467 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.034 -4.152 -1.009 1.00 0.00 H new ATOM 763 N THR A 54 -4.579 -5.182 5.068 1.00 0.00 N ATOM 764 CA THR A 54 -4.365 -4.489 6.332 1.00 0.00 C ATOM 765 C THR A 54 -2.881 -4.409 6.670 1.00 0.00 C ATOM 766 O THR A 54 -2.114 -5.322 6.365 1.00 0.00 O ATOM 767 CB THR A 54 -5.106 -5.187 7.488 1.00 0.00 C ATOM 768 OG1 THR A 54 -6.510 -5.242 7.207 1.00 0.00 O ATOM 769 CG2 THR A 54 -4.875 -4.453 8.800 1.00 0.00 C ATOM 0 H THR A 54 -4.572 -6.200 5.138 1.00 0.00 H new ATOM 0 HA THR A 54 -4.763 -3.481 6.211 1.00 0.00 H new ATOM 0 HB THR A 54 -4.714 -6.200 7.583 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.974 -5.689 7.946 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.408 -4.964 9.602 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.809 -4.438 9.025 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.243 -3.430 8.714 1.00 0.00 H new ATOM 777 N VAL A 55 -2.482 -3.310 7.304 1.00 0.00 N ATOM 778 CA VAL A 55 -1.089 -3.112 7.686 1.00 0.00 C ATOM 779 C VAL A 55 -0.982 -2.531 9.091 1.00 0.00 C ATOM 780 O VAL A 55 -1.547 -1.478 9.383 1.00 0.00 O ATOM 781 CB VAL A 55 -0.364 -2.177 6.699 1.00 0.00 C ATOM 782 CG1 VAL A 55 1.144 -2.339 6.820 1.00 0.00 C ATOM 783 CG2 VAL A 55 -0.825 -2.446 5.275 1.00 0.00 C ATOM 0 H VAL A 55 -3.104 -2.544 7.563 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.612 -4.092 7.664 1.00 0.00 H new ATOM 0 HB VAL A 55 -0.616 -1.146 6.949 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.639 -1.671 6.115 1.00 0.00 H new ATOM 0 HG12 VAL A 55 1.456 -2.092 7.835 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.418 -3.370 6.597 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -0.303 -1.777 4.591 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.604 -3.480 5.010 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.899 -2.274 5.202 1.00 0.00 H new ATOM 793 N ALA A 56 -0.251 -3.225 9.958 1.00 0.00 N ATOM 794 CA ALA A 56 -0.068 -2.777 11.333 1.00 0.00 C ATOM 795 C ALA A 56 1.342 -2.237 11.551 1.00 0.00 C ATOM 796 O ALA A 56 2.319 -2.984 11.497 1.00 0.00 O ATOM 797 CB ALA A 56 -0.355 -3.914 12.302 1.00 0.00 C ATOM 0 H ALA A 56 0.224 -4.099 9.732 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.773 -1.967 11.522 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.214 -3.565 13.325 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.383 -4.252 12.172 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.326 -4.741 12.104 1.00 0.00 H new ATOM 803 N PHE A 57 1.441 -0.935 11.797 1.00 0.00 N ATOM 804 CA PHE A 57 2.732 -0.295 12.021 1.00 0.00 C ATOM 805 C PHE A 57 3.035 -0.191 13.513 1.00 0.00 C ATOM 806 O PHE A 57 2.276 0.410 14.271 1.00 0.00 O ATOM 807 CB PHE A 57 2.752 1.097 11.387 1.00 0.00 C ATOM 808 CG PHE A 57 3.029 1.080 9.911 1.00 0.00 C ATOM 809 CD1 PHE A 57 4.318 0.895 9.437 1.00 0.00 C ATOM 810 CD2 PHE A 57 2.001 1.250 8.997 1.00 0.00 C ATOM 811 CE1 PHE A 57 4.577 0.877 8.079 1.00 0.00 C ATOM 812 CE2 PHE A 57 2.254 1.233 7.639 1.00 0.00 C ATOM 813 CZ PHE A 57 3.543 1.048 7.179 1.00 0.00 C ATOM 0 H PHE A 57 0.643 -0.302 11.846 1.00 0.00 H new ATOM 0 HA PHE A 57 3.501 -0.910 11.554 1.00 0.00 H new ATOM 0 HB2 PHE A 57 1.791 1.581 11.563 1.00 0.00 H new ATOM 0 HB3 PHE A 57 3.510 1.703 11.884 1.00 0.00 H new ATOM 0 HD1 PHE A 57 5.130 0.763 10.137 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.991 1.397 9.350 1.00 0.00 H new ATOM 0 HE1 PHE A 57 5.586 0.730 7.723 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.444 1.364 6.937 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.742 1.037 6.118 1.00 0.00 H new ATOM 823 N ASN A 58 4.152 -0.782 13.926 1.00 0.00 N ATOM 824 CA ASN A 58 4.556 -0.758 15.327 1.00 0.00 C ATOM 825 C ASN A 58 4.828 0.670 15.790 1.00 0.00 C ATOM 826 O ASN A 58 4.762 0.969 16.981 1.00 0.00 O ATOM 827 CB ASN A 58 5.804 -1.620 15.534 1.00 0.00 C ATOM 828 CG ASN A 58 5.526 -3.097 15.333 1.00 0.00 C ATOM 829 OD1 ASN A 58 4.748 -3.700 16.073 1.00 0.00 O ATOM 830 ND2 ASN A 58 6.162 -3.687 14.327 1.00 0.00 N ATOM 0 H ASN A 58 4.793 -1.283 13.311 1.00 0.00 H new ATOM 0 HA ASN A 58 3.739 -1.165 15.923 1.00 0.00 H new ATOM 0 HB2 ASN A 58 6.581 -1.302 14.840 1.00 0.00 H new ATOM 0 HB3 ASN A 58 6.190 -1.459 16.541 1.00 0.00 H new ATOM 0 HD21 ASN A 58 6.014 -4.679 14.142 1.00 0.00 H new ATOM 0 HD22 ASN A 58 6.798 -3.148 13.739 1.00 0.00 H new ATOM 837 N GLN A 59 5.135 1.546 14.838 1.00 0.00 N ATOM 838 CA GLN A 59 5.417 2.943 15.149 1.00 0.00 C ATOM 839 C GLN A 59 4.656 3.874 14.211 1.00 0.00 C ATOM 840 O GLN A 59 4.477 3.591 13.026 1.00 0.00 O ATOM 841 CB GLN A 59 6.919 3.216 15.050 1.00 0.00 C ATOM 842 CG GLN A 59 7.464 3.112 13.634 1.00 0.00 C ATOM 843 CD GLN A 59 8.175 4.375 13.189 1.00 0.00 C ATOM 844 OE1 GLN A 59 9.334 4.335 12.775 1.00 0.00 O ATOM 845 NE2 GLN A 59 7.483 5.505 13.273 1.00 0.00 N ATOM 0 H GLN A 59 5.195 1.314 13.847 1.00 0.00 H new ATOM 0 HA GLN A 59 5.086 3.136 16.170 1.00 0.00 H new ATOM 0 HB2 GLN A 59 7.125 4.214 15.437 1.00 0.00 H new ATOM 0 HB3 GLN A 59 7.451 2.510 15.688 1.00 0.00 H new ATOM 0 HG2 GLN A 59 8.155 2.271 13.575 1.00 0.00 H new ATOM 0 HG3 GLN A 59 6.644 2.900 12.948 1.00 0.00 H new ATOM 0 HE21 GLN A 59 6.525 5.491 13.622 1.00 0.00 H new ATOM 0 HE22 GLN A 59 7.910 6.387 12.988 1.00 0.00 H new ATOM 854 N PRO A 60 4.195 5.012 14.751 1.00 0.00 N ATOM 855 CA PRO A 60 3.446 6.008 13.979 1.00 0.00 C ATOM 856 C PRO A 60 4.321 6.730 12.961 1.00 0.00 C ATOM 857 O PRO A 60 5.179 7.535 13.324 1.00 0.00 O ATOM 858 CB PRO A 60 2.951 6.986 15.048 1.00 0.00 C ATOM 859 CG PRO A 60 3.927 6.851 16.166 1.00 0.00 C ATOM 860 CD PRO A 60 4.372 5.414 16.157 1.00 0.00 C ATOM 0 HA PRO A 60 2.646 5.553 13.394 1.00 0.00 H new ATOM 0 HB2 PRO A 60 2.923 8.007 14.668 1.00 0.00 H new ATOM 0 HB3 PRO A 60 1.940 6.739 15.373 1.00 0.00 H new ATOM 0 HG2 PRO A 60 4.774 7.523 16.027 1.00 0.00 H new ATOM 0 HG3 PRO A 60 3.467 7.111 17.119 1.00 0.00 H new ATOM 0 HD2 PRO A 60 5.409 5.312 16.477 1.00 0.00 H new ATOM 0 HD3 PRO A 60 3.770 4.802 16.829 1.00 0.00 H new ATOM 868 N VAL A 61 4.098 6.439 11.683 1.00 0.00 N ATOM 869 CA VAL A 61 4.865 7.062 10.612 1.00 0.00 C ATOM 870 C VAL A 61 3.990 7.990 9.777 1.00 0.00 C ATOM 871 O VAL A 61 2.839 8.256 10.125 1.00 0.00 O ATOM 872 CB VAL A 61 5.501 6.005 9.688 1.00 0.00 C ATOM 873 CG1 VAL A 61 6.336 5.024 10.496 1.00 0.00 C ATOM 874 CG2 VAL A 61 4.426 5.277 8.894 1.00 0.00 C ATOM 0 H VAL A 61 3.392 5.775 11.365 1.00 0.00 H new ATOM 0 HA VAL A 61 5.656 7.643 11.086 1.00 0.00 H new ATOM 0 HB VAL A 61 6.160 6.511 8.983 1.00 0.00 H new ATOM 0 HG11 VAL A 61 6.777 4.285 9.827 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.129 5.563 11.015 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.701 4.520 11.225 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.892 4.534 8.247 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.740 4.781 9.580 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.875 5.994 8.285 1.00 0.00 H new ATOM 884 N LYS A 62 4.542 8.480 8.672 1.00 0.00 N ATOM 885 CA LYS A 62 3.812 9.378 7.785 1.00 0.00 C ATOM 886 C LYS A 62 3.748 8.811 6.370 1.00 0.00 C ATOM 887 O LYS A 62 4.779 8.566 5.741 1.00 0.00 O ATOM 888 CB LYS A 62 4.475 10.757 7.763 1.00 0.00 C ATOM 889 CG LYS A 62 4.511 11.436 9.122 1.00 0.00 C ATOM 890 CD LYS A 62 4.176 12.914 9.016 1.00 0.00 C ATOM 891 CE LYS A 62 5.434 13.765 8.928 1.00 0.00 C ATOM 892 NZ LYS A 62 5.831 14.306 10.257 1.00 0.00 N ATOM 0 H LYS A 62 5.493 8.270 8.369 1.00 0.00 H new ATOM 0 HA LYS A 62 2.795 9.476 8.165 1.00 0.00 H new ATOM 0 HB2 LYS A 62 5.494 10.655 7.390 1.00 0.00 H new ATOM 0 HB3 LYS A 62 3.941 11.397 7.060 1.00 0.00 H new ATOM 0 HG2 LYS A 62 3.803 10.949 9.792 1.00 0.00 H new ATOM 0 HG3 LYS A 62 5.501 11.317 9.563 1.00 0.00 H new ATOM 0 HD2 LYS A 62 3.557 13.086 8.136 1.00 0.00 H new ATOM 0 HD3 LYS A 62 3.589 13.218 9.883 1.00 0.00 H new ATOM 0 HE2 LYS A 62 6.249 13.167 8.521 1.00 0.00 H new ATOM 0 HE3 LYS A 62 5.267 14.590 8.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 6.692 14.880 10.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 5.063 14.897 10.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 6.015 13.519 10.911 1.00 0.00 H new ATOM 906 N LEU A 63 2.533 8.606 5.874 1.00 0.00 N ATOM 907 CA LEU A 63 2.335 8.069 4.532 1.00 0.00 C ATOM 908 C LEU A 63 2.361 9.183 3.491 1.00 0.00 C ATOM 909 O LEU A 63 1.326 9.760 3.158 1.00 0.00 O ATOM 910 CB LEU A 63 1.007 7.314 4.455 1.00 0.00 C ATOM 911 CG LEU A 63 0.808 6.198 5.481 1.00 0.00 C ATOM 912 CD1 LEU A 63 -0.465 5.421 5.185 1.00 0.00 C ATOM 913 CD2 LEU A 63 2.012 5.267 5.496 1.00 0.00 C ATOM 0 H LEU A 63 1.670 8.803 6.381 1.00 0.00 H new ATOM 0 HA LEU A 63 3.151 7.379 4.319 1.00 0.00 H new ATOM 0 HB2 LEU A 63 0.196 8.033 4.569 1.00 0.00 H new ATOM 0 HB3 LEU A 63 0.914 6.884 3.458 1.00 0.00 H new ATOM 0 HG LEU A 63 0.711 6.651 6.468 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.590 4.631 5.926 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.321 6.095 5.226 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.399 4.979 4.191 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.853 4.479 6.232 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.140 4.822 4.509 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.906 5.833 5.758 1.00 0.00 H new ATOM 925 N TYR A 64 3.550 9.479 2.978 1.00 0.00 N ATOM 926 CA TYR A 64 3.712 10.524 1.975 1.00 0.00 C ATOM 927 C TYR A 64 3.318 10.016 0.591 1.00 0.00 C ATOM 928 O TYR A 64 2.827 10.775 -0.245 1.00 0.00 O ATOM 929 CB TYR A 64 5.158 11.023 1.955 1.00 0.00 C ATOM 930 CG TYR A 64 5.500 11.934 3.112 1.00 0.00 C ATOM 931 CD1 TYR A 64 5.976 11.418 4.311 1.00 0.00 C ATOM 932 CD2 TYR A 64 5.346 13.311 3.006 1.00 0.00 C ATOM 933 CE1 TYR A 64 6.290 12.247 5.371 1.00 0.00 C ATOM 934 CE2 TYR A 64 5.658 14.147 4.060 1.00 0.00 C ATOM 935 CZ TYR A 64 6.129 13.611 5.240 1.00 0.00 C ATOM 936 OH TYR A 64 6.440 14.440 6.293 1.00 0.00 O ATOM 0 H TYR A 64 4.416 9.009 3.241 1.00 0.00 H new ATOM 0 HA TYR A 64 3.054 11.351 2.240 1.00 0.00 H new ATOM 0 HB2 TYR A 64 5.830 10.165 1.968 1.00 0.00 H new ATOM 0 HB3 TYR A 64 5.337 11.554 1.020 1.00 0.00 H new ATOM 0 HD1 TYR A 64 6.103 10.351 4.416 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.976 13.734 2.084 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.659 11.830 6.296 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.534 15.215 3.961 1.00 0.00 H new ATOM 0 HH TYR A 64 6.271 15.371 6.037 1.00 0.00 H new ATOM 946 N SER A 65 3.537 8.726 0.357 1.00 0.00 N ATOM 947 CA SER A 65 3.208 8.115 -0.925 1.00 0.00 C ATOM 948 C SER A 65 3.027 6.607 -0.778 1.00 0.00 C ATOM 949 O SER A 65 3.347 6.031 0.261 1.00 0.00 O ATOM 950 CB SER A 65 4.305 8.411 -1.951 1.00 0.00 C ATOM 951 OG SER A 65 5.279 9.291 -1.416 1.00 0.00 O ATOM 0 H SER A 65 3.941 8.084 1.039 1.00 0.00 H new ATOM 0 HA SER A 65 2.268 8.544 -1.274 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.781 7.480 -2.258 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.863 8.852 -2.844 1.00 0.00 H new ATOM 0 HG SER A 65 5.969 9.463 -2.090 1.00 0.00 H new ATOM 957 N MET A 66 2.511 5.975 -1.827 1.00 0.00 N ATOM 958 CA MET A 66 2.288 4.534 -1.816 1.00 0.00 C ATOM 959 C MET A 66 2.650 3.917 -3.164 1.00 0.00 C ATOM 960 O MET A 66 2.318 4.461 -4.217 1.00 0.00 O ATOM 961 CB MET A 66 0.829 4.225 -1.476 1.00 0.00 C ATOM 962 CG MET A 66 0.374 2.851 -1.943 1.00 0.00 C ATOM 963 SD MET A 66 -1.304 2.459 -1.414 1.00 0.00 S ATOM 964 CE MET A 66 -2.249 3.058 -2.813 1.00 0.00 C ATOM 0 H MET A 66 2.240 6.438 -2.695 1.00 0.00 H new ATOM 0 HA MET A 66 2.932 4.098 -1.052 1.00 0.00 H new ATOM 0 HB2 MET A 66 0.693 4.296 -0.397 1.00 0.00 H new ATOM 0 HB3 MET A 66 0.190 4.984 -1.929 1.00 0.00 H new ATOM 0 HG2 MET A 66 0.428 2.805 -3.031 1.00 0.00 H new ATOM 0 HG3 MET A 66 1.058 2.095 -1.557 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.266 3.287 -2.494 1.00 0.00 H new ATOM 0 HE2 MET A 66 -1.781 3.960 -3.209 1.00 0.00 H new ATOM 0 HE3 MET A 66 -2.276 2.293 -3.589 1.00 0.00 H new ATOM 974 N LYS A 67 3.334 2.779 -3.124 1.00 0.00 N ATOM 975 CA LYS A 67 3.741 2.087 -4.341 1.00 0.00 C ATOM 976 C LYS A 67 2.865 0.864 -4.591 1.00 0.00 C ATOM 977 O LYS A 67 3.134 -0.221 -4.074 1.00 0.00 O ATOM 978 CB LYS A 67 5.209 1.665 -4.246 1.00 0.00 C ATOM 979 CG LYS A 67 6.184 2.824 -4.361 1.00 0.00 C ATOM 980 CD LYS A 67 7.564 2.352 -4.787 1.00 0.00 C ATOM 981 CE LYS A 67 8.344 3.461 -5.476 1.00 0.00 C ATOM 982 NZ LYS A 67 9.343 2.920 -6.439 1.00 0.00 N ATOM 0 H LYS A 67 3.618 2.316 -2.261 1.00 0.00 H new ATOM 0 HA LYS A 67 3.620 2.775 -5.178 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.372 1.157 -3.295 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.422 0.942 -5.034 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.807 3.547 -5.084 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.254 3.338 -3.402 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.117 2.005 -3.914 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.467 1.501 -5.461 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.652 4.119 -6.002 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.853 4.067 -4.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.854 3.707 -6.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.019 2.312 -5.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.855 2.363 -7.169 1.00 0.00 H new ATOM 996 N PHE A 68 1.816 1.045 -5.387 1.00 0.00 N ATOM 997 CA PHE A 68 0.900 -0.044 -5.705 1.00 0.00 C ATOM 998 C PHE A 68 0.967 -0.394 -7.189 1.00 0.00 C ATOM 999 O PHE A 68 0.729 0.454 -8.048 1.00 0.00 O ATOM 1000 CB PHE A 68 -0.532 0.337 -5.323 1.00 0.00 C ATOM 1001 CG PHE A 68 -1.281 -0.765 -4.631 1.00 0.00 C ATOM 1002 CD1 PHE A 68 -0.709 -1.450 -3.571 1.00 0.00 C ATOM 1003 CD2 PHE A 68 -2.557 -1.117 -5.041 1.00 0.00 C ATOM 1004 CE1 PHE A 68 -1.396 -2.465 -2.931 1.00 0.00 C ATOM 1005 CE2 PHE A 68 -3.249 -2.131 -4.405 1.00 0.00 C ATOM 1006 CZ PHE A 68 -2.667 -2.806 -3.350 1.00 0.00 C ATOM 0 H PHE A 68 1.579 1.936 -5.824 1.00 0.00 H new ATOM 0 HA PHE A 68 1.201 -0.919 -5.129 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.506 1.211 -4.673 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.075 0.625 -6.223 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.285 -1.188 -3.241 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.016 -0.593 -5.867 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.940 -2.990 -2.105 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -4.244 -2.395 -4.733 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.205 -3.600 -2.853 1.00 0.00 H new ATOM 1016 N GLN A 69 1.292 -1.649 -7.480 1.00 0.00 N ATOM 1017 CA GLN A 69 1.392 -2.112 -8.860 1.00 0.00 C ATOM 1018 C GLN A 69 1.021 -3.587 -8.967 1.00 0.00 C ATOM 1019 O GLN A 69 0.510 -4.180 -8.018 1.00 0.00 O ATOM 1020 CB GLN A 69 2.807 -1.889 -9.394 1.00 0.00 C ATOM 1021 CG GLN A 69 3.691 -1.080 -8.458 1.00 0.00 C ATOM 1022 CD GLN A 69 5.112 -0.945 -8.968 1.00 0.00 C ATOM 1023 OE1 GLN A 69 5.508 -1.616 -9.921 1.00 0.00 O ATOM 1024 NE2 GLN A 69 5.888 -0.074 -8.334 1.00 0.00 N ATOM 0 H GLN A 69 1.491 -2.364 -6.780 1.00 0.00 H new ATOM 0 HA GLN A 69 0.690 -1.535 -9.462 1.00 0.00 H new ATOM 0 HB2 GLN A 69 3.274 -2.857 -9.575 1.00 0.00 H new ATOM 0 HB3 GLN A 69 2.747 -1.379 -10.355 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.261 -0.087 -8.326 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.705 -1.555 -7.477 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.518 0.461 -7.549 1.00 0.00 H new ATOM 0 HE22 GLN A 69 6.854 0.060 -8.632 1.00 0.00 H new ATOM 1033 N GLY A 70 1.283 -4.175 -10.131 1.00 0.00 N ATOM 1034 CA GLY A 70 0.970 -5.577 -10.341 1.00 0.00 C ATOM 1035 C GLY A 70 1.993 -6.274 -11.215 1.00 0.00 C ATOM 1036 O GLY A 70 3.092 -5.769 -11.445 1.00 0.00 O ATOM 0 H GLY A 70 1.706 -3.706 -10.932 1.00 0.00 H new ATOM 0 HA2 GLY A 70 0.916 -6.082 -9.377 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.014 -5.661 -10.801 1.00 0.00 H new ATOM 1040 N PRO A 71 1.635 -7.465 -11.718 1.00 0.00 N ATOM 1041 CA PRO A 71 2.516 -8.259 -12.578 1.00 0.00 C ATOM 1042 C PRO A 71 2.708 -7.627 -13.953 1.00 0.00 C ATOM 1043 O PRO A 71 2.296 -6.491 -14.187 1.00 0.00 O ATOM 1044 CB PRO A 71 1.781 -9.596 -12.702 1.00 0.00 C ATOM 1045 CG PRO A 71 0.348 -9.262 -12.471 1.00 0.00 C ATOM 1046 CD PRO A 71 0.340 -8.127 -11.485 1.00 0.00 C ATOM 0 HA PRO A 71 3.520 -8.346 -12.163 1.00 0.00 H new ATOM 0 HB2 PRO A 71 1.930 -10.040 -13.686 1.00 0.00 H new ATOM 0 HB3 PRO A 71 2.143 -10.317 -11.969 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -0.140 -8.973 -13.402 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -0.195 -10.122 -12.080 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.495 -7.449 -11.659 1.00 0.00 H new ATOM 0 HD3 PRO A 71 0.251 -8.486 -10.460 1.00 0.00 H new ATOM 1054 N ASP A 72 3.335 -8.370 -14.858 1.00 0.00 N ATOM 1055 CA ASP A 72 3.580 -7.882 -16.210 1.00 0.00 C ATOM 1056 C ASP A 72 2.615 -8.524 -17.202 1.00 0.00 C ATOM 1057 O ASP A 72 2.942 -8.701 -18.375 1.00 0.00 O ATOM 1058 CB ASP A 72 5.024 -8.169 -16.625 1.00 0.00 C ATOM 1059 CG ASP A 72 6.016 -7.244 -15.948 1.00 0.00 C ATOM 1060 OD1 ASP A 72 6.034 -7.205 -14.699 1.00 0.00 O ATOM 1061 OD2 ASP A 72 6.774 -6.560 -16.666 1.00 0.00 O ATOM 0 H ASP A 72 3.683 -9.312 -14.680 1.00 0.00 H new ATOM 0 HA ASP A 72 3.416 -6.804 -16.216 1.00 0.00 H new ATOM 0 HB2 ASP A 72 5.270 -9.202 -16.381 1.00 0.00 H new ATOM 0 HB3 ASP A 72 5.115 -8.066 -17.706 1.00 0.00 H new ATOM 1066 N ASN A 73 1.426 -8.872 -16.723 1.00 0.00 N ATOM 1067 CA ASN A 73 0.414 -9.496 -17.567 1.00 0.00 C ATOM 1068 C ASN A 73 -0.605 -8.467 -18.047 1.00 0.00 C ATOM 1069 O ASN A 73 -1.153 -8.584 -19.142 1.00 0.00 O ATOM 1070 CB ASN A 73 -0.297 -10.616 -16.805 1.00 0.00 C ATOM 1071 CG ASN A 73 -1.542 -11.103 -17.520 1.00 0.00 C ATOM 1072 OD1 ASN A 73 -1.501 -11.436 -18.704 1.00 0.00 O ATOM 1073 ND2 ASN A 73 -2.658 -11.145 -16.801 1.00 0.00 N ATOM 0 H ASN A 73 1.139 -8.732 -15.754 1.00 0.00 H new ATOM 0 HA ASN A 73 0.915 -9.919 -18.438 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.390 -11.451 -16.668 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.568 -10.260 -15.811 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.528 -11.463 -17.228 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.645 -10.859 -15.822 1.00 0.00 H new ATOM 1080 N GLY A 74 -0.852 -7.457 -17.219 1.00 0.00 N ATOM 1081 CA GLY A 74 -1.804 -6.421 -17.576 1.00 0.00 C ATOM 1082 C GLY A 74 -2.948 -6.318 -16.586 1.00 0.00 C ATOM 1083 O GLY A 74 -4.024 -5.826 -16.922 1.00 0.00 O ATOM 0 H GLY A 74 -0.410 -7.337 -16.307 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -1.289 -5.462 -17.632 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -2.204 -6.626 -18.569 1.00 0.00 H new ATOM 1087 N GLN A 75 -2.714 -6.784 -15.364 1.00 0.00 N ATOM 1088 CA GLN A 75 -3.735 -6.744 -14.323 1.00 0.00 C ATOM 1089 C GLN A 75 -3.235 -5.986 -13.098 1.00 0.00 C ATOM 1090 O GLN A 75 -2.509 -6.535 -12.270 1.00 0.00 O ATOM 1091 CB GLN A 75 -4.145 -8.164 -13.927 1.00 0.00 C ATOM 1092 CG GLN A 75 -4.829 -8.934 -15.046 1.00 0.00 C ATOM 1093 CD GLN A 75 -5.821 -9.957 -14.528 1.00 0.00 C ATOM 1094 OE1 GLN A 75 -6.932 -10.076 -15.044 1.00 0.00 O ATOM 1095 NE2 GLN A 75 -5.423 -10.702 -13.504 1.00 0.00 N ATOM 0 H GLN A 75 -1.827 -7.193 -15.070 1.00 0.00 H new ATOM 0 HA GLN A 75 -4.604 -6.220 -14.721 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -3.259 -8.713 -13.608 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -4.815 -8.114 -13.069 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -5.345 -8.233 -15.702 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.074 -9.438 -15.649 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -4.493 -10.569 -13.108 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -6.048 -11.408 -13.114 1.00 0.00 H new ATOM 1104 N GLY A 76 -3.627 -4.720 -12.990 1.00 0.00 N ATOM 1105 CA GLY A 76 -3.208 -3.908 -11.863 1.00 0.00 C ATOM 1106 C GLY A 76 -4.355 -3.125 -11.255 1.00 0.00 C ATOM 1107 O GLY A 76 -5.331 -2.790 -11.926 1.00 0.00 O ATOM 0 H GLY A 76 -4.227 -4.243 -13.663 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.766 -4.550 -11.101 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.431 -3.216 -12.187 1.00 0.00 H new ATOM 1111 N PRO A 77 -4.245 -2.824 -9.952 1.00 0.00 N ATOM 1112 CA PRO A 77 -5.273 -2.074 -9.224 1.00 0.00 C ATOM 1113 C PRO A 77 -5.340 -0.613 -9.657 1.00 0.00 C ATOM 1114 O PRO A 77 -4.314 0.015 -9.921 1.00 0.00 O ATOM 1115 CB PRO A 77 -4.821 -2.179 -7.765 1.00 0.00 C ATOM 1116 CG PRO A 77 -3.349 -2.394 -7.839 1.00 0.00 C ATOM 1117 CD PRO A 77 -3.109 -3.192 -9.090 1.00 0.00 C ATOM 0 HA PRO A 77 -6.272 -2.470 -9.405 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.061 -1.272 -7.210 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -5.317 -3.005 -7.255 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -2.817 -1.443 -7.875 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -2.988 -2.928 -6.960 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -2.155 -2.938 -9.552 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -3.089 -4.263 -8.886 1.00 0.00 H new ATOM 1125 N LYS A 78 -6.554 -0.077 -9.728 1.00 0.00 N ATOM 1126 CA LYS A 78 -6.756 1.311 -10.128 1.00 0.00 C ATOM 1127 C LYS A 78 -7.391 2.115 -8.998 1.00 0.00 C ATOM 1128 O LYS A 78 -6.717 2.894 -8.323 1.00 0.00 O ATOM 1129 CB LYS A 78 -7.638 1.380 -11.376 1.00 0.00 C ATOM 1130 CG LYS A 78 -8.165 2.774 -11.672 1.00 0.00 C ATOM 1131 CD LYS A 78 -8.439 2.963 -13.154 1.00 0.00 C ATOM 1132 CE LYS A 78 -7.243 3.572 -13.870 1.00 0.00 C ATOM 1133 NZ LYS A 78 -7.580 3.985 -15.260 1.00 0.00 N ATOM 0 H LYS A 78 -7.413 -0.583 -9.514 1.00 0.00 H new ATOM 0 HA LYS A 78 -5.782 1.744 -10.355 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -7.067 1.027 -12.234 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.481 0.700 -11.253 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.081 2.945 -11.107 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -7.441 3.517 -11.337 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -8.683 2.001 -13.605 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.309 3.607 -13.285 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -6.887 4.437 -13.311 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.427 2.849 -13.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.739 4.395 -15.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -7.896 3.155 -15.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -8.341 4.694 -15.237 1.00 0.00 H new ATOM 1147 N TYR A 79 -8.689 1.920 -8.796 1.00 0.00 N ATOM 1148 CA TYR A 79 -9.415 2.628 -7.749 1.00 0.00 C ATOM 1149 C TYR A 79 -9.321 1.882 -6.421 1.00 0.00 C ATOM 1150 O TYR A 79 -10.048 0.917 -6.185 1.00 0.00 O ATOM 1151 CB TYR A 79 -10.882 2.803 -8.145 1.00 0.00 C ATOM 1152 CG TYR A 79 -11.592 3.892 -7.371 1.00 0.00 C ATOM 1153 CD1 TYR A 79 -11.462 5.227 -7.734 1.00 0.00 C ATOM 1154 CD2 TYR A 79 -12.392 3.585 -6.278 1.00 0.00 C ATOM 1155 CE1 TYR A 79 -12.108 6.224 -7.030 1.00 0.00 C ATOM 1156 CE2 TYR A 79 -13.043 4.576 -5.569 1.00 0.00 C ATOM 1157 CZ TYR A 79 -12.898 5.894 -5.948 1.00 0.00 C ATOM 1158 OH TYR A 79 -13.543 6.884 -5.244 1.00 0.00 O ATOM 0 H TYR A 79 -9.260 1.277 -9.344 1.00 0.00 H new ATOM 0 HA TYR A 79 -8.959 3.610 -7.627 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.938 3.030 -9.210 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.406 1.859 -7.992 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -10.845 5.489 -8.581 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -12.507 2.554 -5.977 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -11.995 7.257 -7.325 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -13.662 4.320 -4.722 1.00 0.00 H new ATOM 0 HH TYR A 79 -14.059 6.483 -4.513 1.00 0.00 H new ATOM 1168 N VAL A 80 -8.419 2.338 -5.557 1.00 0.00 N ATOM 1169 CA VAL A 80 -8.230 1.716 -4.251 1.00 0.00 C ATOM 1170 C VAL A 80 -8.563 2.689 -3.126 1.00 0.00 C ATOM 1171 O VAL A 80 -8.169 3.854 -3.160 1.00 0.00 O ATOM 1172 CB VAL A 80 -6.783 1.217 -4.072 1.00 0.00 C ATOM 1173 CG1 VAL A 80 -6.766 -0.274 -3.774 1.00 0.00 C ATOM 1174 CG2 VAL A 80 -5.955 1.532 -5.309 1.00 0.00 C ATOM 0 H VAL A 80 -7.808 3.135 -5.737 1.00 0.00 H new ATOM 0 HA VAL A 80 -8.909 0.865 -4.204 1.00 0.00 H new ATOM 0 HB VAL A 80 -6.339 1.737 -3.223 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -5.736 -0.609 -3.651 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -7.323 -0.468 -2.857 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -7.227 -0.815 -4.600 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.936 1.173 -5.166 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -6.395 1.040 -6.176 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -5.940 2.610 -5.472 1.00 0.00 H new ATOM 1184 N LYS A 81 -9.292 2.202 -2.127 1.00 0.00 N ATOM 1185 CA LYS A 81 -9.679 3.026 -0.989 1.00 0.00 C ATOM 1186 C LYS A 81 -8.694 2.858 0.164 1.00 0.00 C ATOM 1187 O LYS A 81 -8.512 1.755 0.681 1.00 0.00 O ATOM 1188 CB LYS A 81 -11.091 2.662 -0.525 1.00 0.00 C ATOM 1189 CG LYS A 81 -12.132 2.739 -1.627 1.00 0.00 C ATOM 1190 CD LYS A 81 -13.542 2.632 -1.071 1.00 0.00 C ATOM 1191 CE LYS A 81 -14.282 3.958 -1.170 1.00 0.00 C ATOM 1192 NZ LYS A 81 -15.225 3.981 -2.323 1.00 0.00 N ATOM 0 H LYS A 81 -9.627 1.239 -2.083 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.666 4.069 -1.306 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -11.081 1.652 -0.116 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.382 3.331 0.285 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.023 3.680 -2.166 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.962 1.938 -2.346 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.092 1.865 -1.617 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -13.500 2.314 -0.029 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.833 4.137 -0.246 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.562 4.769 -1.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.582 4.948 -2.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.730 3.670 -3.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.022 3.341 -2.132 1.00 0.00 H new ATOM 1206 N ILE A 82 -8.063 3.957 0.562 1.00 0.00 N ATOM 1207 CA ILE A 82 -7.099 3.931 1.655 1.00 0.00 C ATOM 1208 C ILE A 82 -7.760 4.294 2.980 1.00 0.00 C ATOM 1209 O ILE A 82 -8.558 5.228 3.053 1.00 0.00 O ATOM 1210 CB ILE A 82 -5.928 4.898 1.397 1.00 0.00 C ATOM 1211 CG1 ILE A 82 -5.208 4.527 0.100 1.00 0.00 C ATOM 1212 CG2 ILE A 82 -4.960 4.882 2.570 1.00 0.00 C ATOM 1213 CD1 ILE A 82 -4.415 5.667 -0.499 1.00 0.00 C ATOM 0 H ILE A 82 -8.202 4.877 0.144 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.713 2.913 1.711 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.326 5.907 1.293 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -4.537 3.690 0.293 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.943 4.184 -0.629 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.138 5.570 2.373 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.481 5.190 3.476 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.566 3.874 2.703 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.931 5.331 -1.416 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.085 6.497 -0.725 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.657 5.996 0.212 1.00 0.00 H new ATOM 1225 N PHE A 83 -7.423 3.548 4.028 1.00 0.00 N ATOM 1226 CA PHE A 83 -7.983 3.792 5.352 1.00 0.00 C ATOM 1227 C PHE A 83 -6.884 3.822 6.410 1.00 0.00 C ATOM 1228 O PHE A 83 -5.899 3.089 6.318 1.00 0.00 O ATOM 1229 CB PHE A 83 -9.012 2.714 5.699 1.00 0.00 C ATOM 1230 CG PHE A 83 -10.239 2.754 4.833 1.00 0.00 C ATOM 1231 CD1 PHE A 83 -10.255 2.118 3.602 1.00 0.00 C ATOM 1232 CD2 PHE A 83 -11.375 3.429 5.249 1.00 0.00 C ATOM 1233 CE1 PHE A 83 -11.382 2.154 2.802 1.00 0.00 C ATOM 1234 CE2 PHE A 83 -12.505 3.468 4.454 1.00 0.00 C ATOM 1235 CZ PHE A 83 -12.508 2.830 3.229 1.00 0.00 C ATOM 0 H PHE A 83 -6.765 2.770 3.985 1.00 0.00 H new ATOM 0 HA PHE A 83 -8.476 4.764 5.338 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -8.544 1.734 5.607 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -9.309 2.829 6.741 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -9.377 1.588 3.264 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.378 3.931 6.205 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -11.382 1.654 1.845 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -13.385 3.997 4.790 1.00 0.00 H new ATOM 0 HZ PHE A 83 -13.390 2.860 2.606 1.00 0.00 H new ATOM 1245 N ILE A 84 -7.061 4.674 7.414 1.00 0.00 N ATOM 1246 CA ILE A 84 -6.086 4.800 8.490 1.00 0.00 C ATOM 1247 C ILE A 84 -6.770 5.098 9.820 1.00 0.00 C ATOM 1248 O ILE A 84 -7.942 5.469 9.857 1.00 0.00 O ATOM 1249 CB ILE A 84 -5.060 5.909 8.193 1.00 0.00 C ATOM 1250 CG1 ILE A 84 -5.768 7.255 8.018 1.00 0.00 C ATOM 1251 CG2 ILE A 84 -4.251 5.565 6.952 1.00 0.00 C ATOM 1252 CD1 ILE A 84 -4.996 8.423 8.590 1.00 0.00 C ATOM 0 H ILE A 84 -7.871 5.287 7.505 1.00 0.00 H new ATOM 0 HA ILE A 84 -5.566 3.844 8.558 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.376 5.986 9.038 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.941 7.430 6.956 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.746 7.207 8.497 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.530 6.359 6.756 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.722 4.626 7.112 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.920 5.463 6.098 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -5.557 9.344 8.430 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.845 8.271 9.659 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -4.028 8.497 8.094 1.00 0.00 H new ATOM 1264 N ASN A 85 -6.029 4.933 10.910 1.00 0.00 N ATOM 1265 CA ASN A 85 -6.563 5.186 12.243 1.00 0.00 C ATOM 1266 C ASN A 85 -7.826 4.366 12.487 1.00 0.00 C ATOM 1267 O ASN A 85 -8.780 4.842 13.104 1.00 0.00 O ATOM 1268 CB ASN A 85 -6.867 6.675 12.420 1.00 0.00 C ATOM 1269 CG ASN A 85 -5.626 7.483 12.747 1.00 0.00 C ATOM 1270 OD1 ASN A 85 -5.555 8.140 13.786 1.00 0.00 O ATOM 1271 ND2 ASN A 85 -4.640 7.439 11.859 1.00 0.00 N ATOM 0 H ASN A 85 -5.057 4.625 10.897 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.809 4.887 12.972 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -7.319 7.062 11.507 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.600 6.801 13.217 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -3.781 7.963 12.025 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.742 6.881 11.011 1.00 0.00 H new ATOM 1278 N LEU A 86 -7.826 3.130 12.000 1.00 0.00 N ATOM 1279 CA LEU A 86 -8.971 2.242 12.165 1.00 0.00 C ATOM 1280 C LEU A 86 -9.023 1.678 13.582 1.00 0.00 C ATOM 1281 O LEU A 86 -8.012 1.586 14.277 1.00 0.00 O ATOM 1282 CB LEU A 86 -8.905 1.098 11.151 1.00 0.00 C ATOM 1283 CG LEU A 86 -9.124 1.484 9.688 1.00 0.00 C ATOM 1284 CD1 LEU A 86 -8.845 0.300 8.776 1.00 0.00 C ATOM 1285 CD2 LEU A 86 -10.541 1.998 9.479 1.00 0.00 C ATOM 0 H LEU A 86 -7.045 2.720 11.487 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.877 2.822 11.991 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -7.930 0.619 11.237 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.652 0.353 11.425 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.427 2.283 9.435 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.006 0.594 7.739 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.812 -0.023 8.905 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -9.516 -0.520 9.029 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.679 2.268 8.432 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -11.254 1.220 9.750 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -10.706 2.875 10.105 1.00 0.00 H new ATOM 1297 N PRO A 87 -10.230 1.291 14.020 1.00 0.00 N ATOM 1298 CA PRO A 87 -10.443 0.727 15.357 1.00 0.00 C ATOM 1299 C PRO A 87 -9.835 -0.664 15.503 1.00 0.00 C ATOM 1300 O PRO A 87 -9.541 -1.109 16.612 1.00 0.00 O ATOM 1301 CB PRO A 87 -11.968 0.659 15.474 1.00 0.00 C ATOM 1302 CG PRO A 87 -12.453 0.574 14.068 1.00 0.00 C ATOM 1303 CD PRO A 87 -11.480 1.372 13.245 1.00 0.00 C ATOM 0 HA PRO A 87 -9.968 1.327 16.133 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -12.282 -0.209 16.054 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -12.366 1.540 15.977 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -12.492 -0.462 13.731 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -13.462 0.977 13.978 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -11.361 0.953 12.246 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.810 2.403 13.121 1.00 0.00 H new ATOM 1311 N ARG A 88 -9.648 -1.344 14.377 1.00 0.00 N ATOM 1312 CA ARG A 88 -9.075 -2.685 14.380 1.00 0.00 C ATOM 1313 C ARG A 88 -8.769 -3.149 12.959 1.00 0.00 C ATOM 1314 O ARG A 88 -7.608 -3.217 12.554 1.00 0.00 O ATOM 1315 CB ARG A 88 -10.032 -3.669 15.055 1.00 0.00 C ATOM 1316 CG ARG A 88 -11.487 -3.233 15.008 1.00 0.00 C ATOM 1317 CD ARG A 88 -12.428 -4.428 15.037 1.00 0.00 C ATOM 1318 NE ARG A 88 -13.216 -4.533 13.812 1.00 0.00 N ATOM 1319 CZ ARG A 88 -13.985 -5.577 13.520 1.00 0.00 C ATOM 1320 NH1 ARG A 88 -14.068 -6.598 14.361 1.00 0.00 N ATOM 1321 NH2 ARG A 88 -14.672 -5.599 12.385 1.00 0.00 N ATOM 0 H ARG A 88 -9.885 -0.989 13.451 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.141 -2.653 14.942 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -9.938 -4.642 14.574 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -9.733 -3.797 16.095 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -11.700 -2.580 15.855 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -11.664 -2.651 14.104 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -11.850 -5.342 15.176 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -13.098 -4.342 15.893 1.00 0.00 H new ATOM 0 HE ARG A 88 -13.174 -3.763 13.144 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -13.541 -6.584 15.234 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -14.659 -7.398 14.135 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -14.610 -4.814 11.736 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -15.262 -6.400 12.161 1.00 0.00 H new ATOM 1335 N SER A 89 -9.817 -3.467 12.207 1.00 0.00 N ATOM 1336 CA SER A 89 -9.660 -3.929 10.833 1.00 0.00 C ATOM 1337 C SER A 89 -10.780 -3.391 9.948 1.00 0.00 C ATOM 1338 O SER A 89 -11.725 -2.768 10.433 1.00 0.00 O ATOM 1339 CB SER A 89 -9.647 -5.458 10.785 1.00 0.00 C ATOM 1340 OG SER A 89 -10.885 -5.993 11.221 1.00 0.00 O ATOM 0 H SER A 89 -10.784 -3.413 12.526 1.00 0.00 H new ATOM 0 HA SER A 89 -8.709 -3.553 10.456 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.441 -5.791 9.768 1.00 0.00 H new ATOM 0 HB3 SER A 89 -8.842 -5.838 11.414 1.00 0.00 H new ATOM 0 HG SER A 89 -10.851 -6.972 11.179 1.00 0.00 H new ATOM 1346 N MET A 90 -10.667 -3.636 8.646 1.00 0.00 N ATOM 1347 CA MET A 90 -11.670 -3.177 7.693 1.00 0.00 C ATOM 1348 C MET A 90 -12.288 -4.354 6.945 1.00 0.00 C ATOM 1349 O MET A 90 -11.576 -5.206 6.412 1.00 0.00 O ATOM 1350 CB MET A 90 -11.048 -2.196 6.698 1.00 0.00 C ATOM 1351 CG MET A 90 -12.066 -1.518 5.795 1.00 0.00 C ATOM 1352 SD MET A 90 -12.456 0.160 6.325 1.00 0.00 S ATOM 1353 CE MET A 90 -12.686 -0.085 8.084 1.00 0.00 C ATOM 0 H MET A 90 -9.891 -4.149 8.228 1.00 0.00 H new ATOM 0 HA MET A 90 -12.458 -2.669 8.249 1.00 0.00 H new ATOM 0 HB2 MET A 90 -10.498 -1.433 7.249 1.00 0.00 H new ATOM 0 HB3 MET A 90 -10.324 -2.728 6.080 1.00 0.00 H new ATOM 0 HG2 MET A 90 -11.681 -1.493 4.775 1.00 0.00 H new ATOM 0 HG3 MET A 90 -12.981 -2.111 5.776 1.00 0.00 H new ATOM 0 HE1 MET A 90 -13.054 0.837 8.535 1.00 0.00 H new ATOM 0 HE2 MET A 90 -13.409 -0.884 8.249 1.00 0.00 H new ATOM 0 HE3 MET A 90 -11.735 -0.358 8.541 1.00 0.00 H new ATOM 1363 N ASP A 91 -13.615 -4.396 6.909 1.00 0.00 N ATOM 1364 CA ASP A 91 -14.328 -5.469 6.226 1.00 0.00 C ATOM 1365 C ASP A 91 -14.851 -4.998 4.872 1.00 0.00 C ATOM 1366 O ASP A 91 -14.492 -3.921 4.398 1.00 0.00 O ATOM 1367 CB ASP A 91 -15.488 -5.970 7.088 1.00 0.00 C ATOM 1368 CG ASP A 91 -15.072 -6.233 8.522 1.00 0.00 C ATOM 1369 OD1 ASP A 91 -14.203 -7.104 8.738 1.00 0.00 O ATOM 1370 OD2 ASP A 91 -15.615 -5.568 9.428 1.00 0.00 O ATOM 0 H ASP A 91 -14.219 -3.699 7.345 1.00 0.00 H new ATOM 0 HA ASP A 91 -13.628 -6.288 6.061 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -16.291 -5.233 7.075 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -15.889 -6.886 6.655 1.00 0.00 H new ATOM 1375 N PHE A 92 -15.699 -5.814 4.255 1.00 0.00 N ATOM 1376 CA PHE A 92 -16.269 -5.482 2.954 1.00 0.00 C ATOM 1377 C PHE A 92 -17.387 -4.453 3.097 1.00 0.00 C ATOM 1378 O PHE A 92 -17.563 -3.590 2.238 1.00 0.00 O ATOM 1379 CB PHE A 92 -16.805 -6.743 2.272 1.00 0.00 C ATOM 1380 CG PHE A 92 -15.730 -7.716 1.880 1.00 0.00 C ATOM 1381 CD1 PHE A 92 -15.050 -8.442 2.844 1.00 0.00 C ATOM 1382 CD2 PHE A 92 -15.398 -7.903 0.548 1.00 0.00 C ATOM 1383 CE1 PHE A 92 -14.060 -9.339 2.487 1.00 0.00 C ATOM 1384 CE2 PHE A 92 -14.410 -8.798 0.185 1.00 0.00 C ATOM 1385 CZ PHE A 92 -13.739 -9.516 1.156 1.00 0.00 C ATOM 0 H PHE A 92 -16.007 -6.709 4.634 1.00 0.00 H new ATOM 0 HA PHE A 92 -15.480 -5.052 2.338 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -17.506 -7.239 2.943 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -17.365 -6.455 1.382 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -15.296 -8.306 3.887 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -15.917 -7.343 -0.215 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -13.539 -9.900 3.248 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -14.162 -8.936 -0.857 1.00 0.00 H new ATOM 0 HZ PHE A 92 -12.965 -10.214 0.874 1.00 0.00 H new ATOM 1395 N GLU A 93 -18.139 -4.553 4.189 1.00 0.00 N ATOM 1396 CA GLU A 93 -19.241 -3.633 4.443 1.00 0.00 C ATOM 1397 C GLU A 93 -18.732 -2.334 5.063 1.00 0.00 C ATOM 1398 O GLU A 93 -19.244 -1.254 4.772 1.00 0.00 O ATOM 1399 CB GLU A 93 -20.274 -4.281 5.367 1.00 0.00 C ATOM 1400 CG GLU A 93 -21.323 -5.095 4.630 1.00 0.00 C ATOM 1401 CD GLU A 93 -22.737 -4.744 5.052 1.00 0.00 C ATOM 1402 OE1 GLU A 93 -23.078 -4.977 6.230 1.00 0.00 O ATOM 1403 OE2 GLU A 93 -23.501 -4.237 4.204 1.00 0.00 O ATOM 0 H GLU A 93 -18.005 -5.261 4.911 1.00 0.00 H new ATOM 0 HA GLU A 93 -19.714 -3.400 3.489 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -19.759 -4.927 6.078 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -20.771 -3.502 5.946 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -21.217 -4.932 3.558 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -21.147 -6.156 4.810 1.00 0.00 H new ATOM 1410 N GLU A 94 -17.722 -2.450 5.920 1.00 0.00 N ATOM 1411 CA GLU A 94 -17.145 -1.286 6.582 1.00 0.00 C ATOM 1412 C GLU A 94 -16.327 -0.452 5.601 1.00 0.00 C ATOM 1413 O GLU A 94 -16.124 0.745 5.805 1.00 0.00 O ATOM 1414 CB GLU A 94 -16.266 -1.722 7.755 1.00 0.00 C ATOM 1415 CG GLU A 94 -16.983 -1.701 9.095 1.00 0.00 C ATOM 1416 CD GLU A 94 -16.323 -0.772 10.095 1.00 0.00 C ATOM 1417 OE1 GLU A 94 -15.111 -0.935 10.347 1.00 0.00 O ATOM 1418 OE2 GLU A 94 -17.020 0.118 10.627 1.00 0.00 O ATOM 0 H GLU A 94 -17.287 -3.338 6.172 1.00 0.00 H new ATOM 0 HA GLU A 94 -17.963 -0.672 6.959 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.897 -2.730 7.566 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -15.395 -1.068 7.808 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -18.017 -1.391 8.945 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -17.009 -2.711 9.505 1.00 0.00 H new ATOM 1425 N ALA A 95 -15.858 -1.093 4.535 1.00 0.00 N ATOM 1426 CA ALA A 95 -15.063 -0.412 3.522 1.00 0.00 C ATOM 1427 C ALA A 95 -15.955 0.321 2.525 1.00 0.00 C ATOM 1428 O ALA A 95 -15.476 1.120 1.721 1.00 0.00 O ATOM 1429 CB ALA A 95 -14.165 -1.405 2.799 1.00 0.00 C ATOM 0 H ALA A 95 -16.016 -2.084 4.351 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.438 0.327 4.023 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.577 -0.882 2.045 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.496 -1.879 3.516 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -14.778 -2.166 2.317 1.00 0.00 H new ATOM 1435 N GLU A 96 -17.253 0.042 2.583 1.00 0.00 N ATOM 1436 CA GLU A 96 -18.211 0.674 1.684 1.00 0.00 C ATOM 1437 C GLU A 96 -18.957 1.803 2.389 1.00 0.00 C ATOM 1438 O GLU A 96 -19.067 2.911 1.865 1.00 0.00 O ATOM 1439 CB GLU A 96 -19.208 -0.360 1.156 1.00 0.00 C ATOM 1440 CG GLU A 96 -19.154 -0.545 -0.351 1.00 0.00 C ATOM 1441 CD GLU A 96 -20.495 -0.303 -1.017 1.00 0.00 C ATOM 1442 OE1 GLU A 96 -21.030 0.818 -0.885 1.00 0.00 O ATOM 1443 OE2 GLU A 96 -21.008 -1.235 -1.671 1.00 0.00 O ATOM 0 H GLU A 96 -17.665 -0.617 3.243 1.00 0.00 H new ATOM 0 HA GLU A 96 -17.658 1.096 0.845 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -19.014 -1.318 1.638 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -20.216 -0.058 1.440 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -18.416 0.138 -0.771 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -18.817 -1.557 -0.577 1.00 0.00 H new ATOM 1450 N ARG A 97 -19.468 1.512 3.581 1.00 0.00 N ATOM 1451 CA ARG A 97 -20.205 2.501 4.358 1.00 0.00 C ATOM 1452 C ARG A 97 -19.294 3.650 4.780 1.00 0.00 C ATOM 1453 O ARG A 97 -19.667 4.819 4.680 1.00 0.00 O ATOM 1454 CB ARG A 97 -20.827 1.849 5.595 1.00 0.00 C ATOM 1455 CG ARG A 97 -19.818 1.134 6.478 1.00 0.00 C ATOM 1456 CD ARG A 97 -20.455 -0.028 7.224 1.00 0.00 C ATOM 1457 NE ARG A 97 -20.367 0.135 8.672 1.00 0.00 N ATOM 1458 CZ ARG A 97 -21.116 -0.541 9.535 1.00 0.00 C ATOM 1459 NH1 ARG A 97 -22.005 -1.422 9.098 1.00 0.00 N ATOM 1460 NH2 ARG A 97 -20.977 -0.336 10.839 1.00 0.00 N ATOM 0 H ARG A 97 -19.385 0.600 4.029 1.00 0.00 H new ATOM 0 HA ARG A 97 -20.999 2.902 3.728 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -21.334 2.614 6.183 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -21.588 1.136 5.276 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -18.994 0.767 5.867 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -19.395 1.839 7.194 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -21.502 -0.115 6.932 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -19.965 -0.957 6.934 1.00 0.00 H new ATOM 0 HE ARG A 97 -19.693 0.805 9.041 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -22.115 -1.582 8.097 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -22.579 -1.940 9.763 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -20.294 0.341 11.179 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -21.553 -0.856 11.501 1.00 0.00 H new ATOM 1474 N SER A 98 -18.099 3.309 5.251 1.00 0.00 N ATOM 1475 CA SER A 98 -17.137 4.312 5.692 1.00 0.00 C ATOM 1476 C SER A 98 -16.217 4.722 4.546 1.00 0.00 C ATOM 1477 O SER A 98 -15.598 3.877 3.901 1.00 0.00 O ATOM 1478 CB SER A 98 -16.307 3.774 6.860 1.00 0.00 C ATOM 1479 OG SER A 98 -17.115 3.040 7.764 1.00 0.00 O ATOM 0 H SER A 98 -17.774 2.346 5.337 1.00 0.00 H new ATOM 0 HA SER A 98 -17.691 5.191 6.023 1.00 0.00 H new ATOM 0 HB2 SER A 98 -15.509 3.136 6.480 1.00 0.00 H new ATOM 0 HB3 SER A 98 -15.830 4.603 7.384 1.00 0.00 H new ATOM 0 HG SER A 98 -17.089 2.089 7.528 1.00 0.00 H new ATOM 1485 N GLU A 99 -16.134 6.026 4.301 1.00 0.00 N ATOM 1486 CA GLU A 99 -15.290 6.549 3.232 1.00 0.00 C ATOM 1487 C GLU A 99 -13.819 6.522 3.638 1.00 0.00 C ATOM 1488 O GLU A 99 -13.470 6.656 4.811 1.00 0.00 O ATOM 1489 CB GLU A 99 -15.706 7.978 2.877 1.00 0.00 C ATOM 1490 CG GLU A 99 -15.324 9.003 3.931 1.00 0.00 C ATOM 1491 CD GLU A 99 -16.322 10.141 4.028 1.00 0.00 C ATOM 1492 OE1 GLU A 99 -16.638 10.744 2.982 1.00 0.00 O ATOM 1493 OE2 GLU A 99 -16.787 10.427 5.151 1.00 0.00 O ATOM 0 H GLU A 99 -16.640 6.739 4.827 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.419 5.912 2.357 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -15.246 8.256 1.929 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -16.785 8.007 2.729 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.246 8.510 4.900 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -14.339 9.408 3.699 1.00 0.00 H new ATOM 1500 N PRO A 100 -12.935 6.344 2.645 1.00 0.00 N ATOM 1501 CA PRO A 100 -11.488 6.295 2.872 1.00 0.00 C ATOM 1502 C PRO A 100 -10.917 7.653 3.269 1.00 0.00 C ATOM 1503 O PRO A 100 -11.610 8.669 3.216 1.00 0.00 O ATOM 1504 CB PRO A 100 -10.930 5.857 1.516 1.00 0.00 C ATOM 1505 CG PRO A 100 -11.954 6.295 0.526 1.00 0.00 C ATOM 1506 CD PRO A 100 -13.281 6.178 1.223 1.00 0.00 C ATOM 0 HA PRO A 100 -11.227 5.626 3.692 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -9.964 6.320 1.317 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -10.780 4.778 1.479 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.772 7.320 0.204 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.926 5.670 -0.367 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -13.980 6.944 0.887 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.751 5.213 1.034 1.00 0.00 H new ATOM 1514 N THR A 101 -9.649 7.663 3.667 1.00 0.00 N ATOM 1515 CA THR A 101 -8.985 8.895 4.074 1.00 0.00 C ATOM 1516 C THR A 101 -8.482 9.673 2.863 1.00 0.00 C ATOM 1517 O THR A 101 -8.260 10.881 2.941 1.00 0.00 O ATOM 1518 CB THR A 101 -7.800 8.610 5.015 1.00 0.00 C ATOM 1519 OG1 THR A 101 -8.259 7.933 6.190 1.00 0.00 O ATOM 1520 CG2 THR A 101 -7.099 9.902 5.409 1.00 0.00 C ATOM 0 H THR A 101 -9.061 6.831 3.716 1.00 0.00 H new ATOM 0 HA THR A 101 -9.725 9.493 4.606 1.00 0.00 H new ATOM 0 HB THR A 101 -7.089 7.976 4.486 1.00 0.00 H new ATOM 0 HG1 THR A 101 -8.047 8.471 6.981 1.00 0.00 H new ATOM 0 HG21 THR A 101 -6.265 9.676 6.074 1.00 0.00 H new ATOM 0 HG22 THR A 101 -6.725 10.400 4.515 1.00 0.00 H new ATOM 0 HG23 THR A 101 -7.804 10.557 5.921 1.00 0.00 H new ATOM 1528 N GLN A 102 -8.306 8.974 1.747 1.00 0.00 N ATOM 1529 CA GLN A 102 -7.830 9.602 0.520 1.00 0.00 C ATOM 1530 C GLN A 102 -8.509 8.993 -0.702 1.00 0.00 C ATOM 1531 O GLN A 102 -9.388 9.607 -1.306 1.00 0.00 O ATOM 1532 CB GLN A 102 -6.312 9.453 0.403 1.00 0.00 C ATOM 1533 CG GLN A 102 -5.766 9.847 -0.960 1.00 0.00 C ATOM 1534 CD GLN A 102 -4.388 10.476 -0.877 1.00 0.00 C ATOM 1535 OE1 GLN A 102 -3.493 9.951 -0.214 1.00 0.00 O ATOM 1536 NE2 GLN A 102 -4.211 11.605 -1.552 1.00 0.00 N ATOM 0 H GLN A 102 -8.486 7.973 1.667 1.00 0.00 H new ATOM 0 HA GLN A 102 -8.082 10.662 0.562 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.835 10.066 1.168 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -6.040 8.418 0.609 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -5.721 8.964 -1.598 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.453 10.548 -1.434 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -4.981 12.005 -2.088 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -3.305 12.073 -1.534 1.00 0.00 H new ATOM 1545 N ALA A 103 -8.094 7.782 -1.061 1.00 0.00 N ATOM 1546 CA ALA A 103 -8.663 7.090 -2.211 1.00 0.00 C ATOM 1547 C ALA A 103 -8.337 7.820 -3.509 1.00 0.00 C ATOM 1548 O ALA A 103 -8.743 8.965 -3.708 1.00 0.00 O ATOM 1549 CB ALA A 103 -10.169 6.947 -2.048 1.00 0.00 C ATOM 0 H ALA A 103 -7.366 7.260 -0.572 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.217 6.097 -2.262 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.581 6.429 -2.914 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.385 6.375 -1.146 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.622 7.935 -1.968 1.00 0.00 H new ATOM 1555 N LEU A 104 -7.600 7.151 -4.389 1.00 0.00 N ATOM 1556 CA LEU A 104 -7.217 7.737 -5.669 1.00 0.00 C ATOM 1557 C LEU A 104 -7.345 6.716 -6.795 1.00 0.00 C ATOM 1558 O LEU A 104 -7.413 5.513 -6.549 1.00 0.00 O ATOM 1559 CB LEU A 104 -5.782 8.263 -5.603 1.00 0.00 C ATOM 1560 CG LEU A 104 -5.294 8.710 -4.224 1.00 0.00 C ATOM 1561 CD1 LEU A 104 -4.664 7.545 -3.478 1.00 0.00 C ATOM 1562 CD2 LEU A 104 -4.305 9.860 -4.356 1.00 0.00 C ATOM 0 H LEU A 104 -7.256 6.203 -4.240 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.892 8.567 -5.877 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.113 7.483 -5.968 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.693 9.106 -6.289 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.153 9.060 -3.651 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.323 7.882 -2.499 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.401 6.752 -3.352 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.816 7.165 -4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.968 10.166 -3.365 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.448 9.537 -4.947 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.790 10.702 -4.850 1.00 0.00 H new ATOM 1574 N GLU A 105 -7.375 7.206 -8.030 1.00 0.00 N ATOM 1575 CA GLU A 105 -7.494 6.336 -9.194 1.00 0.00 C ATOM 1576 C GLU A 105 -6.133 6.112 -9.847 1.00 0.00 C ATOM 1577 O GLU A 105 -5.735 6.851 -10.749 1.00 0.00 O ATOM 1578 CB GLU A 105 -8.467 6.936 -10.211 1.00 0.00 C ATOM 1579 CG GLU A 105 -8.572 6.136 -11.498 1.00 0.00 C ATOM 1580 CD GLU A 105 -9.377 6.851 -12.566 1.00 0.00 C ATOM 1581 OE1 GLU A 105 -9.424 8.099 -12.538 1.00 0.00 O ATOM 1582 OE2 GLU A 105 -9.960 6.163 -13.429 1.00 0.00 O ATOM 0 H GLU A 105 -7.319 8.200 -8.250 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.880 5.374 -8.858 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.455 7.009 -9.757 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.150 7.951 -10.449 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.571 5.933 -11.878 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.033 5.172 -11.285 1.00 0.00 H new ATOM 1589 N LEU A 106 -5.423 5.089 -9.385 1.00 0.00 N ATOM 1590 CA LEU A 106 -4.105 4.767 -9.923 1.00 0.00 C ATOM 1591 C LEU A 106 -4.158 4.617 -11.440 1.00 0.00 C ATOM 1592 O LEU A 106 -5.092 4.027 -11.985 1.00 0.00 O ATOM 1593 CB LEU A 106 -3.575 3.479 -9.290 1.00 0.00 C ATOM 1594 CG LEU A 106 -3.622 3.413 -7.763 1.00 0.00 C ATOM 1595 CD1 LEU A 106 -2.931 2.155 -7.262 1.00 0.00 C ATOM 1596 CD2 LEU A 106 -2.983 4.653 -7.156 1.00 0.00 C ATOM 0 H LEU A 106 -5.737 4.468 -8.639 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.430 5.588 -9.681 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.147 2.640 -9.688 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.542 3.340 -9.608 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.666 3.378 -7.452 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.974 2.125 -6.173 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.433 1.277 -7.669 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.890 2.159 -7.584 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.025 4.589 -6.069 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.943 4.720 -7.475 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.522 5.540 -7.488 1.00 0.00 H new ATOM 1608 N THR A 107 -3.149 5.154 -12.118 1.00 0.00 N ATOM 1609 CA THR A 107 -3.079 5.079 -13.572 1.00 0.00 C ATOM 1610 C THR A 107 -1.990 4.112 -14.022 1.00 0.00 C ATOM 1611 O THR A 107 -1.242 3.582 -13.202 1.00 0.00 O ATOM 1612 CB THR A 107 -2.810 6.463 -14.194 1.00 0.00 C ATOM 1613 OG1 THR A 107 -2.946 6.395 -15.617 1.00 0.00 O ATOM 1614 CG2 THR A 107 -1.416 6.955 -13.835 1.00 0.00 C ATOM 0 H THR A 107 -2.368 5.646 -11.683 1.00 0.00 H new ATOM 0 HA THR A 107 -4.048 4.716 -13.916 1.00 0.00 H new ATOM 0 HB THR A 107 -3.541 7.166 -13.793 1.00 0.00 H new ATOM 0 HG1 THR A 107 -2.775 7.279 -16.005 1.00 0.00 H new ATOM 0 HG21 THR A 107 -1.248 7.934 -14.285 1.00 0.00 H new ATOM 0 HG22 THR A 107 -1.326 7.033 -12.752 1.00 0.00 H new ATOM 0 HG23 THR A 107 -0.674 6.251 -14.211 1.00 0.00 H new ATOM 1622 N GLU A 108 -1.907 3.888 -15.330 1.00 0.00 N ATOM 1623 CA GLU A 108 -0.908 2.984 -15.887 1.00 0.00 C ATOM 1624 C GLU A 108 0.502 3.433 -15.511 1.00 0.00 C ATOM 1625 O GLU A 108 1.430 2.626 -15.468 1.00 0.00 O ATOM 1626 CB GLU A 108 -1.044 2.914 -17.409 1.00 0.00 C ATOM 1627 CG GLU A 108 -0.927 4.266 -18.094 1.00 0.00 C ATOM 1628 CD GLU A 108 -1.603 4.293 -19.451 1.00 0.00 C ATOM 1629 OE1 GLU A 108 -2.829 4.521 -19.499 1.00 0.00 O ATOM 1630 OE2 GLU A 108 -0.904 4.086 -20.465 1.00 0.00 O ATOM 0 H GLU A 108 -2.519 4.320 -16.023 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.079 1.992 -15.468 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.276 2.249 -17.804 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.008 2.472 -17.659 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.369 5.032 -17.457 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.127 4.519 -18.212 1.00 0.00 H new ATOM 1637 N ASP A 109 0.653 4.725 -15.242 1.00 0.00 N ATOM 1638 CA ASP A 109 1.948 5.282 -14.869 1.00 0.00 C ATOM 1639 C ASP A 109 2.190 5.139 -13.370 1.00 0.00 C ATOM 1640 O ASP A 109 3.309 5.327 -12.891 1.00 0.00 O ATOM 1641 CB ASP A 109 2.029 6.755 -15.274 1.00 0.00 C ATOM 1642 CG ASP A 109 1.689 6.973 -16.735 1.00 0.00 C ATOM 1643 OD1 ASP A 109 0.505 6.812 -17.098 1.00 0.00 O ATOM 1644 OD2 ASP A 109 2.606 7.305 -17.515 1.00 0.00 O ATOM 0 H ASP A 109 -0.105 5.406 -15.275 1.00 0.00 H new ATOM 0 HA ASP A 109 2.722 4.725 -15.398 1.00 0.00 H new ATOM 0 HB2 ASP A 109 1.347 7.337 -14.654 1.00 0.00 H new ATOM 0 HB3 ASP A 109 3.034 7.128 -15.078 1.00 0.00 H new ATOM 1649 N ASP A 110 1.135 4.807 -12.635 1.00 0.00 N ATOM 1650 CA ASP A 110 1.232 4.639 -11.189 1.00 0.00 C ATOM 1651 C ASP A 110 1.408 3.168 -10.823 1.00 0.00 C ATOM 1652 O ASP A 110 1.782 2.839 -9.697 1.00 0.00 O ATOM 1653 CB ASP A 110 -0.013 5.202 -10.504 1.00 0.00 C ATOM 1654 CG ASP A 110 -0.260 6.656 -10.855 1.00 0.00 C ATOM 1655 OD1 ASP A 110 0.723 7.374 -11.132 1.00 0.00 O ATOM 1656 OD2 ASP A 110 -1.437 7.076 -10.853 1.00 0.00 O ATOM 0 H ASP A 110 0.202 4.649 -13.016 1.00 0.00 H new ATOM 0 HA ASP A 110 2.107 5.188 -10.842 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -0.881 4.609 -10.791 1.00 0.00 H new ATOM 0 HB3 ASP A 110 0.095 5.105 -9.424 1.00 0.00 H new ATOM 1661 N ILE A 111 1.137 2.289 -11.782 1.00 0.00 N ATOM 1662 CA ILE A 111 1.265 0.854 -11.560 1.00 0.00 C ATOM 1663 C ILE A 111 2.295 0.242 -12.504 1.00 0.00 C ATOM 1664 O ILE A 111 2.246 -0.950 -12.806 1.00 0.00 O ATOM 1665 CB ILE A 111 -0.082 0.132 -11.751 1.00 0.00 C ATOM 1666 CG1 ILE A 111 -0.540 0.238 -13.207 1.00 0.00 C ATOM 1667 CG2 ILE A 111 -1.132 0.714 -10.816 1.00 0.00 C ATOM 1668 CD1 ILE A 111 -0.761 -1.104 -13.870 1.00 0.00 C ATOM 0 H ILE A 111 0.828 2.545 -12.720 1.00 0.00 H new ATOM 0 HA ILE A 111 1.595 0.722 -10.530 1.00 0.00 H new ATOM 0 HB ILE A 111 0.049 -0.922 -11.507 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -1.466 0.811 -13.247 1.00 0.00 H new ATOM 0 HG13 ILE A 111 0.205 0.796 -13.774 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.078 0.194 -10.963 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -0.807 0.592 -9.783 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -1.264 1.774 -11.032 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -1.084 -0.952 -14.900 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.170 -1.672 -13.862 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -1.528 -1.656 -13.327 1.00 0.00 H new ATOM 1680 N LYS A 112 3.230 1.066 -12.965 1.00 0.00 N ATOM 1681 CA LYS A 112 4.275 0.607 -13.872 1.00 0.00 C ATOM 1682 C LYS A 112 5.517 0.176 -13.097 1.00 0.00 C ATOM 1683 O LYS A 112 5.498 0.102 -11.869 1.00 0.00 O ATOM 1684 CB LYS A 112 4.639 1.713 -14.865 1.00 0.00 C ATOM 1685 CG LYS A 112 5.233 2.948 -14.210 1.00 0.00 C ATOM 1686 CD LYS A 112 6.173 3.681 -15.152 1.00 0.00 C ATOM 1687 CE LYS A 112 5.833 5.162 -15.237 1.00 0.00 C ATOM 1688 NZ LYS A 112 6.453 5.805 -16.429 1.00 0.00 N ATOM 0 H LYS A 112 3.285 2.056 -12.725 1.00 0.00 H new ATOM 0 HA LYS A 112 3.893 -0.254 -14.421 1.00 0.00 H new ATOM 0 HB2 LYS A 112 5.351 1.319 -15.590 1.00 0.00 H new ATOM 0 HB3 LYS A 112 3.746 2.000 -15.419 1.00 0.00 H new ATOM 0 HG2 LYS A 112 4.431 3.618 -13.900 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.773 2.659 -13.308 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.201 3.561 -14.808 1.00 0.00 H new ATOM 0 HD3 LYS A 112 6.115 3.236 -16.145 1.00 0.00 H new ATOM 0 HE2 LYS A 112 4.751 5.284 -15.280 1.00 0.00 H new ATOM 0 HE3 LYS A 112 6.175 5.666 -14.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.198 6.813 -16.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.487 5.710 -16.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.107 5.341 -17.293 1.00 0.00 H new ATOM 1702 N GLU A 113 6.594 -0.104 -13.824 1.00 0.00 N ATOM 1703 CA GLU A 113 7.844 -0.526 -13.203 1.00 0.00 C ATOM 1704 C GLU A 113 8.251 0.434 -12.089 1.00 0.00 C ATOM 1705 O GLU A 113 8.761 0.016 -11.050 1.00 0.00 O ATOM 1706 CB GLU A 113 8.957 -0.610 -14.250 1.00 0.00 C ATOM 1707 CG GLU A 113 9.267 0.720 -14.916 1.00 0.00 C ATOM 1708 CD GLU A 113 10.240 0.581 -16.071 1.00 0.00 C ATOM 1709 OE1 GLU A 113 9.889 -0.085 -17.067 1.00 0.00 O ATOM 1710 OE2 GLU A 113 11.354 1.140 -15.978 1.00 0.00 O ATOM 0 H GLU A 113 6.626 -0.046 -14.842 1.00 0.00 H new ATOM 0 HA GLU A 113 7.688 -1.513 -12.769 1.00 0.00 H new ATOM 0 HB2 GLU A 113 9.862 -0.989 -13.776 1.00 0.00 H new ATOM 0 HB3 GLU A 113 8.671 -1.332 -15.015 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.340 1.166 -15.278 1.00 0.00 H new ATOM 0 HG3 GLU A 113 9.682 1.405 -14.176 1.00 0.00 H new ATOM 1717 N ASP A 114 8.021 1.723 -12.315 1.00 0.00 N ATOM 1718 CA ASP A 114 8.362 2.744 -11.331 1.00 0.00 C ATOM 1719 C ASP A 114 7.135 3.569 -10.956 1.00 0.00 C ATOM 1720 O ASP A 114 7.231 4.772 -10.719 1.00 0.00 O ATOM 1721 CB ASP A 114 9.460 3.660 -11.875 1.00 0.00 C ATOM 1722 CG ASP A 114 10.367 4.189 -10.782 1.00 0.00 C ATOM 1723 OD1 ASP A 114 11.288 3.454 -10.367 1.00 0.00 O ATOM 1724 OD2 ASP A 114 10.157 5.339 -10.342 1.00 0.00 O ATOM 0 H ASP A 114 7.600 2.085 -13.170 1.00 0.00 H new ATOM 0 HA ASP A 114 8.728 2.242 -10.435 1.00 0.00 H new ATOM 0 HB2 ASP A 114 10.057 3.113 -12.605 1.00 0.00 H new ATOM 0 HB3 ASP A 114 9.003 4.498 -12.401 1.00 0.00 H new ATOM 1729 N GLY A 115 5.980 2.911 -10.904 1.00 0.00 N ATOM 1730 CA GLY A 115 4.750 3.599 -10.558 1.00 0.00 C ATOM 1731 C GLY A 115 4.751 4.106 -9.129 1.00 0.00 C ATOM 1732 O GLY A 115 5.139 3.386 -8.209 1.00 0.00 O ATOM 0 H GLY A 115 5.875 1.915 -11.095 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.603 4.438 -11.238 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.907 2.923 -10.700 1.00 0.00 H new ATOM 1736 N ILE A 116 4.318 5.348 -8.944 1.00 0.00 N ATOM 1737 CA ILE A 116 4.271 5.950 -7.617 1.00 0.00 C ATOM 1738 C ILE A 116 2.940 6.655 -7.379 1.00 0.00 C ATOM 1739 O ILE A 116 2.441 7.373 -8.246 1.00 0.00 O ATOM 1740 CB ILE A 116 5.417 6.960 -7.416 1.00 0.00 C ATOM 1741 CG1 ILE A 116 5.318 7.608 -6.034 1.00 0.00 C ATOM 1742 CG2 ILE A 116 5.385 8.020 -8.507 1.00 0.00 C ATOM 1743 CD1 ILE A 116 5.350 6.612 -4.896 1.00 0.00 C ATOM 0 H ILE A 116 3.995 5.957 -9.696 1.00 0.00 H new ATOM 0 HA ILE A 116 4.383 5.138 -6.899 1.00 0.00 H new ATOM 0 HB ILE A 116 6.366 6.428 -7.480 1.00 0.00 H new ATOM 0 HG12 ILE A 116 6.140 8.313 -5.912 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.394 8.183 -5.977 1.00 0.00 H new ATOM 0 HG21 ILE A 116 6.200 8.727 -8.352 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.498 7.543 -9.481 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.433 8.551 -8.471 1.00 0.00 H new ATOM 0 HD11 ILE A 116 5.276 7.142 -3.946 1.00 0.00 H new ATOM 0 HD12 ILE A 116 4.512 5.922 -4.993 1.00 0.00 H new ATOM 0 HD13 ILE A 116 6.285 6.053 -4.928 1.00 0.00 H new ATOM 1755 N VAL A 117 2.369 6.446 -6.197 1.00 0.00 N ATOM 1756 CA VAL A 117 1.096 7.063 -5.843 1.00 0.00 C ATOM 1757 C VAL A 117 1.280 8.118 -4.758 1.00 0.00 C ATOM 1758 O VAL A 117 1.420 7.810 -3.574 1.00 0.00 O ATOM 1759 CB VAL A 117 0.080 6.014 -5.356 1.00 0.00 C ATOM 1760 CG1 VAL A 117 -1.313 6.619 -5.268 1.00 0.00 C ATOM 1761 CG2 VAL A 117 0.086 4.801 -6.274 1.00 0.00 C ATOM 0 H VAL A 117 2.768 5.854 -5.468 1.00 0.00 H new ATOM 0 HA VAL A 117 0.712 7.537 -6.746 1.00 0.00 H new ATOM 0 HB VAL A 117 0.372 5.688 -4.358 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -2.017 5.862 -4.922 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.304 7.453 -4.567 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.618 6.975 -6.252 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -0.638 4.069 -5.915 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.180 5.109 -7.285 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.080 4.354 -6.280 1.00 0.00 H new ATOM 1771 N PRO A 118 1.280 9.395 -5.168 1.00 0.00 N ATOM 1772 CA PRO A 118 1.444 10.523 -4.247 1.00 0.00 C ATOM 1773 C PRO A 118 0.233 10.711 -3.339 1.00 0.00 C ATOM 1774 O PRO A 118 -0.849 11.078 -3.799 1.00 0.00 O ATOM 1775 CB PRO A 118 1.604 11.725 -5.181 1.00 0.00 C ATOM 1776 CG PRO A 118 0.915 11.321 -6.439 1.00 0.00 C ATOM 1777 CD PRO A 118 1.117 9.837 -6.564 1.00 0.00 C ATOM 0 HA PRO A 118 2.286 10.377 -3.571 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.154 12.621 -4.754 1.00 0.00 H new ATOM 0 HB3 PRO A 118 2.655 11.950 -5.360 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -0.146 11.568 -6.400 1.00 0.00 H new ATOM 0 HG3 PRO A 118 1.333 11.845 -7.298 1.00 0.00 H new ATOM 0 HD2 PRO A 118 0.264 9.354 -7.041 1.00 0.00 H new ATOM 0 HD3 PRO A 118 1.995 9.600 -7.165 1.00 0.00 H new ATOM 1785 N LEU A 119 0.422 10.459 -2.048 1.00 0.00 N ATOM 1786 CA LEU A 119 -0.655 10.602 -1.075 1.00 0.00 C ATOM 1787 C LEU A 119 -0.607 11.972 -0.406 1.00 0.00 C ATOM 1788 O LEU A 119 0.172 12.840 -0.802 1.00 0.00 O ATOM 1789 CB LEU A 119 -0.562 9.502 -0.017 1.00 0.00 C ATOM 1790 CG LEU A 119 -0.539 8.066 -0.542 1.00 0.00 C ATOM 1791 CD1 LEU A 119 0.017 7.121 0.512 1.00 0.00 C ATOM 1792 CD2 LEU A 119 -1.933 7.631 -0.968 1.00 0.00 C ATOM 0 H LEU A 119 1.311 10.155 -1.651 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.604 10.510 -1.604 1.00 0.00 H new ATOM 0 HB2 LEU A 119 0.341 9.667 0.571 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.408 9.606 0.662 1.00 0.00 H new ATOM 0 HG LEU A 119 0.114 8.029 -1.414 1.00 0.00 H new ATOM 0 HD11 LEU A 119 0.026 6.104 0.120 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.033 7.420 0.769 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.609 7.161 1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -1.897 6.607 -1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.608 7.684 -0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -2.294 8.290 -1.757 1.00 0.00 H new ATOM 1804 N ARG A 120 -1.443 12.159 0.609 1.00 0.00 N ATOM 1805 CA ARG A 120 -1.495 13.423 1.334 1.00 0.00 C ATOM 1806 C ARG A 120 -1.073 13.234 2.788 1.00 0.00 C ATOM 1807 O ARG A 120 -1.883 12.863 3.638 1.00 0.00 O ATOM 1808 CB ARG A 120 -2.905 14.012 1.274 1.00 0.00 C ATOM 1809 CG ARG A 120 -4.002 12.995 1.544 1.00 0.00 C ATOM 1810 CD ARG A 120 -5.380 13.573 1.260 1.00 0.00 C ATOM 1811 NE ARG A 120 -5.592 13.807 -0.166 1.00 0.00 N ATOM 1812 CZ ARG A 120 -6.792 13.970 -0.714 1.00 0.00 C ATOM 1813 NH1 ARG A 120 -7.880 13.925 0.042 1.00 0.00 N ATOM 1814 NH2 ARG A 120 -6.904 14.178 -2.019 1.00 0.00 N ATOM 0 H ARG A 120 -2.094 11.451 0.949 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.799 14.114 0.859 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -2.983 14.820 2.001 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -3.064 14.453 0.290 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.842 12.112 0.925 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -3.950 12.669 2.583 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -6.143 12.890 1.633 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -5.499 14.511 1.803 1.00 0.00 H new ATOM 0 HE ARG A 120 -4.775 13.848 -0.775 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -7.797 13.765 1.046 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -8.800 14.050 -0.380 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -6.069 14.213 -2.603 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -7.825 14.303 -2.438 1.00 0.00 H new ATOM 1828 N TYR A 121 0.201 13.490 3.067 1.00 0.00 N ATOM 1829 CA TYR A 121 0.731 13.345 4.417 1.00 0.00 C ATOM 1830 C TYR A 121 -0.059 14.195 5.407 1.00 0.00 C ATOM 1831 O TYR A 121 -0.075 13.918 6.607 1.00 0.00 O ATOM 1832 CB TYR A 121 2.208 13.742 4.452 1.00 0.00 C ATOM 1833 CG TYR A 121 2.433 15.237 4.484 1.00 0.00 C ATOM 1834 CD1 TYR A 121 1.901 16.060 3.499 1.00 0.00 C ATOM 1835 CD2 TYR A 121 3.176 15.826 5.499 1.00 0.00 C ATOM 1836 CE1 TYR A 121 2.105 17.426 3.524 1.00 0.00 C ATOM 1837 CE2 TYR A 121 3.383 17.192 5.533 1.00 0.00 C ATOM 1838 CZ TYR A 121 2.846 17.987 4.543 1.00 0.00 C ATOM 1839 OH TYR A 121 3.050 19.348 4.572 1.00 0.00 O ATOM 0 H TYR A 121 0.885 13.799 2.376 1.00 0.00 H new ATOM 0 HA TYR A 121 0.635 12.299 4.707 1.00 0.00 H new ATOM 0 HB2 TYR A 121 2.675 13.294 5.329 1.00 0.00 H new ATOM 0 HB3 TYR A 121 2.708 13.326 3.577 1.00 0.00 H new ATOM 0 HD1 TYR A 121 1.318 15.625 2.701 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.599 15.206 6.275 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.686 18.052 2.750 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.962 17.634 6.330 1.00 0.00 H new ATOM 0 HH TYR A 121 3.591 19.581 5.355 1.00 0.00 H new ATOM 1849 N VAL A 122 -0.715 15.231 4.896 1.00 0.00 N ATOM 1850 CA VAL A 122 -1.510 16.122 5.733 1.00 0.00 C ATOM 1851 C VAL A 122 -2.578 15.349 6.498 1.00 0.00 C ATOM 1852 O VAL A 122 -3.075 15.808 7.527 1.00 0.00 O ATOM 1853 CB VAL A 122 -2.189 17.222 4.895 1.00 0.00 C ATOM 1854 CG1 VAL A 122 -3.101 16.607 3.845 1.00 0.00 C ATOM 1855 CG2 VAL A 122 -2.964 18.174 5.795 1.00 0.00 C ATOM 0 H VAL A 122 -0.712 15.475 3.906 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.824 16.587 6.441 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.416 17.793 4.380 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.572 17.399 3.263 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.515 15.969 3.183 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.871 16.011 4.336 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -3.437 18.945 5.187 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.729 17.619 6.338 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -2.281 18.640 6.505 1.00 0.00 H new ATOM 1865 N LYS A 123 -2.927 14.172 5.990 1.00 0.00 N ATOM 1866 CA LYS A 123 -3.935 13.332 6.626 1.00 0.00 C ATOM 1867 C LYS A 123 -3.283 12.183 7.389 1.00 0.00 C ATOM 1868 O LYS A 123 -3.799 11.734 8.413 1.00 0.00 O ATOM 1869 CB LYS A 123 -4.902 12.778 5.577 1.00 0.00 C ATOM 1870 CG LYS A 123 -5.617 13.856 4.781 1.00 0.00 C ATOM 1871 CD LYS A 123 -6.911 14.280 5.454 1.00 0.00 C ATOM 1872 CE LYS A 123 -6.709 15.509 6.327 1.00 0.00 C ATOM 1873 NZ LYS A 123 -7.960 16.304 6.465 1.00 0.00 N ATOM 0 H LYS A 123 -2.526 13.778 5.139 1.00 0.00 H new ATOM 0 HA LYS A 123 -4.490 13.947 7.335 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -4.351 12.136 4.890 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -5.644 12.152 6.073 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -4.963 14.721 4.670 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -5.831 13.487 3.778 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -7.665 14.491 4.695 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -7.292 13.459 6.062 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -6.364 15.200 7.314 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -5.927 16.135 5.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -7.780 17.133 7.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -8.276 16.620 5.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -8.700 15.715 6.899 1.00 0.00 H new ATOM 1887 N PHE A 124 -2.147 11.713 6.885 1.00 0.00 N ATOM 1888 CA PHE A 124 -1.425 10.616 7.520 1.00 0.00 C ATOM 1889 C PHE A 124 -0.267 11.143 8.362 1.00 0.00 C ATOM 1890 O PHE A 124 0.776 10.499 8.473 1.00 0.00 O ATOM 1891 CB PHE A 124 -0.900 9.643 6.462 1.00 0.00 C ATOM 1892 CG PHE A 124 -1.900 9.332 5.385 1.00 0.00 C ATOM 1893 CD1 PHE A 124 -2.948 8.458 5.627 1.00 0.00 C ATOM 1894 CD2 PHE A 124 -1.791 9.911 4.132 1.00 0.00 C ATOM 1895 CE1 PHE A 124 -3.870 8.170 4.638 1.00 0.00 C ATOM 1896 CE2 PHE A 124 -2.710 9.627 3.139 1.00 0.00 C ATOM 1897 CZ PHE A 124 -3.750 8.754 3.393 1.00 0.00 C ATOM 0 H PHE A 124 -1.706 12.074 6.039 1.00 0.00 H new ATOM 0 HA PHE A 124 -2.118 10.089 8.176 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.005 10.064 6.005 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.602 8.715 6.949 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -3.045 7.997 6.599 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -0.978 10.593 3.928 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -4.683 7.489 4.839 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -2.615 10.087 2.166 1.00 0.00 H new ATOM 0 HZ PHE A 124 -4.468 8.529 2.619 1.00 0.00 H new ATOM 1907 N GLN A 125 -0.459 12.319 8.952 1.00 0.00 N ATOM 1908 CA GLN A 125 0.570 12.933 9.783 1.00 0.00 C ATOM 1909 C GLN A 125 1.072 11.955 10.840 1.00 0.00 C ATOM 1910 O GLN A 125 2.228 12.014 11.255 1.00 0.00 O ATOM 1911 CB GLN A 125 0.025 14.194 10.456 1.00 0.00 C ATOM 1912 CG GLN A 125 -0.454 15.250 9.473 1.00 0.00 C ATOM 1913 CD GLN A 125 0.657 16.183 9.032 1.00 0.00 C ATOM 1914 OE1 GLN A 125 0.751 17.319 9.499 1.00 0.00 O ATOM 1915 NE2 GLN A 125 1.505 15.708 8.127 1.00 0.00 N ATOM 0 H GLN A 125 -1.317 12.865 8.870 1.00 0.00 H new ATOM 0 HA GLN A 125 1.407 13.205 9.140 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -0.801 13.918 11.111 1.00 0.00 H new ATOM 0 HB3 GLN A 125 0.803 14.624 11.088 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -0.880 14.760 8.598 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -1.252 15.833 9.932 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.389 14.761 7.767 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.272 16.291 7.792 1.00 0.00 H new ATOM 1924 N ASN A 126 0.194 11.055 11.271 1.00 0.00 N ATOM 1925 CA ASN A 126 0.548 10.064 12.280 1.00 0.00 C ATOM 1926 C ASN A 126 -0.434 8.896 12.265 1.00 0.00 C ATOM 1927 O ASN A 126 -1.501 8.961 12.876 1.00 0.00 O ATOM 1928 CB ASN A 126 0.573 10.706 13.669 1.00 0.00 C ATOM 1929 CG ASN A 126 1.062 9.749 14.739 1.00 0.00 C ATOM 1930 OD1 ASN A 126 0.550 8.638 14.874 1.00 0.00 O ATOM 1931 ND2 ASN A 126 2.057 10.179 15.507 1.00 0.00 N ATOM 0 H ASN A 126 -0.768 10.992 10.937 1.00 0.00 H new ATOM 0 HA ASN A 126 1.542 9.683 12.045 1.00 0.00 H new ATOM 0 HB2 ASN A 126 1.218 11.584 13.649 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -0.429 11.052 13.925 1.00 0.00 H new ATOM 0 HD21 ASN A 126 2.427 9.580 16.245 1.00 0.00 H new ATOM 0 HD22 ASN A 126 2.451 11.108 15.359 1.00 0.00 H new ATOM 1938 N VAL A 127 -0.066 7.829 11.564 1.00 0.00 N ATOM 1939 CA VAL A 127 -0.913 6.646 11.470 1.00 0.00 C ATOM 1940 C VAL A 127 -0.203 5.416 12.023 1.00 0.00 C ATOM 1941 O VAL A 127 1.004 5.254 11.851 1.00 0.00 O ATOM 1942 CB VAL A 127 -1.334 6.371 10.014 1.00 0.00 C ATOM 1943 CG1 VAL A 127 -1.818 7.650 9.347 1.00 0.00 C ATOM 1944 CG2 VAL A 127 -0.182 5.756 9.234 1.00 0.00 C ATOM 0 H VAL A 127 0.814 7.759 11.052 1.00 0.00 H new ATOM 0 HA VAL A 127 -1.803 6.846 12.066 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.159 5.659 10.021 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -2.111 7.436 8.319 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.675 8.044 9.894 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.016 8.388 9.349 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.497 5.568 8.207 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.665 6.442 9.234 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.113 4.816 9.701 1.00 0.00 H new ATOM 1954 N ASN A 128 -0.961 4.551 12.689 1.00 0.00 N ATOM 1955 CA ASN A 128 -0.404 3.334 13.268 1.00 0.00 C ATOM 1956 C ASN A 128 -0.960 2.096 12.572 1.00 0.00 C ATOM 1957 O ASN A 128 -0.418 0.999 12.706 1.00 0.00 O ATOM 1958 CB ASN A 128 -0.709 3.271 14.766 1.00 0.00 C ATOM 1959 CG ASN A 128 -0.417 1.907 15.359 1.00 0.00 C ATOM 1960 OD1 ASN A 128 0.671 1.666 15.883 1.00 0.00 O ATOM 1961 ND2 ASN A 128 -1.389 1.006 15.279 1.00 0.00 N ATOM 0 H ASN A 128 -1.963 4.670 12.841 1.00 0.00 H new ATOM 0 HA ASN A 128 0.676 3.355 13.124 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -0.118 4.024 15.286 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -1.758 3.519 14.931 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -1.250 0.070 15.661 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -2.275 1.249 14.836 1.00 0.00 H new ATOM 1968 N SER A 129 -2.046 2.280 11.827 1.00 0.00 N ATOM 1969 CA SER A 129 -2.678 1.177 11.112 1.00 0.00 C ATOM 1970 C SER A 129 -3.331 1.669 9.824 1.00 0.00 C ATOM 1971 O SER A 129 -4.231 2.509 9.851 1.00 0.00 O ATOM 1972 CB SER A 129 -3.722 0.498 12.000 1.00 0.00 C ATOM 1973 OG SER A 129 -4.665 1.437 12.488 1.00 0.00 O ATOM 0 H SER A 129 -2.506 3.182 11.703 1.00 0.00 H new ATOM 0 HA SER A 129 -1.905 0.453 10.854 1.00 0.00 H new ATOM 0 HB2 SER A 129 -4.237 -0.278 11.433 1.00 0.00 H new ATOM 0 HB3 SER A 129 -3.227 0.006 12.837 1.00 0.00 H new ATOM 0 HG SER A 129 -4.845 2.109 11.797 1.00 0.00 H new ATOM 1979 N VAL A 130 -2.871 1.139 8.695 1.00 0.00 N ATOM 1980 CA VAL A 130 -3.409 1.522 7.395 1.00 0.00 C ATOM 1981 C VAL A 130 -3.956 0.311 6.648 1.00 0.00 C ATOM 1982 O VAL A 130 -3.393 -0.782 6.718 1.00 0.00 O ATOM 1983 CB VAL A 130 -2.341 2.209 6.525 1.00 0.00 C ATOM 1984 CG1 VAL A 130 -1.089 1.349 6.437 1.00 0.00 C ATOM 1985 CG2 VAL A 130 -2.892 2.505 5.138 1.00 0.00 C ATOM 0 H VAL A 130 -2.127 0.443 8.655 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.220 2.226 7.584 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.071 3.156 6.993 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.345 1.851 5.818 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.684 1.193 7.437 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.340 0.386 5.993 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.123 2.991 4.537 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.192 1.573 4.659 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.756 3.164 5.223 1.00 0.00 H new ATOM 1995 N THR A 131 -5.057 0.512 5.931 1.00 0.00 N ATOM 1996 CA THR A 131 -5.681 -0.564 5.171 1.00 0.00 C ATOM 1997 C THR A 131 -6.043 -0.104 3.763 1.00 0.00 C ATOM 1998 O THR A 131 -6.426 1.048 3.556 1.00 0.00 O ATOM 1999 CB THR A 131 -6.951 -1.083 5.871 1.00 0.00 C ATOM 2000 OG1 THR A 131 -6.619 -1.612 7.159 1.00 0.00 O ATOM 2001 CG2 THR A 131 -7.628 -2.159 5.035 1.00 0.00 C ATOM 0 H THR A 131 -5.535 1.410 5.861 1.00 0.00 H new ATOM 0 HA THR A 131 -4.952 -1.372 5.111 1.00 0.00 H new ATOM 0 HB THR A 131 -7.641 -0.248 5.989 1.00 0.00 H new ATOM 0 HG1 THR A 131 -7.432 -1.938 7.598 1.00 0.00 H new ATOM 0 HG21 THR A 131 -8.522 -2.510 5.549 1.00 0.00 H new ATOM 0 HG22 THR A 131 -7.906 -1.745 4.066 1.00 0.00 H new ATOM 0 HG23 THR A 131 -6.941 -2.993 4.890 1.00 0.00 H new ATOM 2009 N ILE A 132 -5.919 -1.011 2.800 1.00 0.00 N ATOM 2010 CA ILE A 132 -6.235 -0.698 1.412 1.00 0.00 C ATOM 2011 C ILE A 132 -7.228 -1.701 0.834 1.00 0.00 C ATOM 2012 O ILE A 132 -6.978 -2.907 0.832 1.00 0.00 O ATOM 2013 CB ILE A 132 -4.969 -0.683 0.536 1.00 0.00 C ATOM 2014 CG1 ILE A 132 -4.006 0.408 1.011 1.00 0.00 C ATOM 2015 CG2 ILE A 132 -5.338 -0.471 -0.925 1.00 0.00 C ATOM 2016 CD1 ILE A 132 -2.578 -0.069 1.156 1.00 0.00 C ATOM 0 H ILE A 132 -5.602 -1.968 2.955 1.00 0.00 H new ATOM 0 HA ILE A 132 -6.682 0.296 1.407 1.00 0.00 H new ATOM 0 HB ILE A 132 -4.470 -1.648 0.629 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -4.033 1.238 0.305 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -4.351 0.794 1.970 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -4.432 -0.463 -1.532 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -5.990 -1.279 -1.257 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -5.857 0.481 -1.035 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.952 0.756 1.496 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -2.537 -0.879 1.884 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -2.215 -0.428 0.193 1.00 0.00 H new ATOM 2028 N PHE A 133 -8.354 -1.195 0.342 1.00 0.00 N ATOM 2029 CA PHE A 133 -9.384 -2.047 -0.240 1.00 0.00 C ATOM 2030 C PHE A 133 -9.417 -1.901 -1.758 1.00 0.00 C ATOM 2031 O PHE A 133 -9.581 -0.800 -2.285 1.00 0.00 O ATOM 2032 CB PHE A 133 -10.754 -1.699 0.346 1.00 0.00 C ATOM 2033 CG PHE A 133 -11.899 -2.345 -0.381 1.00 0.00 C ATOM 2034 CD1 PHE A 133 -11.833 -3.675 -0.762 1.00 0.00 C ATOM 2035 CD2 PHE A 133 -13.041 -1.621 -0.684 1.00 0.00 C ATOM 2036 CE1 PHE A 133 -12.885 -4.273 -1.430 1.00 0.00 C ATOM 2037 CE2 PHE A 133 -14.096 -2.213 -1.353 1.00 0.00 C ATOM 2038 CZ PHE A 133 -14.017 -3.540 -1.727 1.00 0.00 C ATOM 0 H PHE A 133 -8.576 -0.200 0.335 1.00 0.00 H new ATOM 0 HA PHE A 133 -9.144 -3.082 0.003 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -10.781 -2.003 1.392 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -10.885 -0.617 0.325 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -10.949 -4.252 -0.534 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -13.108 -0.583 -0.394 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -12.822 -5.312 -1.719 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -14.981 -1.638 -1.583 1.00 0.00 H new ATOM 0 HZ PHE A 133 -14.839 -4.004 -2.251 1.00 0.00 H new ATOM 2048 N VAL A 134 -9.258 -3.020 -2.458 1.00 0.00 N ATOM 2049 CA VAL A 134 -9.269 -3.019 -3.916 1.00 0.00 C ATOM 2050 C VAL A 134 -10.695 -2.986 -4.455 1.00 0.00 C ATOM 2051 O VAL A 134 -11.521 -3.827 -4.103 1.00 0.00 O ATOM 2052 CB VAL A 134 -8.546 -4.255 -4.484 1.00 0.00 C ATOM 2053 CG1 VAL A 134 -8.602 -4.255 -6.004 1.00 0.00 C ATOM 2054 CG2 VAL A 134 -7.107 -4.301 -3.995 1.00 0.00 C ATOM 0 H VAL A 134 -9.120 -3.939 -2.038 1.00 0.00 H new ATOM 0 HA VAL A 134 -8.742 -2.120 -4.236 1.00 0.00 H new ATOM 0 HB VAL A 134 -9.056 -5.149 -4.126 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -8.086 -5.135 -6.387 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -9.642 -4.273 -6.330 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -8.118 -3.356 -6.386 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -6.611 -5.180 -4.406 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -6.583 -3.403 -4.322 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -7.094 -4.353 -2.906 1.00 0.00 H new ATOM 2064 N GLN A 135 -10.975 -2.008 -5.310 1.00 0.00 N ATOM 2065 CA GLN A 135 -12.302 -1.865 -5.898 1.00 0.00 C ATOM 2066 C GLN A 135 -12.279 -2.203 -7.384 1.00 0.00 C ATOM 2067 O GLN A 135 -12.917 -3.160 -7.823 1.00 0.00 O ATOM 2068 CB GLN A 135 -12.822 -0.440 -5.695 1.00 0.00 C ATOM 2069 CG GLN A 135 -14.321 -0.369 -5.451 1.00 0.00 C ATOM 2070 CD GLN A 135 -14.735 0.900 -4.732 1.00 0.00 C ATOM 2071 OE1 GLN A 135 -14.628 1.999 -5.277 1.00 0.00 O ATOM 2072 NE2 GLN A 135 -15.211 0.755 -3.501 1.00 0.00 N ATOM 0 H GLN A 135 -10.302 -1.303 -5.611 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.971 -2.564 -5.396 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -12.303 0.010 -4.849 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -12.577 0.156 -6.574 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.844 -0.429 -6.405 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -14.631 -1.233 -4.863 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.282 -0.175 -3.088 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.505 1.574 -2.968 1.00 0.00 H new ATOM 2081 N SER A 136 -11.539 -1.412 -8.155 1.00 0.00 N ATOM 2082 CA SER A 136 -11.436 -1.626 -9.594 1.00 0.00 C ATOM 2083 C SER A 136 -9.975 -1.666 -10.033 1.00 0.00 C ATOM 2084 O SER A 136 -9.079 -1.284 -9.282 1.00 0.00 O ATOM 2085 CB SER A 136 -12.177 -0.521 -10.349 1.00 0.00 C ATOM 2086 OG SER A 136 -13.281 -1.046 -11.066 1.00 0.00 O ATOM 0 H SER A 136 -11.002 -0.617 -7.807 1.00 0.00 H new ATOM 0 HA SER A 136 -11.895 -2.587 -9.828 1.00 0.00 H new ATOM 0 HB2 SER A 136 -12.523 0.236 -9.645 1.00 0.00 H new ATOM 0 HB3 SER A 136 -11.493 -0.026 -11.039 1.00 0.00 H new ATOM 0 HG SER A 136 -13.739 -0.320 -11.539 1.00 0.00 H new ATOM 2092 N ASN A 137 -9.744 -2.133 -11.256 1.00 0.00 N ATOM 2093 CA ASN A 137 -8.393 -2.225 -11.797 1.00 0.00 C ATOM 2094 C ASN A 137 -8.185 -1.210 -12.917 1.00 0.00 C ATOM 2095 O ASN A 137 -9.055 -0.382 -13.185 1.00 0.00 O ATOM 2096 CB ASN A 137 -8.125 -3.638 -12.318 1.00 0.00 C ATOM 2097 CG ASN A 137 -9.341 -4.538 -12.203 1.00 0.00 C ATOM 2098 OD1 ASN A 137 -10.387 -4.264 -12.791 1.00 0.00 O ATOM 2099 ND2 ASN A 137 -9.208 -5.617 -11.441 1.00 0.00 N ATOM 0 H ASN A 137 -10.475 -2.454 -11.891 1.00 0.00 H new ATOM 0 HA ASN A 137 -7.691 -2.002 -10.994 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -7.814 -3.584 -13.361 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -7.298 -4.077 -11.760 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -9.992 -6.259 -11.324 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -8.322 -5.804 -10.972 1.00 0.00 H new ATOM 2106 N GLN A 138 -7.028 -1.283 -13.566 1.00 0.00 N ATOM 2107 CA GLN A 138 -6.707 -0.370 -14.657 1.00 0.00 C ATOM 2108 C GLN A 138 -7.659 -0.569 -15.832 1.00 0.00 C ATOM 2109 O GLN A 138 -8.390 0.345 -16.213 1.00 0.00 O ATOM 2110 CB GLN A 138 -5.262 -0.578 -15.116 1.00 0.00 C ATOM 2111 CG GLN A 138 -4.242 -0.435 -13.997 1.00 0.00 C ATOM 2112 CD GLN A 138 -4.014 1.010 -13.597 1.00 0.00 C ATOM 2113 OE1 GLN A 138 -3.585 1.830 -14.409 1.00 0.00 O ATOM 2114 NE2 GLN A 138 -4.302 1.329 -12.341 1.00 0.00 N ATOM 0 H GLN A 138 -6.298 -1.964 -13.356 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.821 0.650 -14.289 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -5.169 -1.571 -15.557 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -5.031 0.142 -15.901 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -4.580 -1.000 -13.128 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -3.296 -0.874 -14.314 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -4.655 0.617 -11.702 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -4.170 2.286 -12.015 1.00 0.00 H new ATOM 2123 N GLY A 139 -7.645 -1.769 -16.403 1.00 0.00 N ATOM 2124 CA GLY A 139 -8.511 -2.066 -17.529 1.00 0.00 C ATOM 2125 C GLY A 139 -9.798 -2.746 -17.107 1.00 0.00 C ATOM 2126 O GLY A 139 -10.408 -3.473 -17.890 1.00 0.00 O ATOM 0 H GLY A 139 -7.049 -2.542 -16.106 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -8.748 -1.141 -18.055 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -7.980 -2.706 -18.233 1.00 0.00 H new ATOM 2130 N GLU A 140 -10.211 -2.511 -15.865 1.00 0.00 N ATOM 2131 CA GLU A 140 -11.432 -3.109 -15.341 1.00 0.00 C ATOM 2132 C GLU A 140 -11.436 -4.619 -15.559 1.00 0.00 C ATOM 2133 O GLU A 140 -12.460 -5.203 -15.912 1.00 0.00 O ATOM 2134 CB GLU A 140 -12.660 -2.484 -16.007 1.00 0.00 C ATOM 2135 CG GLU A 140 -12.643 -0.964 -16.009 1.00 0.00 C ATOM 2136 CD GLU A 140 -14.015 -0.367 -16.258 1.00 0.00 C ATOM 2137 OE1 GLU A 140 -14.760 -0.164 -15.277 1.00 0.00 O ATOM 2138 OE2 GLU A 140 -14.342 -0.101 -17.434 1.00 0.00 O ATOM 0 H GLU A 140 -9.718 -1.911 -15.204 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.470 -2.914 -14.269 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -12.726 -2.840 -17.035 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -13.557 -2.828 -15.492 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -12.264 -0.607 -15.052 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -11.953 -0.613 -16.776 1.00 0.00 H new ATOM 2145 N GLU A 141 -10.282 -5.245 -15.346 1.00 0.00 N ATOM 2146 CA GLU A 141 -10.152 -6.686 -15.521 1.00 0.00 C ATOM 2147 C GLU A 141 -11.102 -7.435 -14.590 1.00 0.00 C ATOM 2148 O GLU A 141 -11.941 -6.829 -13.925 1.00 0.00 O ATOM 2149 CB GLU A 141 -8.710 -7.126 -15.257 1.00 0.00 C ATOM 2150 CG GLU A 141 -7.688 -6.416 -16.129 1.00 0.00 C ATOM 2151 CD GLU A 141 -7.438 -7.136 -17.439 1.00 0.00 C ATOM 2152 OE1 GLU A 141 -8.232 -8.036 -17.783 1.00 0.00 O ATOM 2153 OE2 GLU A 141 -6.447 -6.798 -18.121 1.00 0.00 O ATOM 0 H GLU A 141 -9.425 -4.776 -15.052 1.00 0.00 H new ATOM 0 HA GLU A 141 -10.415 -6.926 -16.551 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.470 -6.945 -14.209 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.631 -8.201 -15.421 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -8.034 -5.403 -16.336 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -6.749 -6.327 -15.583 1.00 0.00 H new ATOM 2160 N GLU A 142 -10.963 -8.757 -14.551 1.00 0.00 N ATOM 2161 CA GLU A 142 -11.809 -9.588 -13.703 1.00 0.00 C ATOM 2162 C GLU A 142 -11.200 -9.747 -12.313 1.00 0.00 C ATOM 2163 O GLU A 142 -11.911 -9.960 -11.331 1.00 0.00 O ATOM 2164 CB GLU A 142 -12.014 -10.963 -14.342 1.00 0.00 C ATOM 2165 CG GLU A 142 -10.717 -11.655 -14.728 1.00 0.00 C ATOM 2166 CD GLU A 142 -10.843 -13.166 -14.741 1.00 0.00 C ATOM 2167 OE1 GLU A 142 -11.366 -13.726 -13.754 1.00 0.00 O ATOM 2168 OE2 GLU A 142 -10.420 -13.788 -15.737 1.00 0.00 O ATOM 0 H GLU A 142 -10.273 -9.274 -15.096 1.00 0.00 H new ATOM 0 HA GLU A 142 -12.775 -9.093 -13.602 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -12.562 -11.599 -13.647 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -12.635 -10.852 -15.231 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -10.406 -11.312 -15.715 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -9.933 -11.366 -14.028 1.00 0.00 H new ATOM 2175 N THR A 143 -9.877 -9.641 -12.238 1.00 0.00 N ATOM 2176 CA THR A 143 -9.170 -9.774 -10.971 1.00 0.00 C ATOM 2177 C THR A 143 -7.903 -8.928 -10.956 1.00 0.00 C ATOM 2178 O THR A 143 -7.315 -8.652 -12.003 1.00 0.00 O ATOM 2179 CB THR A 143 -8.797 -11.242 -10.686 1.00 0.00 C ATOM 2180 OG1 THR A 143 -7.740 -11.301 -9.722 1.00 0.00 O ATOM 2181 CG2 THR A 143 -8.365 -11.947 -11.963 1.00 0.00 C ATOM 0 H THR A 143 -9.273 -9.463 -13.041 1.00 0.00 H new ATOM 0 HA THR A 143 -9.848 -9.422 -10.194 1.00 0.00 H new ATOM 0 HB THR A 143 -9.678 -11.748 -10.290 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.510 -12.237 -9.545 1.00 0.00 H new ATOM 0 HG21 THR A 143 -8.106 -12.982 -11.738 1.00 0.00 H new ATOM 0 HG22 THR A 143 -9.182 -11.926 -12.684 1.00 0.00 H new ATOM 0 HG23 THR A 143 -7.497 -11.439 -12.383 1.00 0.00 H new ATOM 2189 N THR A 144 -7.484 -8.517 -9.763 1.00 0.00 N ATOM 2190 CA THR A 144 -6.286 -7.702 -9.612 1.00 0.00 C ATOM 2191 C THR A 144 -5.151 -8.502 -8.982 1.00 0.00 C ATOM 2192 O THR A 144 -5.304 -9.064 -7.898 1.00 0.00 O ATOM 2193 CB THR A 144 -6.559 -6.455 -8.750 1.00 0.00 C ATOM 2194 OG1 THR A 144 -7.837 -5.900 -9.083 1.00 0.00 O ATOM 2195 CG2 THR A 144 -5.476 -5.407 -8.955 1.00 0.00 C ATOM 0 H THR A 144 -7.958 -8.736 -8.887 1.00 0.00 H new ATOM 0 HA THR A 144 -5.992 -7.386 -10.613 1.00 0.00 H new ATOM 0 HB THR A 144 -6.556 -6.757 -7.703 1.00 0.00 H new ATOM 0 HG1 THR A 144 -7.937 -5.026 -8.651 1.00 0.00 H new ATOM 0 HG21 THR A 144 -5.691 -4.536 -8.336 1.00 0.00 H new ATOM 0 HG22 THR A 144 -4.509 -5.823 -8.673 1.00 0.00 H new ATOM 0 HG23 THR A 144 -5.451 -5.110 -10.003 1.00 0.00 H new ATOM 2203 N ARG A 145 -4.014 -8.548 -9.668 1.00 0.00 N ATOM 2204 CA ARG A 145 -2.854 -9.281 -9.175 1.00 0.00 C ATOM 2205 C ARG A 145 -1.831 -8.329 -8.562 1.00 0.00 C ATOM 2206 O ARG A 145 -1.329 -7.426 -9.232 1.00 0.00 O ATOM 2207 CB ARG A 145 -2.208 -10.079 -10.309 1.00 0.00 C ATOM 2208 CG ARG A 145 -2.426 -11.579 -10.200 1.00 0.00 C ATOM 2209 CD ARG A 145 -2.861 -12.177 -11.529 1.00 0.00 C ATOM 2210 NE ARG A 145 -1.905 -11.891 -12.596 1.00 0.00 N ATOM 2211 CZ ARG A 145 -0.759 -12.545 -12.751 1.00 0.00 C ATOM 2212 NH1 ARG A 145 -0.428 -13.517 -11.912 1.00 0.00 N ATOM 2213 NH2 ARG A 145 0.058 -12.227 -13.747 1.00 0.00 N ATOM 0 H ARG A 145 -3.871 -8.087 -10.566 1.00 0.00 H new ATOM 0 HA ARG A 145 -3.193 -9.971 -8.402 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -2.609 -9.731 -11.261 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -1.137 -9.876 -10.320 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -1.505 -12.058 -9.868 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -3.183 -11.784 -9.443 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -2.973 -13.256 -11.422 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -3.839 -11.781 -11.802 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.130 -11.149 -13.258 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -1.054 -13.764 -11.145 1.00 0.00 H new ATOM 0 HH12 ARG A 145 0.452 -14.018 -12.033 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -0.194 -11.480 -14.394 1.00 0.00 H new ATOM 0 HH22 ARG A 145 0.938 -12.730 -13.865 1.00 0.00 H new ATOM 2227 N ILE A 146 -1.528 -8.538 -7.285 1.00 0.00 N ATOM 2228 CA ILE A 146 -0.565 -7.699 -6.582 1.00 0.00 C ATOM 2229 C ILE A 146 0.817 -8.345 -6.564 1.00 0.00 C ATOM 2230 O ILE A 146 0.956 -9.529 -6.258 1.00 0.00 O ATOM 2231 CB ILE A 146 -1.009 -7.425 -5.133 1.00 0.00 C ATOM 2232 CG1 ILE A 146 -2.527 -7.241 -5.068 1.00 0.00 C ATOM 2233 CG2 ILE A 146 -0.297 -6.198 -4.584 1.00 0.00 C ATOM 2234 CD1 ILE A 146 -3.041 -6.142 -5.972 1.00 0.00 C ATOM 0 H ILE A 146 -1.935 -9.281 -6.716 1.00 0.00 H new ATOM 0 HA ILE A 146 -0.516 -6.754 -7.123 1.00 0.00 H new ATOM 0 HB ILE A 146 -0.739 -8.283 -4.517 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -3.011 -8.179 -5.339 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.814 -7.019 -4.040 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -0.621 -6.017 -3.559 1.00 0.00 H new ATOM 0 HG22 ILE A 146 0.780 -6.365 -4.600 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -0.539 -5.331 -5.199 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.124 -6.068 -5.875 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.585 -5.194 -5.687 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -2.784 -6.372 -7.006 1.00 0.00 H new ATOM 2246 N SER A 147 1.836 -7.557 -6.893 1.00 0.00 N ATOM 2247 CA SER A 147 3.207 -8.052 -6.917 1.00 0.00 C ATOM 2248 C SER A 147 4.089 -7.256 -5.960 1.00 0.00 C ATOM 2249 O SER A 147 4.890 -7.825 -5.218 1.00 0.00 O ATOM 2250 CB SER A 147 3.775 -7.975 -8.336 1.00 0.00 C ATOM 2251 OG SER A 147 4.307 -6.688 -8.602 1.00 0.00 O ATOM 0 H SER A 147 1.738 -6.574 -7.146 1.00 0.00 H new ATOM 0 HA SER A 147 3.197 -9.093 -6.593 1.00 0.00 H new ATOM 0 HB2 SER A 147 4.554 -8.727 -8.461 1.00 0.00 H new ATOM 0 HB3 SER A 147 2.991 -8.205 -9.058 1.00 0.00 H new ATOM 0 HG SER A 147 4.044 -6.405 -9.503 1.00 0.00 H new ATOM 2257 N TYR A 148 3.935 -5.937 -5.982 1.00 0.00 N ATOM 2258 CA TYR A 148 4.718 -5.061 -5.119 1.00 0.00 C ATOM 2259 C TYR A 148 3.816 -4.082 -4.375 1.00 0.00 C ATOM 2260 O TYR A 148 3.058 -3.329 -4.987 1.00 0.00 O ATOM 2261 CB TYR A 148 5.754 -4.294 -5.941 1.00 0.00 C ATOM 2262 CG TYR A 148 6.848 -3.669 -5.105 1.00 0.00 C ATOM 2263 CD1 TYR A 148 7.462 -4.381 -4.082 1.00 0.00 C ATOM 2264 CD2 TYR A 148 7.269 -2.365 -5.339 1.00 0.00 C ATOM 2265 CE1 TYR A 148 8.461 -3.814 -3.316 1.00 0.00 C ATOM 2266 CE2 TYR A 148 8.269 -1.790 -4.578 1.00 0.00 C ATOM 2267 CZ TYR A 148 8.861 -2.518 -3.567 1.00 0.00 C ATOM 2268 OH TYR A 148 9.857 -1.950 -2.807 1.00 0.00 O ATOM 0 H TYR A 148 3.275 -5.451 -6.588 1.00 0.00 H new ATOM 0 HA TYR A 148 5.233 -5.681 -4.386 1.00 0.00 H new ATOM 0 HB2 TYR A 148 6.205 -4.972 -6.666 1.00 0.00 H new ATOM 0 HB3 TYR A 148 5.249 -3.511 -6.507 1.00 0.00 H new ATOM 0 HD1 TYR A 148 7.152 -5.396 -3.882 1.00 0.00 H new ATOM 0 HD2 TYR A 148 6.807 -1.792 -6.129 1.00 0.00 H new ATOM 0 HE1 TYR A 148 8.927 -4.382 -2.524 1.00 0.00 H new ATOM 0 HE2 TYR A 148 8.585 -0.776 -4.774 1.00 0.00 H new ATOM 0 HH TYR A 148 10.020 -1.034 -3.113 1.00 0.00 H new ATOM 2278 N PHE A 149 3.903 -4.097 -3.049 1.00 0.00 N ATOM 2279 CA PHE A 149 3.096 -3.210 -2.219 1.00 0.00 C ATOM 2280 C PHE A 149 3.899 -2.702 -1.025 1.00 0.00 C ATOM 2281 O PHE A 149 4.568 -3.474 -0.337 1.00 0.00 O ATOM 2282 CB PHE A 149 1.840 -3.937 -1.732 1.00 0.00 C ATOM 2283 CG PHE A 149 1.214 -3.305 -0.522 1.00 0.00 C ATOM 2284 CD1 PHE A 149 0.856 -1.966 -0.530 1.00 0.00 C ATOM 2285 CD2 PHE A 149 0.982 -4.050 0.623 1.00 0.00 C ATOM 2286 CE1 PHE A 149 0.280 -1.382 0.583 1.00 0.00 C ATOM 2287 CE2 PHE A 149 0.406 -3.471 1.739 1.00 0.00 C ATOM 2288 CZ PHE A 149 0.054 -2.136 1.718 1.00 0.00 C ATOM 0 H PHE A 149 4.524 -4.714 -2.526 1.00 0.00 H new ATOM 0 HA PHE A 149 2.800 -2.354 -2.825 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.108 -3.962 -2.539 1.00 0.00 H new ATOM 0 HB3 PHE A 149 2.095 -4.971 -1.501 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.029 -1.372 -1.415 1.00 0.00 H new ATOM 0 HD2 PHE A 149 1.254 -5.095 0.644 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.007 -0.337 0.565 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.232 -4.062 2.626 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.397 -1.682 2.588 1.00 0.00 H new ATOM 2298 N THR A 150 3.828 -1.396 -0.785 1.00 0.00 N ATOM 2299 CA THR A 150 4.548 -0.783 0.324 1.00 0.00 C ATOM 2300 C THR A 150 4.021 0.618 0.614 1.00 0.00 C ATOM 2301 O THR A 150 3.003 1.035 0.063 1.00 0.00 O ATOM 2302 CB THR A 150 6.059 -0.702 0.036 1.00 0.00 C ATOM 2303 OG1 THR A 150 6.780 -0.491 1.255 1.00 0.00 O ATOM 2304 CG2 THR A 150 6.364 0.425 -0.940 1.00 0.00 C ATOM 0 H THR A 150 3.279 -0.743 -1.344 1.00 0.00 H new ATOM 0 HA THR A 150 4.385 -1.417 1.196 1.00 0.00 H new ATOM 0 HB THR A 150 6.372 -1.645 -0.412 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.401 -1.235 1.401 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.437 0.463 -1.128 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.837 0.247 -1.877 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.037 1.374 -0.514 1.00 0.00 H new ATOM 2312 N PHE A 151 4.722 1.340 1.483 1.00 0.00 N ATOM 2313 CA PHE A 151 4.324 2.695 1.846 1.00 0.00 C ATOM 2314 C PHE A 151 5.536 3.621 1.903 1.00 0.00 C ATOM 2315 O PHE A 151 6.424 3.446 2.738 1.00 0.00 O ATOM 2316 CB PHE A 151 3.605 2.693 3.197 1.00 0.00 C ATOM 2317 CG PHE A 151 2.115 2.839 3.084 1.00 0.00 C ATOM 2318 CD1 PHE A 151 1.559 3.952 2.475 1.00 0.00 C ATOM 2319 CD2 PHE A 151 1.270 1.862 3.585 1.00 0.00 C ATOM 2320 CE1 PHE A 151 0.187 4.089 2.370 1.00 0.00 C ATOM 2321 CE2 PHE A 151 -0.102 1.993 3.483 1.00 0.00 C ATOM 2322 CZ PHE A 151 -0.644 3.108 2.873 1.00 0.00 C ATOM 0 H PHE A 151 5.567 1.009 1.948 1.00 0.00 H new ATOM 0 HA PHE A 151 3.642 3.065 1.080 1.00 0.00 H new ATOM 0 HB2 PHE A 151 3.832 1.763 3.719 1.00 0.00 H new ATOM 0 HB3 PHE A 151 3.996 3.506 3.809 1.00 0.00 H new ATOM 0 HD1 PHE A 151 2.204 4.721 2.078 1.00 0.00 H new ATOM 0 HD2 PHE A 151 1.689 0.988 4.061 1.00 0.00 H new ATOM 0 HE1 PHE A 151 -0.234 4.963 1.895 1.00 0.00 H new ATOM 0 HE2 PHE A 151 -0.750 1.225 3.880 1.00 0.00 H new ATOM 0 HZ PHE A 151 -1.716 3.212 2.790 1.00 0.00 H new ATOM 2332 N ILE A 152 5.564 4.604 1.010 1.00 0.00 N ATOM 2333 CA ILE A 152 6.665 5.557 0.959 1.00 0.00 C ATOM 2334 C ILE A 152 6.436 6.715 1.924 1.00 0.00 C ATOM 2335 O ILE A 152 5.364 7.317 1.944 1.00 0.00 O ATOM 2336 CB ILE A 152 6.858 6.119 -0.463 1.00 0.00 C ATOM 2337 CG1 ILE A 152 6.843 4.985 -1.489 1.00 0.00 C ATOM 2338 CG2 ILE A 152 8.159 6.903 -0.550 1.00 0.00 C ATOM 2339 CD1 ILE A 152 7.893 3.926 -1.236 1.00 0.00 C ATOM 0 H ILE A 152 4.837 4.761 0.312 1.00 0.00 H new ATOM 0 HA ILE A 152 7.564 5.015 1.252 1.00 0.00 H new ATOM 0 HB ILE A 152 6.033 6.796 -0.686 1.00 0.00 H new ATOM 0 HG12 ILE A 152 5.859 4.517 -1.486 1.00 0.00 H new ATOM 0 HG13 ILE A 152 6.994 5.404 -2.484 1.00 0.00 H new ATOM 0 HG21 ILE A 152 8.281 7.294 -1.560 1.00 0.00 H new ATOM 0 HG22 ILE A 152 8.133 7.731 0.159 1.00 0.00 H new ATOM 0 HG23 ILE A 152 8.996 6.247 -0.311 1.00 0.00 H new ATOM 0 HD11 ILE A 152 7.823 3.154 -2.002 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.883 4.380 -1.268 1.00 0.00 H new ATOM 0 HD13 ILE A 152 7.730 3.479 -0.255 1.00 0.00 H new ATOM 2351 N GLY A 153 7.453 7.022 2.724 1.00 0.00 N ATOM 2352 CA GLY A 153 7.343 8.108 3.680 1.00 0.00 C ATOM 2353 C GLY A 153 8.470 8.104 4.694 1.00 0.00 C ATOM 2354 O GLY A 153 9.614 7.790 4.362 1.00 0.00 O ATOM 0 H GLY A 153 8.351 6.538 2.727 1.00 0.00 H new ATOM 0 HA2 GLY A 153 7.342 9.059 3.147 1.00 0.00 H new ATOM 0 HA3 GLY A 153 6.389 8.034 4.202 1.00 0.00 H new ATOM 2358 N THR A 154 8.148 8.455 5.935 1.00 0.00 N ATOM 2359 CA THR A 154 9.142 8.494 7.000 1.00 0.00 C ATOM 2360 C THR A 154 8.478 8.540 8.371 1.00 0.00 C ATOM 2361 O THR A 154 7.326 8.950 8.516 1.00 0.00 O ATOM 2362 CB THR A 154 10.075 9.711 6.854 1.00 0.00 C ATOM 2363 OG1 THR A 154 10.332 10.289 8.139 1.00 0.00 O ATOM 2364 CG2 THR A 154 9.461 10.757 5.936 1.00 0.00 C ATOM 0 H THR A 154 7.206 8.716 6.227 1.00 0.00 H new ATOM 0 HA THR A 154 9.731 7.581 6.915 1.00 0.00 H new ATOM 0 HB THR A 154 11.013 9.371 6.415 1.00 0.00 H new ATOM 0 HG1 THR A 154 10.927 11.061 8.037 1.00 0.00 H new ATOM 0 HG21 THR A 154 10.138 11.607 5.848 1.00 0.00 H new ATOM 0 HG22 THR A 154 9.294 10.323 4.950 1.00 0.00 H new ATOM 0 HG23 THR A 154 8.510 11.092 6.351 1.00 0.00 H new ATOM 2372 N PRO A 155 9.218 8.109 9.403 1.00 0.00 N ATOM 2373 CA PRO A 155 8.720 8.092 10.782 1.00 0.00 C ATOM 2374 C PRO A 155 8.558 9.495 11.357 1.00 0.00 C ATOM 2375 O PRO A 155 9.426 10.352 11.185 1.00 0.00 O ATOM 2376 CB PRO A 155 9.805 7.325 11.542 1.00 0.00 C ATOM 2377 CG PRO A 155 11.044 7.525 10.738 1.00 0.00 C ATOM 2378 CD PRO A 155 10.598 7.606 9.304 1.00 0.00 C ATOM 0 HA PRO A 155 7.731 7.640 10.852 1.00 0.00 H new ATOM 0 HB2 PRO A 155 9.925 7.708 12.555 1.00 0.00 H new ATOM 0 HB3 PRO A 155 9.555 6.267 11.628 1.00 0.00 H new ATOM 0 HG2 PRO A 155 11.561 8.436 11.038 1.00 0.00 H new ATOM 0 HG3 PRO A 155 11.741 6.700 10.884 1.00 0.00 H new ATOM 0 HD2 PRO A 155 11.230 8.279 8.724 1.00 0.00 H new ATOM 0 HD3 PRO A 155 10.637 6.632 8.816 1.00 0.00 H new ATOM 2386 N VAL A 156 7.442 9.724 12.041 1.00 0.00 N ATOM 2387 CA VAL A 156 7.167 11.023 12.643 1.00 0.00 C ATOM 2388 C VAL A 156 8.342 11.495 13.492 1.00 0.00 C ATOM 2389 O VAL A 156 8.581 12.695 13.625 1.00 0.00 O ATOM 2390 CB VAL A 156 5.900 10.979 13.519 1.00 0.00 C ATOM 2391 CG1 VAL A 156 4.704 10.514 12.703 1.00 0.00 C ATOM 2392 CG2 VAL A 156 6.117 10.078 14.725 1.00 0.00 C ATOM 0 H VAL A 156 6.713 9.027 12.192 1.00 0.00 H new ATOM 0 HA VAL A 156 7.009 11.724 11.824 1.00 0.00 H new ATOM 0 HB VAL A 156 5.693 11.986 13.881 1.00 0.00 H new ATOM 0 HG11 VAL A 156 3.818 10.489 13.338 1.00 0.00 H new ATOM 0 HG12 VAL A 156 4.538 11.204 11.875 1.00 0.00 H new ATOM 0 HG13 VAL A 156 4.897 9.516 12.310 1.00 0.00 H new ATOM 0 HG21 VAL A 156 5.212 10.059 15.332 1.00 0.00 H new ATOM 0 HG22 VAL A 156 6.349 9.068 14.387 1.00 0.00 H new ATOM 0 HG23 VAL A 156 6.946 10.461 15.321 1.00 0.00 H new ATOM 2402 N GLN A 157 9.072 10.543 14.064 1.00 0.00 N ATOM 2403 CA GLN A 157 10.223 10.862 14.900 1.00 0.00 C ATOM 2404 C GLN A 157 11.336 9.837 14.709 1.00 0.00 C ATOM 2405 O GLN A 157 11.075 8.670 14.419 1.00 0.00 O ATOM 2406 CB GLN A 157 9.811 10.916 16.373 1.00 0.00 C ATOM 2407 CG GLN A 157 9.565 9.547 16.986 1.00 0.00 C ATOM 2408 CD GLN A 157 10.632 9.156 17.988 1.00 0.00 C ATOM 2409 OE1 GLN A 157 11.824 9.355 17.753 1.00 0.00 O ATOM 2410 NE2 GLN A 157 10.210 8.596 19.116 1.00 0.00 N ATOM 0 H GLN A 157 8.887 9.545 13.964 1.00 0.00 H new ATOM 0 HA GLN A 157 10.599 11.840 14.599 1.00 0.00 H new ATOM 0 HB2 GLN A 157 10.590 11.425 16.941 1.00 0.00 H new ATOM 0 HB3 GLN A 157 8.905 11.515 16.467 1.00 0.00 H new ATOM 0 HG2 GLN A 157 8.592 9.543 17.477 1.00 0.00 H new ATOM 0 HG3 GLN A 157 9.525 8.800 16.193 1.00 0.00 H new ATOM 0 HE21 GLN A 157 9.212 8.449 19.270 1.00 0.00 H new ATOM 0 HE22 GLN A 157 10.883 8.313 19.828 1.00 0.00 H new