USER MOD reduce.3.24.130724 H: found=0, std=0, add=825, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 825 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 Single : A 688 GLN : amide:sc= -1.34 K(o=-1.3,f=-0.37) USER MOD Single : A 691 TYR OH : rot 180:sc= 0 USER MOD Single : A 698 GLN : amide:sc= -1.54! K(o=-1.5!,f=-0.08) USER MOD Single : A 699 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 702 MET CE :methyl -122:sc= -1.85 (180deg=-3.11) USER MOD Single : B 1 MET CE :methyl 170:sc=-0.00138 (180deg=-0.172) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= -1.61 X(o=-1.6,f=-2.1) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0 USER MOD Single : B 9 THR OG1 : rot 180:sc=-0.00698 USER MOD Single : B 11 LYS NZ :NH3+ -179:sc= 1.03 (180deg=1.01) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 80:sc= -0.149 USER MOD Single : B 25 ASN : amide:sc= 0.489 K(o=0.49,f=-0.078) USER MOD Single : B 27 LYS NZ :NH3+ 173:sc= 1.15 (180deg=1.1) USER MOD Single : B 29 LYS NZ :NH3+ -170:sc= 1.11 (180deg=1.04) USER MOD Single : B 31 GLN : amide:sc= -0.396 K(o=-0.4,f=-1.3) USER MOD Single : B 33 LYS NZ :NH3+ -127:sc= 0.104 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= 0.0838 K(o=0.084,f=-4.9!) USER MOD Single : B 41 GLN : amide:sc= -0.0231 K(o=-0.023,f=-3.8!) USER MOD Single : B 48 LYS NZ :NH3+ -116:sc= -0.0248 (180deg=-0.29) USER MOD Single : B 49 GLN : amide:sc= -1.16 K(o=-1.2,f=-6.4!) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 131:sc= -2.63 USER MOD Single : B 60 ASN : amide:sc= -0.256 X(o=-0.26,f=-0.35) USER MOD Single : B 62 GLN : amide:sc= 1.08 K(o=1.1,f=-0.22) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot -120:sc= 0.582 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= -0.24 X(o=-0.24,f=-0.098) USER MOD ----------------------------------------------------------------- ATOM 63 N LEU A 679 18.181 -2.319 4.623 1.00 0.00 N ATOM 64 CA LEU A 679 16.905 -2.571 4.006 1.00 0.00 C ATOM 65 C LEU A 679 17.104 -3.109 2.583 1.00 0.00 C ATOM 66 O LEU A 679 18.225 -3.105 2.073 1.00 0.00 O ATOM 67 CB LEU A 679 16.096 -1.273 4.009 1.00 0.00 C ATOM 68 CG LEU A 679 16.073 -0.450 5.305 1.00 0.00 C ATOM 69 CD1 LEU A 679 15.725 -1.314 6.516 1.00 0.00 C ATOM 70 CD2 LEU A 679 17.364 0.317 5.588 1.00 0.00 C ATOM 0 HA LEU A 679 16.357 -3.329 4.565 1.00 0.00 H new ATOM 0 HB2 LEU A 679 16.482 -0.635 3.214 1.00 0.00 H new ATOM 0 HB3 LEU A 679 15.066 -1.519 3.749 1.00 0.00 H new ATOM 0 HG LEU A 679 15.291 0.291 5.140 1.00 0.00 H new ATOM 0 HD11 LEU A 679 15.719 -0.696 7.414 1.00 0.00 H new ATOM 0 HD12 LEU A 679 14.740 -1.759 6.375 1.00 0.00 H new ATOM 0 HD13 LEU A 679 16.468 -2.104 6.625 1.00 0.00 H new ATOM 0 HD21 LEU A 679 17.261 0.871 6.521 1.00 0.00 H new ATOM 0 HD22 LEU A 679 18.193 -0.385 5.672 1.00 0.00 H new ATOM 0 HD23 LEU A 679 17.560 1.014 4.773 1.00 0.00 H new ATOM 82 N PRO A 680 16.028 -3.573 1.932 1.00 0.00 N ATOM 83 CA PRO A 680 16.034 -4.188 0.608 1.00 0.00 C ATOM 84 C PRO A 680 16.424 -3.237 -0.525 1.00 0.00 C ATOM 85 O PRO A 680 16.213 -3.555 -1.694 1.00 0.00 O ATOM 86 CB PRO A 680 14.609 -4.712 0.396 1.00 0.00 C ATOM 87 CG PRO A 680 13.999 -4.741 1.794 1.00 0.00 C ATOM 88 CD PRO A 680 14.683 -3.557 2.464 1.00 0.00 C ATOM 0 HA PRO A 680 16.792 -4.971 0.577 1.00 0.00 H new ATOM 0 HB2 PRO A 680 14.042 -4.062 -0.271 1.00 0.00 H new ATOM 0 HB3 PRO A 680 14.614 -5.704 -0.055 1.00 0.00 H new ATOM 0 HG2 PRO A 680 12.915 -4.625 1.769 1.00 0.00 H new ATOM 0 HG3 PRO A 680 14.207 -5.678 2.310 1.00 0.00 H new ATOM 0 HD2 PRO A 680 14.175 -2.621 2.232 1.00 0.00 H new ATOM 0 HD3 PRO A 680 14.683 -3.660 3.549 1.00 0.00 H new ATOM 96 N PHE A 681 16.988 -2.078 -0.187 1.00 0.00 N ATOM 97 CA PHE A 681 17.338 -1.036 -1.140 1.00 0.00 C ATOM 98 C PHE A 681 18.444 -1.505 -2.093 1.00 0.00 C ATOM 99 O PHE A 681 19.145 -2.473 -1.795 1.00 0.00 O ATOM 100 CB PHE A 681 17.844 0.188 -0.365 1.00 0.00 C ATOM 101 CG PHE A 681 16.838 0.876 0.539 1.00 0.00 C ATOM 102 CD1 PHE A 681 15.518 0.417 0.642 1.00 0.00 C ATOM 103 CD2 PHE A 681 17.236 1.998 1.279 1.00 0.00 C ATOM 104 CE1 PHE A 681 14.613 1.069 1.488 1.00 0.00 C ATOM 105 CE2 PHE A 681 16.326 2.656 2.121 1.00 0.00 C ATOM 106 CZ PHE A 681 15.011 2.185 2.231 1.00 0.00 C ATOM 0 H PHE A 681 17.217 -1.836 0.777 1.00 0.00 H new ATOM 0 HA PHE A 681 16.453 -0.791 -1.728 1.00 0.00 H new ATOM 0 HB2 PHE A 681 18.695 -0.120 0.243 1.00 0.00 H new ATOM 0 HB3 PHE A 681 18.214 0.919 -1.084 1.00 0.00 H new ATOM 0 HD1 PHE A 681 15.199 -0.440 0.068 1.00 0.00 H new ATOM 0 HD2 PHE A 681 18.251 2.359 1.201 1.00 0.00 H new ATOM 0 HE1 PHE A 681 13.599 0.707 1.568 1.00 0.00 H new ATOM 0 HE2 PHE A 681 16.639 3.524 2.683 1.00 0.00 H new ATOM 0 HZ PHE A 681 14.309 2.681 2.885 1.00 0.00 H new ATOM 116 N PRO A 682 18.619 -0.833 -3.241 1.00 0.00 N ATOM 117 CA PRO A 682 17.762 0.221 -3.766 1.00 0.00 C ATOM 118 C PRO A 682 16.553 -0.221 -4.616 1.00 0.00 C ATOM 119 O PRO A 682 15.723 0.642 -4.898 1.00 0.00 O ATOM 120 CB PRO A 682 18.706 1.029 -4.657 1.00 0.00 C ATOM 121 CG PRO A 682 19.582 -0.060 -5.273 1.00 0.00 C ATOM 122 CD PRO A 682 19.758 -1.043 -4.116 1.00 0.00 C ATOM 0 HA PRO A 682 17.304 0.744 -2.927 1.00 0.00 H new ATOM 0 HB2 PRO A 682 18.165 1.594 -5.416 1.00 0.00 H new ATOM 0 HB3 PRO A 682 19.292 1.747 -4.083 1.00 0.00 H new ATOM 0 HG2 PRO A 682 19.102 -0.528 -6.133 1.00 0.00 H new ATOM 0 HG3 PRO A 682 20.538 0.335 -5.618 1.00 0.00 H new ATOM 0 HD2 PRO A 682 19.789 -2.071 -4.478 1.00 0.00 H new ATOM 0 HD3 PRO A 682 20.695 -0.862 -3.589 1.00 0.00 H new ATOM 130 N PRO A 683 16.382 -1.487 -5.049 1.00 0.00 N ATOM 131 CA PRO A 683 15.295 -1.825 -5.953 1.00 0.00 C ATOM 132 C PRO A 683 13.939 -1.914 -5.250 1.00 0.00 C ATOM 133 O PRO A 683 13.853 -1.889 -4.024 1.00 0.00 O ATOM 134 CB PRO A 683 15.672 -3.184 -6.541 1.00 0.00 C ATOM 135 CG PRO A 683 16.405 -3.842 -5.382 1.00 0.00 C ATOM 136 CD PRO A 683 17.179 -2.673 -4.781 1.00 0.00 C ATOM 0 HA PRO A 683 15.178 -1.049 -6.709 1.00 0.00 H new ATOM 0 HB2 PRO A 683 14.794 -3.754 -6.844 1.00 0.00 H new ATOM 0 HB3 PRO A 683 16.307 -3.085 -7.421 1.00 0.00 H new ATOM 0 HG2 PRO A 683 15.715 -4.285 -4.664 1.00 0.00 H new ATOM 0 HG3 PRO A 683 17.068 -4.638 -5.720 1.00 0.00 H new ATOM 0 HD2 PRO A 683 17.325 -2.811 -3.710 1.00 0.00 H new ATOM 0 HD3 PRO A 683 18.169 -2.588 -5.230 1.00 0.00 H new ATOM 144 N ASP A 684 12.890 -2.024 -6.073 1.00 0.00 N ATOM 145 CA ASP A 684 11.489 -2.218 -5.709 1.00 0.00 C ATOM 146 C ASP A 684 10.853 -1.125 -4.847 1.00 0.00 C ATOM 147 O ASP A 684 9.630 -1.002 -4.861 1.00 0.00 O ATOM 148 CB ASP A 684 11.307 -3.593 -5.061 1.00 0.00 C ATOM 149 CG ASP A 684 11.780 -4.715 -5.981 1.00 0.00 C ATOM 150 OD1 ASP A 684 11.186 -4.851 -7.075 1.00 0.00 O ATOM 151 OD2 ASP A 684 12.726 -5.431 -5.590 1.00 0.00 O ATOM 0 H ASP A 684 13.011 -1.976 -7.085 1.00 0.00 H new ATOM 0 HA ASP A 684 10.946 -2.153 -6.652 1.00 0.00 H new ATOM 0 HB2 ASP A 684 11.863 -3.631 -4.124 1.00 0.00 H new ATOM 0 HB3 ASP A 684 10.256 -3.743 -4.814 1.00 0.00 H new ATOM 156 N ILE A 685 11.634 -0.331 -4.108 1.00 0.00 N ATOM 157 CA ILE A 685 11.097 0.735 -3.267 1.00 0.00 C ATOM 158 C ILE A 685 12.118 1.841 -3.031 1.00 0.00 C ATOM 159 O ILE A 685 13.303 1.708 -3.330 1.00 0.00 O ATOM 160 CB ILE A 685 10.630 0.210 -1.894 1.00 0.00 C ATOM 161 CG1 ILE A 685 11.393 -1.013 -1.376 1.00 0.00 C ATOM 162 CG2 ILE A 685 9.127 -0.047 -1.891 1.00 0.00 C ATOM 163 CD1 ILE A 685 12.752 -0.574 -0.849 1.00 0.00 C ATOM 0 H ILE A 685 12.650 -0.411 -4.078 1.00 0.00 H new ATOM 0 HA ILE A 685 10.242 1.136 -3.812 1.00 0.00 H new ATOM 0 HB ILE A 685 10.866 1.010 -1.192 1.00 0.00 H new ATOM 0 HG12 ILE A 685 10.824 -1.502 -0.585 1.00 0.00 H new ATOM 0 HG13 ILE A 685 11.519 -1.743 -2.176 1.00 0.00 H new ATOM 0 HG21 ILE A 685 8.823 -0.417 -0.912 1.00 0.00 H new ATOM 0 HG22 ILE A 685 8.599 0.881 -2.109 1.00 0.00 H new ATOM 0 HG23 ILE A 685 8.883 -0.790 -2.651 1.00 0.00 H new ATOM 0 HD11 ILE A 685 13.297 -1.443 -0.480 1.00 0.00 H new ATOM 0 HD12 ILE A 685 13.319 -0.104 -1.652 1.00 0.00 H new ATOM 0 HD13 ILE A 685 12.614 0.140 -0.037 1.00 0.00 H new ATOM 175 N ASP A 686 11.612 2.943 -2.477 1.00 0.00 N ATOM 176 CA ASP A 686 12.381 4.090 -2.036 1.00 0.00 C ATOM 177 C ASP A 686 11.655 4.638 -0.809 1.00 0.00 C ATOM 178 O ASP A 686 10.433 4.789 -0.847 1.00 0.00 O ATOM 179 CB ASP A 686 12.424 5.135 -3.151 1.00 0.00 C ATOM 180 CG ASP A 686 13.117 4.618 -4.409 1.00 0.00 C ATOM 181 OD1 ASP A 686 14.369 4.638 -4.422 1.00 0.00 O ATOM 182 OD2 ASP A 686 12.391 4.211 -5.344 1.00 0.00 O ATOM 0 H ASP A 686 10.611 3.058 -2.320 1.00 0.00 H new ATOM 0 HA ASP A 686 13.410 3.826 -1.794 1.00 0.00 H new ATOM 0 HB2 ASP A 686 11.407 5.439 -3.399 1.00 0.00 H new ATOM 0 HB3 ASP A 686 12.944 6.023 -2.792 1.00 0.00 H new ATOM 187 N PRO A 687 12.368 4.944 0.285 1.00 0.00 N ATOM 188 CA PRO A 687 11.736 5.373 1.521 1.00 0.00 C ATOM 189 C PRO A 687 11.044 6.715 1.329 1.00 0.00 C ATOM 190 O PRO A 687 10.089 7.034 2.031 1.00 0.00 O ATOM 191 CB PRO A 687 12.862 5.430 2.551 1.00 0.00 C ATOM 192 CG PRO A 687 14.124 5.627 1.713 1.00 0.00 C ATOM 193 CD PRO A 687 13.808 4.889 0.413 1.00 0.00 C ATOM 0 HA PRO A 687 10.952 4.692 1.851 1.00 0.00 H new ATOM 0 HB2 PRO A 687 12.718 6.251 3.254 1.00 0.00 H new ATOM 0 HB3 PRO A 687 12.912 4.513 3.138 1.00 0.00 H new ATOM 0 HG2 PRO A 687 14.327 6.683 1.536 1.00 0.00 H new ATOM 0 HG3 PRO A 687 15.003 5.212 2.207 1.00 0.00 H new ATOM 0 HD2 PRO A 687 14.297 5.363 -0.438 1.00 0.00 H new ATOM 0 HD3 PRO A 687 14.161 3.858 0.450 1.00 0.00 H new ATOM 201 N GLN A 688 11.528 7.500 0.367 1.00 0.00 N ATOM 202 CA GLN A 688 10.946 8.775 -0.016 1.00 0.00 C ATOM 203 C GLN A 688 9.586 8.600 -0.699 1.00 0.00 C ATOM 204 O GLN A 688 9.039 9.573 -1.210 1.00 0.00 O ATOM 205 CB GLN A 688 11.921 9.507 -0.945 1.00 0.00 C ATOM 206 CG GLN A 688 12.449 8.574 -2.041 1.00 0.00 C ATOM 207 CD GLN A 688 13.950 8.356 -1.943 1.00 0.00 C ATOM 208 OE1 GLN A 688 14.651 8.397 -2.949 1.00 0.00 O ATOM 209 NE2 GLN A 688 14.460 8.126 -0.738 1.00 0.00 N ATOM 0 H GLN A 688 12.355 7.256 -0.177 1.00 0.00 H new ATOM 0 HA GLN A 688 10.776 9.363 0.886 1.00 0.00 H new ATOM 0 HB2 GLN A 688 11.421 10.361 -1.401 1.00 0.00 H new ATOM 0 HB3 GLN A 688 12.756 9.899 -0.364 1.00 0.00 H new ATOM 0 HG2 GLN A 688 11.940 7.613 -1.972 1.00 0.00 H new ATOM 0 HG3 GLN A 688 12.209 8.993 -3.018 1.00 0.00 H new ATOM 0 HE21 GLN A 688 13.848 8.099 0.078 1.00 0.00 H new ATOM 0 HE22 GLN A 688 15.463 7.977 -0.629 1.00 0.00 H new ATOM 218 N VAL A 689 9.026 7.381 -0.722 1.00 0.00 N ATOM 219 CA VAL A 689 7.757 7.127 -1.381 1.00 0.00 C ATOM 220 C VAL A 689 6.810 6.396 -0.429 1.00 0.00 C ATOM 221 O VAL A 689 5.635 6.210 -0.739 1.00 0.00 O ATOM 222 CB VAL A 689 8.008 6.350 -2.677 1.00 0.00 C ATOM 223 CG1 VAL A 689 6.720 6.218 -3.480 1.00 0.00 C ATOM 224 CG2 VAL A 689 9.021 7.082 -3.559 1.00 0.00 C ATOM 0 H VAL A 689 9.443 6.558 -0.286 1.00 0.00 H new ATOM 0 HA VAL A 689 7.272 8.066 -1.648 1.00 0.00 H new ATOM 0 HB VAL A 689 8.387 5.368 -2.396 1.00 0.00 H new ATOM 0 HG11 VAL A 689 6.918 5.663 -4.397 1.00 0.00 H new ATOM 0 HG12 VAL A 689 5.975 5.686 -2.888 1.00 0.00 H new ATOM 0 HG13 VAL A 689 6.344 7.210 -3.730 1.00 0.00 H new ATOM 0 HG21 VAL A 689 9.185 6.513 -4.474 1.00 0.00 H new ATOM 0 HG22 VAL A 689 8.637 8.071 -3.810 1.00 0.00 H new ATOM 0 HG23 VAL A 689 9.964 7.185 -3.022 1.00 0.00 H new ATOM 234 N PHE A 690 7.307 5.976 0.741 1.00 0.00 N ATOM 235 CA PHE A 690 6.455 5.417 1.777 1.00 0.00 C ATOM 236 C PHE A 690 6.585 6.168 3.107 1.00 0.00 C ATOM 237 O PHE A 690 5.798 5.933 4.017 1.00 0.00 O ATOM 238 CB PHE A 690 6.666 3.911 1.894 1.00 0.00 C ATOM 239 CG PHE A 690 8.039 3.426 2.287 1.00 0.00 C ATOM 240 CD1 PHE A 690 8.399 3.356 3.641 1.00 0.00 C ATOM 241 CD2 PHE A 690 8.942 3.012 1.300 1.00 0.00 C ATOM 242 CE1 PHE A 690 9.654 2.854 4.011 1.00 0.00 C ATOM 243 CE2 PHE A 690 10.198 2.519 1.666 1.00 0.00 C ATOM 244 CZ PHE A 690 10.556 2.442 3.022 1.00 0.00 C ATOM 0 H PHE A 690 8.296 6.016 0.986 1.00 0.00 H new ATOM 0 HA PHE A 690 5.416 5.562 1.480 1.00 0.00 H new ATOM 0 HB2 PHE A 690 5.953 3.528 2.624 1.00 0.00 H new ATOM 0 HB3 PHE A 690 6.413 3.461 0.934 1.00 0.00 H new ATOM 0 HD1 PHE A 690 7.707 3.690 4.400 1.00 0.00 H new ATOM 0 HD2 PHE A 690 8.668 3.073 0.257 1.00 0.00 H new ATOM 0 HE1 PHE A 690 9.924 2.785 5.054 1.00 0.00 H new ATOM 0 HE2 PHE A 690 10.894 2.197 0.905 1.00 0.00 H new ATOM 0 HZ PHE A 690 11.528 2.065 3.302 1.00 0.00 H new ATOM 254 N TYR A 691 7.565 7.072 3.224 1.00 0.00 N ATOM 255 CA TYR A 691 7.646 8.046 4.305 1.00 0.00 C ATOM 256 C TYR A 691 6.597 9.145 4.092 1.00 0.00 C ATOM 257 O TYR A 691 6.402 9.991 4.961 1.00 0.00 O ATOM 258 CB TYR A 691 9.039 8.680 4.339 1.00 0.00 C ATOM 259 CG TYR A 691 10.142 7.788 4.873 1.00 0.00 C ATOM 260 CD1 TYR A 691 9.873 6.470 5.275 1.00 0.00 C ATOM 261 CD2 TYR A 691 11.446 8.295 4.975 1.00 0.00 C ATOM 262 CE1 TYR A 691 10.891 5.679 5.817 1.00 0.00 C ATOM 263 CE2 TYR A 691 12.472 7.504 5.509 1.00 0.00 C ATOM 264 CZ TYR A 691 12.197 6.191 5.941 1.00 0.00 C ATOM 265 OH TYR A 691 13.193 5.423 6.468 1.00 0.00 O ATOM 0 H TYR A 691 8.333 7.144 2.557 1.00 0.00 H new ATOM 0 HA TYR A 691 7.458 7.537 5.250 1.00 0.00 H new ATOM 0 HB2 TYR A 691 9.303 8.992 3.329 1.00 0.00 H new ATOM 0 HB3 TYR A 691 8.995 9.582 4.950 1.00 0.00 H new ATOM 0 HD1 TYR A 691 8.877 6.066 5.165 1.00 0.00 H new ATOM 0 HD2 TYR A 691 11.660 9.299 4.641 1.00 0.00 H new ATOM 0 HE1 TYR A 691 10.675 4.672 6.142 1.00 0.00 H new ATOM 0 HE2 TYR A 691 13.473 7.900 5.590 1.00 0.00 H new ATOM 0 HH TYR A 691 14.029 5.934 6.478 1.00 0.00 H new ATOM 275 N GLU A 692 5.922 9.134 2.936 1.00 0.00 N ATOM 276 CA GLU A 692 4.820 10.035 2.598 1.00 0.00 C ATOM 277 C GLU A 692 3.560 9.664 3.384 1.00 0.00 C ATOM 278 O GLU A 692 2.438 9.913 2.942 1.00 0.00 O ATOM 279 CB GLU A 692 4.542 9.965 1.091 1.00 0.00 C ATOM 280 CG GLU A 692 5.746 10.453 0.282 1.00 0.00 C ATOM 281 CD GLU A 692 5.400 10.560 -1.201 1.00 0.00 C ATOM 282 OE1 GLU A 692 5.209 9.495 -1.828 1.00 0.00 O ATOM 283 OE2 GLU A 692 5.328 11.706 -1.703 1.00 0.00 O ATOM 0 H GLU A 692 6.137 8.475 2.188 1.00 0.00 H new ATOM 0 HA GLU A 692 5.103 11.053 2.866 1.00 0.00 H new ATOM 0 HB2 GLU A 692 4.304 8.939 0.810 1.00 0.00 H new ATOM 0 HB3 GLU A 692 3.669 10.572 0.851 1.00 0.00 H new ATOM 0 HG2 GLU A 692 6.070 11.425 0.655 1.00 0.00 H new ATOM 0 HG3 GLU A 692 6.581 9.766 0.416 1.00 0.00 H new ATOM 290 N LEU A 693 3.756 9.058 4.555 1.00 0.00 N ATOM 291 CA LEU A 693 2.737 8.437 5.377 1.00 0.00 C ATOM 292 C LEU A 693 3.140 8.582 6.841 1.00 0.00 C ATOM 293 O LEU A 693 4.267 8.981 7.133 1.00 0.00 O ATOM 294 CB LEU A 693 2.719 6.942 5.044 1.00 0.00 C ATOM 295 CG LEU A 693 2.094 6.622 3.684 1.00 0.00 C ATOM 296 CD1 LEU A 693 2.237 5.128 3.423 1.00 0.00 C ATOM 297 CD2 LEU A 693 0.612 6.986 3.647 1.00 0.00 C ATOM 0 H LEU A 693 4.684 8.988 4.972 1.00 0.00 H new ATOM 0 HA LEU A 693 1.765 8.897 5.199 1.00 0.00 H new ATOM 0 HB2 LEU A 693 3.741 6.562 5.063 1.00 0.00 H new ATOM 0 HB3 LEU A 693 2.168 6.412 5.821 1.00 0.00 H new ATOM 0 HG LEU A 693 2.609 7.208 2.923 1.00 0.00 H new ATOM 0 HD11 LEU A 693 1.796 4.884 2.457 1.00 0.00 H new ATOM 0 HD12 LEU A 693 3.293 4.859 3.418 1.00 0.00 H new ATOM 0 HD13 LEU A 693 1.724 4.571 4.207 1.00 0.00 H new ATOM 0 HD21 LEU A 693 0.202 6.745 2.666 1.00 0.00 H new ATOM 0 HD22 LEU A 693 0.079 6.421 4.412 1.00 0.00 H new ATOM 0 HD23 LEU A 693 0.495 8.053 3.837 1.00 0.00 H new ATOM 309 N PRO A 694 2.242 8.263 7.776 1.00 0.00 N ATOM 310 CA PRO A 694 2.595 8.133 9.171 1.00 0.00 C ATOM 311 C PRO A 694 3.426 6.881 9.331 1.00 0.00 C ATOM 312 O PRO A 694 3.166 5.846 8.718 1.00 0.00 O ATOM 313 CB PRO A 694 1.266 8.034 9.917 1.00 0.00 C ATOM 314 CG PRO A 694 0.350 7.388 8.884 1.00 0.00 C ATOM 315 CD PRO A 694 0.840 7.978 7.564 1.00 0.00 C ATOM 0 HA PRO A 694 3.181 8.967 9.556 1.00 0.00 H new ATOM 0 HB2 PRO A 694 1.352 7.427 10.818 1.00 0.00 H new ATOM 0 HB3 PRO A 694 0.901 9.013 10.226 1.00 0.00 H new ATOM 0 HG2 PRO A 694 0.434 6.301 8.895 1.00 0.00 H new ATOM 0 HG3 PRO A 694 -0.697 7.628 9.068 1.00 0.00 H new ATOM 0 HD2 PRO A 694 0.700 7.276 6.742 1.00 0.00 H new ATOM 0 HD3 PRO A 694 0.288 8.882 7.307 1.00 0.00 H new ATOM 323 N GLU A 695 4.441 7.003 10.179 1.00 0.00 N ATOM 324 CA GLU A 695 5.262 5.930 10.680 1.00 0.00 C ATOM 325 C GLU A 695 4.521 4.608 10.786 1.00 0.00 C ATOM 326 O GLU A 695 5.083 3.587 10.441 1.00 0.00 O ATOM 327 CB GLU A 695 5.761 6.364 12.049 1.00 0.00 C ATOM 328 CG GLU A 695 7.281 6.459 12.027 1.00 0.00 C ATOM 329 CD GLU A 695 7.830 6.830 13.405 1.00 0.00 C ATOM 330 OE1 GLU A 695 8.029 5.898 14.212 1.00 0.00 O ATOM 331 OE2 GLU A 695 8.049 8.038 13.635 1.00 0.00 O ATOM 0 H GLU A 695 4.721 7.910 10.551 1.00 0.00 H new ATOM 0 HA GLU A 695 6.080 5.751 9.982 1.00 0.00 H new ATOM 0 HB2 GLU A 695 5.329 7.328 12.317 1.00 0.00 H new ATOM 0 HB3 GLU A 695 5.441 5.650 12.808 1.00 0.00 H new ATOM 0 HG2 GLU A 695 7.703 5.506 11.709 1.00 0.00 H new ATOM 0 HG3 GLU A 695 7.591 7.205 11.296 1.00 0.00 H new ATOM 338 N GLU A 696 3.275 4.608 11.253 1.00 0.00 N ATOM 339 CA GLU A 696 2.462 3.423 11.415 1.00 0.00 C ATOM 340 C GLU A 696 2.509 2.503 10.188 1.00 0.00 C ATOM 341 O GLU A 696 2.185 1.320 10.295 1.00 0.00 O ATOM 342 CB GLU A 696 1.040 3.879 11.740 1.00 0.00 C ATOM 343 CG GLU A 696 0.100 2.688 11.834 1.00 0.00 C ATOM 344 CD GLU A 696 -1.276 3.113 12.338 1.00 0.00 C ATOM 345 OE1 GLU A 696 -2.113 3.495 11.488 1.00 0.00 O ATOM 346 OE2 GLU A 696 -1.483 3.052 13.572 1.00 0.00 O ATOM 0 H GLU A 696 2.796 5.463 11.536 1.00 0.00 H new ATOM 0 HA GLU A 696 2.856 2.818 12.231 1.00 0.00 H new ATOM 0 HB2 GLU A 696 1.035 4.427 12.682 1.00 0.00 H new ATOM 0 HB3 GLU A 696 0.688 4.566 10.970 1.00 0.00 H new ATOM 0 HG2 GLU A 696 0.003 2.219 10.855 1.00 0.00 H new ATOM 0 HG3 GLU A 696 0.522 1.940 12.505 1.00 0.00 H new ATOM 353 N VAL A 697 2.913 3.034 9.029 1.00 0.00 N ATOM 354 CA VAL A 697 3.148 2.235 7.836 1.00 0.00 C ATOM 355 C VAL A 697 4.573 2.444 7.327 1.00 0.00 C ATOM 356 O VAL A 697 5.153 1.540 6.728 1.00 0.00 O ATOM 357 CB VAL A 697 2.108 2.594 6.771 1.00 0.00 C ATOM 358 CG1 VAL A 697 2.444 1.951 5.427 1.00 0.00 C ATOM 359 CG2 VAL A 697 0.728 2.099 7.204 1.00 0.00 C ATOM 0 H VAL A 697 3.084 4.031 8.898 1.00 0.00 H new ATOM 0 HA VAL A 697 3.042 1.177 8.076 1.00 0.00 H new ATOM 0 HB VAL A 697 2.112 3.678 6.662 1.00 0.00 H new ATOM 0 HG11 VAL A 697 1.686 2.225 4.693 1.00 0.00 H new ATOM 0 HG12 VAL A 697 3.420 2.301 5.090 1.00 0.00 H new ATOM 0 HG13 VAL A 697 2.466 0.867 5.538 1.00 0.00 H new ATOM 0 HG21 VAL A 697 -0.007 2.358 6.442 1.00 0.00 H new ATOM 0 HG22 VAL A 697 0.753 1.017 7.331 1.00 0.00 H new ATOM 0 HG23 VAL A 697 0.453 2.569 8.148 1.00 0.00 H new ATOM 369 N GLN A 698 5.150 3.626 7.564 1.00 0.00 N ATOM 370 CA GLN A 698 6.538 3.917 7.215 1.00 0.00 C ATOM 371 C GLN A 698 7.506 3.157 8.138 1.00 0.00 C ATOM 372 O GLN A 698 8.719 3.191 7.943 1.00 0.00 O ATOM 373 CB GLN A 698 6.726 5.443 7.232 1.00 0.00 C ATOM 374 CG GLN A 698 7.891 5.984 8.066 1.00 0.00 C ATOM 375 CD GLN A 698 7.879 7.512 8.059 1.00 0.00 C ATOM 376 OE1 GLN A 698 8.923 8.151 7.974 1.00 0.00 O ATOM 377 NE2 GLN A 698 6.690 8.104 8.147 1.00 0.00 N ATOM 0 H GLN A 698 4.664 4.407 8.004 1.00 0.00 H new ATOM 0 HA GLN A 698 6.773 3.564 6.211 1.00 0.00 H new ATOM 0 HB2 GLN A 698 6.858 5.781 6.204 1.00 0.00 H new ATOM 0 HB3 GLN A 698 5.805 5.895 7.601 1.00 0.00 H new ATOM 0 HG2 GLN A 698 7.816 5.617 9.090 1.00 0.00 H new ATOM 0 HG3 GLN A 698 8.836 5.618 7.664 1.00 0.00 H new ATOM 0 HE21 GLN A 698 5.843 7.540 8.216 1.00 0.00 H new ATOM 0 HE22 GLN A 698 6.626 9.122 8.145 1.00 0.00 H new ATOM 386 N LYS A 699 6.959 2.469 9.145 1.00 0.00 N ATOM 387 CA LYS A 699 7.677 1.667 10.127 1.00 0.00 C ATOM 388 C LYS A 699 7.261 0.203 10.015 1.00 0.00 C ATOM 389 O LYS A 699 7.954 -0.698 10.489 1.00 0.00 O ATOM 390 CB LYS A 699 7.366 2.227 11.525 1.00 0.00 C ATOM 391 CG LYS A 699 6.095 1.640 12.162 1.00 0.00 C ATOM 392 CD LYS A 699 5.603 2.477 13.344 1.00 0.00 C ATOM 393 CE LYS A 699 6.729 2.819 14.311 1.00 0.00 C ATOM 394 NZ LYS A 699 7.264 1.618 14.980 1.00 0.00 N ATOM 0 H LYS A 699 5.951 2.459 9.301 1.00 0.00 H new ATOM 0 HA LYS A 699 8.751 1.717 9.947 1.00 0.00 H new ATOM 0 HB2 LYS A 699 8.214 2.031 12.181 1.00 0.00 H new ATOM 0 HB3 LYS A 699 7.260 3.310 11.457 1.00 0.00 H new ATOM 0 HG2 LYS A 699 5.308 1.579 11.410 1.00 0.00 H new ATOM 0 HG3 LYS A 699 6.295 0.622 12.498 1.00 0.00 H new ATOM 0 HD2 LYS A 699 5.152 3.397 12.973 1.00 0.00 H new ATOM 0 HD3 LYS A 699 4.823 1.931 13.875 1.00 0.00 H new ATOM 0 HE2 LYS A 699 7.531 3.321 13.771 1.00 0.00 H new ATOM 0 HE3 LYS A 699 6.363 3.520 15.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 8.028 1.894 15.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 6.505 1.152 15.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 7.637 0.960 14.266 1.00 0.00 H new ATOM 408 N GLU A 700 6.114 -0.040 9.377 1.00 0.00 N ATOM 409 CA GLU A 700 5.588 -1.380 9.222 1.00 0.00 C ATOM 410 C GLU A 700 6.404 -2.042 8.132 1.00 0.00 C ATOM 411 O GLU A 700 6.709 -3.225 8.208 1.00 0.00 O ATOM 412 CB GLU A 700 4.124 -1.299 8.808 1.00 0.00 C ATOM 413 CG GLU A 700 3.477 -2.678 8.866 1.00 0.00 C ATOM 414 CD GLU A 700 1.984 -2.599 8.557 1.00 0.00 C ATOM 415 OE1 GLU A 700 1.641 -2.085 7.468 1.00 0.00 O ATOM 416 OE2 GLU A 700 1.192 -3.054 9.411 1.00 0.00 O ATOM 0 H GLU A 700 5.534 0.687 8.959 1.00 0.00 H new ATOM 0 HA GLU A 700 5.650 -1.948 10.150 1.00 0.00 H new ATOM 0 HB2 GLU A 700 3.591 -0.613 9.466 1.00 0.00 H new ATOM 0 HB3 GLU A 700 4.047 -0.897 7.798 1.00 0.00 H new ATOM 0 HG2 GLU A 700 3.964 -3.342 8.152 1.00 0.00 H new ATOM 0 HG3 GLU A 700 3.624 -3.111 9.856 1.00 0.00 H new ATOM 423 N LEU A 701 6.753 -1.251 7.113 1.00 0.00 N ATOM 424 CA LEU A 701 7.654 -1.662 6.063 1.00 0.00 C ATOM 425 C LEU A 701 9.034 -1.925 6.665 1.00 0.00 C ATOM 426 O LEU A 701 9.708 -2.877 6.280 1.00 0.00 O ATOM 427 CB LEU A 701 7.709 -0.540 5.025 1.00 0.00 C ATOM 428 CG LEU A 701 6.846 -0.874 3.804 1.00 0.00 C ATOM 429 CD1 LEU A 701 5.377 -1.038 4.194 1.00 0.00 C ATOM 430 CD2 LEU A 701 6.957 0.246 2.775 1.00 0.00 C ATOM 0 H LEU A 701 6.407 -0.298 7.004 1.00 0.00 H new ATOM 0 HA LEU A 701 7.313 -2.579 5.583 1.00 0.00 H new ATOM 0 HB2 LEU A 701 7.364 0.392 5.474 1.00 0.00 H new ATOM 0 HB3 LEU A 701 8.741 -0.380 4.712 1.00 0.00 H new ATOM 0 HG LEU A 701 7.207 -1.813 3.385 1.00 0.00 H new ATOM 0 HD11 LEU A 701 4.789 -1.275 3.307 1.00 0.00 H new ATOM 0 HD12 LEU A 701 5.281 -1.846 4.919 1.00 0.00 H new ATOM 0 HD13 LEU A 701 5.012 -0.110 4.634 1.00 0.00 H new ATOM 0 HD21 LEU A 701 6.342 0.006 1.908 1.00 0.00 H new ATOM 0 HD22 LEU A 701 6.612 1.181 3.216 1.00 0.00 H new ATOM 0 HD23 LEU A 701 7.996 0.353 2.464 1.00 0.00 H new ATOM 442 N MET A 702 9.457 -1.086 7.618 1.00 0.00 N ATOM 443 CA MET A 702 10.735 -1.265 8.292 1.00 0.00 C ATOM 444 C MET A 702 10.725 -2.527 9.158 1.00 0.00 C ATOM 445 O MET A 702 11.783 -2.963 9.601 1.00 0.00 O ATOM 446 CB MET A 702 11.032 -0.063 9.195 1.00 0.00 C ATOM 447 CG MET A 702 11.168 1.270 8.458 1.00 0.00 C ATOM 448 SD MET A 702 12.776 1.566 7.674 1.00 0.00 S ATOM 449 CE MET A 702 12.439 0.930 6.017 1.00 0.00 C ATOM 0 H MET A 702 8.926 -0.275 7.936 1.00 0.00 H new ATOM 0 HA MET A 702 11.502 -1.357 7.523 1.00 0.00 H new ATOM 0 HB2 MET A 702 10.235 0.025 9.934 1.00 0.00 H new ATOM 0 HB3 MET A 702 11.955 -0.256 9.743 1.00 0.00 H new ATOM 0 HG2 MET A 702 10.394 1.323 7.692 1.00 0.00 H new ATOM 0 HG3 MET A 702 10.973 2.077 9.164 1.00 0.00 H new ATOM 0 HE1 MET A 702 13.146 0.135 5.782 1.00 0.00 H new ATOM 0 HE2 MET A 702 11.424 0.536 5.978 1.00 0.00 H new ATOM 0 HE3 MET A 702 12.543 1.735 5.290 1.00 0.00 H new ATOM 459 N ALA A 703 9.547 -3.114 9.406 1.00 0.00 N ATOM 460 CA ALA A 703 9.437 -4.331 10.200 1.00 0.00 C ATOM 461 C ALA A 703 9.041 -5.518 9.329 1.00 0.00 C ATOM 462 O ALA A 703 9.254 -6.673 9.697 1.00 0.00 O ATOM 463 CB ALA A 703 8.364 -4.120 11.264 1.00 0.00 C ATOM 0 H ALA A 703 8.655 -2.758 9.063 1.00 0.00 H new ATOM 0 HA ALA A 703 10.404 -4.543 10.656 1.00 0.00 H new ATOM 0 HB1 ALA A 703 8.268 -5.022 11.868 1.00 0.00 H new ATOM 0 HB2 ALA A 703 8.645 -3.283 11.903 1.00 0.00 H new ATOM 0 HB3 ALA A 703 7.411 -3.904 10.782 1.00 0.00 H new ATOM 469 N GLU A 704 8.460 -5.235 8.164 1.00 0.00 N ATOM 470 CA GLU A 704 7.995 -6.215 7.227 1.00 0.00 C ATOM 471 C GLU A 704 9.197 -6.823 6.527 1.00 0.00 C ATOM 472 O GLU A 704 9.154 -7.953 6.046 1.00 0.00 O ATOM 473 CB GLU A 704 7.126 -5.443 6.239 1.00 0.00 C ATOM 474 CG GLU A 704 6.703 -6.398 5.154 1.00 0.00 C ATOM 475 CD GLU A 704 5.633 -5.790 4.251 1.00 0.00 C ATOM 476 OE1 GLU A 704 4.437 -5.933 4.597 1.00 0.00 O ATOM 477 OE2 GLU A 704 6.018 -5.191 3.222 1.00 0.00 O ATOM 0 H GLU A 704 8.302 -4.277 7.850 1.00 0.00 H new ATOM 0 HA GLU A 704 7.434 -7.025 7.694 1.00 0.00 H new ATOM 0 HB2 GLU A 704 6.254 -5.026 6.742 1.00 0.00 H new ATOM 0 HB3 GLU A 704 7.681 -4.605 5.816 1.00 0.00 H new ATOM 0 HG2 GLU A 704 7.570 -6.675 4.555 1.00 0.00 H new ATOM 0 HG3 GLU A 704 6.321 -7.314 5.604 1.00 0.00 H new ATOM 484 N TRP A 705 10.274 -6.043 6.486 1.00 0.00 N ATOM 485 CA TRP A 705 11.490 -6.365 5.777 1.00 0.00 C ATOM 486 C TRP A 705 12.419 -7.139 6.698 1.00 0.00 C ATOM 487 O TRP A 705 13.226 -7.949 6.250 1.00 0.00 O ATOM 488 CB TRP A 705 12.099 -5.039 5.354 1.00 0.00 C ATOM 489 CG TRP A 705 11.336 -4.332 4.280 1.00 0.00 C ATOM 490 CD1 TRP A 705 10.293 -4.828 3.579 1.00 0.00 C ATOM 491 CD2 TRP A 705 11.542 -2.984 3.771 1.00 0.00 C ATOM 492 NE1 TRP A 705 9.848 -3.889 2.675 1.00 0.00 N ATOM 493 CE2 TRP A 705 10.590 -2.730 2.748 1.00 0.00 C ATOM 494 CE3 TRP A 705 12.450 -1.958 4.077 1.00 0.00 C ATOM 495 CZ2 TRP A 705 10.547 -1.518 2.052 1.00 0.00 C ATOM 496 CZ3 TRP A 705 12.430 -0.745 3.373 1.00 0.00 C ATOM 497 CH2 TRP A 705 11.487 -0.528 2.360 1.00 0.00 C ATOM 0 H TRP A 705 10.317 -5.143 6.963 1.00 0.00 H new ATOM 0 HA TRP A 705 11.309 -6.991 4.903 1.00 0.00 H new ATOM 0 HB2 TRP A 705 12.167 -4.388 6.226 1.00 0.00 H new ATOM 0 HB3 TRP A 705 13.117 -5.213 5.007 1.00 0.00 H new ATOM 0 HD1 TRP A 705 9.871 -5.814 3.708 1.00 0.00 H new ATOM 0 HE1 TRP A 705 9.068 -4.033 2.033 1.00 0.00 H new ATOM 0 HE3 TRP A 705 13.174 -2.105 4.865 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 9.801 -1.349 1.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 13.146 0.027 3.613 1.00 0.00 H new ATOM 0 HH2 TRP A 705 11.485 0.405 1.816 1.00 0.00 H new ATOM 575 N MET B 1 -11.172 12.963 -16.138 1.00 0.00 N ATOM 576 CA MET B 1 -11.787 12.068 -15.137 1.00 0.00 C ATOM 577 C MET B 1 -10.872 10.893 -14.829 1.00 0.00 C ATOM 578 O MET B 1 -11.037 9.812 -15.383 1.00 0.00 O ATOM 579 CB MET B 1 -13.145 11.574 -15.631 1.00 0.00 C ATOM 580 CG MET B 1 -13.782 10.573 -14.662 1.00 0.00 C ATOM 581 SD MET B 1 -15.485 10.125 -15.089 1.00 0.00 S ATOM 582 CE MET B 1 -15.182 9.238 -16.643 1.00 0.00 C ATOM 0 H1 MET B 1 -11.813 13.758 -16.333 1.00 0.00 H new ATOM 0 H2 MET B 1 -10.270 13.328 -15.770 1.00 0.00 H new ATOM 0 H3 MET B 1 -10.999 12.434 -17.017 1.00 0.00 H new ATOM 0 HA MET B 1 -11.935 12.633 -14.217 1.00 0.00 H new ATOM 0 HB2 MET B 1 -13.813 12.425 -15.764 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.026 11.106 -16.608 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.174 9.669 -14.636 1.00 0.00 H new ATOM 0 HG3 MET B 1 -13.768 10.995 -13.657 1.00 0.00 H new ATOM 0 HE1 MET B 1 -16.097 8.737 -16.960 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.871 9.946 -17.411 1.00 0.00 H new ATOM 0 HE3 MET B 1 -14.396 8.498 -16.492 1.00 0.00 H new ATOM 594 N GLN B 2 -9.908 11.113 -13.941 1.00 0.00 N ATOM 595 CA GLN B 2 -8.959 10.112 -13.490 1.00 0.00 C ATOM 596 C GLN B 2 -8.209 10.623 -12.258 1.00 0.00 C ATOM 597 O GLN B 2 -8.197 11.827 -12.006 1.00 0.00 O ATOM 598 CB GLN B 2 -8.000 9.818 -14.646 1.00 0.00 C ATOM 599 CG GLN B 2 -7.529 11.115 -15.307 1.00 0.00 C ATOM 600 CD GLN B 2 -6.543 10.908 -16.452 1.00 0.00 C ATOM 601 OE1 GLN B 2 -5.655 11.730 -16.659 1.00 0.00 O ATOM 602 NE2 GLN B 2 -6.677 9.821 -17.207 1.00 0.00 N ATOM 0 H GLN B 2 -9.765 12.023 -13.504 1.00 0.00 H new ATOM 0 HA GLN B 2 -9.470 9.193 -13.202 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -7.140 9.260 -14.277 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -8.496 9.188 -15.384 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -8.398 11.655 -15.683 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -7.064 11.747 -14.551 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -7.424 9.154 -17.013 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -6.033 9.654 -17.980 1.00 0.00 H new ATOM 611 N ILE B 3 -7.580 9.720 -11.499 1.00 0.00 N ATOM 612 CA ILE B 3 -6.831 10.084 -10.295 1.00 0.00 C ATOM 613 C ILE B 3 -5.379 9.634 -10.425 1.00 0.00 C ATOM 614 O ILE B 3 -5.065 8.732 -11.197 1.00 0.00 O ATOM 615 CB ILE B 3 -7.481 9.527 -9.010 1.00 0.00 C ATOM 616 CG1 ILE B 3 -7.203 8.035 -8.780 1.00 0.00 C ATOM 617 CG2 ILE B 3 -8.994 9.765 -8.967 1.00 0.00 C ATOM 618 CD1 ILE B 3 -7.724 7.124 -9.888 1.00 0.00 C ATOM 0 H ILE B 3 -7.576 8.720 -11.702 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.854 11.170 -10.204 1.00 0.00 H new ATOM 0 HB ILE B 3 -7.007 10.088 -8.205 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -6.128 7.888 -8.680 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.655 7.734 -7.835 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.401 9.354 -8.043 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -9.195 10.835 -9.008 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -9.464 9.275 -9.820 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -7.487 6.087 -9.648 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -8.805 7.238 -9.975 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -7.253 7.395 -10.833 1.00 0.00 H new ATOM 630 N PHE B 4 -4.491 10.277 -9.660 1.00 0.00 N ATOM 631 CA PHE B 4 -3.056 10.087 -9.781 1.00 0.00 C ATOM 632 C PHE B 4 -2.566 9.222 -8.628 1.00 0.00 C ATOM 633 O PHE B 4 -2.197 9.719 -7.564 1.00 0.00 O ATOM 634 CB PHE B 4 -2.344 11.440 -9.763 1.00 0.00 C ATOM 635 CG PHE B 4 -2.480 12.301 -11.003 1.00 0.00 C ATOM 636 CD1 PHE B 4 -3.661 12.315 -11.762 1.00 0.00 C ATOM 637 CD2 PHE B 4 -1.401 13.106 -11.401 1.00 0.00 C ATOM 638 CE1 PHE B 4 -3.752 13.096 -12.920 1.00 0.00 C ATOM 639 CE2 PHE B 4 -1.494 13.898 -12.556 1.00 0.00 C ATOM 640 CZ PHE B 4 -2.669 13.888 -13.320 1.00 0.00 C ATOM 0 H PHE B 4 -4.757 10.946 -8.938 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.834 9.591 -10.726 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -2.718 12.009 -8.912 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -1.283 11.263 -9.587 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -4.506 11.719 -11.450 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.494 13.116 -10.815 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -4.659 13.088 -13.506 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -0.660 14.515 -12.856 1.00 0.00 H new ATOM 0 HZ PHE B 4 -2.739 14.489 -14.214 1.00 0.00 H new ATOM 650 N VAL B 5 -2.566 7.911 -8.839 1.00 0.00 N ATOM 651 CA VAL B 5 -2.153 6.955 -7.821 1.00 0.00 C ATOM 652 C VAL B 5 -0.638 6.764 -7.881 1.00 0.00 C ATOM 653 O VAL B 5 -0.121 6.225 -8.859 1.00 0.00 O ATOM 654 CB VAL B 5 -2.885 5.629 -8.050 1.00 0.00 C ATOM 655 CG1 VAL B 5 -2.622 4.738 -6.847 1.00 0.00 C ATOM 656 CG2 VAL B 5 -4.394 5.833 -8.188 1.00 0.00 C ATOM 0 H VAL B 5 -2.852 7.482 -9.719 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.410 7.328 -6.830 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.520 5.181 -8.974 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -3.132 3.784 -6.982 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -1.550 4.566 -6.749 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -2.995 5.224 -5.946 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -4.878 4.870 -8.349 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -4.784 6.287 -7.277 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.597 6.487 -9.036 1.00 0.00 H new ATOM 666 N LYS B 6 0.081 7.199 -6.842 1.00 0.00 N ATOM 667 CA LYS B 6 1.530 7.120 -6.793 1.00 0.00 C ATOM 668 C LYS B 6 1.966 5.770 -6.240 1.00 0.00 C ATOM 669 O LYS B 6 1.632 5.414 -5.110 1.00 0.00 O ATOM 670 CB LYS B 6 2.052 8.265 -5.928 1.00 0.00 C ATOM 671 CG LYS B 6 3.565 8.135 -5.756 1.00 0.00 C ATOM 672 CD LYS B 6 4.159 9.377 -5.099 1.00 0.00 C ATOM 673 CE LYS B 6 4.131 10.540 -6.088 1.00 0.00 C ATOM 674 NZ LYS B 6 4.730 11.750 -5.498 1.00 0.00 N ATOM 0 H LYS B 6 -0.336 7.617 -6.010 1.00 0.00 H new ATOM 0 HA LYS B 6 1.944 7.212 -7.797 1.00 0.00 H new ATOM 0 HB2 LYS B 6 1.810 9.222 -6.390 1.00 0.00 H new ATOM 0 HB3 LYS B 6 1.563 8.249 -4.954 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.790 7.258 -5.149 1.00 0.00 H new ATOM 0 HG3 LYS B 6 4.031 7.978 -6.729 1.00 0.00 H new ATOM 0 HD2 LYS B 6 3.593 9.634 -4.204 1.00 0.00 H new ATOM 0 HD3 LYS B 6 5.183 9.179 -4.783 1.00 0.00 H new ATOM 0 HE2 LYS B 6 4.673 10.266 -6.993 1.00 0.00 H new ATOM 0 HE3 LYS B 6 3.102 10.746 -6.383 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 4.699 12.526 -6.190 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 4.196 12.023 -4.648 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 5.719 11.557 -5.239 1.00 0.00 H new ATOM 688 N THR B 7 2.718 5.032 -7.053 1.00 0.00 N ATOM 689 CA THR B 7 3.250 3.731 -6.676 1.00 0.00 C ATOM 690 C THR B 7 4.470 3.918 -5.777 1.00 0.00 C ATOM 691 O THR B 7 5.000 5.022 -5.662 1.00 0.00 O ATOM 692 CB THR B 7 3.594 2.935 -7.942 1.00 0.00 C ATOM 693 OG1 THR B 7 3.718 1.569 -7.609 1.00 0.00 O ATOM 694 CG2 THR B 7 4.907 3.403 -8.550 1.00 0.00 C ATOM 0 H THR B 7 2.975 5.324 -7.996 1.00 0.00 H new ATOM 0 HA THR B 7 2.505 3.167 -6.115 1.00 0.00 H new ATOM 0 HB THR B 7 2.796 3.090 -8.668 1.00 0.00 H new ATOM 0 HG1 THR B 7 3.936 1.055 -8.414 1.00 0.00 H new ATOM 0 HG21 THR B 7 5.122 2.819 -9.445 1.00 0.00 H new ATOM 0 HG22 THR B 7 4.830 4.458 -8.814 1.00 0.00 H new ATOM 0 HG23 THR B 7 5.711 3.268 -7.827 1.00 0.00 H new ATOM 702 N LEU B 8 4.909 2.831 -5.144 1.00 0.00 N ATOM 703 CA LEU B 8 5.995 2.806 -4.170 1.00 0.00 C ATOM 704 C LEU B 8 7.378 3.102 -4.767 1.00 0.00 C ATOM 705 O LEU B 8 8.387 2.786 -4.136 1.00 0.00 O ATOM 706 CB LEU B 8 5.969 1.437 -3.488 1.00 0.00 C ATOM 707 CG LEU B 8 4.759 1.261 -2.566 1.00 0.00 C ATOM 708 CD1 LEU B 8 4.772 -0.162 -2.015 1.00 0.00 C ATOM 709 CD2 LEU B 8 4.818 2.237 -1.391 1.00 0.00 C ATOM 0 H LEU B 8 4.501 1.910 -5.303 1.00 0.00 H new ATOM 0 HA LEU B 8 5.831 3.610 -3.453 1.00 0.00 H new ATOM 0 HB2 LEU B 8 5.958 0.656 -4.249 1.00 0.00 H new ATOM 0 HB3 LEU B 8 6.884 1.306 -2.910 1.00 0.00 H new ATOM 0 HG LEU B 8 3.852 1.455 -3.138 1.00 0.00 H new ATOM 0 HD11 LEU B 8 3.916 -0.305 -1.356 1.00 0.00 H new ATOM 0 HD12 LEU B 8 4.717 -0.872 -2.840 1.00 0.00 H new ATOM 0 HD13 LEU B 8 5.693 -0.327 -1.455 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.947 2.091 -0.752 1.00 0.00 H new ATOM 0 HD22 LEU B 8 5.725 2.058 -0.814 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.824 3.260 -1.768 1.00 0.00 H new ATOM 721 N THR B 9 7.449 3.701 -5.960 1.00 0.00 N ATOM 722 CA THR B 9 8.719 4.070 -6.579 1.00 0.00 C ATOM 723 C THR B 9 8.707 5.516 -7.078 1.00 0.00 C ATOM 724 O THR B 9 9.686 5.974 -7.667 1.00 0.00 O ATOM 725 CB THR B 9 9.064 3.114 -7.724 1.00 0.00 C ATOM 726 OG1 THR B 9 8.085 3.209 -8.734 1.00 0.00 O ATOM 727 CG2 THR B 9 9.135 1.668 -7.235 1.00 0.00 C ATOM 0 H THR B 9 6.630 3.941 -6.519 1.00 0.00 H new ATOM 0 HA THR B 9 9.489 3.990 -5.812 1.00 0.00 H new ATOM 0 HB THR B 9 10.040 3.398 -8.117 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.310 2.597 -9.466 1.00 0.00 H new ATOM 0 HG21 THR B 9 9.382 1.013 -8.071 1.00 0.00 H new ATOM 0 HG22 THR B 9 9.903 1.581 -6.467 1.00 0.00 H new ATOM 0 HG23 THR B 9 8.171 1.377 -6.818 1.00 0.00 H new ATOM 735 N GLY B 10 7.605 6.239 -6.847 1.00 0.00 N ATOM 736 CA GLY B 10 7.493 7.652 -7.190 1.00 0.00 C ATOM 737 C GLY B 10 6.760 7.873 -8.509 1.00 0.00 C ATOM 738 O GLY B 10 6.496 9.017 -8.879 1.00 0.00 O ATOM 0 H GLY B 10 6.765 5.854 -6.415 1.00 0.00 H new ATOM 0 HA2 GLY B 10 6.966 8.176 -6.392 1.00 0.00 H new ATOM 0 HA3 GLY B 10 8.490 8.088 -7.254 1.00 0.00 H new ATOM 742 N LYS B 11 6.429 6.789 -9.215 1.00 0.00 N ATOM 743 CA LYS B 11 5.718 6.853 -10.478 1.00 0.00 C ATOM 744 C LYS B 11 4.245 7.098 -10.179 1.00 0.00 C ATOM 745 O LYS B 11 3.760 6.735 -9.109 1.00 0.00 O ATOM 746 CB LYS B 11 5.984 5.543 -11.230 1.00 0.00 C ATOM 747 CG LYS B 11 5.108 5.307 -12.461 1.00 0.00 C ATOM 748 CD LYS B 11 3.774 4.625 -12.117 1.00 0.00 C ATOM 749 CE LYS B 11 2.939 4.501 -13.393 1.00 0.00 C ATOM 750 NZ LYS B 11 3.512 3.514 -14.329 1.00 0.00 N ATOM 0 H LYS B 11 6.652 5.839 -8.917 1.00 0.00 H new ATOM 0 HA LYS B 11 6.054 7.670 -11.117 1.00 0.00 H new ATOM 0 HB2 LYS B 11 7.029 5.527 -11.540 1.00 0.00 H new ATOM 0 HB3 LYS B 11 5.843 4.712 -10.539 1.00 0.00 H new ATOM 0 HG2 LYS B 11 4.909 6.261 -12.948 1.00 0.00 H new ATOM 0 HG3 LYS B 11 5.652 4.691 -13.177 1.00 0.00 H new ATOM 0 HD2 LYS B 11 3.954 3.640 -11.687 1.00 0.00 H new ATOM 0 HD3 LYS B 11 3.235 5.206 -11.369 1.00 0.00 H new ATOM 0 HE2 LYS B 11 1.921 4.209 -13.134 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.877 5.473 -13.883 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 2.928 3.471 -15.188 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 4.480 3.797 -14.582 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 3.532 2.578 -13.877 1.00 0.00 H new ATOM 764 N THR B 12 3.530 7.710 -11.123 1.00 0.00 N ATOM 765 CA THR B 12 2.140 8.079 -10.927 1.00 0.00 C ATOM 766 C THR B 12 1.280 7.431 -11.999 1.00 0.00 C ATOM 767 O THR B 12 1.357 7.780 -13.176 1.00 0.00 O ATOM 768 CB THR B 12 2.020 9.603 -10.954 1.00 0.00 C ATOM 769 OG1 THR B 12 2.733 10.149 -9.866 1.00 0.00 O ATOM 770 CG2 THR B 12 0.559 10.027 -10.842 1.00 0.00 C ATOM 0 H THR B 12 3.902 7.960 -12.039 1.00 0.00 H new ATOM 0 HA THR B 12 1.787 7.723 -9.959 1.00 0.00 H new ATOM 0 HB THR B 12 2.429 9.966 -11.897 1.00 0.00 H new ATOM 0 HG1 THR B 12 2.658 11.126 -9.883 1.00 0.00 H new ATOM 0 HG21 THR B 12 0.493 11.115 -10.863 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.005 9.613 -11.678 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.143 9.656 -9.905 1.00 0.00 H new ATOM 778 N ILE B 13 0.458 6.477 -11.567 1.00 0.00 N ATOM 779 CA ILE B 13 -0.510 5.794 -12.402 1.00 0.00 C ATOM 780 C ILE B 13 -1.699 6.736 -12.532 1.00 0.00 C ATOM 781 O ILE B 13 -2.007 7.479 -11.603 1.00 0.00 O ATOM 782 CB ILE B 13 -0.940 4.486 -11.717 1.00 0.00 C ATOM 783 CG1 ILE B 13 0.250 3.710 -11.131 1.00 0.00 C ATOM 784 CG2 ILE B 13 -1.672 3.603 -12.728 1.00 0.00 C ATOM 785 CD1 ILE B 13 -0.218 2.603 -10.187 1.00 0.00 C ATOM 0 H ILE B 13 0.452 6.154 -10.600 1.00 0.00 H new ATOM 0 HA ILE B 13 -0.100 5.544 -13.380 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.597 4.751 -10.889 1.00 0.00 H new ATOM 0 HG12 ILE B 13 0.838 3.276 -11.940 1.00 0.00 H new ATOM 0 HG13 ILE B 13 0.905 4.396 -10.594 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.978 2.675 -12.246 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -2.553 4.127 -13.098 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -1.007 3.377 -13.562 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.648 2.073 -9.790 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.784 3.041 -9.365 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.852 1.904 -10.732 1.00 0.00 H new ATOM 797 N THR B 14 -2.372 6.707 -13.679 1.00 0.00 N ATOM 798 CA THR B 14 -3.517 7.580 -13.907 1.00 0.00 C ATOM 799 C THR B 14 -4.599 6.809 -14.647 1.00 0.00 C ATOM 800 O THR B 14 -4.407 6.389 -15.785 1.00 0.00 O ATOM 801 CB THR B 14 -3.104 8.836 -14.677 1.00 0.00 C ATOM 802 OG1 THR B 14 -1.925 9.393 -14.133 1.00 0.00 O ATOM 803 CG2 THR B 14 -4.220 9.871 -14.556 1.00 0.00 C ATOM 0 H THR B 14 -2.145 6.092 -14.460 1.00 0.00 H new ATOM 0 HA THR B 14 -3.913 7.908 -12.946 1.00 0.00 H new ATOM 0 HB THR B 14 -2.925 8.566 -15.718 1.00 0.00 H new ATOM 0 HG1 THR B 14 -1.677 10.194 -14.640 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.940 10.773 -15.100 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.140 9.465 -14.976 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.377 10.115 -13.505 1.00 0.00 H new ATOM 811 N LEU B 15 -5.742 6.628 -13.982 1.00 0.00 N ATOM 812 CA LEU B 15 -6.838 5.778 -14.424 1.00 0.00 C ATOM 813 C LEU B 15 -8.154 6.446 -14.079 1.00 0.00 C ATOM 814 O LEU B 15 -8.258 7.192 -13.107 1.00 0.00 O ATOM 815 CB LEU B 15 -6.745 4.416 -13.712 1.00 0.00 C ATOM 816 CG LEU B 15 -6.434 4.612 -12.220 1.00 0.00 C ATOM 817 CD1 LEU B 15 -7.187 3.603 -11.367 1.00 0.00 C ATOM 818 CD2 LEU B 15 -4.945 4.431 -11.940 1.00 0.00 C ATOM 0 H LEU B 15 -5.932 7.087 -13.091 1.00 0.00 H new ATOM 0 HA LEU B 15 -6.778 5.626 -15.502 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -7.684 3.874 -13.826 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -5.968 3.808 -14.175 1.00 0.00 H new ATOM 0 HG LEU B 15 -6.744 5.626 -11.967 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -6.948 3.765 -10.316 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -8.259 3.727 -11.519 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -6.894 2.593 -11.654 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -4.755 4.575 -10.877 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -4.640 3.426 -12.230 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -4.375 5.163 -12.513 1.00 0.00 H new ATOM 830 N GLU B 16 -9.159 6.166 -14.901 1.00 0.00 N ATOM 831 CA GLU B 16 -10.425 6.845 -14.836 1.00 0.00 C ATOM 832 C GLU B 16 -11.337 6.159 -13.835 1.00 0.00 C ATOM 833 O GLU B 16 -11.348 4.936 -13.718 1.00 0.00 O ATOM 834 CB GLU B 16 -11.057 6.810 -16.218 1.00 0.00 C ATOM 835 CG GLU B 16 -10.129 7.455 -17.247 1.00 0.00 C ATOM 836 CD GLU B 16 -8.891 6.621 -17.568 1.00 0.00 C ATOM 837 OE1 GLU B 16 -9.049 5.406 -17.821 1.00 0.00 O ATOM 838 OE2 GLU B 16 -7.787 7.211 -17.556 1.00 0.00 O ATOM 0 H GLU B 16 -9.107 5.456 -15.631 1.00 0.00 H new ATOM 0 HA GLU B 16 -10.277 7.876 -14.515 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -11.265 5.779 -16.503 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.012 7.335 -16.201 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -10.687 7.629 -18.167 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -9.813 8.430 -16.877 1.00 0.00 H new ATOM 845 N VAL B 17 -12.104 6.972 -13.121 1.00 0.00 N ATOM 846 CA VAL B 17 -12.961 6.514 -12.033 1.00 0.00 C ATOM 847 C VAL B 17 -14.181 7.411 -11.889 1.00 0.00 C ATOM 848 O VAL B 17 -14.283 8.444 -12.547 1.00 0.00 O ATOM 849 CB VAL B 17 -12.182 6.513 -10.709 1.00 0.00 C ATOM 850 CG1 VAL B 17 -11.007 5.538 -10.737 1.00 0.00 C ATOM 851 CG2 VAL B 17 -11.651 7.914 -10.403 1.00 0.00 C ATOM 0 H VAL B 17 -12.150 7.978 -13.282 1.00 0.00 H new ATOM 0 HA VAL B 17 -13.289 5.502 -12.269 1.00 0.00 H new ATOM 0 HB VAL B 17 -12.878 6.195 -9.933 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -10.485 5.570 -9.781 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -11.376 4.528 -10.915 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -10.320 5.819 -11.535 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.101 7.897 -9.462 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -10.987 8.235 -11.206 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -12.486 8.610 -10.323 1.00 0.00 H new ATOM 861 N GLU B 18 -15.115 7.012 -11.021 1.00 0.00 N ATOM 862 CA GLU B 18 -16.354 7.745 -10.809 1.00 0.00 C ATOM 863 C GLU B 18 -16.743 7.679 -9.335 1.00 0.00 C ATOM 864 O GLU B 18 -16.266 6.808 -8.609 1.00 0.00 O ATOM 865 CB GLU B 18 -17.459 7.119 -11.665 1.00 0.00 C ATOM 866 CG GLU B 18 -17.085 7.160 -13.143 1.00 0.00 C ATOM 867 CD GLU B 18 -18.236 6.667 -14.016 1.00 0.00 C ATOM 868 OE1 GLU B 18 -19.245 7.400 -14.118 1.00 0.00 O ATOM 869 OE2 GLU B 18 -18.100 5.558 -14.582 1.00 0.00 O ATOM 0 H GLU B 18 -15.028 6.172 -10.449 1.00 0.00 H new ATOM 0 HA GLU B 18 -16.218 8.788 -11.094 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -17.625 6.087 -11.355 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -18.395 7.654 -11.507 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -16.821 8.179 -13.426 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -16.204 6.542 -13.315 1.00 0.00 H new ATOM 876 N PRO B 19 -17.614 8.590 -8.882 1.00 0.00 N ATOM 877 CA PRO B 19 -18.127 8.595 -7.524 1.00 0.00 C ATOM 878 C PRO B 19 -19.056 7.411 -7.270 1.00 0.00 C ATOM 879 O PRO B 19 -19.657 7.316 -6.199 1.00 0.00 O ATOM 880 CB PRO B 19 -18.873 9.919 -7.370 1.00 0.00 C ATOM 881 CG PRO B 19 -19.258 10.290 -8.800 1.00 0.00 C ATOM 882 CD PRO B 19 -18.158 9.686 -9.661 1.00 0.00 C ATOM 0 HA PRO B 19 -17.319 8.500 -6.798 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -19.752 9.811 -6.735 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -18.242 10.683 -6.915 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -20.235 9.887 -9.065 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -19.314 11.371 -8.928 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -18.554 9.332 -10.613 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -17.389 10.424 -9.890 1.00 0.00 H new ATOM 890 N SER B 20 -19.174 6.508 -8.247 1.00 0.00 N ATOM 891 CA SER B 20 -19.990 5.315 -8.141 1.00 0.00 C ATOM 892 C SER B 20 -19.116 4.069 -8.218 1.00 0.00 C ATOM 893 O SER B 20 -19.610 2.956 -8.037 1.00 0.00 O ATOM 894 CB SER B 20 -21.057 5.323 -9.231 1.00 0.00 C ATOM 895 OG SER B 20 -20.445 5.419 -10.502 1.00 0.00 O ATOM 0 H SER B 20 -18.695 6.595 -9.143 1.00 0.00 H new ATOM 0 HA SER B 20 -20.494 5.303 -7.175 1.00 0.00 H new ATOM 0 HB2 SER B 20 -21.655 4.414 -9.173 1.00 0.00 H new ATOM 0 HB3 SER B 20 -21.737 6.162 -9.081 1.00 0.00 H new ATOM 0 HG SER B 20 -21.135 5.422 -11.198 1.00 0.00 H new ATOM 901 N ASP B 21 -17.816 4.248 -8.479 1.00 0.00 N ATOM 902 CA ASP B 21 -16.848 3.191 -8.333 1.00 0.00 C ATOM 903 C ASP B 21 -16.484 3.150 -6.854 1.00 0.00 C ATOM 904 O ASP B 21 -16.918 3.976 -6.054 1.00 0.00 O ATOM 905 CB ASP B 21 -15.609 3.459 -9.195 1.00 0.00 C ATOM 906 CG ASP B 21 -15.867 3.208 -10.681 1.00 0.00 C ATOM 907 OD1 ASP B 21 -16.892 3.705 -11.194 1.00 0.00 O ATOM 908 OD2 ASP B 21 -15.025 2.514 -11.292 1.00 0.00 O ATOM 0 H ASP B 21 -17.421 5.133 -8.796 1.00 0.00 H new ATOM 0 HA ASP B 21 -17.255 2.236 -8.666 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -15.288 4.491 -9.054 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -14.791 2.822 -8.858 1.00 0.00 H new ATOM 913 N THR B 22 -15.675 2.165 -6.513 1.00 0.00 N ATOM 914 CA THR B 22 -15.312 1.806 -5.151 1.00 0.00 C ATOM 915 C THR B 22 -13.816 1.532 -5.095 1.00 0.00 C ATOM 916 O THR B 22 -13.163 1.449 -6.135 1.00 0.00 O ATOM 917 CB THR B 22 -16.136 0.581 -4.724 1.00 0.00 C ATOM 918 OG1 THR B 22 -15.603 -0.001 -3.553 1.00 0.00 O ATOM 919 CG2 THR B 22 -16.153 -0.481 -5.822 1.00 0.00 C ATOM 0 H THR B 22 -15.232 1.565 -7.208 1.00 0.00 H new ATOM 0 HA THR B 22 -15.532 2.619 -4.459 1.00 0.00 H new ATOM 0 HB THR B 22 -17.151 0.930 -4.536 1.00 0.00 H new ATOM 0 HG1 THR B 22 -15.893 0.514 -2.771 1.00 0.00 H new ATOM 0 HG21 THR B 22 -16.743 -1.336 -5.492 1.00 0.00 H new ATOM 0 HG22 THR B 22 -16.595 -0.062 -6.726 1.00 0.00 H new ATOM 0 HG23 THR B 22 -15.133 -0.803 -6.032 1.00 0.00 H new ATOM 927 N ILE B 23 -13.247 1.390 -3.898 1.00 0.00 N ATOM 928 CA ILE B 23 -11.820 1.180 -3.775 1.00 0.00 C ATOM 929 C ILE B 23 -11.398 -0.077 -4.537 1.00 0.00 C ATOM 930 O ILE B 23 -10.299 -0.115 -5.084 1.00 0.00 O ATOM 931 CB ILE B 23 -11.442 1.083 -2.294 1.00 0.00 C ATOM 932 CG1 ILE B 23 -11.890 2.302 -1.478 1.00 0.00 C ATOM 933 CG2 ILE B 23 -9.927 0.928 -2.174 1.00 0.00 C ATOM 934 CD1 ILE B 23 -11.456 3.640 -2.087 1.00 0.00 C ATOM 0 H ILE B 23 -13.753 1.417 -3.013 1.00 0.00 H new ATOM 0 HA ILE B 23 -11.291 2.026 -4.214 1.00 0.00 H new ATOM 0 HB ILE B 23 -11.961 0.216 -1.886 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -12.976 2.289 -1.387 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -11.485 2.223 -0.469 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -9.651 0.858 -1.122 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -9.612 0.023 -2.693 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -9.436 1.792 -2.622 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -11.807 4.457 -1.457 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -10.369 3.674 -2.153 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -11.883 3.741 -3.085 1.00 0.00 H new ATOM 946 N GLU B 24 -12.248 -1.112 -4.588 1.00 0.00 N ATOM 947 CA GLU B 24 -11.875 -2.337 -5.285 1.00 0.00 C ATOM 948 C GLU B 24 -11.896 -2.151 -6.804 1.00 0.00 C ATOM 949 O GLU B 24 -11.263 -2.923 -7.521 1.00 0.00 O ATOM 950 CB GLU B 24 -12.760 -3.509 -4.841 1.00 0.00 C ATOM 951 CG GLU B 24 -14.160 -3.428 -5.443 1.00 0.00 C ATOM 952 CD GLU B 24 -15.035 -4.594 -4.983 1.00 0.00 C ATOM 953 OE1 GLU B 24 -14.652 -5.752 -5.266 1.00 0.00 O ATOM 954 OE2 GLU B 24 -16.081 -4.322 -4.352 1.00 0.00 O ATOM 0 H GLU B 24 -13.176 -1.122 -4.164 1.00 0.00 H new ATOM 0 HA GLU B 24 -10.847 -2.577 -5.012 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -12.292 -4.448 -5.136 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -12.833 -3.517 -3.753 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -14.627 -2.486 -5.156 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -14.090 -3.431 -6.531 1.00 0.00 H new ATOM 961 N ASN B 25 -12.613 -1.140 -7.310 1.00 0.00 N ATOM 962 CA ASN B 25 -12.602 -0.805 -8.718 1.00 0.00 C ATOM 963 C ASN B 25 -11.306 -0.069 -9.032 1.00 0.00 C ATOM 964 O ASN B 25 -10.729 -0.254 -10.099 1.00 0.00 O ATOM 965 CB ASN B 25 -13.773 0.126 -9.003 1.00 0.00 C ATOM 966 CG ASN B 25 -15.030 -0.609 -9.422 1.00 0.00 C ATOM 967 OD1 ASN B 25 -15.343 -1.685 -8.922 1.00 0.00 O ATOM 968 ND2 ASN B 25 -15.761 -0.016 -10.356 1.00 0.00 N ATOM 0 H ASN B 25 -13.213 -0.538 -6.746 1.00 0.00 H new ATOM 0 HA ASN B 25 -12.680 -1.708 -9.324 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -13.985 0.716 -8.112 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -13.490 0.826 -9.789 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -16.621 -0.455 -10.686 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -15.464 0.879 -10.745 1.00 0.00 H new ATOM 975 N VAL B 26 -10.848 0.767 -8.099 1.00 0.00 N ATOM 976 CA VAL B 26 -9.593 1.481 -8.267 1.00 0.00 C ATOM 977 C VAL B 26 -8.450 0.472 -8.257 1.00 0.00 C ATOM 978 O VAL B 26 -7.488 0.626 -9.003 1.00 0.00 O ATOM 979 CB VAL B 26 -9.444 2.553 -7.184 1.00 0.00 C ATOM 980 CG1 VAL B 26 -8.159 3.349 -7.396 1.00 0.00 C ATOM 981 CG2 VAL B 26 -10.621 3.530 -7.247 1.00 0.00 C ATOM 0 H VAL B 26 -11.331 0.962 -7.222 1.00 0.00 H new ATOM 0 HA VAL B 26 -9.574 2.003 -9.224 1.00 0.00 H new ATOM 0 HB VAL B 26 -9.418 2.052 -6.216 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -8.068 4.107 -6.618 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -7.303 2.676 -7.349 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -8.188 3.833 -8.372 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -10.506 4.289 -6.473 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -10.643 4.010 -8.225 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -11.553 2.988 -7.088 1.00 0.00 H new ATOM 991 N LYS B 27 -8.552 -0.567 -7.418 1.00 0.00 N ATOM 992 CA LYS B 27 -7.561 -1.636 -7.413 1.00 0.00 C ATOM 993 C LYS B 27 -7.620 -2.420 -8.721 1.00 0.00 C ATOM 994 O LYS B 27 -6.588 -2.848 -9.226 1.00 0.00 O ATOM 995 CB LYS B 27 -7.803 -2.590 -6.241 1.00 0.00 C ATOM 996 CG LYS B 27 -7.571 -1.932 -4.879 1.00 0.00 C ATOM 997 CD LYS B 27 -7.975 -2.915 -3.776 1.00 0.00 C ATOM 998 CE LYS B 27 -7.747 -2.297 -2.398 1.00 0.00 C ATOM 999 NZ LYS B 27 -8.248 -3.184 -1.332 1.00 0.00 N ATOM 0 H LYS B 27 -9.306 -0.684 -6.741 1.00 0.00 H new ATOM 0 HA LYS B 27 -6.576 -1.182 -7.307 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -8.826 -2.964 -6.289 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -7.144 -3.452 -6.339 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -6.523 -1.653 -4.769 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -8.155 -1.015 -4.799 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -9.024 -3.187 -3.890 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -7.396 -3.834 -3.869 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -6.683 -2.110 -2.251 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -8.251 -1.332 -2.340 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -7.977 -2.800 -0.404 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -9.284 -3.247 -1.391 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -7.837 -4.132 -1.448 1.00 0.00 H new ATOM 1013 N ALA B 28 -8.823 -2.609 -9.271 1.00 0.00 N ATOM 1014 CA ALA B 28 -9.020 -3.353 -10.506 1.00 0.00 C ATOM 1015 C ALA B 28 -8.501 -2.579 -11.717 1.00 0.00 C ATOM 1016 O ALA B 28 -8.059 -3.187 -12.691 1.00 0.00 O ATOM 1017 CB ALA B 28 -10.518 -3.641 -10.657 1.00 0.00 C ATOM 0 H ALA B 28 -9.687 -2.247 -8.867 1.00 0.00 H new ATOM 0 HA ALA B 28 -8.456 -4.285 -10.458 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -10.690 -4.199 -11.577 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -10.863 -4.229 -9.806 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -11.067 -2.700 -10.695 1.00 0.00 H new ATOM 1023 N LYS B 29 -8.545 -1.244 -11.666 1.00 0.00 N ATOM 1024 CA LYS B 29 -7.990 -0.403 -12.720 1.00 0.00 C ATOM 1025 C LYS B 29 -6.470 -0.349 -12.605 1.00 0.00 C ATOM 1026 O LYS B 29 -5.774 -0.311 -13.614 1.00 0.00 O ATOM 1027 CB LYS B 29 -8.573 1.002 -12.585 1.00 0.00 C ATOM 1028 CG LYS B 29 -10.056 1.027 -12.942 1.00 0.00 C ATOM 1029 CD LYS B 29 -10.744 2.147 -12.166 1.00 0.00 C ATOM 1030 CE LYS B 29 -12.261 2.044 -12.292 1.00 0.00 C ATOM 1031 NZ LYS B 29 -12.723 2.472 -13.626 1.00 0.00 N ATOM 0 H LYS B 29 -8.965 -0.723 -10.896 1.00 0.00 H new ATOM 0 HA LYS B 29 -8.247 -0.819 -13.694 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -8.437 1.357 -11.563 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -8.029 1.687 -13.235 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -10.181 1.182 -14.014 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -10.515 0.068 -12.703 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -10.458 2.096 -11.115 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.409 3.114 -12.541 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -12.573 1.016 -12.110 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -12.733 2.660 -11.527 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -13.760 2.552 -13.625 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.305 3.395 -13.859 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -12.431 1.771 -14.336 1.00 0.00 H new ATOM 1045 N ILE B 30 -5.945 -0.347 -11.377 1.00 0.00 N ATOM 1046 CA ILE B 30 -4.504 -0.405 -11.155 1.00 0.00 C ATOM 1047 C ILE B 30 -3.991 -1.786 -11.540 1.00 0.00 C ATOM 1048 O ILE B 30 -2.837 -1.939 -11.935 1.00 0.00 O ATOM 1049 CB ILE B 30 -4.212 -0.095 -9.686 1.00 0.00 C ATOM 1050 CG1 ILE B 30 -4.510 1.387 -9.437 1.00 0.00 C ATOM 1051 CG2 ILE B 30 -2.754 -0.400 -9.330 1.00 0.00 C ATOM 1052 CD1 ILE B 30 -4.590 1.678 -7.941 1.00 0.00 C ATOM 0 H ILE B 30 -6.500 -0.306 -10.522 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.993 0.334 -11.772 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.842 -0.724 -9.057 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.732 2.001 -9.891 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.450 1.659 -9.916 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.580 -0.169 -8.279 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.549 -1.456 -9.508 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -2.094 0.207 -9.949 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -4.802 2.736 -7.787 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.385 1.080 -7.496 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.640 1.426 -7.470 1.00 0.00 H new ATOM 1064 N GLN B 31 -4.849 -2.803 -11.430 1.00 0.00 N ATOM 1065 CA GLN B 31 -4.505 -4.146 -11.858 1.00 0.00 C ATOM 1066 C GLN B 31 -4.436 -4.225 -13.384 1.00 0.00 C ATOM 1067 O GLN B 31 -3.974 -5.210 -13.958 1.00 0.00 O ATOM 1068 CB GLN B 31 -5.515 -5.141 -11.282 1.00 0.00 C ATOM 1069 CG GLN B 31 -4.994 -6.516 -11.658 1.00 0.00 C ATOM 1070 CD GLN B 31 -5.536 -7.656 -10.819 1.00 0.00 C ATOM 1071 OE1 GLN B 31 -6.687 -7.650 -10.391 1.00 0.00 O ATOM 1072 NE2 GLN B 31 -4.689 -8.653 -10.583 1.00 0.00 N ATOM 0 H GLN B 31 -5.789 -2.713 -11.045 1.00 0.00 H new ATOM 0 HA GLN B 31 -3.516 -4.406 -11.479 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -5.596 -5.035 -10.200 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -6.510 -4.973 -11.694 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -5.236 -6.707 -12.703 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.907 -6.511 -11.578 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -3.741 -8.617 -10.958 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -4.987 -9.454 -10.027 1.00 0.00 H new ATOM 1081 N ASP B 32 -4.902 -3.176 -14.054 1.00 0.00 N ATOM 1082 CA ASP B 32 -4.842 -3.072 -15.503 1.00 0.00 C ATOM 1083 C ASP B 32 -3.604 -2.287 -15.909 1.00 0.00 C ATOM 1084 O ASP B 32 -2.940 -2.598 -16.895 1.00 0.00 O ATOM 1085 CB ASP B 32 -6.073 -2.310 -15.980 1.00 0.00 C ATOM 1086 CG ASP B 32 -6.522 -2.784 -17.358 1.00 0.00 C ATOM 1087 OD1 ASP B 32 -7.150 -3.865 -17.422 1.00 0.00 O ATOM 1088 OD2 ASP B 32 -6.233 -2.066 -18.340 1.00 0.00 O ATOM 0 H ASP B 32 -5.334 -2.370 -13.602 1.00 0.00 H new ATOM 0 HA ASP B 32 -4.805 -4.069 -15.943 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -6.885 -2.444 -15.265 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.851 -1.243 -16.015 1.00 0.00 H new ATOM 1093 N LYS B 33 -3.314 -1.253 -15.114 1.00 0.00 N ATOM 1094 CA LYS B 33 -2.208 -0.336 -15.324 1.00 0.00 C ATOM 1095 C LYS B 33 -0.860 -0.938 -14.945 1.00 0.00 C ATOM 1096 O LYS B 33 0.149 -0.614 -15.566 1.00 0.00 O ATOM 1097 CB LYS B 33 -2.453 0.882 -14.442 1.00 0.00 C ATOM 1098 CG LYS B 33 -3.574 1.777 -14.971 1.00 0.00 C ATOM 1099 CD LYS B 33 -3.111 2.536 -16.214 1.00 0.00 C ATOM 1100 CE LYS B 33 -4.168 3.574 -16.572 1.00 0.00 C ATOM 1101 NZ LYS B 33 -3.824 4.287 -17.817 1.00 0.00 N ATOM 0 H LYS B 33 -3.863 -1.031 -14.284 1.00 0.00 H new ATOM 0 HA LYS B 33 -2.166 -0.088 -16.385 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -2.703 0.551 -13.434 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -1.534 1.463 -14.368 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -4.448 1.172 -15.212 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -3.879 2.483 -14.199 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.153 3.021 -16.026 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -2.962 1.846 -17.045 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.136 3.085 -16.687 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.267 4.290 -15.756 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -3.849 5.313 -17.648 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -2.870 4.010 -18.124 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -4.511 4.042 -18.559 1.00 0.00 H new ATOM 1115 N GLU B 34 -0.842 -1.808 -13.935 1.00 0.00 N ATOM 1116 CA GLU B 34 0.393 -2.393 -13.427 1.00 0.00 C ATOM 1117 C GLU B 34 0.299 -3.904 -13.210 1.00 0.00 C ATOM 1118 O GLU B 34 1.322 -4.559 -13.016 1.00 0.00 O ATOM 1119 CB GLU B 34 0.716 -1.731 -12.090 1.00 0.00 C ATOM 1120 CG GLU B 34 1.115 -0.261 -12.241 1.00 0.00 C ATOM 1121 CD GLU B 34 2.439 -0.078 -12.986 1.00 0.00 C ATOM 1122 OE1 GLU B 34 3.218 -1.056 -13.056 1.00 0.00 O ATOM 1123 OE2 GLU B 34 2.667 1.049 -13.482 1.00 0.00 O ATOM 0 H GLU B 34 -1.681 -2.124 -13.449 1.00 0.00 H new ATOM 0 HA GLU B 34 1.170 -2.222 -14.173 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -0.152 -1.802 -11.435 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.527 -2.276 -11.606 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.327 0.271 -12.774 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.194 0.192 -11.253 1.00 0.00 H new ATOM 1130 N GLY B 35 -0.913 -4.464 -13.240 1.00 0.00 N ATOM 1131 CA GLY B 35 -1.099 -5.899 -13.032 1.00 0.00 C ATOM 1132 C GLY B 35 -0.955 -6.274 -11.564 1.00 0.00 C ATOM 1133 O GLY B 35 -0.782 -7.447 -11.239 1.00 0.00 O ATOM 0 H GLY B 35 -1.776 -3.946 -13.406 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -2.086 -6.194 -13.389 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -0.368 -6.451 -13.623 1.00 0.00 H new ATOM 1137 N ILE B 36 -1.025 -5.281 -10.675 1.00 0.00 N ATOM 1138 CA ILE B 36 -0.866 -5.500 -9.246 1.00 0.00 C ATOM 1139 C ILE B 36 -2.131 -6.166 -8.717 1.00 0.00 C ATOM 1140 O ILE B 36 -3.237 -5.743 -9.047 1.00 0.00 O ATOM 1141 CB ILE B 36 -0.634 -4.157 -8.547 1.00 0.00 C ATOM 1142 CG1 ILE B 36 0.734 -3.602 -8.955 1.00 0.00 C ATOM 1143 CG2 ILE B 36 -0.669 -4.316 -7.026 1.00 0.00 C ATOM 1144 CD1 ILE B 36 0.812 -2.101 -8.687 1.00 0.00 C ATOM 0 H ILE B 36 -1.193 -4.308 -10.930 1.00 0.00 H new ATOM 0 HA ILE B 36 -0.008 -6.143 -9.051 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.428 -3.474 -8.847 1.00 0.00 H new ATOM 0 HG12 ILE B 36 1.520 -4.116 -8.402 1.00 0.00 H new ATOM 0 HG13 ILE B 36 0.910 -3.797 -10.013 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -0.501 -3.347 -6.555 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.642 -4.704 -6.723 1.00 0.00 H new ATOM 0 HG23 ILE B 36 0.111 -5.011 -6.715 1.00 0.00 H new ATOM 0 HD11 ILE B 36 1.792 -1.729 -8.984 1.00 0.00 H new ATOM 0 HD12 ILE B 36 0.040 -1.588 -9.261 1.00 0.00 H new ATOM 0 HD13 ILE B 36 0.660 -1.913 -7.624 1.00 0.00 H new ATOM 1156 N PRO B 37 -1.991 -7.212 -7.893 1.00 0.00 N ATOM 1157 CA PRO B 37 -3.123 -7.920 -7.336 1.00 0.00 C ATOM 1158 C PRO B 37 -3.831 -7.061 -6.296 1.00 0.00 C ATOM 1159 O PRO B 37 -3.180 -6.516 -5.408 1.00 0.00 O ATOM 1160 CB PRO B 37 -2.535 -9.170 -6.684 1.00 0.00 C ATOM 1161 CG PRO B 37 -1.093 -8.782 -6.363 1.00 0.00 C ATOM 1162 CD PRO B 37 -0.731 -7.777 -7.457 1.00 0.00 C ATOM 0 HA PRO B 37 -3.862 -8.167 -8.098 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -3.083 -9.445 -5.783 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -2.577 -10.027 -7.356 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -1.010 -8.339 -5.370 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -0.432 -9.649 -6.382 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -0.065 -7.003 -7.075 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -0.213 -8.265 -8.283 1.00 0.00 H new ATOM 1170 N PRO B 38 -5.162 -6.935 -6.389 1.00 0.00 N ATOM 1171 CA PRO B 38 -5.983 -6.333 -5.351 1.00 0.00 C ATOM 1172 C PRO B 38 -5.748 -7.010 -4.000 1.00 0.00 C ATOM 1173 O PRO B 38 -6.023 -6.416 -2.959 1.00 0.00 O ATOM 1174 CB PRO B 38 -7.430 -6.501 -5.823 1.00 0.00 C ATOM 1175 CG PRO B 38 -7.358 -7.584 -6.899 1.00 0.00 C ATOM 1176 CD PRO B 38 -5.984 -7.366 -7.501 1.00 0.00 C ATOM 0 HA PRO B 38 -5.737 -5.282 -5.200 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -8.083 -6.799 -5.003 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -7.827 -5.569 -6.224 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -7.460 -8.583 -6.475 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -8.148 -7.470 -7.641 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -5.597 -8.282 -7.948 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -6.011 -6.613 -8.289 1.00 0.00 H new ATOM 1184 N ASP B 39 -5.241 -8.246 -4.015 1.00 0.00 N ATOM 1185 CA ASP B 39 -4.888 -8.981 -2.806 1.00 0.00 C ATOM 1186 C ASP B 39 -3.660 -8.387 -2.104 1.00 0.00 C ATOM 1187 O ASP B 39 -3.347 -8.777 -0.981 1.00 0.00 O ATOM 1188 CB ASP B 39 -4.657 -10.449 -3.161 1.00 0.00 C ATOM 1189 CG ASP B 39 -4.497 -11.310 -1.908 1.00 0.00 C ATOM 1190 OD1 ASP B 39 -5.446 -11.332 -1.093 1.00 0.00 O ATOM 1191 OD2 ASP B 39 -3.424 -11.941 -1.775 1.00 0.00 O ATOM 0 H ASP B 39 -5.064 -8.765 -4.875 1.00 0.00 H new ATOM 0 HA ASP B 39 -5.716 -8.900 -2.102 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -5.495 -10.818 -3.752 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -3.765 -10.538 -3.781 1.00 0.00 H new ATOM 1196 N GLN B 40 -2.957 -7.445 -2.744 1.00 0.00 N ATOM 1197 CA GLN B 40 -1.873 -6.719 -2.086 1.00 0.00 C ATOM 1198 C GLN B 40 -2.158 -5.230 -1.950 1.00 0.00 C ATOM 1199 O GLN B 40 -1.540 -4.576 -1.113 1.00 0.00 O ATOM 1200 CB GLN B 40 -0.579 -6.840 -2.890 1.00 0.00 C ATOM 1201 CG GLN B 40 0.073 -8.212 -2.764 1.00 0.00 C ATOM 1202 CD GLN B 40 1.503 -8.169 -3.288 1.00 0.00 C ATOM 1203 OE1 GLN B 40 2.153 -7.127 -3.273 1.00 0.00 O ATOM 1204 NE2 GLN B 40 2.008 -9.300 -3.758 1.00 0.00 N ATOM 0 H GLN B 40 -3.121 -7.171 -3.713 1.00 0.00 H new ATOM 0 HA GLN B 40 -1.781 -7.168 -1.097 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.790 -6.639 -3.940 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.124 -6.077 -2.554 1.00 0.00 H new ATOM 0 HG2 GLN B 40 0.070 -8.529 -1.721 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -0.504 -8.949 -3.323 1.00 0.00 H new ATOM 0 HE21 GLN B 40 1.444 -10.150 -3.757 1.00 0.00 H new ATOM 0 HE22 GLN B 40 2.961 -9.321 -4.120 1.00 0.00 H new ATOM 1213 N GLN B 41 -3.070 -4.677 -2.750 1.00 0.00 N ATOM 1214 CA GLN B 41 -3.257 -3.236 -2.767 1.00 0.00 C ATOM 1215 C GLN B 41 -3.846 -2.717 -1.458 1.00 0.00 C ATOM 1216 O GLN B 41 -4.820 -3.253 -0.931 1.00 0.00 O ATOM 1217 CB GLN B 41 -4.122 -2.823 -3.954 1.00 0.00 C ATOM 1218 CG GLN B 41 -3.366 -3.089 -5.256 1.00 0.00 C ATOM 1219 CD GLN B 41 -4.110 -2.520 -6.458 1.00 0.00 C ATOM 1220 OE1 GLN B 41 -4.440 -1.339 -6.483 1.00 0.00 O ATOM 1221 NE2 GLN B 41 -4.382 -3.355 -7.457 1.00 0.00 N ATOM 0 H GLN B 41 -3.678 -5.198 -3.382 1.00 0.00 H new ATOM 0 HA GLN B 41 -2.273 -2.781 -2.876 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -5.059 -3.380 -3.945 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -4.379 -1.766 -3.880 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -2.372 -2.645 -5.198 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -3.229 -4.163 -5.386 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -4.091 -4.331 -7.400 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -4.882 -3.019 -8.281 1.00 0.00 H new ATOM 1230 N ARG B 42 -3.221 -1.649 -0.956 1.00 0.00 N ATOM 1231 CA ARG B 42 -3.643 -0.887 0.210 1.00 0.00 C ATOM 1232 C ARG B 42 -3.634 0.591 -0.154 1.00 0.00 C ATOM 1233 O ARG B 42 -2.754 1.336 0.270 1.00 0.00 O ATOM 1234 CB ARG B 42 -2.700 -1.143 1.381 1.00 0.00 C ATOM 1235 CG ARG B 42 -2.839 -2.540 1.978 1.00 0.00 C ATOM 1236 CD ARG B 42 -1.826 -2.692 3.113 1.00 0.00 C ATOM 1237 NE ARG B 42 -2.030 -1.691 4.168 1.00 0.00 N ATOM 1238 CZ ARG B 42 -1.214 -1.538 5.216 1.00 0.00 C ATOM 1239 NH1 ARG B 42 -0.139 -2.310 5.361 1.00 0.00 N ATOM 1240 NH2 ARG B 42 -1.468 -0.607 6.132 1.00 0.00 N ATOM 0 H ARG B 42 -2.368 -1.279 -1.375 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.645 -1.194 0.509 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -1.672 -0.999 1.048 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -2.890 -0.403 2.159 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -3.851 -2.692 2.352 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -2.665 -3.297 1.213 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -1.907 -3.691 3.540 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -0.816 -2.597 2.713 1.00 0.00 H new ATOM 0 HE ARG B 42 -2.841 -1.077 4.097 1.00 0.00 H new ATOM 0 HH11 ARG B 42 0.070 -3.028 4.668 1.00 0.00 H new ATOM 0 HH12 ARG B 42 0.475 -2.183 6.165 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -2.287 -0.007 6.036 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -0.843 -0.493 6.930 1.00 0.00 H new ATOM 1254 N LEU B 43 -4.617 1.005 -0.949 1.00 0.00 N ATOM 1255 CA LEU B 43 -4.769 2.396 -1.353 1.00 0.00 C ATOM 1256 C LEU B 43 -4.965 3.287 -0.130 1.00 0.00 C ATOM 1257 O LEU B 43 -5.519 2.857 0.882 1.00 0.00 O ATOM 1258 CB LEU B 43 -5.952 2.522 -2.318 1.00 0.00 C ATOM 1259 CG LEU B 43 -5.655 1.826 -3.650 1.00 0.00 C ATOM 1260 CD1 LEU B 43 -6.918 1.806 -4.508 1.00 0.00 C ATOM 1261 CD2 LEU B 43 -4.561 2.566 -4.416 1.00 0.00 C ATOM 0 H LEU B 43 -5.330 0.383 -1.330 1.00 0.00 H new ATOM 0 HA LEU B 43 -3.864 2.724 -1.863 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -6.842 2.084 -1.866 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -6.170 3.575 -2.495 1.00 0.00 H new ATOM 0 HG LEU B 43 -5.321 0.810 -3.437 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -6.706 1.311 -5.456 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -7.706 1.265 -3.984 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -7.245 2.828 -4.698 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -4.367 2.054 -5.358 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -4.885 3.587 -4.618 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -3.649 2.586 -3.819 1.00 0.00 H new ATOM 1273 N ILE B 44 -4.506 4.534 -0.234 1.00 0.00 N ATOM 1274 CA ILE B 44 -4.543 5.485 0.865 1.00 0.00 C ATOM 1275 C ILE B 44 -4.773 6.904 0.340 1.00 0.00 C ATOM 1276 O ILE B 44 -4.427 7.215 -0.796 1.00 0.00 O ATOM 1277 CB ILE B 44 -3.212 5.415 1.635 1.00 0.00 C ATOM 1278 CG1 ILE B 44 -3.072 4.059 2.338 1.00 0.00 C ATOM 1279 CG2 ILE B 44 -3.109 6.552 2.653 1.00 0.00 C ATOM 1280 CD1 ILE B 44 -1.868 4.008 3.281 1.00 0.00 C ATOM 0 H ILE B 44 -4.097 4.910 -1.089 1.00 0.00 H new ATOM 0 HA ILE B 44 -5.367 5.231 1.532 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.399 5.525 0.917 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.981 3.851 2.903 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.976 3.273 1.589 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -2.160 6.480 3.184 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -3.164 7.510 2.136 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -3.930 6.477 3.366 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -1.816 3.026 3.752 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -0.954 4.187 2.714 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -1.975 4.774 4.049 1.00 0.00 H new ATOM 1292 N PHE B 45 -5.360 7.755 1.189 1.00 0.00 N ATOM 1293 CA PHE B 45 -5.540 9.168 0.918 1.00 0.00 C ATOM 1294 C PHE B 45 -5.420 9.887 2.257 1.00 0.00 C ATOM 1295 O PHE B 45 -6.214 9.637 3.161 1.00 0.00 O ATOM 1296 CB PHE B 45 -6.913 9.380 0.280 1.00 0.00 C ATOM 1297 CG PHE B 45 -7.236 10.834 0.029 1.00 0.00 C ATOM 1298 CD1 PHE B 45 -6.762 11.459 -1.131 1.00 0.00 C ATOM 1299 CD2 PHE B 45 -8.005 11.559 0.951 1.00 0.00 C ATOM 1300 CE1 PHE B 45 -7.056 12.806 -1.372 1.00 0.00 C ATOM 1301 CE2 PHE B 45 -8.299 12.908 0.710 1.00 0.00 C ATOM 1302 CZ PHE B 45 -7.825 13.532 -0.453 1.00 0.00 C ATOM 0 H PHE B 45 -5.726 7.467 2.096 1.00 0.00 H new ATOM 0 HA PHE B 45 -4.795 9.558 0.224 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -6.955 8.837 -0.664 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -7.677 8.952 0.928 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -6.169 10.901 -1.840 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -8.370 11.078 1.846 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -6.690 13.286 -2.267 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -8.891 13.467 1.420 1.00 0.00 H new ATOM 0 HZ PHE B 45 -8.052 14.571 -0.640 1.00 0.00 H new ATOM 1312 N ALA B 46 -4.432 10.777 2.397 1.00 0.00 N ATOM 1313 CA ALA B 46 -4.150 11.475 3.644 1.00 0.00 C ATOM 1314 C ALA B 46 -3.913 10.505 4.807 1.00 0.00 C ATOM 1315 O ALA B 46 -3.960 10.901 5.971 1.00 0.00 O ATOM 1316 CB ALA B 46 -5.264 12.482 3.935 1.00 0.00 C ATOM 0 H ALA B 46 -3.802 11.032 1.636 1.00 0.00 H new ATOM 0 HA ALA B 46 -3.217 12.027 3.531 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -5.050 13.002 4.869 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -5.322 13.205 3.122 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -6.215 11.957 4.022 1.00 0.00 H new ATOM 1322 N GLY B 47 -3.657 9.229 4.492 1.00 0.00 N ATOM 1323 CA GLY B 47 -3.384 8.199 5.486 1.00 0.00 C ATOM 1324 C GLY B 47 -4.649 7.631 6.120 1.00 0.00 C ATOM 1325 O GLY B 47 -4.558 6.843 7.058 1.00 0.00 O ATOM 0 H GLY B 47 -3.635 8.886 3.532 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.824 7.389 5.018 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -2.748 8.616 6.267 1.00 0.00 H new ATOM 1329 N LYS B 48 -5.828 8.016 5.619 1.00 0.00 N ATOM 1330 CA LYS B 48 -7.100 7.544 6.155 1.00 0.00 C ATOM 1331 C LYS B 48 -7.505 6.221 5.516 1.00 0.00 C ATOM 1332 O LYS B 48 -8.682 5.969 5.277 1.00 0.00 O ATOM 1333 CB LYS B 48 -8.169 8.627 6.013 1.00 0.00 C ATOM 1334 CG LYS B 48 -8.621 8.906 4.578 1.00 0.00 C ATOM 1335 CD LYS B 48 -10.123 8.650 4.422 1.00 0.00 C ATOM 1336 CE LYS B 48 -10.656 9.368 3.182 1.00 0.00 C ATOM 1337 NZ LYS B 48 -10.708 10.829 3.398 1.00 0.00 N ATOM 0 H LYS B 48 -5.922 8.661 4.834 1.00 0.00 H new ATOM 0 HA LYS B 48 -6.987 7.345 7.221 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.039 8.337 6.602 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -7.787 9.552 6.444 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -8.394 9.939 4.315 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -8.066 8.272 3.887 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.310 7.579 4.339 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.653 8.999 5.309 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -10.018 9.146 2.326 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -11.652 8.996 2.942 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -11.696 11.150 3.361 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -10.304 11.057 4.329 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -10.160 11.309 2.656 1.00 0.00 H new ATOM 1351 N GLN B 49 -6.485 5.400 5.250 1.00 0.00 N ATOM 1352 CA GLN B 49 -6.522 4.132 4.531 1.00 0.00 C ATOM 1353 C GLN B 49 -7.945 3.631 4.275 1.00 0.00 C ATOM 1354 O GLN B 49 -8.635 3.170 5.184 1.00 0.00 O ATOM 1355 CB GLN B 49 -5.666 3.096 5.264 1.00 0.00 C ATOM 1356 CG GLN B 49 -4.433 3.744 5.911 1.00 0.00 C ATOM 1357 CD GLN B 49 -3.376 2.717 6.305 1.00 0.00 C ATOM 1358 OE1 GLN B 49 -3.493 1.526 6.021 1.00 0.00 O ATOM 1359 NE2 GLN B 49 -2.324 3.179 6.971 1.00 0.00 N ATOM 0 H GLN B 49 -5.539 5.627 5.558 1.00 0.00 H new ATOM 0 HA GLN B 49 -6.097 4.298 3.541 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -6.265 2.604 6.031 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -5.348 2.324 4.564 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -3.997 4.462 5.217 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -4.741 4.302 6.795 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -2.256 4.173 7.191 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -1.584 2.540 7.262 1.00 0.00 H new ATOM 1368 N LEU B 50 -8.365 3.738 3.012 1.00 0.00 N ATOM 1369 CA LEU B 50 -9.739 3.536 2.583 1.00 0.00 C ATOM 1370 C LEU B 50 -10.228 2.104 2.795 1.00 0.00 C ATOM 1371 O LEU B 50 -9.457 1.180 3.057 1.00 0.00 O ATOM 1372 CB LEU B 50 -9.878 3.912 1.101 1.00 0.00 C ATOM 1373 CG LEU B 50 -9.442 5.331 0.707 1.00 0.00 C ATOM 1374 CD1 LEU B 50 -10.009 6.374 1.666 1.00 0.00 C ATOM 1375 CD2 LEU B 50 -7.927 5.506 0.644 1.00 0.00 C ATOM 0 H LEU B 50 -7.737 3.974 2.244 1.00 0.00 H new ATOM 0 HA LEU B 50 -10.362 4.181 3.202 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -9.296 3.202 0.513 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -10.922 3.784 0.814 1.00 0.00 H new ATOM 0 HG LEU B 50 -9.843 5.481 -0.296 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -9.681 7.367 1.359 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -11.098 6.330 1.649 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -9.653 6.171 2.676 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -7.691 6.531 0.360 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -7.495 5.291 1.621 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -7.512 4.820 -0.095 1.00 0.00 H new ATOM 1387 N GLU B 51 -11.546 1.952 2.672 1.00 0.00 N ATOM 1388 CA GLU B 51 -12.276 0.700 2.805 1.00 0.00 C ATOM 1389 C GLU B 51 -12.172 -0.128 1.524 1.00 0.00 C ATOM 1390 O GLU B 51 -11.232 0.027 0.746 1.00 0.00 O ATOM 1391 CB GLU B 51 -13.729 1.036 3.127 1.00 0.00 C ATOM 1392 CG GLU B 51 -13.794 1.775 4.461 1.00 0.00 C ATOM 1393 CD GLU B 51 -13.392 0.877 5.632 1.00 0.00 C ATOM 1394 OE1 GLU B 51 -14.108 -0.122 5.867 1.00 0.00 O ATOM 1395 OE2 GLU B 51 -12.371 1.194 6.282 1.00 0.00 O ATOM 0 H GLU B 51 -12.160 2.740 2.467 1.00 0.00 H new ATOM 0 HA GLU B 51 -11.849 0.098 3.607 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -14.155 1.653 2.336 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -14.323 0.123 3.175 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -13.136 2.643 4.427 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -14.806 2.148 4.620 1.00 0.00 H new ATOM 1402 N ASP B 52 -13.142 -1.012 1.302 1.00 0.00 N ATOM 1403 CA ASP B 52 -13.151 -1.885 0.132 1.00 0.00 C ATOM 1404 C ASP B 52 -14.569 -2.069 -0.431 1.00 0.00 C ATOM 1405 O ASP B 52 -14.807 -2.978 -1.226 1.00 0.00 O ATOM 1406 CB ASP B 52 -12.500 -3.219 0.506 1.00 0.00 C ATOM 1407 CG ASP B 52 -12.014 -3.986 -0.722 1.00 0.00 C ATOM 1408 OD1 ASP B 52 -11.081 -3.474 -1.382 1.00 0.00 O ATOM 1409 OD2 ASP B 52 -12.570 -5.074 -0.986 1.00 0.00 O ATOM 0 H ASP B 52 -13.939 -1.143 1.925 1.00 0.00 H new ATOM 0 HA ASP B 52 -12.573 -1.422 -0.668 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -11.659 -3.036 1.175 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -13.217 -3.830 1.054 1.00 0.00 H new ATOM 1414 N GLY B 53 -15.513 -1.213 -0.021 1.00 0.00 N ATOM 1415 CA GLY B 53 -16.897 -1.269 -0.488 1.00 0.00 C ATOM 1416 C GLY B 53 -17.563 0.109 -0.504 1.00 0.00 C ATOM 1417 O GLY B 53 -18.741 0.228 -0.837 1.00 0.00 O ATOM 0 H GLY B 53 -15.335 -0.462 0.645 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -16.922 -1.693 -1.492 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -17.468 -1.938 0.156 1.00 0.00 H new ATOM 1421 N ARG B 54 -16.802 1.147 -0.143 1.00 0.00 N ATOM 1422 CA ARG B 54 -17.215 2.546 -0.148 1.00 0.00 C ATOM 1423 C ARG B 54 -17.148 3.119 -1.565 1.00 0.00 C ATOM 1424 O ARG B 54 -17.131 2.358 -2.529 1.00 0.00 O ATOM 1425 CB ARG B 54 -16.239 3.287 0.758 1.00 0.00 C ATOM 1426 CG ARG B 54 -16.506 3.060 2.239 1.00 0.00 C ATOM 1427 CD ARG B 54 -17.853 3.669 2.624 1.00 0.00 C ATOM 1428 NE ARG B 54 -17.830 4.161 4.004 1.00 0.00 N ATOM 1429 CZ ARG B 54 -18.250 3.481 5.073 1.00 0.00 C ATOM 1430 NH1 ARG B 54 -18.738 2.249 4.954 1.00 0.00 N ATOM 1431 NH2 ARG B 54 -18.184 4.038 6.279 1.00 0.00 N ATOM 0 H ARG B 54 -15.840 1.025 0.174 1.00 0.00 H new ATOM 0 HA ARG B 54 -18.242 2.650 0.201 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -15.223 2.968 0.525 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -16.294 4.355 0.545 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -16.504 1.992 2.458 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -15.711 3.509 2.834 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -18.093 4.488 1.946 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -18.639 2.922 2.513 1.00 0.00 H new ATOM 0 HE ARG B 54 -17.463 5.100 4.161 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -18.796 1.810 4.035 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -19.054 1.744 5.782 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -17.813 4.982 6.385 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -18.504 3.521 7.098 1.00 0.00 H new ATOM 1445 N THR B 55 -17.107 4.449 -1.705 1.00 0.00 N ATOM 1446 CA THR B 55 -17.014 5.078 -3.021 1.00 0.00 C ATOM 1447 C THR B 55 -16.157 6.327 -2.954 1.00 0.00 C ATOM 1448 O THR B 55 -15.944 6.879 -1.878 1.00 0.00 O ATOM 1449 CB THR B 55 -18.395 5.459 -3.548 1.00 0.00 C ATOM 1450 OG1 THR B 55 -19.075 6.246 -2.595 1.00 0.00 O ATOM 1451 CG2 THR B 55 -19.219 4.214 -3.857 1.00 0.00 C ATOM 0 H THR B 55 -17.137 5.105 -0.925 1.00 0.00 H new ATOM 0 HA THR B 55 -16.560 4.353 -3.697 1.00 0.00 H new ATOM 0 HB THR B 55 -18.263 6.030 -4.467 1.00 0.00 H new ATOM 0 HG1 THR B 55 -19.959 6.488 -2.941 1.00 0.00 H new ATOM 0 HG21 THR B 55 -20.199 4.510 -4.231 1.00 0.00 H new ATOM 0 HG22 THR B 55 -18.707 3.617 -4.612 1.00 0.00 H new ATOM 0 HG23 THR B 55 -19.340 3.623 -2.949 1.00 0.00 H new ATOM 1459 N LEU B 56 -15.658 6.789 -4.106 1.00 0.00 N ATOM 1460 CA LEU B 56 -14.782 7.955 -4.137 1.00 0.00 C ATOM 1461 C LEU B 56 -15.520 9.189 -3.625 1.00 0.00 C ATOM 1462 O LEU B 56 -14.915 10.083 -3.032 1.00 0.00 O ATOM 1463 CB LEU B 56 -14.262 8.173 -5.556 1.00 0.00 C ATOM 1464 CG LEU B 56 -13.391 7.003 -6.025 1.00 0.00 C ATOM 1465 CD1 LEU B 56 -12.907 7.291 -7.440 1.00 0.00 C ATOM 1466 CD2 LEU B 56 -12.166 6.817 -5.133 1.00 0.00 C ATOM 0 H LEU B 56 -15.846 6.375 -5.019 1.00 0.00 H new ATOM 0 HA LEU B 56 -13.930 7.781 -3.480 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.104 8.296 -6.237 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -13.683 9.096 -5.594 1.00 0.00 H new ATOM 0 HG LEU B 56 -13.993 6.096 -5.983 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.285 6.466 -7.787 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -13.765 7.402 -8.103 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -12.324 8.212 -7.445 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -11.574 5.978 -5.498 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -11.561 7.724 -5.152 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -12.487 6.617 -4.111 1.00 0.00 H new ATOM 1478 N SER B 57 -16.834 9.234 -3.849 1.00 0.00 N ATOM 1479 CA SER B 57 -17.692 10.292 -3.343 1.00 0.00 C ATOM 1480 C SER B 57 -17.732 10.282 -1.816 1.00 0.00 C ATOM 1481 O SER B 57 -17.873 11.330 -1.188 1.00 0.00 O ATOM 1482 CB SER B 57 -19.102 10.070 -3.880 1.00 0.00 C ATOM 1483 OG SER B 57 -19.908 11.203 -3.639 1.00 0.00 O ATOM 0 H SER B 57 -17.331 8.528 -4.392 1.00 0.00 H new ATOM 0 HA SER B 57 -17.298 11.254 -3.670 1.00 0.00 H new ATOM 0 HB2 SER B 57 -19.062 9.866 -4.950 1.00 0.00 H new ATOM 0 HB3 SER B 57 -19.544 9.194 -3.405 1.00 0.00 H new ATOM 0 HG SER B 57 -20.809 11.045 -3.991 1.00 0.00 H new ATOM 1489 N ASP B 58 -17.601 9.091 -1.220 1.00 0.00 N ATOM 1490 CA ASP B 58 -17.623 8.934 0.229 1.00 0.00 C ATOM 1491 C ASP B 58 -16.448 9.646 0.897 1.00 0.00 C ATOM 1492 O ASP B 58 -16.480 9.883 2.104 1.00 0.00 O ATOM 1493 CB ASP B 58 -17.618 7.451 0.603 1.00 0.00 C ATOM 1494 CG ASP B 58 -17.952 7.254 2.079 1.00 0.00 C ATOM 1495 OD1 ASP B 58 -19.112 7.543 2.452 1.00 0.00 O ATOM 1496 OD2 ASP B 58 -17.051 6.815 2.827 1.00 0.00 O ATOM 0 H ASP B 58 -17.478 8.216 -1.730 1.00 0.00 H new ATOM 0 HA ASP B 58 -18.541 9.395 0.593 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.342 6.916 -0.011 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.639 7.022 0.388 1.00 0.00 H new ATOM 1501 N TYR B 59 -15.409 9.993 0.127 1.00 0.00 N ATOM 1502 CA TYR B 59 -14.245 10.686 0.652 1.00 0.00 C ATOM 1503 C TYR B 59 -14.106 12.080 0.041 1.00 0.00 C ATOM 1504 O TYR B 59 -13.084 12.735 0.235 1.00 0.00 O ATOM 1505 CB TYR B 59 -12.997 9.861 0.339 1.00 0.00 C ATOM 1506 CG TYR B 59 -13.204 8.372 0.209 1.00 0.00 C ATOM 1507 CD1 TYR B 59 -13.461 7.572 1.329 1.00 0.00 C ATOM 1508 CD2 TYR B 59 -13.129 7.791 -1.060 1.00 0.00 C ATOM 1509 CE1 TYR B 59 -13.611 6.190 1.187 1.00 0.00 C ATOM 1510 CE2 TYR B 59 -13.276 6.408 -1.216 1.00 0.00 C ATOM 1511 CZ TYR B 59 -13.516 5.608 -0.087 1.00 0.00 C ATOM 1512 OH TYR B 59 -13.656 4.266 -0.219 1.00 0.00 O ATOM 0 H TYR B 59 -15.360 9.798 -0.873 1.00 0.00 H new ATOM 0 HA TYR B 59 -14.364 10.803 1.729 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -12.565 10.230 -0.591 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -12.262 10.038 1.124 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -13.544 8.025 2.306 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -12.957 8.413 -1.926 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -13.799 5.573 2.053 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -13.205 5.960 -2.196 1.00 0.00 H new ATOM 0 HH TYR B 59 -14.295 4.073 -0.936 1.00 0.00 H new ATOM 1522 N ASN B 60 -15.127 12.532 -0.696 1.00 0.00 N ATOM 1523 CA ASN B 60 -15.098 13.771 -1.457 1.00 0.00 C ATOM 1524 C ASN B 60 -13.848 13.858 -2.335 1.00 0.00 C ATOM 1525 O ASN B 60 -13.346 14.948 -2.615 1.00 0.00 O ATOM 1526 CB ASN B 60 -15.262 14.960 -0.510 1.00 0.00 C ATOM 1527 CG ASN B 60 -15.589 16.233 -1.280 1.00 0.00 C ATOM 1528 OD1 ASN B 60 -16.558 16.280 -2.031 1.00 0.00 O ATOM 1529 ND2 ASN B 60 -14.784 17.276 -1.103 1.00 0.00 N ATOM 0 H ASN B 60 -16.012 12.031 -0.777 1.00 0.00 H new ATOM 0 HA ASN B 60 -15.939 13.792 -2.150 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -16.056 14.751 0.207 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -14.345 15.103 0.062 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -14.964 18.149 -1.599 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -13.987 17.203 -0.471 1.00 0.00 H new ATOM 1536 N ILE B 61 -13.341 12.701 -2.763 1.00 0.00 N ATOM 1537 CA ILE B 61 -12.211 12.611 -3.675 1.00 0.00 C ATOM 1538 C ILE B 61 -12.630 13.094 -5.061 1.00 0.00 C ATOM 1539 O ILE B 61 -13.695 12.733 -5.561 1.00 0.00 O ATOM 1540 CB ILE B 61 -11.710 11.160 -3.688 1.00 0.00 C ATOM 1541 CG1 ILE B 61 -10.661 11.030 -2.577 1.00 0.00 C ATOM 1542 CG2 ILE B 61 -11.132 10.759 -5.046 1.00 0.00 C ATOM 1543 CD1 ILE B 61 -10.210 9.585 -2.369 1.00 0.00 C ATOM 0 H ILE B 61 -13.711 11.793 -2.480 1.00 0.00 H new ATOM 0 HA ILE B 61 -11.392 13.252 -3.348 1.00 0.00 H new ATOM 0 HB ILE B 61 -12.545 10.481 -3.512 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -9.796 11.646 -2.824 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -11.073 11.417 -1.645 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.791 9.725 -5.005 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.901 10.858 -5.812 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.291 11.409 -5.290 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -9.467 9.547 -1.572 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -11.068 8.972 -2.095 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -9.772 9.204 -3.292 1.00 0.00 H new ATOM 1555 N GLN B 62 -11.778 13.917 -5.679 1.00 0.00 N ATOM 1556 CA GLN B 62 -11.959 14.429 -7.025 1.00 0.00 C ATOM 1557 C GLN B 62 -10.969 13.738 -7.964 1.00 0.00 C ATOM 1558 O GLN B 62 -10.347 12.750 -7.582 1.00 0.00 O ATOM 1559 CB GLN B 62 -11.759 15.942 -7.015 1.00 0.00 C ATOM 1560 CG GLN B 62 -12.529 16.569 -5.856 1.00 0.00 C ATOM 1561 CD GLN B 62 -14.028 16.301 -5.928 1.00 0.00 C ATOM 1562 OE1 GLN B 62 -14.636 16.356 -6.996 1.00 0.00 O ATOM 1563 NE2 GLN B 62 -14.632 16.001 -4.782 1.00 0.00 N ATOM 0 H GLN B 62 -10.921 14.250 -5.237 1.00 0.00 H new ATOM 0 HA GLN B 62 -12.967 14.220 -7.382 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -10.698 16.175 -6.924 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -12.099 16.367 -7.959 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -12.140 16.180 -4.915 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -12.357 17.645 -5.852 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -14.094 15.965 -3.916 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -15.633 15.807 -4.769 1.00 0.00 H new ATOM 1572 N LYS B 63 -10.821 14.253 -9.188 1.00 0.00 N ATOM 1573 CA LYS B 63 -9.942 13.675 -10.198 1.00 0.00 C ATOM 1574 C LYS B 63 -8.468 13.647 -9.758 1.00 0.00 C ATOM 1575 O LYS B 63 -8.033 12.709 -9.099 1.00 0.00 O ATOM 1576 CB LYS B 63 -10.202 14.353 -11.549 1.00 0.00 C ATOM 1577 CG LYS B 63 -9.994 15.870 -11.566 1.00 0.00 C ATOM 1578 CD LYS B 63 -10.829 16.475 -12.689 1.00 0.00 C ATOM 1579 CE LYS B 63 -12.292 16.577 -12.255 1.00 0.00 C ATOM 1580 NZ LYS B 63 -13.119 17.213 -13.299 1.00 0.00 N ATOM 0 H LYS B 63 -11.313 15.089 -9.504 1.00 0.00 H new ATOM 0 HA LYS B 63 -10.181 12.619 -10.324 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -9.547 13.904 -12.295 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -11.226 14.139 -11.854 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -10.285 16.300 -10.608 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -8.940 16.103 -11.714 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -10.447 17.463 -12.946 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -10.749 15.860 -13.585 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -12.679 15.581 -12.038 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -12.360 17.154 -11.333 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.106 17.268 -12.975 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -12.763 18.172 -13.488 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -13.072 16.648 -14.171 1.00 0.00 H new ATOM 1594 N GLU B 64 -7.676 14.659 -10.104 1.00 0.00 N ATOM 1595 CA GLU B 64 -6.256 14.740 -9.772 1.00 0.00 C ATOM 1596 C GLU B 64 -5.990 14.873 -8.265 1.00 0.00 C ATOM 1597 O GLU B 64 -4.921 15.337 -7.871 1.00 0.00 O ATOM 1598 CB GLU B 64 -5.624 15.893 -10.555 1.00 0.00 C ATOM 1599 CG GLU B 64 -6.298 17.222 -10.217 1.00 0.00 C ATOM 1600 CD GLU B 64 -5.651 18.373 -10.984 1.00 0.00 C ATOM 1601 OE1 GLU B 64 -6.089 18.626 -12.128 1.00 0.00 O ATOM 1602 OE2 GLU B 64 -4.722 18.993 -10.421 1.00 0.00 O ATOM 0 H GLU B 64 -8.011 15.463 -10.635 1.00 0.00 H new ATOM 0 HA GLU B 64 -5.792 13.797 -10.063 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -4.560 15.953 -10.325 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -5.709 15.700 -11.624 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -7.359 17.168 -10.461 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -6.226 17.408 -9.145 1.00 0.00 H new ATOM 1609 N SER B 65 -6.943 14.473 -7.415 1.00 0.00 N ATOM 1610 CA SER B 65 -6.799 14.528 -5.964 1.00 0.00 C ATOM 1611 C SER B 65 -5.588 13.730 -5.481 1.00 0.00 C ATOM 1612 O SER B 65 -5.133 13.940 -4.358 1.00 0.00 O ATOM 1613 CB SER B 65 -8.065 13.978 -5.312 1.00 0.00 C ATOM 1614 OG SER B 65 -9.103 14.926 -5.429 1.00 0.00 O ATOM 0 H SER B 65 -7.841 14.100 -7.722 1.00 0.00 H new ATOM 0 HA SER B 65 -6.645 15.569 -5.680 1.00 0.00 H new ATOM 0 HB2 SER B 65 -8.356 13.043 -5.790 1.00 0.00 H new ATOM 0 HB3 SER B 65 -7.879 13.755 -4.262 1.00 0.00 H new ATOM 0 HG SER B 65 -9.413 15.184 -4.536 1.00 0.00 H new ATOM 1620 N THR B 66 -5.074 12.828 -6.325 1.00 0.00 N ATOM 1621 CA THR B 66 -3.913 11.982 -6.054 1.00 0.00 C ATOM 1622 C THR B 66 -4.157 11.005 -4.902 1.00 0.00 C ATOM 1623 O THR B 66 -4.888 11.299 -3.959 1.00 0.00 O ATOM 1624 CB THR B 66 -2.688 12.869 -5.785 1.00 0.00 C ATOM 1625 OG1 THR B 66 -2.507 13.761 -6.865 1.00 0.00 O ATOM 1626 CG2 THR B 66 -1.393 12.071 -5.625 1.00 0.00 C ATOM 0 H THR B 66 -5.472 12.663 -7.249 1.00 0.00 H new ATOM 0 HA THR B 66 -3.728 11.368 -6.935 1.00 0.00 H new ATOM 0 HB THR B 66 -2.887 13.393 -4.850 1.00 0.00 H new ATOM 0 HG1 THR B 66 -1.727 14.328 -6.693 1.00 0.00 H new ATOM 0 HG21 THR B 66 -0.565 12.755 -5.437 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.492 11.382 -4.786 1.00 0.00 H new ATOM 0 HG23 THR B 66 -1.198 11.507 -6.537 1.00 0.00 H new ATOM 1634 N LEU B 67 -3.531 9.829 -4.985 1.00 0.00 N ATOM 1635 CA LEU B 67 -3.593 8.789 -3.963 1.00 0.00 C ATOM 1636 C LEU B 67 -2.254 8.054 -3.921 1.00 0.00 C ATOM 1637 O LEU B 67 -1.349 8.355 -4.699 1.00 0.00 O ATOM 1638 CB LEU B 67 -4.722 7.784 -4.250 1.00 0.00 C ATOM 1639 CG LEU B 67 -6.112 8.313 -3.868 1.00 0.00 C ATOM 1640 CD1 LEU B 67 -6.822 8.933 -5.072 1.00 0.00 C ATOM 1641 CD2 LEU B 67 -6.977 7.160 -3.367 1.00 0.00 C ATOM 0 H LEU B 67 -2.954 9.570 -5.785 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.800 9.260 -3.002 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -4.715 7.532 -5.310 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -4.528 6.862 -3.702 1.00 0.00 H new ATOM 0 HG LEU B 67 -5.975 9.070 -3.096 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -7.803 9.298 -4.768 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -6.229 9.763 -5.456 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -6.940 8.181 -5.852 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -7.963 7.536 -3.096 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -7.077 6.412 -4.153 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -6.509 6.707 -2.493 1.00 0.00 H new ATOM 1653 N HIS B 68 -2.131 7.084 -3.015 1.00 0.00 N ATOM 1654 CA HIS B 68 -0.928 6.287 -2.863 1.00 0.00 C ATOM 1655 C HIS B 68 -1.308 4.827 -2.637 1.00 0.00 C ATOM 1656 O HIS B 68 -2.452 4.531 -2.296 1.00 0.00 O ATOM 1657 CB HIS B 68 -0.139 6.798 -1.656 1.00 0.00 C ATOM 1658 CG HIS B 68 0.274 8.242 -1.770 1.00 0.00 C ATOM 1659 ND1 HIS B 68 -0.500 9.342 -1.389 1.00 0.00 N ATOM 1660 CD2 HIS B 68 1.470 8.678 -2.259 1.00 0.00 C ATOM 1661 CE1 HIS B 68 0.256 10.417 -1.663 1.00 0.00 C ATOM 1662 NE2 HIS B 68 1.441 10.049 -2.182 1.00 0.00 N ATOM 0 H HIS B 68 -2.874 6.832 -2.363 1.00 0.00 H new ATOM 0 HA HIS B 68 -0.319 6.367 -3.764 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -0.744 6.672 -0.758 1.00 0.00 H new ATOM 0 HB3 HIS B 68 0.752 6.183 -1.529 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.279 8.067 -2.632 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -0.046 11.439 -1.490 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.189 10.680 -2.469 1.00 0.00 H new ATOM 1670 N LEU B 69 -0.346 3.923 -2.825 1.00 0.00 N ATOM 1671 CA LEU B 69 -0.520 2.508 -2.502 1.00 0.00 C ATOM 1672 C LEU B 69 0.568 2.015 -1.551 1.00 0.00 C ATOM 1673 O LEU B 69 1.609 2.651 -1.394 1.00 0.00 O ATOM 1674 CB LEU B 69 -0.582 1.626 -3.757 1.00 0.00 C ATOM 1675 CG LEU B 69 0.467 1.962 -4.816 1.00 0.00 C ATOM 1676 CD1 LEU B 69 0.811 0.709 -5.615 1.00 0.00 C ATOM 1677 CD2 LEU B 69 -0.135 2.967 -5.784 1.00 0.00 C ATOM 0 H LEU B 69 0.573 4.151 -3.204 1.00 0.00 H new ATOM 0 HA LEU B 69 -1.482 2.422 -1.997 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.461 0.584 -3.461 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -1.573 1.718 -4.202 1.00 0.00 H new ATOM 0 HG LEU B 69 1.359 2.357 -4.329 1.00 0.00 H new ATOM 0 HD11 LEU B 69 1.559 0.952 -6.369 1.00 0.00 H new ATOM 0 HD12 LEU B 69 1.207 -0.053 -4.944 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -0.087 0.331 -6.104 1.00 0.00 H new ATOM 0 HD21 LEU B 69 0.599 3.220 -6.549 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -1.017 2.534 -6.256 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -0.420 3.869 -5.242 1.00 0.00 H new ATOM 1689 N VAL B 70 0.298 0.865 -0.927 1.00 0.00 N ATOM 1690 CA VAL B 70 1.149 0.235 0.078 1.00 0.00 C ATOM 1691 C VAL B 70 1.057 -1.282 -0.097 1.00 0.00 C ATOM 1692 O VAL B 70 0.511 -1.980 0.753 1.00 0.00 O ATOM 1693 CB VAL B 70 0.706 0.657 1.491 1.00 0.00 C ATOM 1694 CG1 VAL B 70 1.677 0.131 2.547 1.00 0.00 C ATOM 1695 CG2 VAL B 70 0.622 2.177 1.626 1.00 0.00 C ATOM 0 H VAL B 70 -0.550 0.331 -1.117 1.00 0.00 H new ATOM 0 HA VAL B 70 2.184 0.553 -0.050 1.00 0.00 H new ATOM 0 HB VAL B 70 -0.284 0.228 1.649 1.00 0.00 H new ATOM 0 HG11 VAL B 70 1.342 0.442 3.536 1.00 0.00 H new ATOM 0 HG12 VAL B 70 1.710 -0.958 2.501 1.00 0.00 H new ATOM 0 HG13 VAL B 70 2.673 0.532 2.358 1.00 0.00 H new ATOM 0 HG21 VAL B 70 0.306 2.436 2.637 1.00 0.00 H new ATOM 0 HG22 VAL B 70 1.601 2.614 1.428 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -0.101 2.567 0.909 1.00 0.00 H new ATOM 1705 N LEU B 71 1.586 -1.798 -1.213 1.00 0.00 N ATOM 1706 CA LEU B 71 1.495 -3.214 -1.542 1.00 0.00 C ATOM 1707 C LEU B 71 1.956 -4.095 -0.381 1.00 0.00 C ATOM 1708 O LEU B 71 2.891 -3.747 0.338 1.00 0.00 O ATOM 1709 CB LEU B 71 2.323 -3.501 -2.798 1.00 0.00 C ATOM 1710 CG LEU B 71 1.938 -2.600 -3.975 1.00 0.00 C ATOM 1711 CD1 LEU B 71 2.648 -3.083 -5.238 1.00 0.00 C ATOM 1712 CD2 LEU B 71 0.429 -2.616 -4.214 1.00 0.00 C ATOM 0 H LEU B 71 2.086 -1.243 -1.907 1.00 0.00 H new ATOM 0 HA LEU B 71 0.449 -3.455 -1.733 1.00 0.00 H new ATOM 0 HB2 LEU B 71 3.380 -3.364 -2.571 1.00 0.00 H new ATOM 0 HB3 LEU B 71 2.191 -4.544 -3.085 1.00 0.00 H new ATOM 0 HG LEU B 71 2.240 -1.580 -3.736 1.00 0.00 H new ATOM 0 HD11 LEU B 71 2.375 -2.442 -6.077 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.727 -3.043 -5.087 1.00 0.00 H new ATOM 0 HD13 LEU B 71 2.350 -4.109 -5.453 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.187 -1.967 -5.056 1.00 0.00 H new ATOM 0 HD22 LEU B 71 0.107 -3.633 -4.436 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -0.085 -2.259 -3.321 1.00 0.00 H new ATOM 1724 N ARG B 72 1.291 -5.244 -0.204 1.00 0.00 N ATOM 1725 CA ARG B 72 1.599 -6.159 0.888 1.00 0.00 C ATOM 1726 C ARG B 72 2.829 -7.017 0.593 1.00 0.00 C ATOM 1727 O ARG B 72 3.323 -7.680 1.501 1.00 0.00 O ATOM 1728 CB ARG B 72 0.382 -7.028 1.200 1.00 0.00 C ATOM 1729 CG ARG B 72 -0.659 -6.189 1.945 1.00 0.00 C ATOM 1730 CD ARG B 72 -1.606 -7.075 2.753 1.00 0.00 C ATOM 1731 NE ARG B 72 -2.314 -8.037 1.906 1.00 0.00 N ATOM 1732 CZ ARG B 72 -3.215 -8.908 2.371 1.00 0.00 C ATOM 1733 NH1 ARG B 72 -3.497 -8.970 3.670 1.00 0.00 N ATOM 1734 NH2 ARG B 72 -3.842 -9.729 1.535 1.00 0.00 N ATOM 0 H ARG B 72 0.533 -5.558 -0.810 1.00 0.00 H new ATOM 0 HA ARG B 72 1.841 -5.561 1.766 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -0.044 -7.422 0.277 1.00 0.00 H new ATOM 0 HB3 ARG B 72 0.678 -7.884 1.806 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -0.156 -5.488 2.611 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -1.231 -5.597 1.231 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -1.040 -7.611 3.515 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -2.330 -6.450 3.275 1.00 0.00 H new ATOM 0 HE ARG B 72 -2.108 -8.043 0.907 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -3.023 -8.348 4.325 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -4.187 -9.640 4.011 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -3.636 -9.695 0.537 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -4.529 -10.393 1.892 1.00 0.00 H new ATOM 1748 N LEU B 73 3.307 -6.997 -0.655 1.00 0.00 N ATOM 1749 CA LEU B 73 4.467 -7.721 -1.178 1.00 0.00 C ATOM 1750 C LEU B 73 4.459 -9.235 -0.923 1.00 0.00 C ATOM 1751 O LEU B 73 4.394 -10.003 -1.881 1.00 0.00 O ATOM 1752 CB LEU B 73 5.756 -7.079 -0.652 1.00 0.00 C ATOM 1753 CG LEU B 73 5.859 -5.584 -0.976 1.00 0.00 C ATOM 1754 CD1 LEU B 73 7.156 -5.030 -0.391 1.00 0.00 C ATOM 1755 CD2 LEU B 73 5.858 -5.332 -2.484 1.00 0.00 C ATOM 0 H LEU B 73 2.860 -6.433 -1.378 1.00 0.00 H new ATOM 0 HA LEU B 73 4.413 -7.630 -2.263 1.00 0.00 H new ATOM 0 HB2 LEU B 73 5.808 -7.215 0.428 1.00 0.00 H new ATOM 0 HB3 LEU B 73 6.614 -7.597 -1.080 1.00 0.00 H new ATOM 0 HG LEU B 73 4.992 -5.087 -0.541 1.00 0.00 H new ATOM 0 HD11 LEU B 73 7.233 -3.967 -0.619 1.00 0.00 H new ATOM 0 HD12 LEU B 73 7.157 -5.170 0.690 1.00 0.00 H new ATOM 0 HD13 LEU B 73 8.005 -5.557 -0.826 1.00 0.00 H new ATOM 0 HD21 LEU B 73 5.932 -4.261 -2.674 1.00 0.00 H new ATOM 0 HD22 LEU B 73 6.708 -5.841 -2.939 1.00 0.00 H new ATOM 0 HD23 LEU B 73 4.933 -5.714 -2.916 1.00 0.00 H new