USER MOD reduce.3.24.130724 H: found=0, std=0, add=825, rem=0, adj=23 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 Set 1.1: B 6 LYS NZ :NH3+ -173:sc= 1.77 (180deg=0.976) USER MOD Set 1.2: B 12 THR OG1 : rot 180:sc= 0.624 USER MOD Single : A 688 GLN :FLIP amide:sc= -1.51 F(o=-4.8,f=-1.5) USER MOD Single : A 691 TYR OH : rot 180:sc= 0 USER MOD Single : A 698 GLN : amide:sc= 0.784 K(o=0.78,f=-0.75) USER MOD Single : A 699 LYS NZ :NH3+ -171:sc= 1.25 (180deg=1.16) USER MOD Single : A 702 MET CE :methyl 148:sc= -2.12 (180deg=-6.17!) USER MOD Single : B 1 MET CE :methyl -154:sc= 0 (180deg=-0.331) USER MOD Single : B 1 MET N :NH3+ -151:sc= 1.45 (180deg=0.481) USER MOD Single : B 2 GLN : amide:sc= -1.51 X(o=-1.5,f=-1.9) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ -164:sc= 1.23 (180deg=1) USER MOD Single : B 14 THR OG1 : rot 180:sc= -0.012 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 76:sc= 0.799 USER MOD Single : B 25 ASN : amide:sc= -0.801! X(o=-0.8!,f=-0.37) USER MOD Single : B 27 LYS NZ :NH3+ -133:sc= 0.249 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -164:sc= 1.15 (180deg=0.937) USER MOD Single : B 31 GLN : amide:sc= -0.666 K(o=-0.67,f=-1.6) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= 0.552 K(o=0.55,f=-0.31) USER MOD Single : B 41 GLN : amide:sc= 0.207 K(o=0.21,f=-4.7!) USER MOD Single : B 48 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000924) USER MOD Single : B 49 GLN :FLIP amide:sc= -0.766 F(o=-3.3!,f=-0.77) 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 -30:sc= -2.6 USER MOD Single : B 60 ASN : amide:sc= -0.279 X(o=-0.28,f=-0.35) USER MOD Single : B 62 GLN : amide:sc= 1.07 K(o=1.1,f=-0.18) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot -120:sc= 0.658 USER MOD Single : B 66 THR OG1 : rot 60:sc= 0.174 USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 63 N LEU A 679 17.658 -2.958 4.436 1.00 0.00 N ATOM 64 CA LEU A 679 16.376 -3.087 3.793 1.00 0.00 C ATOM 65 C LEU A 679 16.570 -3.377 2.297 1.00 0.00 C ATOM 66 O LEU A 679 17.698 -3.354 1.807 1.00 0.00 O ATOM 67 CB LEU A 679 15.595 -1.795 4.044 1.00 0.00 C ATOM 68 CG LEU A 679 15.515 -1.300 5.495 1.00 0.00 C ATOM 69 CD1 LEU A 679 15.037 -2.409 6.433 1.00 0.00 C ATOM 70 CD2 LEU A 679 16.812 -0.709 6.043 1.00 0.00 C ATOM 0 HA LEU A 679 15.808 -3.923 4.201 1.00 0.00 H new ATOM 0 HB2 LEU A 679 16.043 -1.005 3.441 1.00 0.00 H new ATOM 0 HB3 LEU A 679 14.578 -1.937 3.678 1.00 0.00 H new ATOM 0 HG LEU A 679 14.790 -0.487 5.462 1.00 0.00 H new ATOM 0 HD11 LEU A 679 14.991 -2.028 7.453 1.00 0.00 H new ATOM 0 HD12 LEU A 679 14.046 -2.744 6.125 1.00 0.00 H new ATOM 0 HD13 LEU A 679 15.733 -3.247 6.390 1.00 0.00 H new ATOM 0 HD21 LEU A 679 16.658 -0.387 7.073 1.00 0.00 H new ATOM 0 HD22 LEU A 679 17.597 -1.464 6.012 1.00 0.00 H new ATOM 0 HD23 LEU A 679 17.107 0.147 5.436 1.00 0.00 H new ATOM 82 N PRO A 680 15.484 -3.649 1.558 1.00 0.00 N ATOM 83 CA PRO A 680 15.487 -4.066 0.159 1.00 0.00 C ATOM 84 C PRO A 680 16.091 -3.071 -0.834 1.00 0.00 C ATOM 85 O PRO A 680 15.996 -3.273 -2.043 1.00 0.00 O ATOM 86 CB PRO A 680 14.020 -4.356 -0.187 1.00 0.00 C ATOM 87 CG PRO A 680 13.361 -4.583 1.173 1.00 0.00 C ATOM 88 CD PRO A 680 14.133 -3.615 2.060 1.00 0.00 C ATOM 0 HA PRO A 680 16.140 -4.933 0.062 1.00 0.00 H new ATOM 0 HB2 PRO A 680 13.562 -3.522 -0.719 1.00 0.00 H new ATOM 0 HB3 PRO A 680 13.926 -5.233 -0.828 1.00 0.00 H new ATOM 0 HG2 PRO A 680 12.295 -4.358 1.153 1.00 0.00 H new ATOM 0 HG3 PRO A 680 13.462 -5.615 1.509 1.00 0.00 H new ATOM 0 HD2 PRO A 680 13.716 -2.610 2.004 1.00 0.00 H new ATOM 0 HD3 PRO A 680 14.092 -3.919 3.106 1.00 0.00 H new ATOM 96 N PHE A 681 16.708 -2.003 -0.336 1.00 0.00 N ATOM 97 CA PHE A 681 17.348 -0.988 -1.156 1.00 0.00 C ATOM 98 C PHE A 681 18.526 -1.592 -1.928 1.00 0.00 C ATOM 99 O PHE A 681 18.989 -2.681 -1.588 1.00 0.00 O ATOM 100 CB PHE A 681 17.887 0.122 -0.244 1.00 0.00 C ATOM 101 CG PHE A 681 16.856 0.831 0.605 1.00 0.00 C ATOM 102 CD1 PHE A 681 15.706 1.380 0.020 1.00 0.00 C ATOM 103 CD2 PHE A 681 17.060 0.951 1.986 1.00 0.00 C ATOM 104 CE1 PHE A 681 14.764 2.045 0.816 1.00 0.00 C ATOM 105 CE2 PHE A 681 16.121 1.621 2.782 1.00 0.00 C ATOM 106 CZ PHE A 681 14.974 2.164 2.197 1.00 0.00 C ATOM 0 H PHE A 681 16.776 -1.819 0.665 1.00 0.00 H new ATOM 0 HA PHE A 681 16.617 -0.591 -1.860 1.00 0.00 H new ATOM 0 HB2 PHE A 681 18.640 -0.309 0.416 1.00 0.00 H new ATOM 0 HB3 PHE A 681 18.392 0.863 -0.864 1.00 0.00 H new ATOM 0 HD1 PHE A 681 15.546 1.290 -1.044 1.00 0.00 H new ATOM 0 HD2 PHE A 681 17.944 0.526 2.439 1.00 0.00 H new ATOM 0 HE1 PHE A 681 13.877 2.466 0.366 1.00 0.00 H new ATOM 0 HE2 PHE A 681 16.284 1.717 3.845 1.00 0.00 H new ATOM 0 HZ PHE A 681 14.248 2.677 2.810 1.00 0.00 H new ATOM 116 N PRO A 682 19.033 -0.905 -2.962 1.00 0.00 N ATOM 117 CA PRO A 682 18.465 0.280 -3.594 1.00 0.00 C ATOM 118 C PRO A 682 17.143 0.085 -4.356 1.00 0.00 C ATOM 119 O PRO A 682 16.334 1.012 -4.350 1.00 0.00 O ATOM 120 CB PRO A 682 19.527 0.746 -4.596 1.00 0.00 C ATOM 121 CG PRO A 682 20.815 0.052 -4.162 1.00 0.00 C ATOM 122 CD PRO A 682 20.293 -1.255 -3.580 1.00 0.00 C ATOM 0 HA PRO A 682 18.218 0.985 -2.800 1.00 0.00 H new ATOM 0 HB2 PRO A 682 19.255 0.471 -5.615 1.00 0.00 H new ATOM 0 HB3 PRO A 682 19.638 1.830 -4.577 1.00 0.00 H new ATOM 0 HG2 PRO A 682 21.490 -0.116 -5.001 1.00 0.00 H new ATOM 0 HG3 PRO A 682 21.364 0.636 -3.424 1.00 0.00 H new ATOM 0 HD2 PRO A 682 20.157 -2.008 -4.356 1.00 0.00 H new ATOM 0 HD3 PRO A 682 20.989 -1.670 -2.852 1.00 0.00 H new ATOM 130 N PRO A 683 16.879 -1.060 -5.012 1.00 0.00 N ATOM 131 CA PRO A 683 15.748 -1.189 -5.919 1.00 0.00 C ATOM 132 C PRO A 683 14.402 -1.364 -5.208 1.00 0.00 C ATOM 133 O PRO A 683 14.320 -1.391 -3.983 1.00 0.00 O ATOM 134 CB PRO A 683 16.061 -2.419 -6.769 1.00 0.00 C ATOM 135 CG PRO A 683 16.814 -3.309 -5.792 1.00 0.00 C ATOM 136 CD PRO A 683 17.641 -2.297 -5.005 1.00 0.00 C ATOM 0 HA PRO A 683 15.634 -0.275 -6.503 1.00 0.00 H new ATOM 0 HB2 PRO A 683 15.155 -2.898 -7.139 1.00 0.00 H new ATOM 0 HB3 PRO A 683 16.667 -2.168 -7.639 1.00 0.00 H new ATOM 0 HG2 PRO A 683 16.137 -3.870 -5.148 1.00 0.00 H new ATOM 0 HG3 PRO A 683 17.442 -4.037 -6.305 1.00 0.00 H new ATOM 0 HD2 PRO A 683 17.813 -2.643 -3.986 1.00 0.00 H new ATOM 0 HD3 PRO A 683 18.620 -2.154 -5.462 1.00 0.00 H new ATOM 144 N ASP A 684 13.353 -1.485 -6.032 1.00 0.00 N ATOM 145 CA ASP A 684 11.959 -1.737 -5.673 1.00 0.00 C ATOM 146 C ASP A 684 11.275 -0.632 -4.860 1.00 0.00 C ATOM 147 O ASP A 684 10.053 -0.499 -4.956 1.00 0.00 O ATOM 148 CB ASP A 684 11.835 -3.093 -4.974 1.00 0.00 C ATOM 149 CG ASP A 684 12.328 -4.234 -5.860 1.00 0.00 C ATOM 150 OD1 ASP A 684 11.739 -4.411 -6.952 1.00 0.00 O ATOM 151 OD2 ASP A 684 13.286 -4.924 -5.443 1.00 0.00 O ATOM 0 H ASP A 684 13.470 -1.402 -7.042 1.00 0.00 H new ATOM 0 HA ASP A 684 11.415 -1.746 -6.618 1.00 0.00 H new ATOM 0 HB2 ASP A 684 12.409 -3.078 -4.047 1.00 0.00 H new ATOM 0 HB3 ASP A 684 10.794 -3.268 -4.702 1.00 0.00 H new ATOM 156 N ILE A 685 12.014 0.154 -4.074 1.00 0.00 N ATOM 157 CA ILE A 685 11.432 1.224 -3.270 1.00 0.00 C ATOM 158 C ILE A 685 12.449 2.313 -2.961 1.00 0.00 C ATOM 159 O ILE A 685 13.635 2.186 -3.259 1.00 0.00 O ATOM 160 CB ILE A 685 10.843 0.693 -1.945 1.00 0.00 C ATOM 161 CG1 ILE A 685 11.544 -0.548 -1.385 1.00 0.00 C ATOM 162 CG2 ILE A 685 9.352 0.423 -2.127 1.00 0.00 C ATOM 163 CD1 ILE A 685 12.881 -0.161 -0.768 1.00 0.00 C ATOM 0 H ILE A 685 13.026 0.066 -3.979 1.00 0.00 H new ATOM 0 HA ILE A 685 10.627 1.649 -3.869 1.00 0.00 H new ATOM 0 HB ILE A 685 11.010 1.474 -1.203 1.00 0.00 H new ATOM 0 HG12 ILE A 685 10.913 -1.024 -0.635 1.00 0.00 H new ATOM 0 HG13 ILE A 685 11.699 -1.277 -2.180 1.00 0.00 H new ATOM 0 HG21 ILE A 685 8.933 0.048 -1.193 1.00 0.00 H new ATOM 0 HG22 ILE A 685 8.846 1.347 -2.406 1.00 0.00 H new ATOM 0 HG23 ILE A 685 9.210 -0.319 -2.912 1.00 0.00 H new ATOM 0 HD11 ILE A 685 13.371 -1.051 -0.373 1.00 0.00 H new ATOM 0 HD12 ILE A 685 13.515 0.294 -1.529 1.00 0.00 H new ATOM 0 HD13 ILE A 685 12.716 0.551 0.040 1.00 0.00 H new ATOM 175 N ASP A 686 11.951 3.390 -2.351 1.00 0.00 N ATOM 176 CA ASP A 686 12.728 4.542 -1.932 1.00 0.00 C ATOM 177 C ASP A 686 12.122 5.061 -0.630 1.00 0.00 C ATOM 178 O ASP A 686 10.900 5.169 -0.529 1.00 0.00 O ATOM 179 CB ASP A 686 12.660 5.608 -3.019 1.00 0.00 C ATOM 180 CG ASP A 686 13.233 5.124 -4.348 1.00 0.00 C ATOM 181 OD1 ASP A 686 14.476 5.137 -4.483 1.00 0.00 O ATOM 182 OD2 ASP A 686 12.422 4.742 -5.222 1.00 0.00 O ATOM 0 H ASP A 686 10.959 3.480 -2.130 1.00 0.00 H new ATOM 0 HA ASP A 686 13.774 4.279 -1.772 1.00 0.00 H new ATOM 0 HB2 ASP A 686 11.623 5.910 -3.163 1.00 0.00 H new ATOM 0 HB3 ASP A 686 13.207 6.492 -2.691 1.00 0.00 H new ATOM 187 N PRO A 687 12.943 5.386 0.378 1.00 0.00 N ATOM 188 CA PRO A 687 12.449 5.802 1.679 1.00 0.00 C ATOM 189 C PRO A 687 11.745 7.147 1.598 1.00 0.00 C ATOM 190 O PRO A 687 10.969 7.509 2.478 1.00 0.00 O ATOM 191 CB PRO A 687 13.675 5.838 2.587 1.00 0.00 C ATOM 192 CG PRO A 687 14.855 6.020 1.634 1.00 0.00 C ATOM 193 CD PRO A 687 14.392 5.362 0.336 1.00 0.00 C ATOM 0 HA PRO A 687 11.698 5.116 2.070 1.00 0.00 H new ATOM 0 HB2 PRO A 687 13.614 6.657 3.303 1.00 0.00 H new ATOM 0 HB3 PRO A 687 13.769 4.917 3.163 1.00 0.00 H new ATOM 0 HG2 PRO A 687 15.088 7.074 1.485 1.00 0.00 H new ATOM 0 HG3 PRO A 687 15.757 5.546 2.021 1.00 0.00 H new ATOM 0 HD2 PRO A 687 14.767 5.903 -0.533 1.00 0.00 H new ATOM 0 HD3 PRO A 687 14.764 4.340 0.261 1.00 0.00 H new ATOM 201 N GLN A 688 12.021 7.888 0.527 1.00 0.00 N ATOM 202 CA GLN A 688 11.410 9.172 0.249 1.00 0.00 C ATOM 203 C GLN A 688 10.011 9.006 -0.342 1.00 0.00 C ATOM 204 O GLN A 688 9.393 9.997 -0.722 1.00 0.00 O ATOM 205 CB GLN A 688 12.307 9.940 -0.730 1.00 0.00 C ATOM 206 CG GLN A 688 12.712 9.034 -1.900 1.00 0.00 C ATOM 207 CD GLN A 688 14.180 8.644 -1.874 1.00 0.00 C ATOM 208 OE1 GLN A 688 14.703 8.302 -0.703 1.00 0.00 O flip ATOM 209 NE2 GLN A 688 14.847 8.645 -2.904 1.00 0.00 N flip ATOM 0 H GLN A 688 12.693 7.599 -0.184 1.00 0.00 H new ATOM 0 HA GLN A 688 11.308 9.726 1.182 1.00 0.00 H new ATOM 0 HB2 GLN A 688 11.780 10.817 -1.105 1.00 0.00 H new ATOM 0 HB3 GLN A 688 13.197 10.299 -0.214 1.00 0.00 H new ATOM 0 HG2 GLN A 688 12.102 8.131 -1.880 1.00 0.00 H new ATOM 0 HG3 GLN A 688 12.495 9.544 -2.838 1.00 0.00 H new ATOM 0 HE21 GLN A 688 14.417 8.913 -3.790 1.00 0.00 H new ATOM 0 HE22 GLN A 688 15.831 8.378 -2.875 1.00 0.00 H new ATOM 218 N VAL A 689 9.500 7.770 -0.430 1.00 0.00 N ATOM 219 CA VAL A 689 8.174 7.531 -0.974 1.00 0.00 C ATOM 220 C VAL A 689 7.359 6.675 -0.004 1.00 0.00 C ATOM 221 O VAL A 689 6.154 6.517 -0.183 1.00 0.00 O ATOM 222 CB VAL A 689 8.291 6.878 -2.355 1.00 0.00 C ATOM 223 CG1 VAL A 689 6.933 6.864 -3.051 1.00 0.00 C ATOM 224 CG2 VAL A 689 9.242 7.657 -3.262 1.00 0.00 C ATOM 0 H VAL A 689 9.991 6.928 -0.130 1.00 0.00 H new ATOM 0 HA VAL A 689 7.649 8.478 -1.098 1.00 0.00 H new ATOM 0 HB VAL A 689 8.666 5.867 -2.193 1.00 0.00 H new ATOM 0 HG11 VAL A 689 7.031 6.397 -4.031 1.00 0.00 H new ATOM 0 HG12 VAL A 689 6.222 6.298 -2.449 1.00 0.00 H new ATOM 0 HG13 VAL A 689 6.575 7.887 -3.170 1.00 0.00 H new ATOM 0 HG21 VAL A 689 9.302 7.166 -4.234 1.00 0.00 H new ATOM 0 HG22 VAL A 689 8.871 8.674 -3.391 1.00 0.00 H new ATOM 0 HG23 VAL A 689 10.233 7.688 -2.809 1.00 0.00 H new ATOM 234 N PHE A 690 8.004 6.118 1.032 1.00 0.00 N ATOM 235 CA PHE A 690 7.294 5.354 2.044 1.00 0.00 C ATOM 236 C PHE A 690 7.437 5.952 3.446 1.00 0.00 C ATOM 237 O PHE A 690 6.810 5.459 4.381 1.00 0.00 O ATOM 238 CB PHE A 690 7.699 3.881 1.977 1.00 0.00 C ATOM 239 CG PHE A 690 8.862 3.480 2.854 1.00 0.00 C ATOM 240 CD1 PHE A 690 8.653 3.184 4.208 1.00 0.00 C ATOM 241 CD2 PHE A 690 10.149 3.399 2.315 1.00 0.00 C ATOM 242 CE1 PHE A 690 9.735 2.842 5.031 1.00 0.00 C ATOM 243 CE2 PHE A 690 11.233 3.064 3.138 1.00 0.00 C ATOM 244 CZ PHE A 690 11.029 2.797 4.498 1.00 0.00 C ATOM 0 H PHE A 690 9.011 6.187 1.182 1.00 0.00 H new ATOM 0 HA PHE A 690 6.228 5.413 1.823 1.00 0.00 H new ATOM 0 HB2 PHE A 690 6.836 3.273 2.249 1.00 0.00 H new ATOM 0 HB3 PHE A 690 7.946 3.638 0.944 1.00 0.00 H new ATOM 0 HD1 PHE A 690 7.655 3.220 4.619 1.00 0.00 H new ATOM 0 HD2 PHE A 690 10.308 3.594 1.265 1.00 0.00 H new ATOM 0 HE1 PHE A 690 9.571 2.614 6.074 1.00 0.00 H new ATOM 0 HE2 PHE A 690 12.228 3.012 2.722 1.00 0.00 H new ATOM 0 HZ PHE A 690 11.868 2.557 5.134 1.00 0.00 H new ATOM 254 N TYR A 691 8.241 7.007 3.616 1.00 0.00 N ATOM 255 CA TYR A 691 8.267 7.784 4.853 1.00 0.00 C ATOM 256 C TYR A 691 7.270 8.947 4.796 1.00 0.00 C ATOM 257 O TYR A 691 7.139 9.695 5.764 1.00 0.00 O ATOM 258 CB TYR A 691 9.674 8.326 5.119 1.00 0.00 C ATOM 259 CG TYR A 691 10.690 7.303 5.591 1.00 0.00 C ATOM 260 CD1 TYR A 691 10.284 6.107 6.206 1.00 0.00 C ATOM 261 CD2 TYR A 691 12.055 7.569 5.420 1.00 0.00 C ATOM 262 CE1 TYR A 691 11.236 5.192 6.662 1.00 0.00 C ATOM 263 CE2 TYR A 691 13.016 6.654 5.878 1.00 0.00 C ATOM 264 CZ TYR A 691 12.610 5.460 6.502 1.00 0.00 C ATOM 265 OH TYR A 691 13.538 4.564 6.947 1.00 0.00 O ATOM 0 H TYR A 691 8.888 7.342 2.902 1.00 0.00 H new ATOM 0 HA TYR A 691 7.980 7.118 5.667 1.00 0.00 H new ATOM 0 HB2 TYR A 691 10.046 8.786 4.204 1.00 0.00 H new ATOM 0 HB3 TYR A 691 9.605 9.115 5.867 1.00 0.00 H new ATOM 0 HD1 TYR A 691 9.232 5.894 6.327 1.00 0.00 H new ATOM 0 HD2 TYR A 691 12.369 8.481 4.934 1.00 0.00 H new ATOM 0 HE1 TYR A 691 10.918 4.277 7.139 1.00 0.00 H new ATOM 0 HE2 TYR A 691 14.067 6.867 5.751 1.00 0.00 H new ATOM 0 HH TYR A 691 14.438 4.903 6.757 1.00 0.00 H new ATOM 275 N GLU A 692 6.564 9.111 3.669 1.00 0.00 N ATOM 276 CA GLU A 692 5.555 10.154 3.480 1.00 0.00 C ATOM 277 C GLU A 692 4.238 9.764 4.165 1.00 0.00 C ATOM 278 O GLU A 692 3.167 10.253 3.815 1.00 0.00 O ATOM 279 CB GLU A 692 5.339 10.373 1.980 1.00 0.00 C ATOM 280 CG GLU A 692 6.632 10.778 1.272 1.00 0.00 C ATOM 281 CD GLU A 692 7.190 12.086 1.827 1.00 0.00 C ATOM 282 OE1 GLU A 692 6.605 13.146 1.506 1.00 0.00 O ATOM 283 OE2 GLU A 692 8.194 12.022 2.571 1.00 0.00 O ATOM 0 H GLU A 692 6.682 8.512 2.852 1.00 0.00 H new ATOM 0 HA GLU A 692 5.904 11.081 3.935 1.00 0.00 H new ATOM 0 HB2 GLU A 692 4.950 9.459 1.532 1.00 0.00 H new ATOM 0 HB3 GLU A 692 4.586 11.146 1.831 1.00 0.00 H new ATOM 0 HG2 GLU A 692 7.374 9.987 1.387 1.00 0.00 H new ATOM 0 HG3 GLU A 692 6.444 10.886 0.204 1.00 0.00 H new ATOM 290 N LEU A 693 4.340 8.867 5.148 1.00 0.00 N ATOM 291 CA LEU A 693 3.252 8.172 5.804 1.00 0.00 C ATOM 292 C LEU A 693 3.303 8.422 7.309 1.00 0.00 C ATOM 293 O LEU A 693 4.254 9.023 7.806 1.00 0.00 O ATOM 294 CB LEU A 693 3.527 6.680 5.609 1.00 0.00 C ATOM 295 CG LEU A 693 3.246 6.100 4.227 1.00 0.00 C ATOM 296 CD1 LEU A 693 4.033 6.761 3.098 1.00 0.00 C ATOM 297 CD2 LEU A 693 3.624 4.625 4.322 1.00 0.00 C ATOM 0 H LEU A 693 5.248 8.595 5.525 1.00 0.00 H new ATOM 0 HA LEU A 693 2.294 8.501 5.401 1.00 0.00 H new ATOM 0 HB2 LEU A 693 4.574 6.494 5.848 1.00 0.00 H new ATOM 0 HB3 LEU A 693 2.931 6.128 6.336 1.00 0.00 H new ATOM 0 HG LEU A 693 2.199 6.270 3.974 1.00 0.00 H new ATOM 0 HD11 LEU A 693 3.774 6.290 2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 693 3.786 7.822 3.055 1.00 0.00 H new ATOM 0 HD13 LEU A 693 5.101 6.644 3.282 1.00 0.00 H new ATOM 0 HD21 LEU A 693 3.448 4.142 3.361 1.00 0.00 H new ATOM 0 HD22 LEU A 693 4.678 4.536 4.585 1.00 0.00 H new ATOM 0 HD23 LEU A 693 3.017 4.142 5.088 1.00 0.00 H new ATOM 309 N PRO A 694 2.288 7.962 8.047 1.00 0.00 N ATOM 310 CA PRO A 694 2.347 7.844 9.491 1.00 0.00 C ATOM 311 C PRO A 694 3.188 6.607 9.794 1.00 0.00 C ATOM 312 O PRO A 694 3.215 5.669 8.995 1.00 0.00 O ATOM 313 CB PRO A 694 0.892 7.672 9.929 1.00 0.00 C ATOM 314 CG PRO A 694 0.248 6.966 8.733 1.00 0.00 C ATOM 315 CD PRO A 694 1.016 7.506 7.527 1.00 0.00 C ATOM 0 HA PRO A 694 2.793 8.694 10.007 1.00 0.00 H new ATOM 0 HB2 PRO A 694 0.813 7.076 10.839 1.00 0.00 H new ATOM 0 HB3 PRO A 694 0.417 8.631 10.134 1.00 0.00 H new ATOM 0 HG2 PRO A 694 0.340 5.883 8.812 1.00 0.00 H new ATOM 0 HG3 PRO A 694 -0.816 7.191 8.662 1.00 0.00 H new ATOM 0 HD2 PRO A 694 1.156 6.732 6.773 1.00 0.00 H new ATOM 0 HD3 PRO A 694 0.473 8.322 7.050 1.00 0.00 H new ATOM 323 N GLU A 695 3.875 6.587 10.934 1.00 0.00 N ATOM 324 CA GLU A 695 4.731 5.513 11.355 1.00 0.00 C ATOM 325 C GLU A 695 4.045 4.185 11.132 1.00 0.00 C ATOM 326 O GLU A 695 4.645 3.238 10.650 1.00 0.00 O ATOM 327 CB GLU A 695 4.927 5.738 12.848 1.00 0.00 C ATOM 328 CG GLU A 695 6.260 5.158 13.265 1.00 0.00 C ATOM 329 CD GLU A 695 6.412 5.110 14.786 1.00 0.00 C ATOM 330 OE1 GLU A 695 5.590 4.420 15.430 1.00 0.00 O ATOM 331 OE2 GLU A 695 7.350 5.762 15.298 1.00 0.00 O ATOM 0 H GLU A 695 3.840 7.354 11.606 1.00 0.00 H new ATOM 0 HA GLU A 695 5.671 5.496 10.804 1.00 0.00 H new ATOM 0 HB2 GLU A 695 4.893 6.803 13.075 1.00 0.00 H new ATOM 0 HB3 GLU A 695 4.120 5.266 13.409 1.00 0.00 H new ATOM 0 HG2 GLU A 695 6.361 4.152 12.858 1.00 0.00 H new ATOM 0 HG3 GLU A 695 7.065 5.756 12.839 1.00 0.00 H new ATOM 338 N GLU A 696 2.768 4.156 11.498 1.00 0.00 N ATOM 339 CA GLU A 696 1.860 3.039 11.476 1.00 0.00 C ATOM 340 C GLU A 696 1.909 2.214 10.189 1.00 0.00 C ATOM 341 O GLU A 696 1.424 1.084 10.182 1.00 0.00 O ATOM 342 CB GLU A 696 0.460 3.596 11.748 1.00 0.00 C ATOM 343 CG GLU A 696 -0.608 2.516 11.663 1.00 0.00 C ATOM 344 CD GLU A 696 -1.965 3.048 12.116 1.00 0.00 C ATOM 345 OE1 GLU A 696 -2.666 3.649 11.273 1.00 0.00 O ATOM 346 OE2 GLU A 696 -2.294 2.847 13.308 1.00 0.00 O ATOM 0 H GLU A 696 2.310 4.998 11.848 1.00 0.00 H new ATOM 0 HA GLU A 696 2.159 2.327 12.245 1.00 0.00 H new ATOM 0 HB2 GLU A 696 0.437 4.052 12.738 1.00 0.00 H new ATOM 0 HB3 GLU A 696 0.237 4.384 11.029 1.00 0.00 H new ATOM 0 HG2 GLU A 696 -0.680 2.152 10.638 1.00 0.00 H new ATOM 0 HG3 GLU A 696 -0.321 1.667 12.284 1.00 0.00 H new ATOM 353 N VAL A 697 2.482 2.749 9.107 1.00 0.00 N ATOM 354 CA VAL A 697 2.634 1.987 7.879 1.00 0.00 C ATOM 355 C VAL A 697 4.063 2.090 7.351 1.00 0.00 C ATOM 356 O VAL A 697 4.494 1.217 6.600 1.00 0.00 O ATOM 357 CB VAL A 697 1.588 2.420 6.847 1.00 0.00 C ATOM 358 CG1 VAL A 697 1.704 1.599 5.564 1.00 0.00 C ATOM 359 CG2 VAL A 697 0.184 2.203 7.407 1.00 0.00 C ATOM 0 H VAL A 697 2.844 3.702 9.063 1.00 0.00 H new ATOM 0 HA VAL A 697 2.455 0.933 8.089 1.00 0.00 H new ATOM 0 HB VAL A 697 1.764 3.473 6.628 1.00 0.00 H new ATOM 0 HG11 VAL A 697 0.949 1.929 4.851 1.00 0.00 H new ATOM 0 HG12 VAL A 697 2.695 1.737 5.132 1.00 0.00 H new ATOM 0 HG13 VAL A 697 1.551 0.544 5.792 1.00 0.00 H new ATOM 0 HG21 VAL A 697 -0.555 2.513 6.668 1.00 0.00 H new ATOM 0 HG22 VAL A 697 0.044 1.147 7.639 1.00 0.00 H new ATOM 0 HG23 VAL A 697 0.059 2.794 8.315 1.00 0.00 H new ATOM 369 N GLN A 698 4.816 3.129 7.731 1.00 0.00 N ATOM 370 CA GLN A 698 6.237 3.147 7.403 1.00 0.00 C ATOM 371 C GLN A 698 6.914 1.995 8.146 1.00 0.00 C ATOM 372 O GLN A 698 7.863 1.385 7.657 1.00 0.00 O ATOM 373 CB GLN A 698 6.927 4.406 7.932 1.00 0.00 C ATOM 374 CG GLN A 698 6.331 5.764 7.607 1.00 0.00 C ATOM 375 CD GLN A 698 7.088 6.822 8.401 1.00 0.00 C ATOM 376 OE1 GLN A 698 8.299 6.729 8.583 1.00 0.00 O ATOM 377 NE2 GLN A 698 6.395 7.837 8.892 1.00 0.00 N ATOM 0 H GLN A 698 4.476 3.940 8.248 1.00 0.00 H new ATOM 0 HA GLN A 698 6.320 3.088 6.318 1.00 0.00 H new ATOM 0 HB2 GLN A 698 6.979 4.321 9.017 1.00 0.00 H new ATOM 0 HB3 GLN A 698 7.952 4.400 7.562 1.00 0.00 H new ATOM 0 HG2 GLN A 698 6.406 5.966 6.538 1.00 0.00 H new ATOM 0 HG3 GLN A 698 5.271 5.784 7.862 1.00 0.00 H new ATOM 0 HE21 GLN A 698 5.390 7.895 8.729 1.00 0.00 H new ATOM 0 HE22 GLN A 698 6.866 8.562 9.434 1.00 0.00 H new ATOM 386 N LYS A 699 6.403 1.714 9.348 1.00 0.00 N ATOM 387 CA LYS A 699 6.999 0.821 10.319 1.00 0.00 C ATOM 388 C LYS A 699 6.553 -0.617 10.088 1.00 0.00 C ATOM 389 O LYS A 699 7.240 -1.564 10.474 1.00 0.00 O ATOM 390 CB LYS A 699 6.652 1.363 11.718 1.00 0.00 C ATOM 391 CG LYS A 699 5.310 0.917 12.304 1.00 0.00 C ATOM 392 CD LYS A 699 5.236 1.508 13.710 1.00 0.00 C ATOM 393 CE LYS A 699 3.826 1.951 14.072 1.00 0.00 C ATOM 394 NZ LYS A 699 3.743 2.353 15.491 1.00 0.00 N ATOM 0 H LYS A 699 5.528 2.124 9.675 1.00 0.00 H new ATOM 0 HA LYS A 699 8.084 0.792 10.219 1.00 0.00 H new ATOM 0 HB2 LYS A 699 7.442 1.064 12.407 1.00 0.00 H new ATOM 0 HB3 LYS A 699 6.662 2.452 11.675 1.00 0.00 H new ATOM 0 HG2 LYS A 699 4.482 1.270 11.690 1.00 0.00 H new ATOM 0 HG3 LYS A 699 5.242 -0.170 12.336 1.00 0.00 H new ATOM 0 HD2 LYS A 699 5.579 0.768 14.432 1.00 0.00 H new ATOM 0 HD3 LYS A 699 5.912 2.360 13.781 1.00 0.00 H new ATOM 0 HE2 LYS A 699 3.529 2.785 13.436 1.00 0.00 H new ATOM 0 HE3 LYS A 699 3.125 1.138 13.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 699 2.747 2.504 15.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 699 4.148 1.604 16.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 699 4.276 3.235 15.634 1.00 0.00 H new ATOM 408 N GLU A 700 5.395 -0.785 9.446 1.00 0.00 N ATOM 409 CA GLU A 700 4.936 -2.106 9.062 1.00 0.00 C ATOM 410 C GLU A 700 5.804 -2.557 7.902 1.00 0.00 C ATOM 411 O GLU A 700 6.069 -3.745 7.746 1.00 0.00 O ATOM 412 CB GLU A 700 3.468 -2.047 8.645 1.00 0.00 C ATOM 413 CG GLU A 700 2.573 -1.889 9.873 1.00 0.00 C ATOM 414 CD GLU A 700 1.088 -1.920 9.501 1.00 0.00 C ATOM 415 OE1 GLU A 700 0.762 -1.569 8.343 1.00 0.00 O ATOM 416 OE2 GLU A 700 0.284 -2.298 10.384 1.00 0.00 O ATOM 0 H GLU A 700 4.767 -0.024 9.186 1.00 0.00 H new ATOM 0 HA GLU A 700 5.014 -2.807 9.893 1.00 0.00 H new ATOM 0 HB2 GLU A 700 3.310 -1.212 7.962 1.00 0.00 H new ATOM 0 HB3 GLU A 700 3.200 -2.955 8.106 1.00 0.00 H new ATOM 0 HG2 GLU A 700 2.787 -2.687 10.584 1.00 0.00 H new ATOM 0 HG3 GLU A 700 2.803 -0.948 10.372 1.00 0.00 H new ATOM 423 N LEU A 701 6.246 -1.589 7.094 1.00 0.00 N ATOM 424 CA LEU A 701 7.198 -1.821 6.029 1.00 0.00 C ATOM 425 C LEU A 701 8.558 -2.199 6.623 1.00 0.00 C ATOM 426 O LEU A 701 9.254 -3.050 6.075 1.00 0.00 O ATOM 427 CB LEU A 701 7.295 -0.544 5.191 1.00 0.00 C ATOM 428 CG LEU A 701 6.717 -0.742 3.784 1.00 0.00 C ATOM 429 CD1 LEU A 701 5.219 -1.031 3.860 1.00 0.00 C ATOM 430 CD2 LEU A 701 6.914 0.529 2.958 1.00 0.00 C ATOM 0 H LEU A 701 5.944 -0.618 7.170 1.00 0.00 H new ATOM 0 HA LEU A 701 6.874 -2.645 5.394 1.00 0.00 H new ATOM 0 HB2 LEU A 701 6.761 0.262 5.694 1.00 0.00 H new ATOM 0 HB3 LEU A 701 8.338 -0.237 5.116 1.00 0.00 H new ATOM 0 HG LEU A 701 7.234 -1.582 3.320 1.00 0.00 H new ATOM 0 HD11 LEU A 701 4.824 -1.169 2.854 1.00 0.00 H new ATOM 0 HD12 LEU A 701 5.052 -1.937 4.443 1.00 0.00 H new ATOM 0 HD13 LEU A 701 4.711 -0.194 4.338 1.00 0.00 H new ATOM 0 HD21 LEU A 701 6.501 0.382 1.960 1.00 0.00 H new ATOM 0 HD22 LEU A 701 6.403 1.361 3.443 1.00 0.00 H new ATOM 0 HD23 LEU A 701 7.978 0.752 2.881 1.00 0.00 H new ATOM 442 N MET A 702 8.943 -1.578 7.749 1.00 0.00 N ATOM 443 CA MET A 702 10.181 -1.908 8.443 1.00 0.00 C ATOM 444 C MET A 702 10.112 -3.281 9.110 1.00 0.00 C ATOM 445 O MET A 702 11.145 -3.798 9.533 1.00 0.00 O ATOM 446 CB MET A 702 10.485 -0.860 9.520 1.00 0.00 C ATOM 447 CG MET A 702 10.797 0.532 8.968 1.00 0.00 C ATOM 448 SD MET A 702 12.438 0.730 8.226 1.00 0.00 S ATOM 449 CE MET A 702 12.076 0.278 6.515 1.00 0.00 C ATOM 0 H MET A 702 8.402 -0.838 8.196 1.00 0.00 H new ATOM 0 HA MET A 702 10.971 -1.921 7.692 1.00 0.00 H new ATOM 0 HB2 MET A 702 9.631 -0.789 10.193 1.00 0.00 H new ATOM 0 HB3 MET A 702 11.332 -1.201 10.115 1.00 0.00 H new ATOM 0 HG2 MET A 702 10.046 0.783 8.218 1.00 0.00 H new ATOM 0 HG3 MET A 702 10.694 1.255 9.777 1.00 0.00 H new ATOM 0 HE1 MET A 702 12.723 0.844 5.845 1.00 0.00 H new ATOM 0 HE2 MET A 702 12.252 -0.789 6.375 1.00 0.00 H new ATOM 0 HE3 MET A 702 11.034 0.506 6.291 1.00 0.00 H new ATOM 459 N ALA A 703 8.922 -3.881 9.211 1.00 0.00 N ATOM 460 CA ALA A 703 8.778 -5.211 9.788 1.00 0.00 C ATOM 461 C ALA A 703 8.486 -6.234 8.698 1.00 0.00 C ATOM 462 O ALA A 703 8.660 -7.439 8.891 1.00 0.00 O ATOM 463 CB ALA A 703 7.621 -5.195 10.781 1.00 0.00 C ATOM 0 H ALA A 703 8.046 -3.462 8.899 1.00 0.00 H new ATOM 0 HA ALA A 703 9.706 -5.485 10.290 1.00 0.00 H new ATOM 0 HB1 ALA A 703 7.504 -6.186 11.219 1.00 0.00 H new ATOM 0 HB2 ALA A 703 7.828 -4.472 11.570 1.00 0.00 H new ATOM 0 HB3 ALA A 703 6.702 -4.916 10.265 1.00 0.00 H new ATOM 469 N GLU A 704 8.040 -5.753 7.540 1.00 0.00 N ATOM 470 CA GLU A 704 7.622 -6.577 6.445 1.00 0.00 C ATOM 471 C GLU A 704 8.839 -6.907 5.587 1.00 0.00 C ATOM 472 O GLU A 704 8.844 -7.886 4.843 1.00 0.00 O ATOM 473 CB GLU A 704 6.585 -5.766 5.670 1.00 0.00 C ATOM 474 CG GLU A 704 6.343 -6.497 4.374 1.00 0.00 C ATOM 475 CD GLU A 704 4.984 -6.175 3.769 1.00 0.00 C ATOM 476 OE1 GLU A 704 4.736 -4.985 3.477 1.00 0.00 O ATOM 477 OE2 GLU A 704 4.198 -7.138 3.602 1.00 0.00 O ATOM 0 H GLU A 704 7.963 -4.754 7.348 1.00 0.00 H new ATOM 0 HA GLU A 704 7.186 -7.522 6.770 1.00 0.00 H new ATOM 0 HB2 GLU A 704 5.661 -5.674 6.241 1.00 0.00 H new ATOM 0 HB3 GLU A 704 6.946 -4.755 5.482 1.00 0.00 H new ATOM 0 HG2 GLU A 704 7.126 -6.236 3.662 1.00 0.00 H new ATOM 0 HG3 GLU A 704 6.415 -7.571 4.547 1.00 0.00 H new ATOM 484 N TRP A 705 9.874 -6.079 5.700 1.00 0.00 N ATOM 485 CA TRP A 705 11.098 -6.232 4.945 1.00 0.00 C ATOM 486 C TRP A 705 12.049 -7.113 5.735 1.00 0.00 C ATOM 487 O TRP A 705 12.918 -7.778 5.173 1.00 0.00 O ATOM 488 CB TRP A 705 11.680 -4.842 4.732 1.00 0.00 C ATOM 489 CG TRP A 705 10.922 -4.002 3.752 1.00 0.00 C ATOM 490 CD1 TRP A 705 9.890 -4.410 2.977 1.00 0.00 C ATOM 491 CD2 TRP A 705 11.129 -2.599 3.421 1.00 0.00 C ATOM 492 NE1 TRP A 705 9.463 -3.366 2.186 1.00 0.00 N ATOM 493 CE2 TRP A 705 10.206 -2.225 2.408 1.00 0.00 C ATOM 494 CE3 TRP A 705 12.015 -1.613 3.879 1.00 0.00 C ATOM 495 CZ2 TRP A 705 10.188 -0.940 1.856 1.00 0.00 C ATOM 496 CZ3 TRP A 705 12.019 -0.326 3.318 1.00 0.00 C ATOM 497 CH2 TRP A 705 11.114 0.008 2.304 1.00 0.00 C ATOM 0 H TRP A 705 9.879 -5.275 6.328 1.00 0.00 H new ATOM 0 HA TRP A 705 10.924 -6.702 3.977 1.00 0.00 H new ATOM 0 HB2 TRP A 705 11.712 -4.323 5.690 1.00 0.00 H new ATOM 0 HB3 TRP A 705 12.710 -4.940 4.389 1.00 0.00 H new ATOM 0 HD1 TRP A 705 9.466 -5.403 2.978 1.00 0.00 H new ATOM 0 HE1 TRP A 705 8.694 -3.429 1.519 1.00 0.00 H new ATOM 0 HE3 TRP A 705 12.705 -1.847 4.676 1.00 0.00 H new ATOM 0 HZ2 TRP A 705 9.468 -0.683 1.093 1.00 0.00 H new ATOM 0 HZ3 TRP A 705 12.725 0.411 3.671 1.00 0.00 H new ATOM 0 HH2 TRP A 705 11.131 0.996 1.868 1.00 0.00 H new ATOM 575 N MET B 1 -12.294 11.421 -16.756 1.00 0.00 N ATOM 576 CA MET B 1 -12.002 11.418 -15.305 1.00 0.00 C ATOM 577 C MET B 1 -11.031 10.298 -14.958 1.00 0.00 C ATOM 578 O MET B 1 -11.196 9.180 -15.434 1.00 0.00 O ATOM 579 CB MET B 1 -13.280 11.266 -14.473 1.00 0.00 C ATOM 580 CG MET B 1 -13.931 9.889 -14.637 1.00 0.00 C ATOM 581 SD MET B 1 -14.643 9.560 -16.272 1.00 0.00 S ATOM 582 CE MET B 1 -15.246 7.874 -15.996 1.00 0.00 C ATOM 0 H1 MET B 1 -12.517 12.389 -17.063 1.00 0.00 H new ATOM 0 H2 MET B 1 -11.464 11.075 -17.278 1.00 0.00 H new ATOM 0 H3 MET B 1 -13.107 10.801 -16.948 1.00 0.00 H new ATOM 0 HA MET B 1 -11.548 12.379 -15.063 1.00 0.00 H new ATOM 0 HB2 MET B 1 -13.046 11.430 -13.421 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.993 12.037 -14.765 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.184 9.124 -14.423 1.00 0.00 H new ATOM 0 HG3 MET B 1 -14.717 9.785 -13.889 1.00 0.00 H new ATOM 0 HE1 MET B 1 -15.288 7.343 -16.947 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.570 7.352 -15.318 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.243 7.911 -15.557 1.00 0.00 H new ATOM 594 N GLN B 2 -10.023 10.587 -14.134 1.00 0.00 N ATOM 595 CA GLN B 2 -9.050 9.610 -13.678 1.00 0.00 C ATOM 596 C GLN B 2 -8.253 10.198 -12.516 1.00 0.00 C ATOM 597 O GLN B 2 -8.108 11.418 -12.431 1.00 0.00 O ATOM 598 CB GLN B 2 -8.136 9.267 -14.859 1.00 0.00 C ATOM 599 CG GLN B 2 -7.693 10.536 -15.589 1.00 0.00 C ATOM 600 CD GLN B 2 -6.774 10.287 -16.780 1.00 0.00 C ATOM 601 OE1 GLN B 2 -5.906 11.105 -17.071 1.00 0.00 O ATOM 602 NE2 GLN B 2 -6.938 9.169 -17.481 1.00 0.00 N ATOM 0 H GLN B 2 -9.863 11.523 -13.762 1.00 0.00 H new ATOM 0 HA GLN B 2 -9.539 8.702 -13.325 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -7.261 8.723 -14.502 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -8.660 8.608 -15.551 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -8.578 11.070 -15.934 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -7.182 11.189 -14.881 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -7.667 8.505 -17.219 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -6.335 8.975 -18.281 1.00 0.00 H new ATOM 611 N ILE B 3 -7.737 9.344 -11.626 1.00 0.00 N ATOM 612 CA ILE B 3 -6.946 9.807 -10.488 1.00 0.00 C ATOM 613 C ILE B 3 -5.486 9.418 -10.668 1.00 0.00 C ATOM 614 O ILE B 3 -5.172 8.483 -11.399 1.00 0.00 O ATOM 615 CB ILE B 3 -7.510 9.319 -9.136 1.00 0.00 C ATOM 616 CG1 ILE B 3 -7.041 7.912 -8.747 1.00 0.00 C ATOM 617 CG2 ILE B 3 -9.040 9.371 -9.071 1.00 0.00 C ATOM 618 CD1 ILE B 3 -7.517 6.823 -9.706 1.00 0.00 C ATOM 0 H ILE B 3 -7.854 8.332 -11.674 1.00 0.00 H new ATOM 0 HA ILE B 3 -7.011 10.895 -10.462 1.00 0.00 H new ATOM 0 HB ILE B 3 -7.102 10.026 -8.414 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -5.952 7.899 -8.707 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.399 7.683 -7.743 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.375 9.016 -8.097 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -9.376 10.398 -9.218 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -9.459 8.737 -9.852 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -7.148 5.854 -9.369 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -8.607 6.808 -9.728 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -7.137 7.028 -10.707 1.00 0.00 H new ATOM 630 N PHE B 4 -4.594 10.148 -9.992 1.00 0.00 N ATOM 631 CA PHE B 4 -3.159 9.966 -10.136 1.00 0.00 C ATOM 632 C PHE B 4 -2.650 9.200 -8.924 1.00 0.00 C ATOM 633 O PHE B 4 -2.313 9.787 -7.900 1.00 0.00 O ATOM 634 CB PHE B 4 -2.456 11.319 -10.237 1.00 0.00 C ATOM 635 CG PHE B 4 -2.621 12.081 -11.541 1.00 0.00 C ATOM 636 CD1 PHE B 4 -3.812 12.018 -12.280 1.00 0.00 C ATOM 637 CD2 PHE B 4 -1.557 12.861 -12.019 1.00 0.00 C ATOM 638 CE1 PHE B 4 -3.935 12.705 -13.494 1.00 0.00 C ATOM 639 CE2 PHE B 4 -1.681 13.559 -13.229 1.00 0.00 C ATOM 640 CZ PHE B 4 -2.869 13.479 -13.970 1.00 0.00 C ATOM 0 H PHE B 4 -4.853 10.880 -9.331 1.00 0.00 H new ATOM 0 HA PHE B 4 -2.947 9.408 -11.048 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -2.818 11.951 -9.426 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -1.391 11.162 -10.068 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -4.642 11.434 -11.909 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -0.639 12.924 -11.453 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -4.851 12.638 -14.063 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -0.860 14.160 -13.591 1.00 0.00 H new ATOM 0 HZ PHE B 4 -2.962 14.012 -14.905 1.00 0.00 H new ATOM 650 N VAL B 5 -2.603 7.878 -9.043 1.00 0.00 N ATOM 651 CA VAL B 5 -2.186 7.017 -7.947 1.00 0.00 C ATOM 652 C VAL B 5 -0.665 6.934 -7.921 1.00 0.00 C ATOM 653 O VAL B 5 -0.063 6.262 -8.753 1.00 0.00 O ATOM 654 CB VAL B 5 -2.789 5.617 -8.099 1.00 0.00 C ATOM 655 CG1 VAL B 5 -2.436 4.777 -6.871 1.00 0.00 C ATOM 656 CG2 VAL B 5 -4.308 5.692 -8.232 1.00 0.00 C ATOM 0 H VAL B 5 -2.851 7.377 -9.896 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.543 7.440 -7.008 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.380 5.160 -9.000 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -2.864 3.780 -6.977 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -1.352 4.699 -6.783 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -2.840 5.252 -5.977 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -4.714 4.686 -8.339 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -4.728 6.160 -7.342 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.568 6.283 -9.110 1.00 0.00 H new ATOM 666 N LYS B 6 -0.046 7.621 -6.964 1.00 0.00 N ATOM 667 CA LYS B 6 1.393 7.598 -6.787 1.00 0.00 C ATOM 668 C LYS B 6 1.813 6.263 -6.181 1.00 0.00 C ATOM 669 O LYS B 6 1.236 5.813 -5.192 1.00 0.00 O ATOM 670 CB LYS B 6 1.777 8.770 -5.878 1.00 0.00 C ATOM 671 CG LYS B 6 3.281 8.769 -5.599 1.00 0.00 C ATOM 672 CD LYS B 6 4.061 9.193 -6.842 1.00 0.00 C ATOM 673 CE LYS B 6 4.177 10.713 -6.922 1.00 0.00 C ATOM 674 NZ LYS B 6 4.639 11.141 -8.255 1.00 0.00 N ATOM 0 H LYS B 6 -0.535 8.210 -6.290 1.00 0.00 H new ATOM 0 HA LYS B 6 1.906 7.702 -7.743 1.00 0.00 H new ATOM 0 HB2 LYS B 6 1.490 9.710 -6.348 1.00 0.00 H new ATOM 0 HB3 LYS B 6 1.228 8.703 -4.939 1.00 0.00 H new ATOM 0 HG2 LYS B 6 3.504 9.447 -4.775 1.00 0.00 H new ATOM 0 HG3 LYS B 6 3.597 7.774 -5.287 1.00 0.00 H new ATOM 0 HD2 LYS B 6 5.056 8.749 -6.820 1.00 0.00 H new ATOM 0 HD3 LYS B 6 3.563 8.815 -7.735 1.00 0.00 H new ATOM 0 HE2 LYS B 6 3.210 11.166 -6.706 1.00 0.00 H new ATOM 0 HE3 LYS B 6 4.872 11.068 -6.161 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 4.823 12.165 -8.247 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 5.514 10.634 -8.498 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 3.907 10.927 -8.962 1.00 0.00 H new ATOM 688 N THR B 7 2.824 5.640 -6.785 1.00 0.00 N ATOM 689 CA THR B 7 3.380 4.375 -6.322 1.00 0.00 C ATOM 690 C THR B 7 4.603 4.619 -5.442 1.00 0.00 C ATOM 691 O THR B 7 5.092 5.743 -5.349 1.00 0.00 O ATOM 692 CB THR B 7 3.723 3.497 -7.531 1.00 0.00 C ATOM 693 OG1 THR B 7 3.809 2.148 -7.125 1.00 0.00 O ATOM 694 CG2 THR B 7 5.051 3.910 -8.149 1.00 0.00 C ATOM 0 H THR B 7 3.283 6.006 -7.619 1.00 0.00 H new ATOM 0 HA THR B 7 2.641 3.853 -5.714 1.00 0.00 H new ATOM 0 HB THR B 7 2.936 3.621 -8.274 1.00 0.00 H new ATOM 0 HG1 THR B 7 4.027 1.587 -7.898 1.00 0.00 H new ATOM 0 HG21 THR B 7 5.269 3.270 -9.004 1.00 0.00 H new ATOM 0 HG22 THR B 7 4.992 4.948 -8.478 1.00 0.00 H new ATOM 0 HG23 THR B 7 5.844 3.808 -7.408 1.00 0.00 H new ATOM 702 N LEU B 8 5.086 3.554 -4.802 1.00 0.00 N ATOM 703 CA LEU B 8 6.199 3.574 -3.852 1.00 0.00 C ATOM 704 C LEU B 8 7.563 3.887 -4.486 1.00 0.00 C ATOM 705 O LEU B 8 8.592 3.585 -3.883 1.00 0.00 O ATOM 706 CB LEU B 8 6.247 2.224 -3.136 1.00 0.00 C ATOM 707 CG LEU B 8 5.098 2.009 -2.149 1.00 0.00 C ATOM 708 CD1 LEU B 8 5.335 0.670 -1.453 1.00 0.00 C ATOM 709 CD2 LEU B 8 5.071 3.113 -1.092 1.00 0.00 C ATOM 0 H LEU B 8 4.699 2.620 -4.936 1.00 0.00 H new ATOM 0 HA LEU B 8 6.012 4.390 -3.153 1.00 0.00 H new ATOM 0 HB2 LEU B 8 6.229 1.428 -3.880 1.00 0.00 H new ATOM 0 HB3 LEU B 8 7.193 2.140 -2.602 1.00 0.00 H new ATOM 0 HG LEU B 8 4.149 2.024 -2.685 1.00 0.00 H new ATOM 0 HD11 LEU B 8 4.532 0.484 -0.740 1.00 0.00 H new ATOM 0 HD12 LEU B 8 5.353 -0.128 -2.195 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.289 0.697 -0.926 1.00 0.00 H new ATOM 0 HD21 LEU B 8 4.245 2.937 -0.403 1.00 0.00 H new ATOM 0 HD22 LEU B 8 6.011 3.111 -0.540 1.00 0.00 H new ATOM 0 HD23 LEU B 8 4.938 4.079 -1.578 1.00 0.00 H new ATOM 721 N THR B 9 7.604 4.484 -5.681 1.00 0.00 N ATOM 722 CA THR B 9 8.861 4.822 -6.345 1.00 0.00 C ATOM 723 C THR B 9 8.837 6.237 -6.925 1.00 0.00 C ATOM 724 O THR B 9 9.769 6.632 -7.627 1.00 0.00 O ATOM 725 CB THR B 9 9.184 3.808 -7.447 1.00 0.00 C ATOM 726 OG1 THR B 9 8.184 3.857 -8.442 1.00 0.00 O ATOM 727 CG2 THR B 9 9.261 2.387 -6.889 1.00 0.00 C ATOM 0 H THR B 9 6.772 4.744 -6.210 1.00 0.00 H new ATOM 0 HA THR B 9 9.644 4.784 -5.587 1.00 0.00 H new ATOM 0 HB THR B 9 10.154 4.068 -7.871 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.392 3.209 -9.147 1.00 0.00 H new ATOM 0 HG21 THR B 9 9.492 1.691 -7.696 1.00 0.00 H new ATOM 0 HG22 THR B 9 10.043 2.336 -6.131 1.00 0.00 H new ATOM 0 HG23 THR B 9 8.304 2.119 -6.442 1.00 0.00 H new ATOM 735 N GLY B 10 7.782 7.008 -6.642 1.00 0.00 N ATOM 736 CA GLY B 10 7.655 8.380 -7.120 1.00 0.00 C ATOM 737 C GLY B 10 6.980 8.451 -8.492 1.00 0.00 C ATOM 738 O GLY B 10 6.856 9.534 -9.062 1.00 0.00 O ATOM 0 H GLY B 10 6.994 6.694 -6.075 1.00 0.00 H new ATOM 0 HA2 GLY B 10 7.077 8.962 -6.402 1.00 0.00 H new ATOM 0 HA3 GLY B 10 8.643 8.836 -7.178 1.00 0.00 H new ATOM 742 N LYS B 11 6.545 7.303 -9.018 1.00 0.00 N ATOM 743 CA LYS B 11 5.883 7.193 -10.309 1.00 0.00 C ATOM 744 C LYS B 11 4.379 7.287 -10.094 1.00 0.00 C ATOM 745 O LYS B 11 3.872 6.916 -9.040 1.00 0.00 O ATOM 746 CB LYS B 11 6.328 5.863 -10.925 1.00 0.00 C ATOM 747 CG LYS B 11 5.555 5.414 -12.164 1.00 0.00 C ATOM 748 CD LYS B 11 4.276 4.637 -11.820 1.00 0.00 C ATOM 749 CE LYS B 11 3.750 3.921 -13.065 1.00 0.00 C ATOM 750 NZ LYS B 11 3.439 4.866 -14.157 1.00 0.00 N ATOM 0 H LYS B 11 6.648 6.407 -8.542 1.00 0.00 H new ATOM 0 HA LYS B 11 6.149 7.996 -10.997 1.00 0.00 H new ATOM 0 HB2 LYS B 11 7.383 5.940 -11.186 1.00 0.00 H new ATOM 0 HB3 LYS B 11 6.244 5.086 -10.165 1.00 0.00 H new ATOM 0 HG2 LYS B 11 5.294 6.288 -12.760 1.00 0.00 H new ATOM 0 HG3 LYS B 11 6.199 4.788 -12.781 1.00 0.00 H new ATOM 0 HD2 LYS B 11 4.482 3.912 -11.033 1.00 0.00 H new ATOM 0 HD3 LYS B 11 3.518 5.319 -11.435 1.00 0.00 H new ATOM 0 HE2 LYS B 11 4.492 3.200 -13.409 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.854 3.357 -12.807 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 2.844 4.393 -14.867 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 2.931 5.687 -13.771 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 4.323 5.184 -14.603 1.00 0.00 H new ATOM 764 N THR B 12 3.660 7.782 -11.098 1.00 0.00 N ATOM 765 CA THR B 12 2.232 8.014 -10.990 1.00 0.00 C ATOM 766 C THR B 12 1.500 7.154 -12.004 1.00 0.00 C ATOM 767 O THR B 12 1.925 7.027 -13.152 1.00 0.00 O ATOM 768 CB THR B 12 1.959 9.500 -11.228 1.00 0.00 C ATOM 769 OG1 THR B 12 2.588 10.268 -10.225 1.00 0.00 O ATOM 770 CG2 THR B 12 0.462 9.797 -11.203 1.00 0.00 C ATOM 0 H THR B 12 4.054 8.031 -12.005 1.00 0.00 H new ATOM 0 HA THR B 12 1.874 7.743 -9.997 1.00 0.00 H new ATOM 0 HB THR B 12 2.356 9.759 -12.210 1.00 0.00 H new ATOM 0 HG1 THR B 12 2.412 11.219 -10.383 1.00 0.00 H new ATOM 0 HG21 THR B 12 0.299 10.861 -11.375 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.036 9.223 -11.984 1.00 0.00 H new ATOM 0 HG23 THR B 12 0.052 9.520 -10.232 1.00 0.00 H new ATOM 778 N ILE B 13 0.394 6.560 -11.561 1.00 0.00 N ATOM 779 CA ILE B 13 -0.473 5.745 -12.392 1.00 0.00 C ATOM 780 C ILE B 13 -1.751 6.546 -12.594 1.00 0.00 C ATOM 781 O ILE B 13 -2.137 7.315 -11.717 1.00 0.00 O ATOM 782 CB ILE B 13 -0.774 4.418 -11.680 1.00 0.00 C ATOM 783 CG1 ILE B 13 0.494 3.797 -11.076 1.00 0.00 C ATOM 784 CG2 ILE B 13 -1.408 3.441 -12.675 1.00 0.00 C ATOM 785 CD1 ILE B 13 0.142 2.686 -10.088 1.00 0.00 C ATOM 0 H ILE B 13 0.074 6.636 -10.595 1.00 0.00 H new ATOM 0 HA ILE B 13 -0.008 5.508 -13.349 1.00 0.00 H new ATOM 0 HB ILE B 13 -1.465 4.620 -10.862 1.00 0.00 H new ATOM 0 HG12 ILE B 13 1.121 3.396 -11.872 1.00 0.00 H new ATOM 0 HG13 ILE B 13 1.075 4.568 -10.570 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.623 2.498 -12.172 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -2.335 3.865 -13.062 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -0.718 3.263 -13.500 1.00 0.00 H new ATOM 0 HD11 ILE B 13 1.058 2.263 -9.675 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.465 3.096 -9.281 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.418 1.905 -10.603 1.00 0.00 H new ATOM 797 N THR B 14 -2.420 6.385 -13.737 1.00 0.00 N ATOM 798 CA THR B 14 -3.604 7.184 -14.026 1.00 0.00 C ATOM 799 C THR B 14 -4.654 6.349 -14.749 1.00 0.00 C ATOM 800 O THR B 14 -4.455 5.947 -15.894 1.00 0.00 O ATOM 801 CB THR B 14 -3.217 8.412 -14.853 1.00 0.00 C ATOM 802 OG1 THR B 14 -2.121 9.081 -14.268 1.00 0.00 O ATOM 803 CG2 THR B 14 -4.399 9.370 -14.901 1.00 0.00 C ATOM 0 H THR B 14 -2.165 5.718 -14.465 1.00 0.00 H new ATOM 0 HA THR B 14 -4.038 7.522 -13.085 1.00 0.00 H new ATOM 0 HB THR B 14 -2.943 8.085 -15.856 1.00 0.00 H new ATOM 0 HG1 THR B 14 -1.887 9.862 -14.811 1.00 0.00 H new ATOM 0 HG21 THR B 14 -4.132 10.248 -15.489 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.253 8.872 -15.361 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.660 9.677 -13.888 1.00 0.00 H new ATOM 811 N LEU B 15 -5.769 6.096 -14.066 1.00 0.00 N ATOM 812 CA LEU B 15 -6.864 5.269 -14.552 1.00 0.00 C ATOM 813 C LEU B 15 -8.182 5.903 -14.144 1.00 0.00 C ATOM 814 O LEU B 15 -8.257 6.657 -13.174 1.00 0.00 O ATOM 815 CB LEU B 15 -6.718 3.803 -14.082 1.00 0.00 C ATOM 816 CG LEU B 15 -6.373 3.522 -12.607 1.00 0.00 C ATOM 817 CD1 LEU B 15 -5.038 4.104 -12.155 1.00 0.00 C ATOM 818 CD2 LEU B 15 -7.468 3.987 -11.659 1.00 0.00 C ATOM 0 H LEU B 15 -5.937 6.473 -13.133 1.00 0.00 H new ATOM 0 HA LEU B 15 -6.838 5.224 -15.641 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -7.655 3.292 -14.304 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -5.947 3.336 -14.695 1.00 0.00 H new ATOM 0 HG LEU B 15 -6.288 2.436 -12.560 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -4.872 3.861 -11.106 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -4.234 3.681 -12.757 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -5.053 5.187 -12.279 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -7.178 3.767 -10.632 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -7.615 5.061 -11.772 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -8.397 3.467 -11.893 1.00 0.00 H new ATOM 830 N GLU B 16 -9.227 5.588 -14.902 1.00 0.00 N ATOM 831 CA GLU B 16 -10.499 6.264 -14.796 1.00 0.00 C ATOM 832 C GLU B 16 -11.379 5.600 -13.752 1.00 0.00 C ATOM 833 O GLU B 16 -11.294 4.395 -13.522 1.00 0.00 O ATOM 834 CB GLU B 16 -11.196 6.204 -16.149 1.00 0.00 C ATOM 835 CG GLU B 16 -10.322 6.804 -17.255 1.00 0.00 C ATOM 836 CD GLU B 16 -9.091 5.967 -17.596 1.00 0.00 C ATOM 837 OE1 GLU B 16 -9.250 4.737 -17.758 1.00 0.00 O ATOM 838 OE2 GLU B 16 -8.001 6.569 -17.689 1.00 0.00 O ATOM 0 H GLU B 16 -9.207 4.852 -15.608 1.00 0.00 H new ATOM 0 HA GLU B 16 -10.328 7.298 -14.496 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -11.433 5.168 -16.392 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.142 6.744 -16.097 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -10.925 6.927 -18.154 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -9.999 7.799 -16.949 1.00 0.00 H new ATOM 845 N VAL B 17 -12.229 6.407 -13.125 1.00 0.00 N ATOM 846 CA VAL B 17 -13.066 5.960 -12.013 1.00 0.00 C ATOM 847 C VAL B 17 -14.365 6.756 -11.950 1.00 0.00 C ATOM 848 O VAL B 17 -14.566 7.684 -12.730 1.00 0.00 O ATOM 849 CB VAL B 17 -12.313 6.122 -10.687 1.00 0.00 C ATOM 850 CG1 VAL B 17 -11.086 5.215 -10.596 1.00 0.00 C ATOM 851 CG2 VAL B 17 -11.869 7.573 -10.486 1.00 0.00 C ATOM 0 H VAL B 17 -12.358 7.388 -13.372 1.00 0.00 H new ATOM 0 HA VAL B 17 -13.304 4.909 -12.177 1.00 0.00 H new ATOM 0 HB VAL B 17 -13.013 5.832 -9.903 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -10.590 5.369 -9.638 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -11.396 4.174 -10.680 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -10.396 5.454 -11.405 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -11.337 7.663 -9.539 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -11.209 7.868 -11.302 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -12.744 8.223 -10.474 1.00 0.00 H new ATOM 861 N GLU B 18 -15.252 6.393 -11.019 1.00 0.00 N ATOM 862 CA GLU B 18 -16.548 7.043 -10.875 1.00 0.00 C ATOM 863 C GLU B 18 -16.933 7.118 -9.398 1.00 0.00 C ATOM 864 O GLU B 18 -16.407 6.358 -8.587 1.00 0.00 O ATOM 865 CB GLU B 18 -17.606 6.234 -11.632 1.00 0.00 C ATOM 866 CG GLU B 18 -17.263 6.142 -13.115 1.00 0.00 C ATOM 867 CD GLU B 18 -18.375 5.453 -13.905 1.00 0.00 C ATOM 868 OE1 GLU B 18 -19.482 6.031 -13.968 1.00 0.00 O ATOM 869 OE2 GLU B 18 -18.112 4.354 -14.443 1.00 0.00 O ATOM 0 H GLU B 18 -15.088 5.642 -10.348 1.00 0.00 H new ATOM 0 HA GLU B 18 -16.490 8.052 -11.283 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -17.676 5.232 -11.208 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -18.583 6.701 -11.509 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -17.098 7.143 -13.514 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -16.331 5.591 -13.241 1.00 0.00 H new ATOM 876 N PRO B 19 -17.851 8.024 -9.041 1.00 0.00 N ATOM 877 CA PRO B 19 -18.363 8.153 -7.686 1.00 0.00 C ATOM 878 C PRO B 19 -19.257 6.972 -7.313 1.00 0.00 C ATOM 879 O PRO B 19 -19.857 6.970 -6.238 1.00 0.00 O ATOM 880 CB PRO B 19 -19.152 9.461 -7.671 1.00 0.00 C ATOM 881 CG PRO B 19 -19.574 9.654 -9.127 1.00 0.00 C ATOM 882 CD PRO B 19 -18.457 8.998 -9.933 1.00 0.00 C ATOM 0 HA PRO B 19 -17.554 8.159 -6.955 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -20.016 9.398 -7.010 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -18.541 10.292 -7.319 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -20.537 9.185 -9.327 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -19.676 10.711 -9.375 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -18.850 8.518 -10.829 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -17.726 9.736 -10.262 1.00 0.00 H new ATOM 890 N SER B 20 -19.347 5.974 -8.193 1.00 0.00 N ATOM 891 CA SER B 20 -20.120 4.767 -7.955 1.00 0.00 C ATOM 892 C SER B 20 -19.200 3.551 -7.985 1.00 0.00 C ATOM 893 O SER B 20 -19.650 2.431 -7.746 1.00 0.00 O ATOM 894 CB SER B 20 -21.243 4.640 -8.981 1.00 0.00 C ATOM 895 OG SER B 20 -22.098 5.764 -8.913 1.00 0.00 O ATOM 0 H SER B 20 -18.878 5.987 -9.099 1.00 0.00 H new ATOM 0 HA SER B 20 -20.581 4.824 -6.969 1.00 0.00 H new ATOM 0 HB2 SER B 20 -20.822 4.555 -9.983 1.00 0.00 H new ATOM 0 HB3 SER B 20 -21.813 3.729 -8.796 1.00 0.00 H new ATOM 0 HG SER B 20 -22.813 5.672 -9.577 1.00 0.00 H new ATOM 901 N ASP B 21 -17.911 3.763 -8.275 1.00 0.00 N ATOM 902 CA ASP B 21 -16.904 2.747 -8.101 1.00 0.00 C ATOM 903 C ASP B 21 -16.525 2.778 -6.631 1.00 0.00 C ATOM 904 O ASP B 21 -16.955 3.638 -5.864 1.00 0.00 O ATOM 905 CB ASP B 21 -15.675 3.025 -8.969 1.00 0.00 C ATOM 906 CG ASP B 21 -15.937 2.835 -10.460 1.00 0.00 C ATOM 907 OD1 ASP B 21 -17.119 2.786 -10.859 1.00 0.00 O ATOM 908 OD2 ASP B 21 -14.930 2.733 -11.194 1.00 0.00 O ATOM 0 H ASP B 21 -17.552 4.647 -8.635 1.00 0.00 H new ATOM 0 HA ASP B 21 -17.285 1.771 -8.402 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -15.338 4.046 -8.793 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -14.864 2.364 -8.662 1.00 0.00 H new ATOM 913 N THR B 22 -15.706 1.813 -6.256 1.00 0.00 N ATOM 914 CA THR B 22 -15.302 1.562 -4.886 1.00 0.00 C ATOM 915 C THR B 22 -13.800 1.317 -4.851 1.00 0.00 C ATOM 916 O THR B 22 -13.174 1.169 -5.898 1.00 0.00 O ATOM 917 CB THR B 22 -16.089 0.367 -4.336 1.00 0.00 C ATOM 918 OG1 THR B 22 -15.708 0.099 -3.007 1.00 0.00 O ATOM 919 CG2 THR B 22 -15.858 -0.891 -5.173 1.00 0.00 C ATOM 0 H THR B 22 -15.290 1.160 -6.920 1.00 0.00 H new ATOM 0 HA THR B 22 -15.520 2.423 -4.254 1.00 0.00 H new ATOM 0 HB THR B 22 -17.146 0.631 -4.378 1.00 0.00 H new ATOM 0 HG1 THR B 22 -16.111 0.764 -2.411 1.00 0.00 H new ATOM 0 HG21 THR B 22 -16.432 -1.718 -4.753 1.00 0.00 H new ATOM 0 HG22 THR B 22 -16.180 -0.710 -6.199 1.00 0.00 H new ATOM 0 HG23 THR B 22 -14.798 -1.144 -5.165 1.00 0.00 H new ATOM 927 N ILE B 23 -13.211 1.270 -3.657 1.00 0.00 N ATOM 928 CA ILE B 23 -11.781 1.067 -3.520 1.00 0.00 C ATOM 929 C ILE B 23 -11.353 -0.219 -4.223 1.00 0.00 C ATOM 930 O ILE B 23 -10.256 -0.289 -4.773 1.00 0.00 O ATOM 931 CB ILE B 23 -11.429 1.024 -2.033 1.00 0.00 C ATOM 932 CG1 ILE B 23 -11.885 2.286 -1.286 1.00 0.00 C ATOM 933 CG2 ILE B 23 -9.921 0.841 -1.882 1.00 0.00 C ATOM 934 CD1 ILE B 23 -11.513 3.588 -2.005 1.00 0.00 C ATOM 0 H ILE B 23 -13.709 1.371 -2.772 1.00 0.00 H new ATOM 0 HA ILE B 23 -11.245 1.891 -3.991 1.00 0.00 H new ATOM 0 HB ILE B 23 -11.960 0.183 -1.587 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -12.966 2.249 -1.153 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -11.441 2.290 -0.290 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -9.662 0.809 -0.824 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -9.618 -0.092 -2.357 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -9.404 1.675 -2.357 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -11.865 4.439 -1.422 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -10.430 3.647 -2.115 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -11.979 3.605 -2.990 1.00 0.00 H new ATOM 946 N GLU B 24 -12.211 -1.243 -4.212 1.00 0.00 N ATOM 947 CA GLU B 24 -11.915 -2.504 -4.877 1.00 0.00 C ATOM 948 C GLU B 24 -11.796 -2.311 -6.391 1.00 0.00 C ATOM 949 O GLU B 24 -11.020 -3.007 -7.043 1.00 0.00 O ATOM 950 CB GLU B 24 -13.016 -3.508 -4.530 1.00 0.00 C ATOM 951 CG GLU B 24 -12.891 -4.762 -5.393 1.00 0.00 C ATOM 952 CD GLU B 24 -13.756 -5.891 -4.844 1.00 0.00 C ATOM 953 OE1 GLU B 24 -14.956 -5.932 -5.201 1.00 0.00 O ATOM 954 OE2 GLU B 24 -13.209 -6.709 -4.070 1.00 0.00 O ATOM 0 H GLU B 24 -13.118 -1.218 -3.747 1.00 0.00 H new ATOM 0 HA GLU B 24 -10.955 -2.886 -4.530 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -12.951 -3.777 -3.476 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -13.994 -3.051 -4.682 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -13.190 -4.535 -6.416 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -11.849 -5.081 -5.428 1.00 0.00 H new ATOM 961 N ASN B 25 -12.555 -1.370 -6.957 1.00 0.00 N ATOM 962 CA ASN B 25 -12.486 -1.069 -8.376 1.00 0.00 C ATOM 963 C ASN B 25 -11.191 -0.323 -8.674 1.00 0.00 C ATOM 964 O ASN B 25 -10.571 -0.559 -9.708 1.00 0.00 O ATOM 965 CB ASN B 25 -13.680 -0.198 -8.775 1.00 0.00 C ATOM 966 CG ASN B 25 -14.588 -0.881 -9.785 1.00 0.00 C ATOM 967 OD1 ASN B 25 -14.826 -2.084 -9.707 1.00 0.00 O ATOM 968 ND2 ASN B 25 -15.099 -0.116 -10.742 1.00 0.00 N ATOM 0 H ASN B 25 -13.228 -0.802 -6.443 1.00 0.00 H new ATOM 0 HA ASN B 25 -12.510 -1.998 -8.945 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -14.256 0.053 -7.884 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -13.317 0.740 -9.194 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -15.713 -0.523 -11.447 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -14.877 0.879 -10.772 1.00 0.00 H new ATOM 975 N VAL B 26 -10.782 0.575 -7.775 1.00 0.00 N ATOM 976 CA VAL B 26 -9.557 1.335 -7.958 1.00 0.00 C ATOM 977 C VAL B 26 -8.362 0.390 -7.935 1.00 0.00 C ATOM 978 O VAL B 26 -7.443 0.541 -8.735 1.00 0.00 O ATOM 979 CB VAL B 26 -9.445 2.412 -6.877 1.00 0.00 C ATOM 980 CG1 VAL B 26 -8.170 3.228 -7.083 1.00 0.00 C ATOM 981 CG2 VAL B 26 -10.641 3.364 -6.958 1.00 0.00 C ATOM 0 H VAL B 26 -11.286 0.789 -6.914 1.00 0.00 H new ATOM 0 HA VAL B 26 -9.574 1.837 -8.926 1.00 0.00 H new ATOM 0 HB VAL B 26 -9.423 1.920 -5.904 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -8.098 3.992 -6.309 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -7.303 2.570 -7.024 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -8.198 3.705 -8.063 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -10.552 4.127 -6.185 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -10.660 3.841 -7.938 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -11.564 2.803 -6.809 1.00 0.00 H new ATOM 991 N LYS B 27 -8.366 -0.592 -7.026 1.00 0.00 N ATOM 992 CA LYS B 27 -7.305 -1.588 -6.980 1.00 0.00 C ATOM 993 C LYS B 27 -7.324 -2.456 -8.233 1.00 0.00 C ATOM 994 O LYS B 27 -6.273 -2.899 -8.688 1.00 0.00 O ATOM 995 CB LYS B 27 -7.458 -2.474 -5.741 1.00 0.00 C ATOM 996 CG LYS B 27 -7.210 -1.698 -4.447 1.00 0.00 C ATOM 997 CD LYS B 27 -7.391 -2.652 -3.264 1.00 0.00 C ATOM 998 CE LYS B 27 -7.058 -1.946 -1.954 1.00 0.00 C ATOM 999 NZ LYS B 27 -7.150 -2.880 -0.816 1.00 0.00 N ATOM 0 H LYS B 27 -9.091 -0.713 -6.319 1.00 0.00 H new ATOM 0 HA LYS B 27 -6.352 -1.062 -6.930 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -8.461 -2.900 -5.722 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -6.759 -3.308 -5.803 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -6.204 -1.278 -4.444 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -7.904 -0.862 -4.368 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -8.418 -3.017 -3.237 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -6.747 -3.522 -3.389 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -6.053 -1.528 -2.007 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -7.743 -1.112 -1.801 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -7.691 -2.437 -0.046 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -7.630 -3.751 -1.120 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -6.194 -3.111 -0.479 1.00 0.00 H new ATOM 1013 N ALA B 28 -8.509 -2.704 -8.800 1.00 0.00 N ATOM 1014 CA ALA B 28 -8.642 -3.516 -9.997 1.00 0.00 C ATOM 1015 C ALA B 28 -8.160 -2.765 -11.237 1.00 0.00 C ATOM 1016 O ALA B 28 -7.672 -3.386 -12.178 1.00 0.00 O ATOM 1017 CB ALA B 28 -10.113 -3.911 -10.149 1.00 0.00 C ATOM 0 H ALA B 28 -9.393 -2.347 -8.439 1.00 0.00 H new ATOM 0 HA ALA B 28 -8.020 -4.406 -9.899 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -10.235 -4.522 -11.043 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -10.429 -4.480 -9.275 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -10.724 -3.013 -10.237 1.00 0.00 H new ATOM 1023 N LYS B 29 -8.287 -1.433 -11.247 1.00 0.00 N ATOM 1024 CA LYS B 29 -7.779 -0.617 -12.343 1.00 0.00 C ATOM 1025 C LYS B 29 -6.265 -0.478 -12.223 1.00 0.00 C ATOM 1026 O LYS B 29 -5.574 -0.380 -13.233 1.00 0.00 O ATOM 1027 CB LYS B 29 -8.442 0.761 -12.300 1.00 0.00 C ATOM 1028 CG LYS B 29 -9.936 0.660 -12.611 1.00 0.00 C ATOM 1029 CD LYS B 29 -10.710 1.709 -11.814 1.00 0.00 C ATOM 1030 CE LYS B 29 -12.218 1.506 -11.957 1.00 0.00 C ATOM 1031 NZ LYS B 29 -12.700 1.954 -13.275 1.00 0.00 N ATOM 0 H LYS B 29 -8.739 -0.901 -10.504 1.00 0.00 H new ATOM 0 HA LYS B 29 -8.013 -1.096 -13.294 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -8.301 1.206 -11.315 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -7.961 1.423 -13.020 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -10.104 0.806 -13.678 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -10.300 -0.337 -12.364 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -10.430 1.651 -10.762 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.440 2.706 -12.161 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -12.459 0.452 -11.819 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -12.736 2.057 -11.172 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -13.734 2.060 -13.249 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -12.264 2.868 -13.512 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -12.442 1.251 -13.996 1.00 0.00 H new ATOM 1045 N ILE B 30 -5.742 -0.474 -10.993 1.00 0.00 N ATOM 1046 CA ILE B 30 -4.306 -0.480 -10.761 1.00 0.00 C ATOM 1047 C ILE B 30 -3.749 -1.862 -11.096 1.00 0.00 C ATOM 1048 O ILE B 30 -2.604 -1.983 -11.525 1.00 0.00 O ATOM 1049 CB ILE B 30 -4.028 -0.112 -9.299 1.00 0.00 C ATOM 1050 CG1 ILE B 30 -4.422 1.351 -9.069 1.00 0.00 C ATOM 1051 CG2 ILE B 30 -2.554 -0.307 -8.950 1.00 0.00 C ATOM 1052 CD1 ILE B 30 -4.551 1.653 -7.576 1.00 0.00 C ATOM 0 H ILE B 30 -6.302 -0.467 -10.141 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.816 0.254 -11.400 1.00 0.00 H new ATOM 0 HB ILE B 30 -4.616 -0.767 -8.657 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.674 2.007 -9.514 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -5.367 1.560 -9.569 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -2.388 -0.038 -7.907 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -2.279 -1.350 -9.104 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -1.941 0.328 -9.590 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -4.831 2.697 -7.439 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -5.317 1.011 -7.140 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -3.597 1.466 -7.083 1.00 0.00 H new ATOM 1064 N GLN B 31 -4.554 -2.910 -10.908 1.00 0.00 N ATOM 1065 CA GLN B 31 -4.162 -4.256 -11.285 1.00 0.00 C ATOM 1066 C GLN B 31 -4.125 -4.388 -12.810 1.00 0.00 C ATOM 1067 O GLN B 31 -3.592 -5.348 -13.361 1.00 0.00 O ATOM 1068 CB GLN B 31 -5.123 -5.269 -10.656 1.00 0.00 C ATOM 1069 CG GLN B 31 -4.606 -6.647 -11.043 1.00 0.00 C ATOM 1070 CD GLN B 31 -5.087 -7.779 -10.159 1.00 0.00 C ATOM 1071 OE1 GLN B 31 -6.233 -7.803 -9.719 1.00 0.00 O ATOM 1072 NE2 GLN B 31 -4.199 -8.731 -9.894 1.00 0.00 N ATOM 0 H GLN B 31 -5.484 -2.844 -10.494 1.00 0.00 H new ATOM 0 HA GLN B 31 -3.159 -4.462 -10.911 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -5.153 -5.155 -9.572 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -6.139 -5.119 -11.020 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -4.904 -6.856 -12.070 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.516 -6.629 -11.025 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -3.257 -8.672 -10.281 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -4.459 -9.521 -9.304 1.00 0.00 H new ATOM 1081 N ASP B 32 -4.694 -3.405 -13.501 1.00 0.00 N ATOM 1082 CA ASP B 32 -4.693 -3.352 -14.952 1.00 0.00 C ATOM 1083 C ASP B 32 -3.475 -2.578 -15.438 1.00 0.00 C ATOM 1084 O ASP B 32 -2.853 -2.928 -16.440 1.00 0.00 O ATOM 1085 CB ASP B 32 -5.942 -2.602 -15.401 1.00 0.00 C ATOM 1086 CG ASP B 32 -6.450 -3.126 -16.741 1.00 0.00 C ATOM 1087 OD1 ASP B 32 -7.096 -4.199 -16.736 1.00 0.00 O ATOM 1088 OD2 ASP B 32 -6.190 -2.452 -17.761 1.00 0.00 O ATOM 0 H ASP B 32 -5.172 -2.618 -13.062 1.00 0.00 H new ATOM 0 HA ASP B 32 -4.672 -4.364 -15.357 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -6.723 -2.707 -14.647 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -5.720 -1.538 -15.484 1.00 0.00 H new ATOM 1093 N LYS B 33 -3.149 -1.512 -14.700 1.00 0.00 N ATOM 1094 CA LYS B 33 -2.055 -0.613 -15.018 1.00 0.00 C ATOM 1095 C LYS B 33 -0.690 -1.174 -14.640 1.00 0.00 C ATOM 1096 O LYS B 33 0.297 -0.876 -15.312 1.00 0.00 O ATOM 1097 CB LYS B 33 -2.288 0.681 -14.247 1.00 0.00 C ATOM 1098 CG LYS B 33 -3.422 1.511 -14.845 1.00 0.00 C ATOM 1099 CD LYS B 33 -3.033 2.069 -16.212 1.00 0.00 C ATOM 1100 CE LYS B 33 -4.077 3.098 -16.623 1.00 0.00 C ATOM 1101 NZ LYS B 33 -3.861 3.572 -18.003 1.00 0.00 N ATOM 0 H LYS B 33 -3.652 -1.252 -13.852 1.00 0.00 H new ATOM 0 HA LYS B 33 -2.043 -0.459 -16.097 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -2.520 0.446 -13.208 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -1.371 1.270 -14.244 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -4.316 0.895 -14.941 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -3.671 2.331 -14.171 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.045 2.527 -16.168 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -2.980 1.267 -16.948 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.072 2.660 -16.540 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -4.043 3.945 -15.938 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.591 4.271 -18.248 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -2.921 4.012 -18.076 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -3.918 2.767 -18.659 1.00 0.00 H new ATOM 1115 N GLU B 34 -0.623 -1.978 -13.576 1.00 0.00 N ATOM 1116 CA GLU B 34 0.642 -2.509 -13.086 1.00 0.00 C ATOM 1117 C GLU B 34 0.604 -4.013 -12.811 1.00 0.00 C ATOM 1118 O GLU B 34 1.650 -4.627 -12.612 1.00 0.00 O ATOM 1119 CB GLU B 34 0.985 -1.784 -11.789 1.00 0.00 C ATOM 1120 CG GLU B 34 1.306 -0.303 -12.012 1.00 0.00 C ATOM 1121 CD GLU B 34 2.545 -0.097 -12.888 1.00 0.00 C ATOM 1122 OE1 GLU B 34 3.462 -0.946 -12.814 1.00 0.00 O ATOM 1123 OE2 GLU B 34 2.565 0.912 -13.628 1.00 0.00 O ATOM 0 H GLU B 34 -1.437 -2.274 -13.038 1.00 0.00 H new ATOM 0 HA GLU B 34 1.390 -2.348 -13.863 1.00 0.00 H new ATOM 0 HB2 GLU B 34 0.148 -1.871 -11.096 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.840 -2.271 -11.319 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.450 0.185 -12.478 1.00 0.00 H new ATOM 0 HG3 GLU B 34 1.462 0.181 -11.048 1.00 0.00 H new ATOM 1130 N GLY B 35 -0.589 -4.614 -12.797 1.00 0.00 N ATOM 1131 CA GLY B 35 -0.725 -6.043 -12.525 1.00 0.00 C ATOM 1132 C GLY B 35 -0.560 -6.356 -11.042 1.00 0.00 C ATOM 1133 O GLY B 35 -0.353 -7.510 -10.673 1.00 0.00 O ATOM 0 H GLY B 35 -1.471 -4.132 -12.971 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -1.703 -6.385 -12.862 1.00 0.00 H new ATOM 0 HA3 GLY B 35 0.020 -6.594 -13.098 1.00 0.00 H new ATOM 1137 N ILE B 36 -0.648 -5.330 -10.191 1.00 0.00 N ATOM 1138 CA ILE B 36 -0.455 -5.486 -8.757 1.00 0.00 C ATOM 1139 C ILE B 36 -1.680 -6.173 -8.162 1.00 0.00 C ATOM 1140 O ILE B 36 -2.808 -5.823 -8.503 1.00 0.00 O ATOM 1141 CB ILE B 36 -0.260 -4.108 -8.115 1.00 0.00 C ATOM 1142 CG1 ILE B 36 1.059 -3.506 -8.607 1.00 0.00 C ATOM 1143 CG2 ILE B 36 -0.210 -4.207 -6.588 1.00 0.00 C ATOM 1144 CD1 ILE B 36 1.077 -1.993 -8.383 1.00 0.00 C ATOM 0 H ILE B 36 -0.854 -4.374 -10.481 1.00 0.00 H new ATOM 0 HA ILE B 36 0.429 -6.094 -8.564 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.104 -3.480 -8.398 1.00 0.00 H new ATOM 0 HG12 ILE B 36 1.894 -3.967 -8.080 1.00 0.00 H new ATOM 0 HG13 ILE B 36 1.191 -3.724 -9.667 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -0.071 -3.213 -6.163 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -1.144 -4.631 -6.220 1.00 0.00 H new ATOM 0 HG23 ILE B 36 0.621 -4.848 -6.292 1.00 0.00 H new ATOM 0 HD11 ILE B 36 2.022 -1.584 -8.739 1.00 0.00 H new ATOM 0 HD12 ILE B 36 0.254 -1.534 -8.931 1.00 0.00 H new ATOM 0 HD13 ILE B 36 0.968 -1.781 -7.319 1.00 0.00 H new ATOM 1156 N PRO B 37 -1.479 -7.150 -7.273 1.00 0.00 N ATOM 1157 CA PRO B 37 -2.562 -7.869 -6.635 1.00 0.00 C ATOM 1158 C PRO B 37 -3.297 -6.950 -5.661 1.00 0.00 C ATOM 1159 O PRO B 37 -2.669 -6.371 -4.776 1.00 0.00 O ATOM 1160 CB PRO B 37 -1.895 -9.031 -5.898 1.00 0.00 C ATOM 1161 CG PRO B 37 -0.475 -8.533 -5.632 1.00 0.00 C ATOM 1162 CD PRO B 37 -0.184 -7.621 -6.820 1.00 0.00 C ATOM 0 HA PRO B 37 -3.303 -8.225 -7.351 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -2.416 -9.267 -4.970 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -1.893 -9.938 -6.502 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -0.410 -7.993 -4.687 1.00 0.00 H new ATOM 0 HG3 PRO B 37 0.235 -9.358 -5.577 1.00 0.00 H new ATOM 0 HD2 PRO B 37 0.456 -6.789 -6.528 1.00 0.00 H new ATOM 0 HD3 PRO B 37 0.336 -8.161 -7.611 1.00 0.00 H new ATOM 1170 N PRO B 38 -4.620 -6.808 -5.802 1.00 0.00 N ATOM 1171 CA PRO B 38 -5.460 -6.075 -4.864 1.00 0.00 C ATOM 1172 C PRO B 38 -5.291 -6.570 -3.428 1.00 0.00 C ATOM 1173 O PRO B 38 -5.572 -5.831 -2.487 1.00 0.00 O ATOM 1174 CB PRO B 38 -6.899 -6.268 -5.359 1.00 0.00 C ATOM 1175 CG PRO B 38 -6.814 -7.464 -6.307 1.00 0.00 C ATOM 1176 CD PRO B 38 -5.421 -7.325 -6.892 1.00 0.00 C ATOM 0 HA PRO B 38 -5.182 -5.021 -4.834 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -7.581 -6.464 -4.532 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -7.266 -5.379 -5.872 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -6.939 -8.409 -5.779 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -7.583 -7.425 -7.078 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -5.041 -8.284 -7.244 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -5.415 -6.647 -7.746 1.00 0.00 H new ATOM 1184 N ASP B 39 -4.833 -7.813 -3.258 1.00 0.00 N ATOM 1185 CA ASP B 39 -4.557 -8.378 -1.944 1.00 0.00 C ATOM 1186 C ASP B 39 -3.365 -7.692 -1.265 1.00 0.00 C ATOM 1187 O ASP B 39 -3.222 -7.769 -0.044 1.00 0.00 O ATOM 1188 CB ASP B 39 -4.296 -9.876 -2.090 1.00 0.00 C ATOM 1189 CG ASP B 39 -4.064 -10.541 -0.736 1.00 0.00 C ATOM 1190 OD1 ASP B 39 -5.070 -10.795 -0.036 1.00 0.00 O ATOM 1191 OD2 ASP B 39 -2.884 -10.794 -0.410 1.00 0.00 O ATOM 0 H ASP B 39 -4.645 -8.452 -4.030 1.00 0.00 H new ATOM 0 HA ASP B 39 -5.426 -8.211 -1.308 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -5.144 -10.347 -2.587 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -3.426 -10.034 -2.727 1.00 0.00 H new ATOM 1196 N GLN B 40 -2.508 -7.022 -2.042 1.00 0.00 N ATOM 1197 CA GLN B 40 -1.352 -6.323 -1.492 1.00 0.00 C ATOM 1198 C GLN B 40 -1.508 -4.810 -1.577 1.00 0.00 C ATOM 1199 O GLN B 40 -0.756 -4.088 -0.930 1.00 0.00 O ATOM 1200 CB GLN B 40 -0.077 -6.756 -2.224 1.00 0.00 C ATOM 1201 CG GLN B 40 0.146 -8.251 -1.995 1.00 0.00 C ATOM 1202 CD GLN B 40 1.369 -8.807 -2.714 1.00 0.00 C ATOM 1203 OE1 GLN B 40 1.309 -9.883 -3.304 1.00 0.00 O ATOM 1204 NE2 GLN B 40 2.490 -8.096 -2.679 1.00 0.00 N ATOM 0 H GLN B 40 -2.597 -6.952 -3.056 1.00 0.00 H new ATOM 0 HA GLN B 40 -1.279 -6.591 -0.438 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -0.166 -6.548 -3.290 1.00 0.00 H new ATOM 0 HB3 GLN B 40 0.778 -6.188 -1.859 1.00 0.00 H new ATOM 0 HG2 GLN B 40 0.250 -8.434 -0.926 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -0.738 -8.796 -2.327 1.00 0.00 H new ATOM 0 HE21 GLN B 40 2.514 -7.205 -2.182 1.00 0.00 H new ATOM 0 HE22 GLN B 40 3.327 -8.440 -3.149 1.00 0.00 H new ATOM 1213 N GLN B 41 -2.467 -4.313 -2.359 1.00 0.00 N ATOM 1214 CA GLN B 41 -2.662 -2.879 -2.481 1.00 0.00 C ATOM 1215 C GLN B 41 -3.244 -2.291 -1.199 1.00 0.00 C ATOM 1216 O GLN B 41 -4.075 -2.908 -0.535 1.00 0.00 O ATOM 1217 CB GLN B 41 -3.589 -2.570 -3.656 1.00 0.00 C ATOM 1218 CG GLN B 41 -2.901 -2.916 -4.976 1.00 0.00 C ATOM 1219 CD GLN B 41 -3.737 -2.466 -6.163 1.00 0.00 C ATOM 1220 OE1 GLN B 41 -4.180 -1.324 -6.209 1.00 0.00 O ATOM 1221 NE2 GLN B 41 -3.960 -3.354 -7.127 1.00 0.00 N ATOM 0 H GLN B 41 -3.112 -4.880 -2.910 1.00 0.00 H new ATOM 0 HA GLN B 41 -1.688 -2.423 -2.658 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -4.513 -3.140 -3.559 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -3.862 -1.515 -3.645 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -1.922 -2.439 -5.015 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -2.734 -3.992 -5.032 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -3.574 -4.295 -7.053 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -4.517 -3.094 -7.941 1.00 0.00 H new ATOM 1230 N ARG B 42 -2.791 -1.079 -0.872 1.00 0.00 N ATOM 1231 CA ARG B 42 -3.288 -0.291 0.248 1.00 0.00 C ATOM 1232 C ARG B 42 -3.372 1.173 -0.172 1.00 0.00 C ATOM 1233 O ARG B 42 -2.473 1.963 0.106 1.00 0.00 O ATOM 1234 CB ARG B 42 -2.363 -0.423 1.455 1.00 0.00 C ATOM 1235 CG ARG B 42 -2.265 -1.859 1.974 1.00 0.00 C ATOM 1236 CD ARG B 42 -1.326 -1.905 3.179 1.00 0.00 C ATOM 1237 NE ARG B 42 -1.849 -1.116 4.300 1.00 0.00 N ATOM 1238 CZ ARG B 42 -1.298 -1.086 5.515 1.00 0.00 C ATOM 1239 NH1 ARG B 42 -0.197 -1.784 5.777 1.00 0.00 N ATOM 1240 NH2 ARG B 42 -1.841 -0.353 6.483 1.00 0.00 N ATOM 0 H ARG B 42 -2.050 -0.611 -1.394 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.275 -0.659 0.528 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -1.368 -0.071 1.184 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -2.723 0.224 2.255 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -3.253 -2.223 2.256 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -1.896 -2.517 1.187 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -1.188 -2.939 3.494 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -0.345 -1.525 2.892 1.00 0.00 H new ATOM 0 HE ARG B 42 -2.686 -0.555 4.141 1.00 0.00 H new ATOM 0 HH11 ARG B 42 0.235 -2.349 5.046 1.00 0.00 H new ATOM 0 HH12 ARG B 42 0.216 -1.754 6.709 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -2.684 0.191 6.299 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -1.414 -0.335 7.409 1.00 0.00 H new ATOM 1254 N LEU B 43 -4.460 1.526 -0.849 1.00 0.00 N ATOM 1255 CA LEU B 43 -4.726 2.882 -1.285 1.00 0.00 C ATOM 1256 C LEU B 43 -4.887 3.794 -0.066 1.00 0.00 C ATOM 1257 O LEU B 43 -5.488 3.388 0.927 1.00 0.00 O ATOM 1258 CB LEU B 43 -6.010 2.831 -2.120 1.00 0.00 C ATOM 1259 CG LEU B 43 -6.285 4.140 -2.845 1.00 0.00 C ATOM 1260 CD1 LEU B 43 -5.312 4.324 -4.009 1.00 0.00 C ATOM 1261 CD2 LEU B 43 -7.707 4.126 -3.395 1.00 0.00 C ATOM 0 H LEU B 43 -5.190 0.864 -1.112 1.00 0.00 H new ATOM 0 HA LEU B 43 -3.907 3.285 -1.881 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -5.934 2.024 -2.849 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -6.853 2.595 -1.471 1.00 0.00 H new ATOM 0 HG LEU B 43 -6.159 4.960 -2.138 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -5.524 5.266 -4.515 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -4.290 4.338 -3.630 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -5.427 3.500 -4.713 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -7.905 5.063 -3.915 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -7.820 3.294 -4.091 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -8.414 4.010 -2.573 1.00 0.00 H new ATOM 1273 N ILE B 44 -4.360 5.020 -0.134 1.00 0.00 N ATOM 1274 CA ILE B 44 -4.451 5.978 0.961 1.00 0.00 C ATOM 1275 C ILE B 44 -4.521 7.396 0.409 1.00 0.00 C ATOM 1276 O ILE B 44 -3.680 7.770 -0.408 1.00 0.00 O ATOM 1277 CB ILE B 44 -3.212 5.857 1.857 1.00 0.00 C ATOM 1278 CG1 ILE B 44 -3.152 4.487 2.542 1.00 0.00 C ATOM 1279 CG2 ILE B 44 -3.234 6.973 2.905 1.00 0.00 C ATOM 1280 CD1 ILE B 44 -2.009 4.421 3.552 1.00 0.00 C ATOM 0 H ILE B 44 -3.860 5.372 -0.950 1.00 0.00 H new ATOM 0 HA ILE B 44 -5.351 5.765 1.539 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.322 5.955 1.235 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -4.098 4.289 3.046 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -3.022 3.708 1.791 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -2.355 6.890 3.544 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -3.229 7.942 2.405 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -4.134 6.883 3.513 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -1.994 3.437 4.020 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -1.062 4.595 3.041 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -2.154 5.184 4.316 1.00 0.00 H new ATOM 1292 N PHE B 45 -5.513 8.175 0.861 1.00 0.00 N ATOM 1293 CA PHE B 45 -5.761 9.526 0.366 1.00 0.00 C ATOM 1294 C PHE B 45 -5.720 10.511 1.535 1.00 0.00 C ATOM 1295 O PHE B 45 -6.764 10.936 2.028 1.00 0.00 O ATOM 1296 CB PHE B 45 -7.060 9.564 -0.449 1.00 0.00 C ATOM 1297 CG PHE B 45 -7.614 10.940 -0.734 1.00 0.00 C ATOM 1298 CD1 PHE B 45 -6.950 11.746 -1.663 1.00 0.00 C ATOM 1299 CD2 PHE B 45 -8.774 11.407 -0.097 1.00 0.00 C ATOM 1300 CE1 PHE B 45 -7.453 13.012 -1.984 1.00 0.00 C ATOM 1301 CE2 PHE B 45 -9.269 12.681 -0.406 1.00 0.00 C ATOM 1302 CZ PHE B 45 -8.611 13.484 -1.351 1.00 0.00 C ATOM 0 H PHE B 45 -6.167 7.879 1.585 1.00 0.00 H new ATOM 0 HA PHE B 45 -4.976 9.835 -0.324 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -6.886 9.058 -1.399 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -7.818 8.990 0.084 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -6.046 11.391 -2.135 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -9.282 10.788 0.627 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -6.950 13.624 -2.718 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -10.159 13.046 0.084 1.00 0.00 H new ATOM 0 HZ PHE B 45 -8.997 14.464 -1.590 1.00 0.00 H new ATOM 1312 N ALA B 46 -4.493 10.849 1.961 1.00 0.00 N ATOM 1313 CA ALA B 46 -4.152 11.811 3.017 1.00 0.00 C ATOM 1314 C ALA B 46 -3.840 11.103 4.339 1.00 0.00 C ATOM 1315 O ALA B 46 -3.915 11.710 5.405 1.00 0.00 O ATOM 1316 CB ALA B 46 -5.241 12.872 3.196 1.00 0.00 C ATOM 0 H ALA B 46 -3.659 10.429 1.549 1.00 0.00 H new ATOM 0 HA ALA B 46 -3.248 12.329 2.698 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -4.949 13.563 3.987 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -5.371 13.421 2.263 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -6.180 12.388 3.466 1.00 0.00 H new ATOM 1322 N GLY B 47 -3.495 9.815 4.271 1.00 0.00 N ATOM 1323 CA GLY B 47 -3.361 8.961 5.446 1.00 0.00 C ATOM 1324 C GLY B 47 -4.732 8.447 5.872 1.00 0.00 C ATOM 1325 O GLY B 47 -4.845 7.670 6.818 1.00 0.00 O ATOM 0 H GLY B 47 -3.300 9.336 3.392 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.701 8.122 5.224 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -2.902 9.519 6.262 1.00 0.00 H new ATOM 1329 N LYS B 48 -5.774 8.888 5.158 1.00 0.00 N ATOM 1330 CA LYS B 48 -7.139 8.435 5.340 1.00 0.00 C ATOM 1331 C LYS B 48 -7.270 7.078 4.661 1.00 0.00 C ATOM 1332 O LYS B 48 -7.955 6.953 3.651 1.00 0.00 O ATOM 1333 CB LYS B 48 -8.120 9.439 4.731 1.00 0.00 C ATOM 1334 CG LYS B 48 -9.537 9.023 5.126 1.00 0.00 C ATOM 1335 CD LYS B 48 -10.511 8.984 3.946 1.00 0.00 C ATOM 1336 CE LYS B 48 -10.586 10.289 3.162 1.00 0.00 C ATOM 1337 NZ LYS B 48 -11.072 11.399 4.002 1.00 0.00 N ATOM 0 H LYS B 48 -5.679 9.587 4.422 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.374 8.350 6.401 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -7.905 10.446 5.090 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -8.018 9.459 3.646 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -9.502 8.038 5.591 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -9.915 9.717 5.877 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.215 8.182 3.270 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -11.506 8.737 4.317 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -9.600 10.535 2.768 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -11.249 10.162 2.306 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -11.127 12.267 3.432 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.016 11.167 4.371 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -10.416 11.547 4.796 1.00 0.00 H new ATOM 1351 N GLN B 49 -6.606 6.066 5.213 1.00 0.00 N ATOM 1352 CA GLN B 49 -6.563 4.746 4.613 1.00 0.00 C ATOM 1353 C GLN B 49 -7.986 4.252 4.338 1.00 0.00 C ATOM 1354 O GLN B 49 -8.767 4.048 5.268 1.00 0.00 O ATOM 1355 CB GLN B 49 -5.753 3.799 5.508 1.00 0.00 C ATOM 1356 CG GLN B 49 -4.611 4.545 6.216 1.00 0.00 C ATOM 1357 CD GLN B 49 -3.539 3.600 6.740 1.00 0.00 C ATOM 1358 OE1 GLN B 49 -2.343 4.131 6.993 1.00 0.00 O flip ATOM 1359 NE2 GLN B 49 -3.770 2.407 6.916 1.00 0.00 N flip ATOM 0 H GLN B 49 -6.085 6.143 6.087 1.00 0.00 H new ATOM 0 HA GLN B 49 -6.055 4.781 3.649 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -6.410 3.345 6.250 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -5.343 2.988 4.907 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -4.159 5.254 5.523 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -5.018 5.124 7.045 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -4.696 2.031 6.713 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -3.036 1.791 7.266 1.00 0.00 H new ATOM 1368 N LEU B 50 -8.317 4.070 3.054 1.00 0.00 N ATOM 1369 CA LEU B 50 -9.684 3.823 2.615 1.00 0.00 C ATOM 1370 C LEU B 50 -10.178 2.433 3.025 1.00 0.00 C ATOM 1371 O LEU B 50 -9.409 1.597 3.498 1.00 0.00 O ATOM 1372 CB LEU B 50 -9.813 4.005 1.093 1.00 0.00 C ATOM 1373 CG LEU B 50 -9.398 5.368 0.509 1.00 0.00 C ATOM 1374 CD1 LEU B 50 -10.080 6.509 1.248 1.00 0.00 C ATOM 1375 CD2 LEU B 50 -7.889 5.599 0.505 1.00 0.00 C ATOM 0 H LEU B 50 -7.638 4.091 2.293 1.00 0.00 H new ATOM 0 HA LEU B 50 -10.315 4.559 3.114 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -9.214 3.234 0.609 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -10.852 3.822 0.818 1.00 0.00 H new ATOM 0 HG LEU B 50 -9.724 5.348 -0.531 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -9.769 7.460 0.815 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -11.161 6.406 1.158 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -9.799 6.480 2.301 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -7.672 6.579 0.080 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -7.511 5.555 1.527 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -7.404 4.828 -0.094 1.00 0.00 H new ATOM 1387 N GLU B 51 -11.482 2.202 2.831 1.00 0.00 N ATOM 1388 CA GLU B 51 -12.151 0.945 3.153 1.00 0.00 C ATOM 1389 C GLU B 51 -12.263 0.073 1.904 1.00 0.00 C ATOM 1390 O GLU B 51 -11.459 0.173 0.980 1.00 0.00 O ATOM 1391 CB GLU B 51 -13.531 1.230 3.754 1.00 0.00 C ATOM 1392 CG GLU B 51 -13.367 2.027 5.041 1.00 0.00 C ATOM 1393 CD GLU B 51 -14.714 2.349 5.678 1.00 0.00 C ATOM 1394 OE1 GLU B 51 -15.456 1.390 5.989 1.00 0.00 O ATOM 1395 OE2 GLU B 51 -15.000 3.557 5.851 1.00 0.00 O ATOM 0 H GLU B 51 -12.111 2.902 2.437 1.00 0.00 H new ATOM 0 HA GLU B 51 -11.562 0.401 3.891 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -14.141 1.787 3.043 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -14.052 0.294 3.957 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -12.757 1.461 5.745 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -12.833 2.954 4.830 1.00 0.00 H new ATOM 1402 N ASP B 52 -13.278 -0.791 1.887 1.00 0.00 N ATOM 1403 CA ASP B 52 -13.536 -1.718 0.801 1.00 0.00 C ATOM 1404 C ASP B 52 -15.037 -1.873 0.515 1.00 0.00 C ATOM 1405 O ASP B 52 -15.444 -2.800 -0.184 1.00 0.00 O ATOM 1406 CB ASP B 52 -12.909 -3.067 1.151 1.00 0.00 C ATOM 1407 CG ASP B 52 -13.384 -3.584 2.509 1.00 0.00 C ATOM 1408 OD1 ASP B 52 -14.499 -4.144 2.557 1.00 0.00 O ATOM 1409 OD2 ASP B 52 -12.624 -3.410 3.489 1.00 0.00 O ATOM 0 H ASP B 52 -13.954 -0.862 2.647 1.00 0.00 H new ATOM 0 HA ASP B 52 -13.088 -1.321 -0.110 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -13.159 -3.794 0.379 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -11.823 -2.971 1.159 1.00 0.00 H new ATOM 1414 N GLY B 53 -15.864 -0.970 1.052 1.00 0.00 N ATOM 1415 CA GLY B 53 -17.312 -1.010 0.874 1.00 0.00 C ATOM 1416 C GLY B 53 -17.887 0.393 0.691 1.00 0.00 C ATOM 1417 O GLY B 53 -19.087 0.600 0.866 1.00 0.00 O ATOM 0 H GLY B 53 -15.543 -0.189 1.624 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -17.557 -1.622 0.006 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -17.774 -1.485 1.740 1.00 0.00 H new ATOM 1421 N ARG B 54 -17.023 1.352 0.341 1.00 0.00 N ATOM 1422 CA ARG B 54 -17.354 2.754 0.162 1.00 0.00 C ATOM 1423 C ARG B 54 -17.246 3.146 -1.307 1.00 0.00 C ATOM 1424 O ARG B 54 -17.190 2.279 -2.178 1.00 0.00 O ATOM 1425 CB ARG B 54 -16.326 3.531 0.972 1.00 0.00 C ATOM 1426 CG ARG B 54 -16.520 3.366 2.468 1.00 0.00 C ATOM 1427 CD ARG B 54 -17.842 4.013 2.872 1.00 0.00 C ATOM 1428 NE ARG B 54 -17.742 4.654 4.183 1.00 0.00 N ATOM 1429 CZ ARG B 54 -18.143 4.113 5.336 1.00 0.00 C ATOM 1430 NH1 ARG B 54 -18.673 2.891 5.370 1.00 0.00 N ATOM 1431 NH2 ARG B 54 -18.018 4.804 6.467 1.00 0.00 N ATOM 0 H ARG B 54 -16.037 1.156 0.170 1.00 0.00 H new ATOM 0 HA ARG B 54 -18.374 2.961 0.485 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -15.325 3.196 0.700 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -16.389 4.588 0.715 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -16.522 2.309 2.733 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -15.694 3.829 3.008 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -18.131 4.752 2.125 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -18.627 3.258 2.893 1.00 0.00 H new ATOM 0 HE ARG B 54 -17.334 5.588 4.219 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -18.777 2.356 4.508 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -18.975 2.491 6.258 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -17.618 5.742 6.450 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -18.323 4.396 7.351 1.00 0.00 H new ATOM 1445 N THR B 55 -17.219 4.453 -1.590 1.00 0.00 N ATOM 1446 CA THR B 55 -17.115 4.955 -2.958 1.00 0.00 C ATOM 1447 C THR B 55 -16.277 6.222 -2.987 1.00 0.00 C ATOM 1448 O THR B 55 -16.103 6.869 -1.957 1.00 0.00 O ATOM 1449 CB THR B 55 -18.491 5.273 -3.539 1.00 0.00 C ATOM 1450 OG1 THR B 55 -19.197 6.126 -2.661 1.00 0.00 O ATOM 1451 CG2 THR B 55 -19.301 4.002 -3.778 1.00 0.00 C ATOM 0 H THR B 55 -17.268 5.185 -0.881 1.00 0.00 H new ATOM 0 HA THR B 55 -16.645 4.175 -3.557 1.00 0.00 H new ATOM 0 HB THR B 55 -18.344 5.770 -4.498 1.00 0.00 H new ATOM 0 HG1 THR B 55 -20.078 6.328 -3.039 1.00 0.00 H new ATOM 0 HG21 THR B 55 -20.275 4.264 -4.192 1.00 0.00 H new ATOM 0 HG22 THR B 55 -18.770 3.358 -4.479 1.00 0.00 H new ATOM 0 HG23 THR B 55 -19.438 3.475 -2.834 1.00 0.00 H new ATOM 1459 N LEU B 56 -15.757 6.585 -4.162 1.00 0.00 N ATOM 1460 CA LEU B 56 -14.900 7.759 -4.272 1.00 0.00 C ATOM 1461 C LEU B 56 -15.649 9.019 -3.845 1.00 0.00 C ATOM 1462 O LEU B 56 -15.054 9.943 -3.291 1.00 0.00 O ATOM 1463 CB LEU B 56 -14.385 7.889 -5.706 1.00 0.00 C ATOM 1464 CG LEU B 56 -13.462 6.722 -6.066 1.00 0.00 C ATOM 1465 CD1 LEU B 56 -13.006 6.900 -7.507 1.00 0.00 C ATOM 1466 CD2 LEU B 56 -12.221 6.694 -5.178 1.00 0.00 C ATOM 0 H LEU B 56 -15.914 6.087 -5.038 1.00 0.00 H new ATOM 0 HA LEU B 56 -14.048 7.639 -3.603 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -15.227 7.918 -6.397 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -13.848 8.831 -5.819 1.00 0.00 H new ATOM 0 HG LEU B 56 -14.013 5.792 -5.926 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.346 6.078 -7.784 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -13.875 6.906 -8.165 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -12.470 7.844 -7.605 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -11.589 5.853 -5.462 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -11.665 7.623 -5.301 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -12.522 6.586 -4.136 1.00 0.00 H new ATOM 1478 N SER B 57 -16.956 9.044 -4.100 1.00 0.00 N ATOM 1479 CA SER B 57 -17.827 10.134 -3.687 1.00 0.00 C ATOM 1480 C SER B 57 -17.893 10.236 -2.167 1.00 0.00 C ATOM 1481 O SER B 57 -18.029 11.328 -1.618 1.00 0.00 O ATOM 1482 CB SER B 57 -19.226 9.865 -4.232 1.00 0.00 C ATOM 1483 OG SER B 57 -20.028 11.019 -4.122 1.00 0.00 O ATOM 0 H SER B 57 -17.440 8.301 -4.603 1.00 0.00 H new ATOM 0 HA SER B 57 -17.431 11.072 -4.076 1.00 0.00 H new ATOM 0 HB2 SER B 57 -19.163 9.556 -5.276 1.00 0.00 H new ATOM 0 HB3 SER B 57 -19.685 9.042 -3.683 1.00 0.00 H new ATOM 0 HG SER B 57 -20.922 10.831 -4.477 1.00 0.00 H new ATOM 1489 N ASP B 58 -17.796 9.094 -1.482 1.00 0.00 N ATOM 1490 CA ASP B 58 -17.842 9.051 -0.028 1.00 0.00 C ATOM 1491 C ASP B 58 -16.679 9.811 0.611 1.00 0.00 C ATOM 1492 O ASP B 58 -16.757 10.172 1.783 1.00 0.00 O ATOM 1493 CB ASP B 58 -17.849 7.602 0.458 1.00 0.00 C ATOM 1494 CG ASP B 58 -18.188 7.525 1.946 1.00 0.00 C ATOM 1495 OD1 ASP B 58 -19.370 7.772 2.276 1.00 0.00 O ATOM 1496 OD2 ASP B 58 -17.269 7.220 2.737 1.00 0.00 O ATOM 0 H ASP B 58 -17.684 8.180 -1.922 1.00 0.00 H new ATOM 0 HA ASP B 58 -18.764 9.544 0.280 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -18.576 7.026 -0.115 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -16.873 7.150 0.280 1.00 0.00 H new ATOM 1501 N TYR B 59 -15.605 10.060 -0.146 1.00 0.00 N ATOM 1502 CA TYR B 59 -14.450 10.785 0.355 1.00 0.00 C ATOM 1503 C TYR B 59 -14.322 12.150 -0.325 1.00 0.00 C ATOM 1504 O TYR B 59 -13.307 12.823 -0.158 1.00 0.00 O ATOM 1505 CB TYR B 59 -13.182 9.966 0.111 1.00 0.00 C ATOM 1506 CG TYR B 59 -13.352 8.467 0.041 1.00 0.00 C ATOM 1507 CD1 TYR B 59 -13.543 7.698 1.196 1.00 0.00 C ATOM 1508 CD2 TYR B 59 -13.307 7.845 -1.210 1.00 0.00 C ATOM 1509 CE1 TYR B 59 -13.657 6.309 1.106 1.00 0.00 C ATOM 1510 CE2 TYR B 59 -13.429 6.454 -1.315 1.00 0.00 C ATOM 1511 CZ TYR B 59 -13.607 5.685 -0.153 1.00 0.00 C ATOM 1512 OH TYR B 59 -13.730 4.339 -0.241 1.00 0.00 O ATOM 0 H TYR B 59 -15.519 9.763 -1.118 1.00 0.00 H new ATOM 0 HA TYR B 59 -14.583 10.946 1.425 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -12.733 10.303 -0.823 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -12.471 10.192 0.906 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -13.602 8.181 2.160 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -13.177 8.441 -2.101 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -13.783 5.716 2.000 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -13.387 5.976 -2.282 1.00 0.00 H new ATOM 0 HH TYR B 59 -13.375 3.924 0.573 1.00 0.00 H new ATOM 1522 N ASN B 60 -15.344 12.552 -1.087 1.00 0.00 N ATOM 1523 CA ASN B 60 -15.338 13.754 -1.906 1.00 0.00 C ATOM 1524 C ASN B 60 -14.096 13.822 -2.799 1.00 0.00 C ATOM 1525 O ASN B 60 -13.632 14.904 -3.155 1.00 0.00 O ATOM 1526 CB ASN B 60 -15.509 14.984 -1.015 1.00 0.00 C ATOM 1527 CG ASN B 60 -15.857 16.217 -1.840 1.00 0.00 C ATOM 1528 OD1 ASN B 60 -16.840 16.219 -2.573 1.00 0.00 O ATOM 1529 ND2 ASN B 60 -15.058 17.274 -1.727 1.00 0.00 N ATOM 0 H ASN B 60 -16.219 12.032 -1.148 1.00 0.00 H new ATOM 0 HA ASN B 60 -16.185 13.726 -2.592 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -16.295 14.799 -0.283 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -14.590 15.163 -0.458 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -15.255 18.121 -2.260 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -14.249 17.238 -1.107 1.00 0.00 H new ATOM 1536 N ILE B 61 -13.558 12.656 -3.160 1.00 0.00 N ATOM 1537 CA ILE B 61 -12.452 12.544 -4.096 1.00 0.00 C ATOM 1538 C ILE B 61 -12.922 12.949 -5.492 1.00 0.00 C ATOM 1539 O ILE B 61 -13.999 12.556 -5.936 1.00 0.00 O ATOM 1540 CB ILE B 61 -11.931 11.100 -4.069 1.00 0.00 C ATOM 1541 CG1 ILE B 61 -10.885 10.998 -2.956 1.00 0.00 C ATOM 1542 CG2 ILE B 61 -11.338 10.673 -5.411 1.00 0.00 C ATOM 1543 CD1 ILE B 61 -10.443 9.553 -2.718 1.00 0.00 C ATOM 0 H ILE B 61 -13.885 11.758 -2.804 1.00 0.00 H new ATOM 0 HA ILE B 61 -11.638 13.212 -3.815 1.00 0.00 H new ATOM 0 HB ILE B 61 -12.764 10.424 -3.877 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -10.018 11.605 -3.217 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -11.296 11.409 -2.033 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.983 9.645 -5.341 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -12.102 10.742 -6.185 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -10.505 11.328 -5.665 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -9.701 9.526 -1.920 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -11.305 8.951 -2.431 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -10.008 9.150 -3.633 1.00 0.00 H new ATOM 1555 N GLN B 62 -12.098 13.739 -6.180 1.00 0.00 N ATOM 1556 CA GLN B 62 -12.325 14.162 -7.552 1.00 0.00 C ATOM 1557 C GLN B 62 -11.360 13.414 -8.471 1.00 0.00 C ATOM 1558 O GLN B 62 -10.702 12.470 -8.034 1.00 0.00 O ATOM 1559 CB GLN B 62 -12.128 15.672 -7.644 1.00 0.00 C ATOM 1560 CG GLN B 62 -12.880 16.370 -6.508 1.00 0.00 C ATOM 1561 CD GLN B 62 -14.376 16.088 -6.527 1.00 0.00 C ATOM 1562 OE1 GLN B 62 -15.012 16.089 -7.578 1.00 0.00 O ATOM 1563 NE2 GLN B 62 -14.950 15.843 -5.354 1.00 0.00 N ATOM 0 H GLN B 62 -11.234 14.109 -5.784 1.00 0.00 H new ATOM 0 HA GLN B 62 -13.343 13.930 -7.865 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -11.066 15.912 -7.589 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -12.488 16.036 -8.606 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -12.467 16.047 -5.553 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -12.717 17.445 -6.578 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -14.391 15.850 -4.501 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -15.950 15.648 -5.306 1.00 0.00 H new ATOM 1572 N LYS B 63 -11.264 13.821 -9.742 1.00 0.00 N ATOM 1573 CA LYS B 63 -10.394 13.155 -10.709 1.00 0.00 C ATOM 1574 C LYS B 63 -8.914 13.230 -10.305 1.00 0.00 C ATOM 1575 O LYS B 63 -8.423 12.358 -9.598 1.00 0.00 O ATOM 1576 CB LYS B 63 -10.711 13.650 -12.124 1.00 0.00 C ATOM 1577 CG LYS B 63 -10.520 15.153 -12.346 1.00 0.00 C ATOM 1578 CD LYS B 63 -11.358 15.589 -13.544 1.00 0.00 C ATOM 1579 CE LYS B 63 -12.824 15.743 -13.136 1.00 0.00 C ATOM 1580 NZ LYS B 63 -13.640 16.242 -14.260 1.00 0.00 N ATOM 0 H LYS B 63 -11.782 14.613 -10.123 1.00 0.00 H new ATOM 0 HA LYS B 63 -10.603 12.085 -10.711 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -10.079 13.111 -12.830 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -11.744 13.392 -12.359 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -10.820 15.706 -11.456 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -9.468 15.377 -12.521 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -10.981 16.534 -13.936 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -11.271 14.854 -14.344 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -13.213 14.782 -12.799 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -12.900 16.431 -12.294 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.630 16.337 -13.955 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -13.281 17.169 -14.565 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -13.585 15.572 -15.053 1.00 0.00 H new ATOM 1594 N GLU B 64 -8.181 14.254 -10.734 1.00 0.00 N ATOM 1595 CA GLU B 64 -6.754 14.404 -10.468 1.00 0.00 C ATOM 1596 C GLU B 64 -6.438 14.697 -8.993 1.00 0.00 C ATOM 1597 O GLU B 64 -5.394 15.275 -8.691 1.00 0.00 O ATOM 1598 CB GLU B 64 -6.185 15.484 -11.391 1.00 0.00 C ATOM 1599 CG GLU B 64 -6.885 16.822 -11.154 1.00 0.00 C ATOM 1600 CD GLU B 64 -6.304 17.908 -12.056 1.00 0.00 C ATOM 1601 OE1 GLU B 64 -6.794 18.031 -13.202 1.00 0.00 O ATOM 1602 OE2 GLU B 64 -5.373 18.609 -11.600 1.00 0.00 O ATOM 0 H GLU B 64 -8.570 15.017 -11.287 1.00 0.00 H new ATOM 0 HA GLU B 64 -6.272 13.449 -10.678 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -5.115 15.592 -11.216 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -6.309 15.182 -12.431 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -7.953 16.717 -11.346 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -6.776 17.114 -10.110 1.00 0.00 H new ATOM 1609 N SER B 65 -7.322 14.308 -8.067 1.00 0.00 N ATOM 1610 CA SER B 65 -7.133 14.521 -6.636 1.00 0.00 C ATOM 1611 C SER B 65 -5.832 13.900 -6.119 1.00 0.00 C ATOM 1612 O SER B 65 -5.355 14.287 -5.055 1.00 0.00 O ATOM 1613 CB SER B 65 -8.315 13.925 -5.875 1.00 0.00 C ATOM 1614 OG SER B 65 -9.441 14.760 -6.020 1.00 0.00 O ATOM 0 H SER B 65 -8.195 13.833 -8.297 1.00 0.00 H new ATOM 0 HA SER B 65 -7.071 15.597 -6.471 1.00 0.00 H new ATOM 0 HB2 SER B 65 -8.538 12.928 -6.254 1.00 0.00 H new ATOM 0 HB3 SER B 65 -8.064 13.817 -4.820 1.00 0.00 H new ATOM 0 HG SER B 65 -9.735 15.069 -5.138 1.00 0.00 H new ATOM 1620 N THR B 66 -5.271 12.947 -6.876 1.00 0.00 N ATOM 1621 CA THR B 66 -4.022 12.248 -6.584 1.00 0.00 C ATOM 1622 C THR B 66 -4.115 11.406 -5.313 1.00 0.00 C ATOM 1623 O THR B 66 -4.520 11.877 -4.253 1.00 0.00 O ATOM 1624 CB THR B 66 -2.863 13.249 -6.499 1.00 0.00 C ATOM 1625 OG1 THR B 66 -2.796 13.995 -7.694 1.00 0.00 O ATOM 1626 CG2 THR B 66 -1.527 12.536 -6.296 1.00 0.00 C ATOM 0 H THR B 66 -5.699 12.632 -7.747 1.00 0.00 H new ATOM 0 HA THR B 66 -3.831 11.556 -7.404 1.00 0.00 H new ATOM 0 HB THR B 66 -3.047 13.903 -5.646 1.00 0.00 H new ATOM 0 HG1 THR B 66 -3.638 14.479 -7.825 1.00 0.00 H new ATOM 0 HG21 THR B 66 -0.726 13.273 -6.240 1.00 0.00 H new ATOM 0 HG22 THR B 66 -1.558 11.962 -5.370 1.00 0.00 H new ATOM 0 HG23 THR B 66 -1.343 11.863 -7.133 1.00 0.00 H new ATOM 1634 N LEU B 67 -3.726 10.135 -5.433 1.00 0.00 N ATOM 1635 CA LEU B 67 -3.754 9.160 -4.366 1.00 0.00 C ATOM 1636 C LEU B 67 -2.349 8.611 -4.137 1.00 0.00 C ATOM 1637 O LEU B 67 -1.425 8.956 -4.873 1.00 0.00 O ATOM 1638 CB LEU B 67 -4.712 8.048 -4.804 1.00 0.00 C ATOM 1639 CG LEU B 67 -5.961 8.019 -3.935 1.00 0.00 C ATOM 1640 CD1 LEU B 67 -5.545 7.569 -2.550 1.00 0.00 C ATOM 1641 CD2 LEU B 67 -6.718 9.342 -3.988 1.00 0.00 C ATOM 0 H LEU B 67 -3.372 9.753 -6.310 1.00 0.00 H new ATOM 0 HA LEU B 67 -4.092 9.601 -3.428 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -4.995 8.198 -5.846 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -4.205 7.085 -4.747 1.00 0.00 H new ATOM 0 HG LEU B 67 -6.690 7.301 -4.311 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -6.419 7.537 -1.900 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -5.100 6.576 -2.609 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -4.816 8.270 -2.143 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -7.603 9.280 -3.355 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -6.072 10.145 -3.632 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -7.020 9.547 -5.015 1.00 0.00 H new ATOM 1653 N HIS B 68 -2.183 7.759 -3.125 1.00 0.00 N ATOM 1654 CA HIS B 68 -0.914 7.114 -2.866 1.00 0.00 C ATOM 1655 C HIS B 68 -1.159 5.628 -2.720 1.00 0.00 C ATOM 1656 O HIS B 68 -2.270 5.196 -2.415 1.00 0.00 O ATOM 1657 CB HIS B 68 -0.294 7.658 -1.582 1.00 0.00 C ATOM 1658 CG HIS B 68 0.104 9.108 -1.686 1.00 0.00 C ATOM 1659 ND1 HIS B 68 -0.693 10.199 -1.334 1.00 0.00 N ATOM 1660 CD2 HIS B 68 1.309 9.556 -2.146 1.00 0.00 C ATOM 1661 CE1 HIS B 68 0.057 11.283 -1.591 1.00 0.00 C ATOM 1662 NE2 HIS B 68 1.260 10.925 -2.078 1.00 0.00 N ATOM 0 H HIS B 68 -2.923 7.504 -2.472 1.00 0.00 H new ATOM 0 HA HIS B 68 -0.227 7.309 -3.690 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -1.005 7.540 -0.764 1.00 0.00 H new ATOM 0 HB3 HIS B 68 0.584 7.064 -1.329 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.135 8.953 -2.494 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -0.261 12.302 -1.429 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.008 11.563 -2.350 1.00 0.00 H new ATOM 1670 N LEU B 69 -0.106 4.852 -2.942 1.00 0.00 N ATOM 1671 CA LEU B 69 -0.184 3.415 -2.852 1.00 0.00 C ATOM 1672 C LEU B 69 1.021 2.910 -2.070 1.00 0.00 C ATOM 1673 O LEU B 69 2.134 3.401 -2.241 1.00 0.00 O ATOM 1674 CB LEU B 69 -0.236 2.863 -4.278 1.00 0.00 C ATOM 1675 CG LEU B 69 -0.770 1.434 -4.337 1.00 0.00 C ATOM 1676 CD1 LEU B 69 -2.213 1.389 -3.843 1.00 0.00 C ATOM 1677 CD2 LEU B 69 -0.727 0.973 -5.790 1.00 0.00 C ATOM 0 H LEU B 69 0.818 5.207 -3.188 1.00 0.00 H new ATOM 0 HA LEU B 69 -1.076 3.080 -2.323 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.867 3.508 -4.890 1.00 0.00 H new ATOM 0 HB3 LEU B 69 0.764 2.891 -4.711 1.00 0.00 H new ATOM 0 HG LEU B 69 -0.162 0.787 -3.705 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -2.582 0.364 -3.890 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -2.256 1.743 -2.813 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -2.833 2.027 -4.472 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -1.104 -0.047 -5.859 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -1.347 1.631 -6.399 1.00 0.00 H new ATOM 0 HD23 LEU B 69 0.301 1.005 -6.152 1.00 0.00 H new ATOM 1689 N VAL B 70 0.779 1.922 -1.211 1.00 0.00 N ATOM 1690 CA VAL B 70 1.781 1.394 -0.305 1.00 0.00 C ATOM 1691 C VAL B 70 1.560 -0.111 -0.177 1.00 0.00 C ATOM 1692 O VAL B 70 0.951 -0.606 0.770 1.00 0.00 O ATOM 1693 CB VAL B 70 1.773 2.190 1.006 1.00 0.00 C ATOM 1694 CG1 VAL B 70 0.361 2.487 1.525 1.00 0.00 C ATOM 1695 CG2 VAL B 70 2.607 1.508 2.087 1.00 0.00 C ATOM 0 H VAL B 70 -0.129 1.465 -1.128 1.00 0.00 H new ATOM 0 HA VAL B 70 2.795 1.518 -0.684 1.00 0.00 H new ATOM 0 HB VAL B 70 2.232 3.150 0.767 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.426 3.052 2.455 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -0.184 3.071 0.783 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -0.165 1.550 1.707 1.00 0.00 H new ATOM 0 HG21 VAL B 70 2.576 2.103 3.000 1.00 0.00 H new ATOM 0 HG22 VAL B 70 2.203 0.516 2.287 1.00 0.00 H new ATOM 0 HG23 VAL B 70 3.639 1.418 1.748 1.00 0.00 H new ATOM 1705 N LEU B 71 2.074 -0.836 -1.176 1.00 0.00 N ATOM 1706 CA LEU B 71 1.873 -2.264 -1.349 1.00 0.00 C ATOM 1707 C LEU B 71 2.403 -3.090 -0.182 1.00 0.00 C ATOM 1708 O LEU B 71 3.267 -2.642 0.572 1.00 0.00 O ATOM 1709 CB LEU B 71 2.593 -2.711 -2.626 1.00 0.00 C ATOM 1710 CG LEU B 71 2.200 -1.891 -3.855 1.00 0.00 C ATOM 1711 CD1 LEU B 71 2.885 -2.480 -5.086 1.00 0.00 C ATOM 1712 CD2 LEU B 71 0.688 -1.914 -4.050 1.00 0.00 C ATOM 0 H LEU B 71 2.658 -0.425 -1.905 1.00 0.00 H new ATOM 0 HA LEU B 71 0.798 -2.433 -1.407 1.00 0.00 H new ATOM 0 HB2 LEU B 71 3.670 -2.634 -2.475 1.00 0.00 H new ATOM 0 HB3 LEU B 71 2.371 -3.762 -2.812 1.00 0.00 H new ATOM 0 HG LEU B 71 2.515 -0.858 -3.711 1.00 0.00 H new ATOM 0 HD11 LEU B 71 2.610 -1.901 -5.967 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.966 -2.446 -4.952 1.00 0.00 H new ATOM 0 HD13 LEU B 71 2.568 -3.515 -5.218 1.00 0.00 H new ATOM 0 HD21 LEU B 71 0.426 -1.325 -4.929 1.00 0.00 H new ATOM 0 HD22 LEU B 71 0.355 -2.942 -4.189 1.00 0.00 H new ATOM 0 HD23 LEU B 71 0.201 -1.491 -3.171 1.00 0.00 H new ATOM 1724 N ARG B 72 1.878 -4.311 -0.050 1.00 0.00 N ATOM 1725 CA ARG B 72 2.408 -5.303 0.864 1.00 0.00 C ATOM 1726 C ARG B 72 3.453 -6.122 0.108 1.00 0.00 C ATOM 1727 O ARG B 72 3.557 -6.009 -1.113 1.00 0.00 O ATOM 1728 CB ARG B 72 1.251 -6.171 1.364 1.00 0.00 C ATOM 1729 CG ARG B 72 0.248 -5.330 2.157 1.00 0.00 C ATOM 1730 CD ARG B 72 -0.990 -6.148 2.525 1.00 0.00 C ATOM 1731 NE ARG B 72 -0.673 -7.222 3.473 1.00 0.00 N ATOM 1732 CZ ARG B 72 -1.398 -8.335 3.610 1.00 0.00 C ATOM 1733 NH1 ARG B 72 -2.456 -8.562 2.836 1.00 0.00 N ATOM 1734 NH2 ARG B 72 -1.065 -9.238 4.530 1.00 0.00 N ATOM 0 H ARG B 72 1.069 -4.632 -0.581 1.00 0.00 H new ATOM 0 HA ARG B 72 2.884 -4.848 1.732 1.00 0.00 H new ATOM 0 HB2 ARG B 72 0.750 -6.641 0.518 1.00 0.00 H new ATOM 0 HB3 ARG B 72 1.637 -6.974 1.992 1.00 0.00 H new ATOM 0 HG2 ARG B 72 0.721 -4.954 3.064 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -0.048 -4.462 1.568 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -1.744 -5.491 2.959 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -1.424 -6.577 1.622 1.00 0.00 H new ATOM 0 HE ARG B 72 0.151 -7.112 4.063 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -2.724 -7.881 2.125 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -3.000 -9.417 2.953 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -0.256 -9.080 5.131 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -1.619 -10.088 4.634 1.00 0.00 H new ATOM 1748 N LEU B 73 4.224 -6.944 0.818 1.00 0.00 N ATOM 1749 CA LEU B 73 5.306 -7.735 0.236 1.00 0.00 C ATOM 1750 C LEU B 73 5.203 -9.180 0.711 1.00 0.00 C ATOM 1751 O LEU B 73 5.832 -10.066 0.132 1.00 0.00 O ATOM 1752 CB LEU B 73 6.683 -7.176 0.622 1.00 0.00 C ATOM 1753 CG LEU B 73 7.183 -5.939 -0.140 1.00 0.00 C ATOM 1754 CD1 LEU B 73 7.094 -6.146 -1.648 1.00 0.00 C ATOM 1755 CD2 LEU B 73 6.452 -4.658 0.248 1.00 0.00 C ATOM 0 H LEU B 73 4.114 -7.081 1.823 1.00 0.00 H new ATOM 0 HA LEU B 73 5.206 -7.687 -0.848 1.00 0.00 H new ATOM 0 HB2 LEU B 73 6.662 -6.931 1.684 1.00 0.00 H new ATOM 0 HB3 LEU B 73 7.418 -7.971 0.493 1.00 0.00 H new ATOM 0 HG LEU B 73 8.227 -5.817 0.149 1.00 0.00 H new ATOM 0 HD11 LEU B 73 7.455 -5.254 -2.160 1.00 0.00 H new ATOM 0 HD12 LEU B 73 7.706 -7.001 -1.935 1.00 0.00 H new ATOM 0 HD13 LEU B 73 6.057 -6.331 -1.929 1.00 0.00 H new ATOM 0 HD21 LEU B 73 6.853 -3.822 -0.326 1.00 0.00 H new ATOM 0 HD22 LEU B 73 5.389 -4.767 0.036 1.00 0.00 H new ATOM 0 HD23 LEU B 73 6.592 -4.467 1.312 1.00 0.00 H new