USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1005 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 68 CYS SG : rot 140:sc= -1.59 USER MOD Set 1.2: A 119 SER OG : rot 145:sc= 0.517 USER MOD Set 2.1: A 47 TYR OH : rot 71:sc= 0.0599 USER MOD Set 2.2: A 64 HIS : no HE2:sc= -6.62! C(o=-6.6!,f=-6.6!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -177:sc= 0.102 (180deg=0.0869) USER MOD Single : A 21 GLN : amide:sc= -1.72! C(o=-1.7!,f=-5.4!) USER MOD Single : A 23 CYS SG : rot 19:sc= 0.21 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= 0.0565 K(o=0.057,f=-2.7!) USER MOD Single : A 29 HIS :FLIP no HD1:sc= -0.479 F(o=-1.3!,f=-0.48) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -1.5 K(o=-1.5,f=-3.7!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 HIS : no HD1:sc= -5.22! C(o=-5.2!,f=-7.7!) USER MOD Single : A 50 TYR OH : rot 180:sc= -1.12 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.00236 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot -63:sc= 0.938 USER MOD Single : A 76 ASN : amide:sc= -0.0461 X(o=-0.046,f=-0.34) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -0.0107 X(o=-0.011,f=0) USER MOD Single : A 92 THR OG1 : rot 140:sc= -0.847 USER MOD Single : A 97 HIS : no HD1:sc= -4.46! C(o=-4.5!,f=-4.6!) USER MOD Single : A 98 TYR OH : rot 30:sc= -0.031 USER MOD Single : A 101 GLN : amide:sc= -0.265 X(o=-0.26,f=-0.13) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.0132 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -1.57 X(o=-1.6,f=-1.5) USER MOD Single : A 117 MET CE :methyl 173:sc= -3.26! (180deg=-3.98!) USER MOD Single : A 121 THR OG1 : rot 130:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 25:sc= 0.781 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.288 -17.256 15.958 1.00 0.00 N ATOM 2 CA GLY A 1 17.289 -16.155 16.906 1.00 0.00 C ATOM 3 C GLY A 1 17.186 -14.810 16.185 1.00 0.00 C ATOM 4 O GLY A 1 16.292 -14.607 15.365 1.00 0.00 O ATOM 0 H1 GLY A 1 17.359 -18.157 16.472 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.406 -17.240 15.408 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.099 -17.160 15.314 1.00 0.00 H new ATOM 0 HA2 GLY A 1 16.454 -16.266 17.598 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.202 -16.184 17.501 1.00 0.00 H new ATOM 8 N SER A 2 18.115 -13.925 16.516 1.00 0.00 N ATOM 9 CA SER A 2 18.141 -12.604 15.909 1.00 0.00 C ATOM 10 C SER A 2 19.403 -12.443 15.060 1.00 0.00 C ATOM 11 O SER A 2 20.466 -12.947 15.420 1.00 0.00 O ATOM 12 CB SER A 2 18.073 -11.508 16.974 1.00 0.00 C ATOM 13 OG SER A 2 19.315 -11.347 17.654 1.00 0.00 O ATOM 0 H SER A 2 18.855 -14.096 17.196 1.00 0.00 H new ATOM 0 HA SER A 2 17.265 -12.504 15.268 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.791 -10.565 16.506 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.293 -11.752 17.696 1.00 0.00 H new ATOM 0 HG SER A 2 19.231 -10.637 18.325 1.00 0.00 H new ATOM 19 N SER A 3 19.245 -11.738 13.949 1.00 0.00 N ATOM 20 CA SER A 3 20.359 -11.504 13.046 1.00 0.00 C ATOM 21 C SER A 3 19.976 -10.450 12.005 1.00 0.00 C ATOM 22 O SER A 3 18.822 -10.378 11.585 1.00 0.00 O ATOM 23 CB SER A 3 20.790 -12.800 12.356 1.00 0.00 C ATOM 24 OG SER A 3 22.121 -12.719 11.853 1.00 0.00 O ATOM 0 H SER A 3 18.362 -11.321 13.654 1.00 0.00 H new ATOM 0 HA SER A 3 21.203 -11.138 13.631 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.719 -13.628 13.062 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.105 -13.020 11.537 1.00 0.00 H new ATOM 0 HG SER A 3 22.360 -13.566 11.421 1.00 0.00 H new ATOM 30 N GLY A 4 20.966 -9.659 11.619 1.00 0.00 N ATOM 31 CA GLY A 4 20.747 -8.613 10.635 1.00 0.00 C ATOM 32 C GLY A 4 21.221 -7.257 11.163 1.00 0.00 C ATOM 33 O GLY A 4 22.410 -7.064 11.412 1.00 0.00 O ATOM 0 H GLY A 4 21.922 -9.721 11.970 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.280 -8.856 9.716 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.687 -8.560 10.385 1.00 0.00 H new ATOM 37 N SER A 5 20.266 -6.351 11.317 1.00 0.00 N ATOM 38 CA SER A 5 20.570 -5.019 11.810 1.00 0.00 C ATOM 39 C SER A 5 21.563 -4.329 10.873 1.00 0.00 C ATOM 40 O SER A 5 22.775 -4.449 11.049 1.00 0.00 O ATOM 41 CB SER A 5 21.132 -5.073 13.232 1.00 0.00 C ATOM 42 OG SER A 5 20.410 -4.229 14.124 1.00 0.00 O ATOM 0 H SER A 5 19.281 -6.514 11.109 1.00 0.00 H new ATOM 0 HA SER A 5 19.644 -4.444 11.836 1.00 0.00 H new ATOM 0 HB2 SER A 5 21.097 -6.100 13.597 1.00 0.00 H new ATOM 0 HB3 SER A 5 22.180 -4.774 13.219 1.00 0.00 H new ATOM 0 HG SER A 5 20.798 -4.293 15.021 1.00 0.00 H new ATOM 48 N SER A 6 21.013 -3.620 9.898 1.00 0.00 N ATOM 49 CA SER A 6 21.835 -2.910 8.933 1.00 0.00 C ATOM 50 C SER A 6 20.991 -1.876 8.187 1.00 0.00 C ATOM 51 O SER A 6 20.011 -2.226 7.531 1.00 0.00 O ATOM 52 CB SER A 6 22.485 -3.879 7.944 1.00 0.00 C ATOM 53 OG SER A 6 23.743 -3.402 7.476 1.00 0.00 O ATOM 0 H SER A 6 20.008 -3.522 9.756 1.00 0.00 H new ATOM 0 HA SER A 6 22.631 -2.398 9.473 1.00 0.00 H new ATOM 0 HB2 SER A 6 22.621 -4.849 8.423 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.818 -4.033 7.096 1.00 0.00 H new ATOM 0 HG SER A 6 24.126 -4.050 6.848 1.00 0.00 H new ATOM 59 N GLY A 7 21.402 -0.622 8.311 1.00 0.00 N ATOM 60 CA GLY A 7 20.696 0.465 7.655 1.00 0.00 C ATOM 61 C GLY A 7 20.571 1.676 8.583 1.00 0.00 C ATOM 62 O GLY A 7 21.144 2.730 8.313 1.00 0.00 O ATOM 0 H GLY A 7 22.215 -0.335 8.856 1.00 0.00 H new ATOM 0 HA2 GLY A 7 21.226 0.752 6.746 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.704 0.129 7.353 1.00 0.00 H new ATOM 66 N VAL A 8 19.819 1.484 9.657 1.00 0.00 N ATOM 67 CA VAL A 8 19.613 2.547 10.626 1.00 0.00 C ATOM 68 C VAL A 8 19.136 3.807 9.900 1.00 0.00 C ATOM 69 O VAL A 8 19.146 3.861 8.671 1.00 0.00 O ATOM 70 CB VAL A 8 20.890 2.771 11.437 1.00 0.00 C ATOM 71 CG1 VAL A 8 21.964 3.458 10.590 1.00 0.00 C ATOM 72 CG2 VAL A 8 20.599 3.572 12.708 1.00 0.00 C ATOM 0 H VAL A 8 19.345 0.608 9.877 1.00 0.00 H new ATOM 0 HA VAL A 8 18.837 2.269 11.339 1.00 0.00 H new ATOM 0 HB VAL A 8 21.272 1.795 11.736 1.00 0.00 H new ATOM 0 HG11 VAL A 8 22.862 3.606 11.190 1.00 0.00 H new ATOM 0 HG12 VAL A 8 22.202 2.834 9.729 1.00 0.00 H new ATOM 0 HG13 VAL A 8 21.594 4.424 10.247 1.00 0.00 H new ATOM 0 HG21 VAL A 8 21.524 3.717 13.266 1.00 0.00 H new ATOM 0 HG22 VAL A 8 20.181 4.542 12.439 1.00 0.00 H new ATOM 0 HG23 VAL A 8 19.884 3.028 13.325 1.00 0.00 H new ATOM 82 N ILE A 9 18.729 4.788 10.691 1.00 0.00 N ATOM 83 CA ILE A 9 18.249 6.044 10.140 1.00 0.00 C ATOM 84 C ILE A 9 17.107 5.763 9.161 1.00 0.00 C ATOM 85 O ILE A 9 16.911 4.624 8.741 1.00 0.00 O ATOM 86 CB ILE A 9 19.405 6.836 9.525 1.00 0.00 C ATOM 87 CG1 ILE A 9 20.165 7.619 10.597 1.00 0.00 C ATOM 88 CG2 ILE A 9 18.910 7.742 8.396 1.00 0.00 C ATOM 89 CD1 ILE A 9 19.905 9.121 10.466 1.00 0.00 C ATOM 0 H ILE A 9 18.722 4.739 11.710 1.00 0.00 H new ATOM 0 HA ILE A 9 17.844 6.677 10.930 1.00 0.00 H new ATOM 0 HB ILE A 9 20.107 6.128 9.085 1.00 0.00 H new ATOM 0 HG12 ILE A 9 19.860 7.278 11.586 1.00 0.00 H new ATOM 0 HG13 ILE A 9 21.233 7.422 10.508 1.00 0.00 H new ATOM 0 HG21 ILE A 9 19.751 8.293 7.976 1.00 0.00 H new ATOM 0 HG22 ILE A 9 18.450 7.134 7.617 1.00 0.00 H new ATOM 0 HG23 ILE A 9 18.175 8.445 8.789 1.00 0.00 H new ATOM 0 HD11 ILE A 9 20.457 9.655 11.240 1.00 0.00 H new ATOM 0 HD12 ILE A 9 20.234 9.463 9.485 1.00 0.00 H new ATOM 0 HD13 ILE A 9 18.839 9.317 10.580 1.00 0.00 H new ATOM 101 N LEU A 10 16.383 6.821 8.828 1.00 0.00 N ATOM 102 CA LEU A 10 15.265 6.703 7.907 1.00 0.00 C ATOM 103 C LEU A 10 15.793 6.354 6.514 1.00 0.00 C ATOM 104 O LEU A 10 16.844 5.730 6.383 1.00 0.00 O ATOM 105 CB LEU A 10 14.407 7.969 7.940 1.00 0.00 C ATOM 106 CG LEU A 10 12.900 7.754 8.093 1.00 0.00 C ATOM 107 CD1 LEU A 10 12.344 6.924 6.934 1.00 0.00 C ATOM 108 CD2 LEU A 10 12.570 7.134 9.452 1.00 0.00 C ATOM 0 H LEU A 10 16.549 7.764 9.179 1.00 0.00 H new ATOM 0 HA LEU A 10 14.605 5.891 8.211 1.00 0.00 H new ATOM 0 HB2 LEU A 10 14.750 8.595 8.764 1.00 0.00 H new ATOM 0 HB3 LEU A 10 14.583 8.527 7.020 1.00 0.00 H new ATOM 0 HG LEU A 10 12.411 8.727 8.056 1.00 0.00 H new ATOM 0 HD11 LEU A 10 11.271 6.786 7.067 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.529 7.443 5.993 1.00 0.00 H new ATOM 0 HD13 LEU A 10 12.835 5.951 6.915 1.00 0.00 H new ATOM 0 HD21 LEU A 10 11.493 6.992 9.535 1.00 0.00 H new ATOM 0 HD22 LEU A 10 13.071 6.171 9.544 1.00 0.00 H new ATOM 0 HD23 LEU A 10 12.911 7.797 10.247 1.00 0.00 H new ATOM 120 N LYS A 11 15.038 6.772 5.508 1.00 0.00 N ATOM 121 CA LYS A 11 15.416 6.511 4.130 1.00 0.00 C ATOM 122 C LYS A 11 14.854 7.616 3.233 1.00 0.00 C ATOM 123 O LYS A 11 15.165 8.792 3.422 1.00 0.00 O ATOM 124 CB LYS A 11 14.986 5.103 3.713 1.00 0.00 C ATOM 125 CG LYS A 11 15.764 4.040 4.490 1.00 0.00 C ATOM 126 CD LYS A 11 15.787 2.712 3.730 1.00 0.00 C ATOM 127 CE LYS A 11 15.935 1.532 4.692 1.00 0.00 C ATOM 128 NZ LYS A 11 16.582 0.387 4.012 1.00 0.00 N ATOM 0 H LYS A 11 14.166 7.290 5.620 1.00 0.00 H new ATOM 0 HA LYS A 11 16.500 6.533 4.023 1.00 0.00 H new ATOM 0 HB2 LYS A 11 13.918 4.978 3.889 1.00 0.00 H new ATOM 0 HB3 LYS A 11 15.151 4.970 2.644 1.00 0.00 H new ATOM 0 HG2 LYS A 11 16.784 4.383 4.660 1.00 0.00 H new ATOM 0 HG3 LYS A 11 15.309 3.895 5.470 1.00 0.00 H new ATOM 0 HD2 LYS A 11 14.868 2.603 3.154 1.00 0.00 H new ATOM 0 HD3 LYS A 11 16.612 2.711 3.018 1.00 0.00 H new ATOM 0 HE2 LYS A 11 16.528 1.832 5.556 1.00 0.00 H new ATOM 0 HE3 LYS A 11 14.955 1.234 5.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 16.675 -0.406 4.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 16.001 0.091 3.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 17.525 0.670 3.677 1.00 0.00 H new ATOM 142 N GLU A 12 14.037 7.201 2.277 1.00 0.00 N ATOM 143 CA GLU A 12 13.429 8.141 1.351 1.00 0.00 C ATOM 144 C GLU A 12 11.945 7.820 1.167 1.00 0.00 C ATOM 145 O GLU A 12 11.106 8.720 1.170 1.00 0.00 O ATOM 146 CB GLU A 12 14.161 8.138 0.007 1.00 0.00 C ATOM 147 CG GLU A 12 15.678 8.117 0.209 1.00 0.00 C ATOM 148 CD GLU A 12 16.229 9.536 0.368 1.00 0.00 C ATOM 149 OE1 GLU A 12 15.748 10.232 1.287 1.00 0.00 O ATOM 150 OE2 GLU A 12 17.120 9.891 -0.434 1.00 0.00 O ATOM 0 H GLU A 12 13.781 6.226 2.123 1.00 0.00 H new ATOM 0 HA GLU A 12 13.515 9.143 1.772 1.00 0.00 H new ATOM 0 HB2 GLU A 12 13.856 7.269 -0.575 1.00 0.00 H new ATOM 0 HB3 GLU A 12 13.879 9.021 -0.567 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.923 7.527 1.092 1.00 0.00 H new ATOM 0 HG3 GLU A 12 16.155 7.631 -0.642 1.00 0.00 H new ATOM 157 N GLU A 13 11.665 6.535 1.011 1.00 0.00 N ATOM 158 CA GLU A 13 10.296 6.084 0.826 1.00 0.00 C ATOM 159 C GLU A 13 9.583 5.983 2.176 1.00 0.00 C ATOM 160 O GLU A 13 8.360 6.093 2.247 1.00 0.00 O ATOM 161 CB GLU A 13 10.254 4.747 0.083 1.00 0.00 C ATOM 162 CG GLU A 13 10.866 3.630 0.930 1.00 0.00 C ATOM 163 CD GLU A 13 11.172 2.398 0.074 1.00 0.00 C ATOM 164 OE1 GLU A 13 11.657 2.601 -1.060 1.00 0.00 O ATOM 165 OE2 GLU A 13 10.913 1.282 0.574 1.00 0.00 O ATOM 0 H GLU A 13 12.363 5.791 1.009 1.00 0.00 H new ATOM 0 HA GLU A 13 9.772 6.819 0.214 1.00 0.00 H new ATOM 0 HB2 GLU A 13 9.222 4.497 -0.165 1.00 0.00 H new ATOM 0 HB3 GLU A 13 10.796 4.833 -0.859 1.00 0.00 H new ATOM 0 HG2 GLU A 13 11.782 3.986 1.402 1.00 0.00 H new ATOM 0 HG3 GLU A 13 10.179 3.359 1.732 1.00 0.00 H new ATOM 172 N PHE A 14 10.379 5.774 3.215 1.00 0.00 N ATOM 173 CA PHE A 14 9.840 5.657 4.559 1.00 0.00 C ATOM 174 C PHE A 14 9.797 7.019 5.254 1.00 0.00 C ATOM 175 O PHE A 14 9.376 7.120 6.405 1.00 0.00 O ATOM 176 CB PHE A 14 10.776 4.730 5.338 1.00 0.00 C ATOM 177 CG PHE A 14 10.914 3.332 4.731 1.00 0.00 C ATOM 178 CD1 PHE A 14 9.897 2.807 3.996 1.00 0.00 C ATOM 179 CD2 PHE A 14 12.053 2.615 4.928 1.00 0.00 C ATOM 180 CE1 PHE A 14 10.025 1.509 3.433 1.00 0.00 C ATOM 181 CE2 PHE A 14 12.180 1.318 4.365 1.00 0.00 C ATOM 182 CZ PHE A 14 11.164 0.792 3.630 1.00 0.00 C ATOM 0 H PHE A 14 11.393 5.683 3.153 1.00 0.00 H new ATOM 0 HA PHE A 14 8.823 5.268 4.518 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.763 5.190 5.393 1.00 0.00 H new ATOM 0 HB3 PHE A 14 10.410 4.637 6.360 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.993 3.377 3.841 1.00 0.00 H new ATOM 0 HD2 PHE A 14 12.860 3.032 5.512 1.00 0.00 H new ATOM 0 HE1 PHE A 14 9.218 1.092 2.849 1.00 0.00 H new ATOM 0 HE2 PHE A 14 13.084 0.749 4.521 1.00 0.00 H new ATOM 0 HZ PHE A 14 11.261 -0.195 3.203 1.00 0.00 H new ATOM 192 N ARG A 15 10.237 8.034 4.524 1.00 0.00 N ATOM 193 CA ARG A 15 10.255 9.386 5.055 1.00 0.00 C ATOM 194 C ARG A 15 8.826 9.906 5.230 1.00 0.00 C ATOM 195 O ARG A 15 8.450 10.912 4.631 1.00 0.00 O ATOM 196 CB ARG A 15 11.025 10.331 4.131 1.00 0.00 C ATOM 197 CG ARG A 15 12.495 9.921 4.028 1.00 0.00 C ATOM 198 CD ARG A 15 13.282 10.392 5.253 1.00 0.00 C ATOM 199 NE ARG A 15 13.222 11.867 5.357 1.00 0.00 N ATOM 200 CZ ARG A 15 13.812 12.576 6.329 1.00 0.00 C ATOM 201 NH1 ARG A 15 14.509 11.950 7.286 1.00 0.00 N ATOM 202 NH2 ARG A 15 13.704 13.911 6.344 1.00 0.00 N ATOM 0 H ARG A 15 10.584 7.947 3.569 1.00 0.00 H new ATOM 0 HA ARG A 15 10.756 9.356 6.023 1.00 0.00 H new ATOM 0 HB2 ARG A 15 10.572 10.325 3.140 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.954 11.351 4.508 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.569 8.837 3.938 1.00 0.00 H new ATOM 0 HG3 ARG A 15 12.932 10.346 3.125 1.00 0.00 H new ATOM 0 HD2 ARG A 15 12.872 9.939 6.155 1.00 0.00 H new ATOM 0 HD3 ARG A 15 14.319 10.067 5.176 1.00 0.00 H new ATOM 0 HE ARG A 15 12.699 12.376 4.644 1.00 0.00 H new ATOM 0 HH11 ARG A 15 14.591 10.933 7.275 1.00 0.00 H new ATOM 0 HH12 ARG A 15 14.958 12.490 8.026 1.00 0.00 H new ATOM 0 HH21 ARG A 15 13.173 14.388 5.616 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.153 14.451 7.084 1.00 0.00 H new ATOM 216 N GLY A 16 8.069 9.196 6.054 1.00 0.00 N ATOM 217 CA GLY A 16 6.690 9.573 6.315 1.00 0.00 C ATOM 218 C GLY A 16 6.198 8.974 7.634 1.00 0.00 C ATOM 219 O GLY A 16 6.990 8.734 8.544 1.00 0.00 O ATOM 0 H GLY A 16 8.384 8.362 6.549 1.00 0.00 H new ATOM 0 HA2 GLY A 16 6.607 10.659 6.351 1.00 0.00 H new ATOM 0 HA3 GLY A 16 6.055 9.232 5.497 1.00 0.00 H new ATOM 223 N VAL A 17 4.894 8.749 7.695 1.00 0.00 N ATOM 224 CA VAL A 17 4.287 8.183 8.887 1.00 0.00 C ATOM 225 C VAL A 17 3.418 6.987 8.493 1.00 0.00 C ATOM 226 O VAL A 17 3.173 6.757 7.309 1.00 0.00 O ATOM 227 CB VAL A 17 3.511 9.263 9.643 1.00 0.00 C ATOM 228 CG1 VAL A 17 2.350 9.795 8.800 1.00 0.00 C ATOM 229 CG2 VAL A 17 3.014 8.739 10.992 1.00 0.00 C ATOM 0 H VAL A 17 4.241 8.949 6.938 1.00 0.00 H new ATOM 0 HA VAL A 17 5.054 7.816 9.569 1.00 0.00 H new ATOM 0 HB VAL A 17 4.192 10.092 9.836 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.815 10.561 9.360 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.738 10.225 7.877 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.669 8.978 8.562 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.466 9.527 11.509 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.356 7.885 10.831 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.866 8.432 11.599 1.00 0.00 H new ATOM 239 N ILE A 18 2.975 6.258 9.507 1.00 0.00 N ATOM 240 CA ILE A 18 2.138 5.092 9.280 1.00 0.00 C ATOM 241 C ILE A 18 0.704 5.408 9.708 1.00 0.00 C ATOM 242 O ILE A 18 0.462 6.397 10.399 1.00 0.00 O ATOM 243 CB ILE A 18 2.731 3.864 9.976 1.00 0.00 C ATOM 244 CG1 ILE A 18 4.077 3.480 9.358 1.00 0.00 C ATOM 245 CG2 ILE A 18 1.741 2.697 9.965 1.00 0.00 C ATOM 246 CD1 ILE A 18 4.943 2.717 10.362 1.00 0.00 C ATOM 0 H ILE A 18 3.180 6.452 10.487 1.00 0.00 H new ATOM 0 HA ILE A 18 2.107 4.845 8.219 1.00 0.00 H new ATOM 0 HB ILE A 18 2.917 4.119 11.019 1.00 0.00 H new ATOM 0 HG12 ILE A 18 3.913 2.865 8.473 1.00 0.00 H new ATOM 0 HG13 ILE A 18 4.600 4.378 9.030 1.00 0.00 H new ATOM 0 HG21 ILE A 18 2.186 1.837 10.465 1.00 0.00 H new ATOM 0 HG22 ILE A 18 0.829 2.988 10.487 1.00 0.00 H new ATOM 0 HG23 ILE A 18 1.501 2.433 8.935 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.894 2.456 9.898 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.125 3.343 11.235 1.00 0.00 H new ATOM 0 HD13 ILE A 18 4.428 1.807 10.670 1.00 0.00 H new ATOM 258 N ILE A 19 -0.210 4.550 9.280 1.00 0.00 N ATOM 259 CA ILE A 19 -1.614 4.726 9.610 1.00 0.00 C ATOM 260 C ILE A 19 -2.257 3.355 9.830 1.00 0.00 C ATOM 261 O ILE A 19 -2.999 3.161 10.792 1.00 0.00 O ATOM 262 CB ILE A 19 -2.314 5.569 8.542 1.00 0.00 C ATOM 263 CG1 ILE A 19 -1.852 5.170 7.139 1.00 0.00 C ATOM 264 CG2 ILE A 19 -2.118 7.063 8.807 1.00 0.00 C ATOM 265 CD1 ILE A 19 -0.462 5.734 6.838 1.00 0.00 C ATOM 0 H ILE A 19 -0.006 3.731 8.708 1.00 0.00 H new ATOM 0 HA ILE A 19 -1.720 5.282 10.542 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.384 5.370 8.597 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -1.834 4.084 7.054 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.565 5.536 6.400 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -2.625 7.639 8.033 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -2.535 7.317 9.781 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.054 7.298 8.795 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -0.158 5.436 5.835 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.489 6.822 6.900 1.00 0.00 H new ATOM 0 HD13 ILE A 19 0.253 5.347 7.564 1.00 0.00 H new ATOM 277 N LYS A 20 -1.950 2.440 8.923 1.00 0.00 N ATOM 278 CA LYS A 20 -2.488 1.093 9.006 1.00 0.00 C ATOM 279 C LYS A 20 -1.335 0.088 9.029 1.00 0.00 C ATOM 280 O LYS A 20 -0.297 0.314 8.409 1.00 0.00 O ATOM 281 CB LYS A 20 -3.495 0.848 7.880 1.00 0.00 C ATOM 282 CG LYS A 20 -4.274 -0.448 8.113 1.00 0.00 C ATOM 283 CD LYS A 20 -5.659 -0.160 8.695 1.00 0.00 C ATOM 284 CE LYS A 20 -6.512 -1.429 8.736 1.00 0.00 C ATOM 285 NZ LYS A 20 -7.179 -1.563 10.050 1.00 0.00 N ATOM 0 H LYS A 20 -1.335 2.605 8.126 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.044 0.962 9.934 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.188 1.687 7.818 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -2.972 0.796 6.925 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.377 -0.989 7.172 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -3.717 -1.094 8.792 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -5.557 0.246 9.701 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.159 0.599 8.094 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -7.260 -1.397 7.944 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -5.886 -2.301 8.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.713 -2.455 10.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -6.463 -1.564 10.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.830 -0.765 10.192 1.00 0.00 H new ATOM 299 N GLN A 21 -1.556 -1.001 9.751 1.00 0.00 N ATOM 300 CA GLN A 21 -0.548 -2.042 9.863 1.00 0.00 C ATOM 301 C GLN A 21 -1.202 -3.377 10.226 1.00 0.00 C ATOM 302 O GLN A 21 -2.166 -3.412 10.989 1.00 0.00 O ATOM 303 CB GLN A 21 0.524 -1.660 10.885 1.00 0.00 C ATOM 304 CG GLN A 21 1.455 -0.582 10.327 1.00 0.00 C ATOM 305 CD GLN A 21 2.672 -0.385 11.233 1.00 0.00 C ATOM 306 OE1 GLN A 21 3.805 -0.637 10.858 1.00 0.00 O ATOM 307 NE2 GLN A 21 2.375 0.077 12.444 1.00 0.00 N ATOM 0 H GLN A 21 -2.418 -1.185 10.264 1.00 0.00 H new ATOM 0 HA GLN A 21 -0.057 -2.151 8.896 1.00 0.00 H new ATOM 0 HB2 GLN A 21 0.049 -1.299 11.797 1.00 0.00 H new ATOM 0 HB3 GLN A 21 1.104 -2.542 11.155 1.00 0.00 H new ATOM 0 HG2 GLN A 21 1.784 -0.863 9.327 1.00 0.00 H new ATOM 0 HG3 GLN A 21 0.912 0.358 10.232 1.00 0.00 H new ATOM 0 HE21 GLN A 21 1.404 0.267 12.693 1.00 0.00 H new ATOM 0 HE22 GLN A 21 3.118 0.241 13.124 1.00 0.00 H new ATOM 316 N GLY A 22 -0.650 -4.442 9.664 1.00 0.00 N ATOM 317 CA GLY A 22 -1.167 -5.776 9.919 1.00 0.00 C ATOM 318 C GLY A 22 -0.721 -6.754 8.831 1.00 0.00 C ATOM 319 O GLY A 22 0.100 -6.412 7.982 1.00 0.00 O ATOM 0 H GLY A 22 0.150 -4.408 9.033 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -0.819 -6.125 10.891 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -2.256 -5.746 9.962 1.00 0.00 H new ATOM 323 N CYS A 23 -1.283 -7.953 8.892 1.00 0.00 N ATOM 324 CA CYS A 23 -0.953 -8.984 7.922 1.00 0.00 C ATOM 325 C CYS A 23 -2.108 -9.091 6.924 1.00 0.00 C ATOM 326 O CYS A 23 -3.270 -8.929 7.293 1.00 0.00 O ATOM 327 CB CYS A 23 -0.658 -10.324 8.599 1.00 0.00 C ATOM 328 SG CYS A 23 -2.176 -10.975 9.387 1.00 0.00 S ATOM 0 H CYS A 23 -1.964 -8.233 9.598 1.00 0.00 H new ATOM 0 HA CYS A 23 -0.040 -8.711 7.393 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -0.285 -11.038 7.864 1.00 0.00 H new ATOM 0 HB3 CYS A 23 0.125 -10.198 9.347 1.00 0.00 H new ATOM 0 HG CYS A 23 -3.217 -10.391 8.872 1.00 0.00 H new ATOM 334 N LEU A 24 -1.748 -9.364 5.678 1.00 0.00 N ATOM 335 CA LEU A 24 -2.739 -9.495 4.624 1.00 0.00 C ATOM 336 C LEU A 24 -2.357 -10.662 3.713 1.00 0.00 C ATOM 337 O LEU A 24 -1.201 -11.081 3.686 1.00 0.00 O ATOM 338 CB LEU A 24 -2.912 -8.167 3.884 1.00 0.00 C ATOM 339 CG LEU A 24 -3.788 -7.122 4.577 1.00 0.00 C ATOM 340 CD1 LEU A 24 -3.926 -5.864 3.716 1.00 0.00 C ATOM 341 CD2 LEU A 24 -5.149 -7.709 4.954 1.00 0.00 C ATOM 0 H LEU A 24 -0.783 -9.498 5.375 1.00 0.00 H new ATOM 0 HA LEU A 24 -3.717 -9.728 5.046 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -1.925 -7.734 3.720 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.336 -8.374 2.902 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.297 -6.826 5.504 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.554 -5.137 4.232 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -2.940 -5.433 3.541 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.383 -6.125 2.761 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.751 -6.945 5.445 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.660 -8.051 4.054 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.007 -8.550 5.632 1.00 0.00 H new ATOM 353 N LEU A 25 -3.350 -11.155 2.987 1.00 0.00 N ATOM 354 CA LEU A 25 -3.133 -12.266 2.076 1.00 0.00 C ATOM 355 C LEU A 25 -3.049 -11.736 0.643 1.00 0.00 C ATOM 356 O LEU A 25 -4.072 -11.479 0.012 1.00 0.00 O ATOM 357 CB LEU A 25 -4.206 -13.339 2.274 1.00 0.00 C ATOM 358 CG LEU A 25 -4.423 -13.813 3.712 1.00 0.00 C ATOM 359 CD1 LEU A 25 -3.164 -14.482 4.265 1.00 0.00 C ATOM 360 CD2 LEU A 25 -4.900 -12.664 4.602 1.00 0.00 C ATOM 0 H LEU A 25 -4.308 -10.805 3.011 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.183 -12.755 2.291 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.152 -12.954 1.893 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.945 -14.203 1.663 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.212 -14.566 3.708 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.346 -14.810 5.289 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.909 -15.344 3.648 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.339 -13.770 4.253 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.047 -13.028 5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.152 -11.871 4.605 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.842 -12.273 4.217 1.00 0.00 H new ATOM 372 N LYS A 26 -1.819 -11.589 0.172 1.00 0.00 N ATOM 373 CA LYS A 26 -1.588 -11.095 -1.175 1.00 0.00 C ATOM 374 C LYS A 26 -1.563 -12.274 -2.149 1.00 0.00 C ATOM 375 O LYS A 26 -0.788 -13.213 -1.973 1.00 0.00 O ATOM 376 CB LYS A 26 -0.325 -10.233 -1.220 1.00 0.00 C ATOM 377 CG LYS A 26 -0.171 -9.556 -2.583 1.00 0.00 C ATOM 378 CD LYS A 26 1.232 -8.969 -2.749 1.00 0.00 C ATOM 379 CE LYS A 26 2.009 -9.703 -3.843 1.00 0.00 C ATOM 380 NZ LYS A 26 3.380 -10.018 -3.383 1.00 0.00 N ATOM 0 H LYS A 26 -0.972 -11.803 0.699 1.00 0.00 H new ATOM 0 HA LYS A 26 -2.403 -10.442 -1.486 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.369 -9.476 -0.437 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.549 -10.852 -1.016 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.363 -10.279 -3.376 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.914 -8.765 -2.686 1.00 0.00 H new ATOM 0 HD2 LYS A 26 1.160 -7.910 -2.998 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.773 -9.038 -1.805 1.00 0.00 H new ATOM 0 HE2 LYS A 26 1.489 -10.623 -4.112 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.053 -9.087 -4.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 3.894 -10.516 -4.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 3.879 -9.136 -3.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 3.332 -10.624 -2.539 1.00 0.00 H new ATOM 394 N GLN A 27 -2.421 -12.187 -3.155 1.00 0.00 N ATOM 395 CA GLN A 27 -2.507 -13.236 -4.157 1.00 0.00 C ATOM 396 C GLN A 27 -1.652 -12.877 -5.375 1.00 0.00 C ATOM 397 O GLN A 27 -1.274 -11.721 -5.554 1.00 0.00 O ATOM 398 CB GLN A 27 -3.960 -13.489 -4.563 1.00 0.00 C ATOM 399 CG GLN A 27 -4.492 -14.773 -3.924 1.00 0.00 C ATOM 400 CD GLN A 27 -4.560 -15.908 -4.948 1.00 0.00 C ATOM 401 OE1 GLN A 27 -3.663 -16.109 -5.751 1.00 0.00 O ATOM 402 NE2 GLN A 27 -5.670 -16.636 -4.876 1.00 0.00 N ATOM 0 H GLN A 27 -3.062 -11.407 -3.298 1.00 0.00 H new ATOM 0 HA GLN A 27 -2.120 -14.158 -3.724 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -4.578 -12.644 -4.260 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -4.031 -13.562 -5.648 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -3.848 -15.065 -3.095 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -5.484 -14.593 -3.509 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -6.381 -16.414 -4.180 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -5.810 -17.417 -5.517 1.00 0.00 H new ATOM 411 N GLY A 28 -1.373 -13.891 -6.181 1.00 0.00 N ATOM 412 CA GLY A 28 -0.570 -13.697 -7.376 1.00 0.00 C ATOM 413 C GLY A 28 0.910 -13.966 -7.093 1.00 0.00 C ATOM 414 O GLY A 28 1.615 -13.098 -6.581 1.00 0.00 O ATOM 0 H GLY A 28 -1.689 -14.849 -6.030 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.920 -14.363 -8.165 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -0.695 -12.677 -7.740 1.00 0.00 H new ATOM 418 N HIS A 29 1.336 -15.172 -7.438 1.00 0.00 N ATOM 419 CA HIS A 29 2.719 -15.566 -7.227 1.00 0.00 C ATOM 420 C HIS A 29 2.866 -17.070 -7.464 1.00 0.00 C ATOM 421 O HIS A 29 3.594 -17.493 -8.360 1.00 0.00 O ATOM 422 CB HIS A 29 3.201 -15.134 -5.841 1.00 0.00 C ATOM 423 CG HIS A 29 4.251 -16.041 -5.246 1.00 0.00 C ATOM 424 ND1 HIS A 29 5.300 -16.691 -5.827 1.00 0.00 N flip ATOM 425 CD2 HIS A 29 4.289 -16.362 -3.900 1.00 0.00 C flip ATOM 426 CE1 HIS A 29 5.944 -17.372 -4.887 1.00 0.00 C flip ATOM 427 NE2 HIS A 29 5.319 -17.169 -3.692 1.00 0.00 N flip ATOM 0 H HIS A 29 0.748 -15.889 -7.862 1.00 0.00 H new ATOM 0 HA HIS A 29 3.360 -15.056 -7.946 1.00 0.00 H new ATOM 0 HB2 HIS A 29 3.603 -14.123 -5.906 1.00 0.00 H new ATOM 0 HB3 HIS A 29 2.346 -15.094 -5.166 1.00 0.00 H new ATOM 0 HD2 HIS A 29 3.597 -16.014 -3.148 1.00 0.00 H new ATOM 0 HE1 HIS A 29 6.819 -17.986 -5.043 1.00 0.00 H new ATOM 0 HE2 HIS A 29 5.596 -17.568 -2.795 1.00 0.00 H new ATOM 435 N ARG A 30 2.162 -17.837 -6.644 1.00 0.00 N ATOM 436 CA ARG A 30 2.205 -19.285 -6.753 1.00 0.00 C ATOM 437 C ARG A 30 0.913 -19.809 -7.386 1.00 0.00 C ATOM 438 O ARG A 30 0.926 -20.820 -8.085 1.00 0.00 O ATOM 439 CB ARG A 30 2.392 -19.935 -5.381 1.00 0.00 C ATOM 440 CG ARG A 30 3.857 -20.309 -5.146 1.00 0.00 C ATOM 441 CD ARG A 30 4.051 -21.826 -5.197 1.00 0.00 C ATOM 442 NE ARG A 30 3.577 -22.439 -3.937 1.00 0.00 N ATOM 443 CZ ARG A 30 3.497 -23.761 -3.728 1.00 0.00 C ATOM 444 NH1 ARG A 30 3.858 -24.615 -4.695 1.00 0.00 N ATOM 445 NH2 ARG A 30 3.056 -24.228 -2.552 1.00 0.00 N ATOM 0 H ARG A 30 1.559 -17.483 -5.902 1.00 0.00 H new ATOM 0 HA ARG A 30 3.054 -19.545 -7.385 1.00 0.00 H new ATOM 0 HB2 ARG A 30 2.058 -19.250 -4.602 1.00 0.00 H new ATOM 0 HB3 ARG A 30 1.769 -20.827 -5.309 1.00 0.00 H new ATOM 0 HG2 ARG A 30 4.483 -19.833 -5.901 1.00 0.00 H new ATOM 0 HG3 ARG A 30 4.182 -19.930 -4.177 1.00 0.00 H new ATOM 0 HD2 ARG A 30 3.503 -22.243 -6.042 1.00 0.00 H new ATOM 0 HD3 ARG A 30 5.104 -22.061 -5.352 1.00 0.00 H new ATOM 0 HE ARG A 30 3.293 -21.817 -3.180 1.00 0.00 H new ATOM 0 HH11 ARG A 30 4.194 -24.260 -5.590 1.00 0.00 H new ATOM 0 HH12 ARG A 30 3.797 -25.621 -4.536 1.00 0.00 H new ATOM 0 HH21 ARG A 30 2.781 -23.578 -1.816 1.00 0.00 H new ATOM 0 HH22 ARG A 30 2.995 -25.234 -2.393 1.00 0.00 H new ATOM 459 N ARG A 31 -0.171 -19.096 -7.117 1.00 0.00 N ATOM 460 CA ARG A 31 -1.468 -19.476 -7.651 1.00 0.00 C ATOM 461 C ARG A 31 -1.825 -20.898 -7.215 1.00 0.00 C ATOM 462 O ARG A 31 -1.577 -21.856 -7.945 1.00 0.00 O ATOM 463 CB ARG A 31 -1.477 -19.401 -9.179 1.00 0.00 C ATOM 464 CG ARG A 31 -2.805 -18.840 -9.692 1.00 0.00 C ATOM 465 CD ARG A 31 -2.900 -17.335 -9.433 1.00 0.00 C ATOM 466 NE ARG A 31 -4.155 -16.801 -10.008 1.00 0.00 N ATOM 467 CZ ARG A 31 -4.436 -15.495 -10.117 1.00 0.00 C ATOM 468 NH1 ARG A 31 -3.552 -14.582 -9.691 1.00 0.00 N ATOM 469 NH2 ARG A 31 -5.600 -15.102 -10.652 1.00 0.00 N ATOM 0 H ARG A 31 -0.178 -18.257 -6.536 1.00 0.00 H new ATOM 0 HA ARG A 31 -2.206 -18.776 -7.260 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.656 -18.771 -9.521 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.312 -20.394 -9.597 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.898 -19.036 -10.760 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.634 -19.350 -9.201 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.869 -17.139 -8.361 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.043 -16.827 -9.875 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.850 -17.469 -10.342 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -2.666 -14.881 -9.284 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -3.765 -13.588 -9.774 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -6.273 -15.797 -10.976 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.813 -14.108 -10.735 1.00 0.00 H new ATOM 483 N LYS A 32 -2.403 -20.991 -6.026 1.00 0.00 N ATOM 484 CA LYS A 32 -2.798 -22.280 -5.484 1.00 0.00 C ATOM 485 C LYS A 32 -3.457 -22.074 -4.119 1.00 0.00 C ATOM 486 O LYS A 32 -4.454 -22.722 -3.803 1.00 0.00 O ATOM 487 CB LYS A 32 -1.603 -23.235 -5.451 1.00 0.00 C ATOM 488 CG LYS A 32 -1.828 -24.425 -6.387 1.00 0.00 C ATOM 489 CD LYS A 32 -2.713 -25.484 -5.726 1.00 0.00 C ATOM 490 CE LYS A 32 -2.717 -26.780 -6.538 1.00 0.00 C ATOM 491 NZ LYS A 32 -2.210 -27.905 -5.722 1.00 0.00 N ATOM 0 H LYS A 32 -2.607 -20.194 -5.423 1.00 0.00 H new ATOM 0 HA LYS A 32 -3.539 -22.754 -6.128 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -0.699 -22.702 -5.745 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -1.446 -23.592 -4.433 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -2.294 -24.082 -7.311 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.868 -24.866 -6.658 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -2.354 -25.684 -4.716 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.731 -25.106 -5.633 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -3.729 -26.998 -6.880 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.098 -26.661 -7.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -2.220 -28.777 -6.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -1.237 -27.701 -5.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -2.817 -28.029 -4.886 1.00 0.00 H new ATOM 505 N ASN A 33 -2.875 -21.169 -3.346 1.00 0.00 N ATOM 506 CA ASN A 33 -3.394 -20.869 -2.022 1.00 0.00 C ATOM 507 C ASN A 33 -3.008 -19.439 -1.639 1.00 0.00 C ATOM 508 O ASN A 33 -2.167 -18.823 -2.293 1.00 0.00 O ATOM 509 CB ASN A 33 -2.805 -21.814 -0.973 1.00 0.00 C ATOM 510 CG ASN A 33 -3.646 -23.087 -0.849 1.00 0.00 C ATOM 511 OD1 ASN A 33 -4.706 -23.222 -1.438 1.00 0.00 O ATOM 512 ND2 ASN A 33 -3.115 -24.010 -0.052 1.00 0.00 N ATOM 0 H ASN A 33 -2.049 -20.633 -3.611 1.00 0.00 H new ATOM 0 HA ASN A 33 -4.477 -20.989 -2.049 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -1.782 -22.074 -1.246 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -2.759 -21.309 -0.008 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -3.599 -24.895 0.096 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -2.224 -23.832 0.411 1.00 0.00 H new ATOM 519 N TRP A 34 -3.641 -18.952 -0.582 1.00 0.00 N ATOM 520 CA TRP A 34 -3.374 -17.606 -0.105 1.00 0.00 C ATOM 521 C TRP A 34 -2.205 -17.677 0.880 1.00 0.00 C ATOM 522 O TRP A 34 -2.160 -18.562 1.733 1.00 0.00 O ATOM 523 CB TRP A 34 -4.631 -16.981 0.504 1.00 0.00 C ATOM 524 CG TRP A 34 -5.779 -16.799 -0.491 1.00 0.00 C ATOM 525 CD1 TRP A 34 -6.452 -17.748 -1.157 1.00 0.00 C ATOM 526 CD2 TRP A 34 -6.366 -15.548 -0.907 1.00 0.00 C ATOM 527 NE1 TRP A 34 -7.426 -17.202 -1.969 1.00 0.00 N ATOM 528 CE2 TRP A 34 -7.372 -15.822 -1.812 1.00 0.00 C ATOM 529 CE3 TRP A 34 -6.058 -14.229 -0.531 1.00 0.00 C ATOM 530 CZ2 TRP A 34 -8.150 -14.827 -2.417 1.00 0.00 C ATOM 531 CZ3 TRP A 34 -6.844 -13.247 -1.145 1.00 0.00 C ATOM 532 CH2 TRP A 34 -7.860 -13.506 -2.058 1.00 0.00 C ATOM 0 H TRP A 34 -4.338 -19.465 -0.043 1.00 0.00 H new ATOM 0 HA TRP A 34 -3.094 -16.952 -0.931 1.00 0.00 H new ATOM 0 HB2 TRP A 34 -4.973 -17.607 1.328 1.00 0.00 H new ATOM 0 HB3 TRP A 34 -4.373 -16.010 0.927 1.00 0.00 H new ATOM 0 HD1 TRP A 34 -6.257 -18.807 -1.069 1.00 0.00 H new ATOM 0 HE1 TRP A 34 -8.067 -17.717 -2.573 1.00 0.00 H new ATOM 0 HE3 TRP A 34 -5.277 -13.992 0.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 -8.932 -15.066 -3.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 -6.647 -12.216 -0.892 1.00 0.00 H new ATOM 0 HH2 TRP A 34 -8.423 -12.691 -2.488 1.00 0.00 H new ATOM 543 N LYS A 35 -1.288 -16.732 0.729 1.00 0.00 N ATOM 544 CA LYS A 35 -0.122 -16.676 1.594 1.00 0.00 C ATOM 545 C LYS A 35 -0.232 -15.457 2.513 1.00 0.00 C ATOM 546 O LYS A 35 -0.702 -14.401 2.094 1.00 0.00 O ATOM 547 CB LYS A 35 1.163 -16.707 0.764 1.00 0.00 C ATOM 548 CG LYS A 35 2.065 -17.866 1.193 1.00 0.00 C ATOM 549 CD LYS A 35 3.227 -18.047 0.215 1.00 0.00 C ATOM 550 CE LYS A 35 3.365 -19.511 -0.208 1.00 0.00 C ATOM 551 NZ LYS A 35 4.481 -20.157 0.518 1.00 0.00 N ATOM 0 H LYS A 35 -1.329 -15.999 0.021 1.00 0.00 H new ATOM 0 HA LYS A 35 -0.081 -17.556 2.235 1.00 0.00 H new ATOM 0 HB2 LYS A 35 0.915 -16.806 -0.293 1.00 0.00 H new ATOM 0 HB3 LYS A 35 1.697 -15.764 0.879 1.00 0.00 H new ATOM 0 HG2 LYS A 35 2.453 -17.678 2.194 1.00 0.00 H new ATOM 0 HG3 LYS A 35 1.482 -18.785 1.245 1.00 0.00 H new ATOM 0 HD2 LYS A 35 3.067 -17.424 -0.665 1.00 0.00 H new ATOM 0 HD3 LYS A 35 4.154 -17.710 0.679 1.00 0.00 H new ATOM 0 HE2 LYS A 35 2.435 -20.043 -0.006 1.00 0.00 H new ATOM 0 HE3 LYS A 35 3.539 -19.570 -1.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 4.561 -21.150 0.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 5.369 -19.659 0.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 4.299 -20.117 1.541 1.00 0.00 H new ATOM 565 N VAL A 36 0.210 -15.645 3.748 1.00 0.00 N ATOM 566 CA VAL A 36 0.167 -14.574 4.729 1.00 0.00 C ATOM 567 C VAL A 36 1.398 -13.683 4.558 1.00 0.00 C ATOM 568 O VAL A 36 2.497 -14.176 4.307 1.00 0.00 O ATOM 569 CB VAL A 36 0.043 -15.159 6.137 1.00 0.00 C ATOM 570 CG1 VAL A 36 0.430 -14.126 7.196 1.00 0.00 C ATOM 571 CG2 VAL A 36 -1.368 -15.697 6.385 1.00 0.00 C ATOM 0 H VAL A 36 0.600 -16.523 4.092 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.712 -13.948 4.573 1.00 0.00 H new ATOM 0 HB VAL A 36 0.738 -15.995 6.215 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.333 -14.568 8.188 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.462 -13.812 7.038 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -0.229 -13.261 7.118 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -1.429 -16.107 7.393 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -2.090 -14.887 6.278 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.591 -16.480 5.661 1.00 0.00 H new ATOM 581 N ARG A 37 1.174 -12.385 4.702 1.00 0.00 N ATOM 582 CA ARG A 37 2.252 -11.420 4.567 1.00 0.00 C ATOM 583 C ARG A 37 1.913 -10.136 5.326 1.00 0.00 C ATOM 584 O ARG A 37 0.741 -9.822 5.531 1.00 0.00 O ATOM 585 CB ARG A 37 2.508 -11.082 3.097 1.00 0.00 C ATOM 586 CG ARG A 37 3.922 -11.491 2.678 1.00 0.00 C ATOM 587 CD ARG A 37 3.923 -12.880 2.036 1.00 0.00 C ATOM 588 NE ARG A 37 4.718 -12.860 0.788 1.00 0.00 N ATOM 589 CZ ARG A 37 5.171 -13.958 0.168 1.00 0.00 C ATOM 590 NH1 ARG A 37 4.913 -15.170 0.677 1.00 0.00 N ATOM 591 NH2 ARG A 37 5.884 -13.844 -0.961 1.00 0.00 N ATOM 0 H ARG A 37 0.262 -11.979 4.911 1.00 0.00 H new ATOM 0 HA ARG A 37 3.152 -11.868 4.987 1.00 0.00 H new ATOM 0 HB2 ARG A 37 1.777 -11.593 2.470 1.00 0.00 H new ATOM 0 HB3 ARG A 37 2.373 -10.012 2.937 1.00 0.00 H new ATOM 0 HG2 ARG A 37 4.322 -10.761 1.975 1.00 0.00 H new ATOM 0 HG3 ARG A 37 4.578 -11.488 3.548 1.00 0.00 H new ATOM 0 HD2 ARG A 37 4.339 -13.610 2.730 1.00 0.00 H new ATOM 0 HD3 ARG A 37 2.901 -13.191 1.821 1.00 0.00 H new ATOM 0 HE ARG A 37 4.935 -11.953 0.374 1.00 0.00 H new ATOM 0 HH11 ARG A 37 4.371 -15.257 1.537 1.00 0.00 H new ATOM 0 HH12 ARG A 37 5.258 -16.006 0.205 1.00 0.00 H new ATOM 0 HH21 ARG A 37 6.082 -12.921 -1.348 1.00 0.00 H new ATOM 0 HH22 ARG A 37 6.229 -14.680 -1.433 1.00 0.00 H new ATOM 605 N LYS A 38 2.960 -9.427 5.724 1.00 0.00 N ATOM 606 CA LYS A 38 2.788 -8.184 6.456 1.00 0.00 C ATOM 607 C LYS A 38 2.576 -7.038 5.465 1.00 0.00 C ATOM 608 O LYS A 38 3.178 -7.021 4.392 1.00 0.00 O ATOM 609 CB LYS A 38 3.959 -7.960 7.414 1.00 0.00 C ATOM 610 CG LYS A 38 3.818 -6.626 8.151 1.00 0.00 C ATOM 611 CD LYS A 38 3.799 -6.836 9.666 1.00 0.00 C ATOM 612 CE LYS A 38 3.906 -5.501 10.406 1.00 0.00 C ATOM 613 NZ LYS A 38 3.686 -5.694 11.857 1.00 0.00 N ATOM 0 H LYS A 38 3.930 -9.690 5.553 1.00 0.00 H new ATOM 0 HA LYS A 38 1.898 -8.232 7.083 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.004 -8.775 8.136 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.896 -7.975 6.858 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.645 -5.969 7.882 1.00 0.00 H new ATOM 0 HG3 LYS A 38 2.900 -6.129 7.838 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.878 -7.343 9.955 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.625 -7.485 9.957 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.889 -5.062 10.236 1.00 0.00 H new ATOM 0 HE3 LYS A 38 3.171 -4.799 10.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.762 -4.778 12.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.738 -6.092 12.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 4.403 -6.347 12.233 1.00 0.00 H new ATOM 627 N PHE A 39 1.719 -6.108 5.859 1.00 0.00 N ATOM 628 CA PHE A 39 1.420 -4.961 5.018 1.00 0.00 C ATOM 629 C PHE A 39 1.304 -3.684 5.853 1.00 0.00 C ATOM 630 O PHE A 39 0.384 -3.546 6.658 1.00 0.00 O ATOM 631 CB PHE A 39 0.076 -5.239 4.343 1.00 0.00 C ATOM 632 CG PHE A 39 0.194 -5.907 2.972 1.00 0.00 C ATOM 633 CD1 PHE A 39 0.312 -7.259 2.882 1.00 0.00 C ATOM 634 CD2 PHE A 39 0.180 -5.149 1.843 1.00 0.00 C ATOM 635 CE1 PHE A 39 0.422 -7.878 1.609 1.00 0.00 C ATOM 636 CE2 PHE A 39 0.289 -5.768 0.570 1.00 0.00 C ATOM 637 CZ PHE A 39 0.408 -7.120 0.480 1.00 0.00 C ATOM 0 H PHE A 39 1.222 -6.125 6.750 1.00 0.00 H new ATOM 0 HA PHE A 39 2.218 -4.816 4.290 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.522 -5.875 4.995 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.465 -4.299 4.232 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.322 -7.861 3.778 1.00 0.00 H new ATOM 0 HD2 PHE A 39 0.086 -4.076 1.915 1.00 0.00 H new ATOM 0 HE1 PHE A 39 0.517 -8.951 1.537 1.00 0.00 H new ATOM 0 HE2 PHE A 39 0.277 -5.166 -0.326 1.00 0.00 H new ATOM 0 HZ PHE A 39 0.491 -7.592 -0.488 1.00 0.00 H new ATOM 647 N ILE A 40 2.251 -2.783 5.633 1.00 0.00 N ATOM 648 CA ILE A 40 2.266 -1.523 6.356 1.00 0.00 C ATOM 649 C ILE A 40 1.940 -0.382 5.390 1.00 0.00 C ATOM 650 O ILE A 40 2.442 -0.352 4.267 1.00 0.00 O ATOM 651 CB ILE A 40 3.596 -1.344 7.092 1.00 0.00 C ATOM 652 CG1 ILE A 40 3.801 -2.449 8.130 1.00 0.00 C ATOM 653 CG2 ILE A 40 3.695 0.051 7.713 1.00 0.00 C ATOM 654 CD1 ILE A 40 5.261 -2.512 8.582 1.00 0.00 C ATOM 0 H ILE A 40 3.013 -2.901 4.965 1.00 0.00 H new ATOM 0 HA ILE A 40 1.497 -1.517 7.128 1.00 0.00 H new ATOM 0 HB ILE A 40 4.403 -1.431 6.365 1.00 0.00 H new ATOM 0 HG12 ILE A 40 3.157 -2.268 8.991 1.00 0.00 H new ATOM 0 HG13 ILE A 40 3.506 -3.409 7.707 1.00 0.00 H new ATOM 0 HG21 ILE A 40 4.649 0.152 8.230 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.626 0.804 6.928 1.00 0.00 H new ATOM 0 HG23 ILE A 40 2.881 0.191 8.424 1.00 0.00 H new ATOM 0 HD11 ILE A 40 5.380 -3.306 9.320 1.00 0.00 H new ATOM 0 HD12 ILE A 40 5.899 -2.717 7.723 1.00 0.00 H new ATOM 0 HD13 ILE A 40 5.546 -1.558 9.026 1.00 0.00 H new ATOM 666 N LEU A 41 1.100 0.527 5.861 1.00 0.00 N ATOM 667 CA LEU A 41 0.700 1.667 5.053 1.00 0.00 C ATOM 668 C LEU A 41 1.344 2.936 5.615 1.00 0.00 C ATOM 669 O LEU A 41 1.459 3.093 6.829 1.00 0.00 O ATOM 670 CB LEU A 41 -0.825 1.744 4.952 1.00 0.00 C ATOM 671 CG LEU A 41 -1.389 2.977 4.244 1.00 0.00 C ATOM 672 CD1 LEU A 41 -1.103 2.925 2.742 1.00 0.00 C ATOM 673 CD2 LEU A 41 -2.881 3.144 4.538 1.00 0.00 C ATOM 0 H LEU A 41 0.685 0.498 6.792 1.00 0.00 H new ATOM 0 HA LEU A 41 1.059 1.553 4.030 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -1.180 0.856 4.430 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.238 1.708 5.960 1.00 0.00 H new ATOM 0 HG LEU A 41 -0.883 3.858 4.638 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -1.514 3.813 2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -0.026 2.890 2.578 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -1.565 2.035 2.314 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -3.257 4.028 4.023 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -3.421 2.264 4.190 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -3.030 3.259 5.612 1.00 0.00 H new ATOM 685 N ARG A 42 1.748 3.809 4.704 1.00 0.00 N ATOM 686 CA ARG A 42 2.377 5.060 5.093 1.00 0.00 C ATOM 687 C ARG A 42 1.864 6.207 4.220 1.00 0.00 C ATOM 688 O ARG A 42 1.971 6.156 2.996 1.00 0.00 O ATOM 689 CB ARG A 42 3.900 4.973 4.966 1.00 0.00 C ATOM 690 CG ARG A 42 4.424 3.656 5.541 1.00 0.00 C ATOM 691 CD ARG A 42 5.937 3.717 5.762 1.00 0.00 C ATOM 692 NE ARG A 42 6.236 4.429 7.024 1.00 0.00 N ATOM 693 CZ ARG A 42 7.410 4.359 7.666 1.00 0.00 C ATOM 694 NH1 ARG A 42 8.402 3.609 7.168 1.00 0.00 N ATOM 695 NH2 ARG A 42 7.592 5.040 8.806 1.00 0.00 N ATOM 0 H ARG A 42 1.652 3.675 3.697 1.00 0.00 H new ATOM 0 HA ARG A 42 2.120 5.250 6.135 1.00 0.00 H new ATOM 0 HB2 ARG A 42 4.186 5.056 3.918 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.361 5.811 5.489 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.923 3.443 6.485 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.185 2.838 4.862 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.349 2.708 5.798 1.00 0.00 H new ATOM 0 HD3 ARG A 42 6.415 4.227 4.925 1.00 0.00 H new ATOM 0 HE ARG A 42 5.503 5.009 7.431 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.264 3.091 6.300 1.00 0.00 H new ATOM 0 HH12 ARG A 42 9.296 3.556 7.657 1.00 0.00 H new ATOM 0 HH21 ARG A 42 6.837 5.611 9.185 1.00 0.00 H new ATOM 0 HH22 ARG A 42 8.486 4.987 9.295 1.00 0.00 H new ATOM 709 N GLU A 43 1.318 7.215 4.884 1.00 0.00 N ATOM 710 CA GLU A 43 0.788 8.372 4.184 1.00 0.00 C ATOM 711 C GLU A 43 1.791 9.526 4.232 1.00 0.00 C ATOM 712 O GLU A 43 2.380 9.799 5.276 1.00 0.00 O ATOM 713 CB GLU A 43 -0.562 8.795 4.768 1.00 0.00 C ATOM 714 CG GLU A 43 -0.457 9.037 6.275 1.00 0.00 C ATOM 715 CD GLU A 43 -1.394 10.163 6.716 1.00 0.00 C ATOM 716 OE1 GLU A 43 -2.574 10.111 6.310 1.00 0.00 O ATOM 717 OE2 GLU A 43 -0.908 11.051 7.450 1.00 0.00 O ATOM 0 H GLU A 43 1.231 7.254 5.900 1.00 0.00 H new ATOM 0 HA GLU A 43 0.627 8.099 3.141 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -0.907 9.703 4.274 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -1.305 8.022 4.571 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -0.705 8.121 6.812 1.00 0.00 H new ATOM 0 HG3 GLU A 43 0.570 9.291 6.535 1.00 0.00 H new ATOM 724 N ASP A 44 1.954 10.174 3.087 1.00 0.00 N ATOM 725 CA ASP A 44 2.876 11.292 2.985 1.00 0.00 C ATOM 726 C ASP A 44 4.266 10.845 3.442 1.00 0.00 C ATOM 727 O ASP A 44 4.677 11.137 4.564 1.00 0.00 O ATOM 728 CB ASP A 44 2.434 12.453 3.878 1.00 0.00 C ATOM 729 CG ASP A 44 3.385 13.652 3.897 1.00 0.00 C ATOM 730 OD1 ASP A 44 4.569 13.443 3.557 1.00 0.00 O ATOM 731 OD2 ASP A 44 2.905 14.751 4.250 1.00 0.00 O ATOM 0 H ASP A 44 1.463 9.946 2.223 1.00 0.00 H new ATOM 0 HA ASP A 44 2.892 11.622 1.946 1.00 0.00 H new ATOM 0 HB2 ASP A 44 1.452 12.792 3.548 1.00 0.00 H new ATOM 0 HB3 ASP A 44 2.318 12.084 4.897 1.00 0.00 H new ATOM 736 N PRO A 45 4.969 10.126 2.527 1.00 0.00 N ATOM 737 CA PRO A 45 4.408 9.825 1.221 1.00 0.00 C ATOM 738 C PRO A 45 3.347 8.727 1.320 1.00 0.00 C ATOM 739 O PRO A 45 3.171 8.122 2.377 1.00 0.00 O ATOM 740 CB PRO A 45 5.598 9.426 0.364 1.00 0.00 C ATOM 741 CG PRO A 45 6.711 9.070 1.336 1.00 0.00 C ATOM 742 CD PRO A 45 6.312 9.584 2.710 1.00 0.00 C ATOM 0 HA PRO A 45 3.885 10.675 0.782 1.00 0.00 H new ATOM 0 HB2 PRO A 45 5.352 8.578 -0.275 1.00 0.00 H new ATOM 0 HB3 PRO A 45 5.899 10.243 -0.292 1.00 0.00 H new ATOM 0 HG2 PRO A 45 6.865 7.991 1.362 1.00 0.00 H new ATOM 0 HG3 PRO A 45 7.653 9.519 1.019 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.319 8.783 3.450 1.00 0.00 H new ATOM 0 HD3 PRO A 45 7.003 10.349 3.063 1.00 0.00 H new ATOM 750 N ALA A 46 2.668 8.502 0.205 1.00 0.00 N ATOM 751 CA ALA A 46 1.630 7.487 0.153 1.00 0.00 C ATOM 752 C ALA A 46 2.208 6.202 -0.444 1.00 0.00 C ATOM 753 O ALA A 46 2.268 6.052 -1.663 1.00 0.00 O ATOM 754 CB ALA A 46 0.438 8.016 -0.647 1.00 0.00 C ATOM 0 H ALA A 46 2.817 9.005 -0.670 1.00 0.00 H new ATOM 0 HA ALA A 46 1.272 7.253 1.156 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -0.341 7.254 -0.686 1.00 0.00 H new ATOM 0 HB2 ALA A 46 0.046 8.912 -0.166 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.759 8.259 -1.660 1.00 0.00 H new ATOM 760 N TYR A 47 2.619 5.308 0.443 1.00 0.00 N ATOM 761 CA TYR A 47 3.190 4.041 0.020 1.00 0.00 C ATOM 762 C TYR A 47 2.725 2.899 0.926 1.00 0.00 C ATOM 763 O TYR A 47 2.330 3.130 2.068 1.00 0.00 O ATOM 764 CB TYR A 47 4.706 4.196 0.152 1.00 0.00 C ATOM 765 CG TYR A 47 5.391 4.713 -1.115 1.00 0.00 C ATOM 766 CD1 TYR A 47 5.226 4.045 -2.311 1.00 0.00 C ATOM 767 CD2 TYR A 47 6.175 5.848 -1.061 1.00 0.00 C ATOM 768 CE1 TYR A 47 5.871 4.531 -3.503 1.00 0.00 C ATOM 769 CE2 TYR A 47 6.820 6.334 -2.253 1.00 0.00 C ATOM 770 CZ TYR A 47 6.636 5.652 -3.415 1.00 0.00 C ATOM 771 OH TYR A 47 7.245 6.112 -4.541 1.00 0.00 O ATOM 0 H TYR A 47 2.568 5.436 1.454 1.00 0.00 H new ATOM 0 HA TYR A 47 2.881 3.803 -0.998 1.00 0.00 H new ATOM 0 HB2 TYR A 47 4.921 4.879 0.974 1.00 0.00 H new ATOM 0 HB3 TYR A 47 5.138 3.231 0.418 1.00 0.00 H new ATOM 0 HD1 TYR A 47 4.613 3.157 -2.353 1.00 0.00 H new ATOM 0 HD2 TYR A 47 6.304 6.371 -0.125 1.00 0.00 H new ATOM 0 HE1 TYR A 47 5.750 4.017 -4.445 1.00 0.00 H new ATOM 0 HE2 TYR A 47 7.436 7.220 -2.225 1.00 0.00 H new ATOM 0 HH TYR A 47 6.573 6.490 -5.146 1.00 0.00 H new ATOM 781 N LEU A 48 2.788 1.692 0.384 1.00 0.00 N ATOM 782 CA LEU A 48 2.379 0.514 1.129 1.00 0.00 C ATOM 783 C LEU A 48 3.456 -0.565 1.001 1.00 0.00 C ATOM 784 O LEU A 48 3.647 -1.131 -0.074 1.00 0.00 O ATOM 785 CB LEU A 48 0.990 0.053 0.683 1.00 0.00 C ATOM 786 CG LEU A 48 0.583 -1.359 1.109 1.00 0.00 C ATOM 787 CD1 LEU A 48 1.372 -2.415 0.332 1.00 0.00 C ATOM 788 CD2 LEU A 48 0.722 -1.537 2.622 1.00 0.00 C ATOM 0 H LEU A 48 3.117 1.504 -0.563 1.00 0.00 H new ATOM 0 HA LEU A 48 2.286 0.748 2.190 1.00 0.00 H new ATOM 0 HB2 LEU A 48 0.253 0.755 1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 48 0.941 0.111 -0.404 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.470 -1.499 0.864 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.063 -3.410 0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 48 1.178 -2.302 -0.735 1.00 0.00 H new ATOM 0 HD13 LEU A 48 2.437 -2.286 0.522 1.00 0.00 H new ATOM 0 HD21 LEU A 48 0.426 -2.549 2.898 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.759 -1.369 2.914 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.080 -0.819 3.133 1.00 0.00 H new ATOM 800 N HIS A 49 4.131 -0.817 2.113 1.00 0.00 N ATOM 801 CA HIS A 49 5.184 -1.819 2.138 1.00 0.00 C ATOM 802 C HIS A 49 4.671 -3.085 2.827 1.00 0.00 C ATOM 803 O HIS A 49 3.757 -3.022 3.648 1.00 0.00 O ATOM 804 CB HIS A 49 6.450 -1.259 2.790 1.00 0.00 C ATOM 805 CG HIS A 49 7.123 -0.170 1.990 1.00 0.00 C ATOM 806 ND1 HIS A 49 6.741 1.158 2.062 1.00 0.00 N ATOM 807 CD2 HIS A 49 8.157 -0.226 1.102 1.00 0.00 C ATOM 808 CE1 HIS A 49 7.516 1.861 1.249 1.00 0.00 C ATOM 809 NE2 HIS A 49 8.393 1.001 0.655 1.00 0.00 N ATOM 0 H HIS A 49 3.970 -0.345 3.003 1.00 0.00 H new ATOM 0 HA HIS A 49 5.460 -2.089 1.119 1.00 0.00 H new ATOM 0 HB2 HIS A 49 6.196 -0.868 3.775 1.00 0.00 H new ATOM 0 HB3 HIS A 49 7.158 -2.073 2.943 1.00 0.00 H new ATOM 0 HD2 HIS A 49 8.693 -1.118 0.812 1.00 0.00 H new ATOM 0 HE1 HIS A 49 7.463 2.927 1.085 1.00 0.00 H new ATOM 0 HE2 HIS A 49 9.112 1.259 -0.021 1.00 0.00 H new ATOM 817 N TYR A 50 5.282 -4.204 2.468 1.00 0.00 N ATOM 818 CA TYR A 50 4.899 -5.483 3.042 1.00 0.00 C ATOM 819 C TYR A 50 6.113 -6.403 3.190 1.00 0.00 C ATOM 820 O TYR A 50 6.799 -6.694 2.211 1.00 0.00 O ATOM 821 CB TYR A 50 3.916 -6.111 2.053 1.00 0.00 C ATOM 822 CG TYR A 50 4.337 -5.980 0.588 1.00 0.00 C ATOM 823 CD1 TYR A 50 4.305 -4.747 -0.032 1.00 0.00 C ATOM 824 CD2 TYR A 50 4.751 -7.094 -0.114 1.00 0.00 C ATOM 825 CE1 TYR A 50 4.702 -4.624 -1.411 1.00 0.00 C ATOM 826 CE2 TYR A 50 5.147 -6.971 -1.493 1.00 0.00 C ATOM 827 CZ TYR A 50 5.103 -5.742 -2.073 1.00 0.00 C ATOM 828 OH TYR A 50 5.478 -5.625 -3.375 1.00 0.00 O ATOM 0 H TYR A 50 6.040 -4.252 1.787 1.00 0.00 H new ATOM 0 HA TYR A 50 4.465 -5.345 4.032 1.00 0.00 H new ATOM 0 HB2 TYR A 50 3.800 -7.168 2.294 1.00 0.00 H new ATOM 0 HB3 TYR A 50 2.939 -5.645 2.183 1.00 0.00 H new ATOM 0 HD1 TYR A 50 3.982 -3.875 0.517 1.00 0.00 H new ATOM 0 HD2 TYR A 50 4.778 -8.058 0.371 1.00 0.00 H new ATOM 0 HE1 TYR A 50 4.682 -3.665 -1.908 1.00 0.00 H new ATOM 0 HE2 TYR A 50 5.472 -7.835 -2.054 1.00 0.00 H new ATOM 0 HH TYR A 50 5.741 -6.504 -3.720 1.00 0.00 H new ATOM 838 N TYR A 51 6.341 -6.835 4.422 1.00 0.00 N ATOM 839 CA TYR A 51 7.460 -7.715 4.710 1.00 0.00 C ATOM 840 C TYR A 51 6.973 -9.120 5.073 1.00 0.00 C ATOM 841 O TYR A 51 5.793 -9.317 5.358 1.00 0.00 O ATOM 842 CB TYR A 51 8.174 -7.108 5.920 1.00 0.00 C ATOM 843 CG TYR A 51 8.307 -5.585 5.863 1.00 0.00 C ATOM 844 CD1 TYR A 51 7.246 -4.785 6.239 1.00 0.00 C ATOM 845 CD2 TYR A 51 9.487 -5.010 5.437 1.00 0.00 C ATOM 846 CE1 TYR A 51 7.371 -3.352 6.186 1.00 0.00 C ATOM 847 CE2 TYR A 51 9.612 -3.577 5.384 1.00 0.00 C ATOM 848 CZ TYR A 51 8.548 -2.818 5.761 1.00 0.00 C ATOM 849 OH TYR A 51 8.666 -1.464 5.711 1.00 0.00 O ATOM 0 H TYR A 51 5.770 -6.592 5.231 1.00 0.00 H new ATOM 0 HA TYR A 51 8.112 -7.804 3.841 1.00 0.00 H new ATOM 0 HB2 TYR A 51 7.631 -7.382 6.825 1.00 0.00 H new ATOM 0 HB3 TYR A 51 9.169 -7.547 6.000 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.322 -5.235 6.573 1.00 0.00 H new ATOM 0 HD2 TYR A 51 10.317 -5.635 5.143 1.00 0.00 H new ATOM 0 HE1 TYR A 51 6.549 -2.715 6.477 1.00 0.00 H new ATOM 0 HE2 TYR A 51 10.530 -3.115 5.052 1.00 0.00 H new ATOM 0 HH TYR A 51 9.561 -1.225 5.390 1.00 0.00 H new ATOM 859 N ASP A 52 7.907 -10.059 5.051 1.00 0.00 N ATOM 860 CA ASP A 52 7.587 -11.440 5.374 1.00 0.00 C ATOM 861 C ASP A 52 7.245 -11.544 6.861 1.00 0.00 C ATOM 862 O ASP A 52 7.892 -10.915 7.697 1.00 0.00 O ATOM 863 CB ASP A 52 8.778 -12.360 5.097 1.00 0.00 C ATOM 864 CG ASP A 52 8.502 -13.852 5.295 1.00 0.00 C ATOM 865 OD1 ASP A 52 8.142 -14.216 6.435 1.00 0.00 O ATOM 866 OD2 ASP A 52 8.657 -14.594 4.301 1.00 0.00 O ATOM 0 H ASP A 52 8.885 -9.892 4.815 1.00 0.00 H new ATOM 0 HA ASP A 52 6.744 -11.745 4.755 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.110 -12.200 4.071 1.00 0.00 H new ATOM 0 HB3 ASP A 52 9.602 -12.069 5.748 1.00 0.00 H new ATOM 871 N PRO A 53 6.201 -12.365 7.154 1.00 0.00 N ATOM 872 CA PRO A 53 5.764 -12.561 8.526 1.00 0.00 C ATOM 873 C PRO A 53 6.735 -13.467 9.287 1.00 0.00 C ATOM 874 O PRO A 53 7.170 -13.131 10.387 1.00 0.00 O ATOM 875 CB PRO A 53 4.367 -13.148 8.414 1.00 0.00 C ATOM 876 CG PRO A 53 4.255 -13.691 6.999 1.00 0.00 C ATOM 877 CD PRO A 53 5.411 -13.126 6.190 1.00 0.00 C ATOM 0 HA PRO A 53 5.747 -11.634 9.099 1.00 0.00 H new ATOM 0 HB2 PRO A 53 4.216 -13.939 9.149 1.00 0.00 H new ATOM 0 HB3 PRO A 53 3.608 -12.389 8.602 1.00 0.00 H new ATOM 0 HG2 PRO A 53 4.289 -14.780 7.004 1.00 0.00 H new ATOM 0 HG3 PRO A 53 3.302 -13.404 6.554 1.00 0.00 H new ATOM 0 HD2 PRO A 53 6.001 -13.921 5.734 1.00 0.00 H new ATOM 0 HD3 PRO A 53 5.054 -12.490 5.380 1.00 0.00 H new ATOM 885 N ALA A 54 7.045 -14.598 8.670 1.00 0.00 N ATOM 886 CA ALA A 54 7.956 -15.554 9.275 1.00 0.00 C ATOM 887 C ALA A 54 9.126 -14.804 9.914 1.00 0.00 C ATOM 888 O ALA A 54 9.523 -15.107 11.038 1.00 0.00 O ATOM 889 CB ALA A 54 8.416 -16.560 8.218 1.00 0.00 C ATOM 0 H ALA A 54 6.681 -14.873 7.758 1.00 0.00 H new ATOM 0 HA ALA A 54 7.455 -16.115 10.064 1.00 0.00 H new ATOM 0 HB1 ALA A 54 9.100 -17.278 8.672 1.00 0.00 H new ATOM 0 HB2 ALA A 54 7.551 -17.087 7.817 1.00 0.00 H new ATOM 0 HB3 ALA A 54 8.926 -16.033 7.412 1.00 0.00 H new ATOM 895 N GLY A 55 9.646 -13.839 9.169 1.00 0.00 N ATOM 896 CA GLY A 55 10.763 -13.043 9.649 1.00 0.00 C ATOM 897 C GLY A 55 11.639 -12.571 8.487 1.00 0.00 C ATOM 898 O GLY A 55 11.952 -13.347 7.585 1.00 0.00 O ATOM 0 H GLY A 55 9.314 -13.591 8.237 1.00 0.00 H new ATOM 0 HA2 GLY A 55 10.389 -12.181 10.201 1.00 0.00 H new ATOM 0 HA3 GLY A 55 11.361 -13.632 10.345 1.00 0.00 H new ATOM 902 N ALA A 56 12.011 -11.301 8.546 1.00 0.00 N ATOM 903 CA ALA A 56 12.845 -10.716 7.510 1.00 0.00 C ATOM 904 C ALA A 56 13.403 -9.380 8.003 1.00 0.00 C ATOM 905 O ALA A 56 13.637 -9.204 9.198 1.00 0.00 O ATOM 906 CB ALA A 56 12.031 -10.568 6.222 1.00 0.00 C ATOM 0 H ALA A 56 11.750 -10.660 9.296 1.00 0.00 H new ATOM 0 HA ALA A 56 13.692 -11.365 7.288 1.00 0.00 H new ATOM 0 HB1 ALA A 56 12.657 -10.129 5.445 1.00 0.00 H new ATOM 0 HB2 ALA A 56 11.683 -11.548 5.897 1.00 0.00 H new ATOM 0 HB3 ALA A 56 11.173 -9.921 6.406 1.00 0.00 H new ATOM 912 N GLU A 57 13.599 -8.471 7.059 1.00 0.00 N ATOM 913 CA GLU A 57 14.124 -7.156 7.383 1.00 0.00 C ATOM 914 C GLU A 57 13.701 -6.139 6.322 1.00 0.00 C ATOM 915 O GLU A 57 13.255 -5.041 6.652 1.00 0.00 O ATOM 916 CB GLU A 57 15.647 -7.195 7.529 1.00 0.00 C ATOM 917 CG GLU A 57 16.190 -8.596 7.241 1.00 0.00 C ATOM 918 CD GLU A 57 17.720 -8.602 7.242 1.00 0.00 C ATOM 919 OE1 GLU A 57 18.286 -8.684 8.353 1.00 0.00 O ATOM 920 OE2 GLU A 57 18.288 -8.525 6.132 1.00 0.00 O ATOM 0 H GLU A 57 13.403 -8.620 6.069 1.00 0.00 H new ATOM 0 HA GLU A 57 13.707 -6.846 8.341 1.00 0.00 H new ATOM 0 HB2 GLU A 57 16.100 -6.478 6.844 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.927 -6.893 8.538 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.820 -9.295 7.991 1.00 0.00 H new ATOM 0 HG3 GLU A 57 15.822 -8.941 6.275 1.00 0.00 H new ATOM 927 N ASP A 58 13.856 -6.540 5.068 1.00 0.00 N ATOM 928 CA ASP A 58 13.495 -5.677 3.956 1.00 0.00 C ATOM 929 C ASP A 58 12.097 -6.051 3.459 1.00 0.00 C ATOM 930 O ASP A 58 11.690 -7.208 3.552 1.00 0.00 O ATOM 931 CB ASP A 58 14.472 -5.843 2.791 1.00 0.00 C ATOM 932 CG ASP A 58 15.948 -5.671 3.155 1.00 0.00 C ATOM 933 OD1 ASP A 58 16.226 -4.792 3.999 1.00 0.00 O ATOM 934 OD2 ASP A 58 16.765 -6.423 2.581 1.00 0.00 O ATOM 0 H ASP A 58 14.227 -7.451 4.798 1.00 0.00 H new ATOM 0 HA ASP A 58 13.524 -4.645 4.306 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.333 -6.834 2.359 1.00 0.00 H new ATOM 0 HB3 ASP A 58 14.217 -5.119 2.017 1.00 0.00 H new ATOM 939 N PRO A 59 11.382 -5.024 2.927 1.00 0.00 N ATOM 940 CA PRO A 59 10.039 -5.233 2.414 1.00 0.00 C ATOM 941 C PRO A 59 10.073 -5.953 1.065 1.00 0.00 C ATOM 942 O PRO A 59 10.791 -5.541 0.155 1.00 0.00 O ATOM 943 CB PRO A 59 9.429 -3.844 2.331 1.00 0.00 C ATOM 944 CG PRO A 59 10.598 -2.873 2.355 1.00 0.00 C ATOM 945 CD PRO A 59 11.832 -3.641 2.800 1.00 0.00 C ATOM 0 HA PRO A 59 9.440 -5.879 3.056 1.00 0.00 H new ATOM 0 HB2 PRO A 59 8.844 -3.728 1.419 1.00 0.00 H new ATOM 0 HB3 PRO A 59 8.754 -3.663 3.168 1.00 0.00 H new ATOM 0 HG2 PRO A 59 10.754 -2.439 1.367 1.00 0.00 H new ATOM 0 HG3 PRO A 59 10.395 -2.048 3.038 1.00 0.00 H new ATOM 0 HD2 PRO A 59 12.638 -3.552 2.071 1.00 0.00 H new ATOM 0 HD3 PRO A 59 12.215 -3.261 3.747 1.00 0.00 H new ATOM 953 N LEU A 60 9.288 -7.017 0.978 1.00 0.00 N ATOM 954 CA LEU A 60 9.220 -7.799 -0.245 1.00 0.00 C ATOM 955 C LEU A 60 9.011 -6.860 -1.434 1.00 0.00 C ATOM 956 O LEU A 60 9.410 -7.173 -2.555 1.00 0.00 O ATOM 957 CB LEU A 60 8.151 -8.887 -0.126 1.00 0.00 C ATOM 958 CG LEU A 60 8.348 -9.901 1.003 1.00 0.00 C ATOM 959 CD1 LEU A 60 7.067 -10.063 1.824 1.00 0.00 C ATOM 960 CD2 LEU A 60 8.852 -11.238 0.458 1.00 0.00 C ATOM 0 H LEU A 60 8.694 -7.356 1.735 1.00 0.00 H new ATOM 0 HA LEU A 60 10.160 -8.325 -0.414 1.00 0.00 H new ATOM 0 HB2 LEU A 60 7.183 -8.404 0.011 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.106 -9.429 -1.071 1.00 0.00 H new ATOM 0 HG LEU A 60 9.116 -9.518 1.676 1.00 0.00 H new ATOM 0 HD11 LEU A 60 7.234 -10.789 2.620 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.791 -9.103 2.261 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.262 -10.412 1.177 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.983 -11.940 1.281 1.00 0.00 H new ATOM 0 HD22 LEU A 60 8.126 -11.640 -0.249 1.00 0.00 H new ATOM 0 HD23 LEU A 60 9.806 -11.089 -0.047 1.00 0.00 H new ATOM 972 N GLY A 61 8.387 -5.726 -1.150 1.00 0.00 N ATOM 973 CA GLY A 61 8.121 -4.739 -2.182 1.00 0.00 C ATOM 974 C GLY A 61 7.248 -3.603 -1.643 1.00 0.00 C ATOM 975 O GLY A 61 7.006 -3.519 -0.440 1.00 0.00 O ATOM 0 H GLY A 61 8.058 -5.469 -0.219 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.062 -4.334 -2.554 1.00 0.00 H new ATOM 0 HA3 GLY A 61 7.623 -5.216 -3.026 1.00 0.00 H new ATOM 979 N ALA A 62 6.801 -2.758 -2.560 1.00 0.00 N ATOM 980 CA ALA A 62 5.961 -1.631 -2.192 1.00 0.00 C ATOM 981 C ALA A 62 4.948 -1.369 -3.308 1.00 0.00 C ATOM 982 O ALA A 62 5.161 -1.771 -4.451 1.00 0.00 O ATOM 983 CB ALA A 62 6.839 -0.412 -1.903 1.00 0.00 C ATOM 0 H ALA A 62 7.005 -2.831 -3.557 1.00 0.00 H new ATOM 0 HA ALA A 62 5.400 -1.851 -1.284 1.00 0.00 H new ATOM 0 HB1 ALA A 62 6.209 0.433 -1.627 1.00 0.00 H new ATOM 0 HB2 ALA A 62 7.520 -0.640 -1.083 1.00 0.00 H new ATOM 0 HB3 ALA A 62 7.415 -0.159 -2.793 1.00 0.00 H new ATOM 989 N ILE A 63 3.867 -0.697 -2.938 1.00 0.00 N ATOM 990 CA ILE A 63 2.821 -0.377 -3.894 1.00 0.00 C ATOM 991 C ILE A 63 2.582 1.134 -3.895 1.00 0.00 C ATOM 992 O ILE A 63 2.066 1.686 -2.924 1.00 0.00 O ATOM 993 CB ILE A 63 1.563 -1.198 -3.606 1.00 0.00 C ATOM 994 CG1 ILE A 63 1.901 -2.681 -3.444 1.00 0.00 C ATOM 995 CG2 ILE A 63 0.499 -0.966 -4.681 1.00 0.00 C ATOM 996 CD1 ILE A 63 0.802 -3.413 -2.671 1.00 0.00 C ATOM 0 H ILE A 63 3.693 -0.366 -1.989 1.00 0.00 H new ATOM 0 HA ILE A 63 3.129 -0.652 -4.903 1.00 0.00 H new ATOM 0 HB ILE A 63 1.143 -0.859 -2.659 1.00 0.00 H new ATOM 0 HG12 ILE A 63 2.026 -3.138 -4.425 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.851 -2.786 -2.920 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.385 -1.561 -4.452 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.229 0.090 -4.704 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.894 -1.261 -5.653 1.00 0.00 H new ATOM 0 HD11 ILE A 63 1.067 -4.465 -2.570 1.00 0.00 H new ATOM 0 HD12 ILE A 63 0.696 -2.969 -1.681 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.141 -3.327 -3.210 1.00 0.00 H new ATOM 1008 N HIS A 64 2.970 1.762 -4.996 1.00 0.00 N ATOM 1009 CA HIS A 64 2.804 3.198 -5.136 1.00 0.00 C ATOM 1010 C HIS A 64 1.323 3.559 -5.011 1.00 0.00 C ATOM 1011 O HIS A 64 0.477 2.965 -5.678 1.00 0.00 O ATOM 1012 CB HIS A 64 3.426 3.692 -6.444 1.00 0.00 C ATOM 1013 CG HIS A 64 3.853 5.140 -6.414 1.00 0.00 C ATOM 1014 ND1 HIS A 64 4.268 5.823 -7.543 1.00 0.00 N ATOM 1015 CD2 HIS A 64 3.924 6.026 -5.379 1.00 0.00 C ATOM 1016 CE1 HIS A 64 4.574 7.063 -7.193 1.00 0.00 C ATOM 1017 NE2 HIS A 64 4.361 7.187 -5.851 1.00 0.00 N ATOM 0 H HIS A 64 3.399 1.302 -5.799 1.00 0.00 H new ATOM 0 HA HIS A 64 3.335 3.708 -4.333 1.00 0.00 H new ATOM 0 HB2 HIS A 64 4.292 3.073 -6.678 1.00 0.00 H new ATOM 0 HB3 HIS A 64 2.707 3.553 -7.251 1.00 0.00 H new ATOM 0 HD1 HIS A 64 4.328 5.437 -8.485 1.00 0.00 H new ATOM 0 HD2 HIS A 64 3.668 5.818 -4.351 1.00 0.00 H new ATOM 0 HE1 HIS A 64 4.930 7.840 -7.854 1.00 0.00 H new ATOM 1025 N LEU A 65 1.054 4.531 -4.151 1.00 0.00 N ATOM 1026 CA LEU A 65 -0.311 4.978 -3.930 1.00 0.00 C ATOM 1027 C LEU A 65 -0.489 6.375 -4.527 1.00 0.00 C ATOM 1028 O LEU A 65 -1.389 7.114 -4.130 1.00 0.00 O ATOM 1029 CB LEU A 65 -0.668 4.893 -2.445 1.00 0.00 C ATOM 1030 CG LEU A 65 -0.328 3.575 -1.747 1.00 0.00 C ATOM 1031 CD1 LEU A 65 -0.337 3.741 -0.226 1.00 0.00 C ATOM 1032 CD2 LEU A 65 -1.262 2.454 -2.207 1.00 0.00 C ATOM 0 H LEU A 65 1.758 5.021 -3.599 1.00 0.00 H new ATOM 0 HA LEU A 65 -1.015 4.321 -4.441 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.156 5.701 -1.922 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.738 5.072 -2.338 1.00 0.00 H new ATOM 0 HG LEU A 65 0.684 3.289 -2.033 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -0.092 2.789 0.245 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.401 4.489 0.063 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -1.326 4.063 0.099 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.999 1.528 -1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -2.292 2.719 -1.970 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.161 2.315 -3.283 1.00 0.00 H new ATOM 1044 N ARG A 66 0.384 6.696 -5.470 1.00 0.00 N ATOM 1045 CA ARG A 66 0.335 7.992 -6.125 1.00 0.00 C ATOM 1046 C ARG A 66 -0.866 8.065 -7.069 1.00 0.00 C ATOM 1047 O ARG A 66 -0.730 7.843 -8.271 1.00 0.00 O ATOM 1048 CB ARG A 66 1.616 8.257 -6.920 1.00 0.00 C ATOM 1049 CG ARG A 66 2.324 9.515 -6.415 1.00 0.00 C ATOM 1050 CD ARG A 66 2.179 10.664 -7.415 1.00 0.00 C ATOM 1051 NE ARG A 66 3.468 11.377 -7.558 1.00 0.00 N ATOM 1052 CZ ARG A 66 4.487 10.944 -8.313 1.00 0.00 C ATOM 1053 NH1 ARG A 66 4.372 9.798 -8.999 1.00 0.00 N ATOM 1054 NH2 ARG A 66 5.619 11.656 -8.383 1.00 0.00 N ATOM 0 H ARG A 66 1.129 6.081 -5.796 1.00 0.00 H new ATOM 0 HA ARG A 66 0.239 8.751 -5.349 1.00 0.00 H new ATOM 0 HB2 ARG A 66 2.285 7.400 -6.835 1.00 0.00 H new ATOM 0 HB3 ARG A 66 1.375 8.370 -7.977 1.00 0.00 H new ATOM 0 HG2 ARG A 66 1.906 9.811 -5.453 1.00 0.00 H new ATOM 0 HG3 ARG A 66 3.380 9.301 -6.251 1.00 0.00 H new ATOM 0 HD2 ARG A 66 1.859 10.277 -8.382 1.00 0.00 H new ATOM 0 HD3 ARG A 66 1.407 11.356 -7.077 1.00 0.00 H new ATOM 0 HE ARG A 66 3.588 12.253 -7.050 1.00 0.00 H new ATOM 0 HH11 ARG A 66 3.509 9.256 -8.946 1.00 0.00 H new ATOM 0 HH12 ARG A 66 5.147 9.468 -9.574 1.00 0.00 H new ATOM 0 HH21 ARG A 66 5.706 12.528 -7.862 1.00 0.00 H new ATOM 0 HH22 ARG A 66 6.394 11.326 -8.958 1.00 0.00 H new ATOM 1068 N GLY A 67 -2.016 8.377 -6.489 1.00 0.00 N ATOM 1069 CA GLY A 67 -3.241 8.481 -7.264 1.00 0.00 C ATOM 1070 C GLY A 67 -3.825 7.097 -7.556 1.00 0.00 C ATOM 1071 O GLY A 67 -4.493 6.903 -8.570 1.00 0.00 O ATOM 0 H GLY A 67 -2.125 8.561 -5.492 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -3.971 9.080 -6.719 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -3.040 9.000 -8.201 1.00 0.00 H new ATOM 1075 N CYS A 68 -3.551 6.171 -6.649 1.00 0.00 N ATOM 1076 CA CYS A 68 -4.041 4.811 -6.796 1.00 0.00 C ATOM 1077 C CYS A 68 -5.558 4.823 -6.603 1.00 0.00 C ATOM 1078 O CYS A 68 -6.134 5.850 -6.245 1.00 0.00 O ATOM 1079 CB CYS A 68 -3.349 3.852 -5.825 1.00 0.00 C ATOM 1080 SG CYS A 68 -3.808 4.268 -4.103 1.00 0.00 S ATOM 0 H CYS A 68 -2.996 6.336 -5.809 1.00 0.00 H new ATOM 0 HA CYS A 68 -3.806 4.444 -7.795 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -3.636 2.825 -6.049 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -2.268 3.915 -5.947 1.00 0.00 H new ATOM 0 HG CYS A 68 -3.997 3.173 -3.428 1.00 0.00 H new ATOM 1086 N VAL A 69 -6.163 3.670 -6.849 1.00 0.00 N ATOM 1087 CA VAL A 69 -7.603 3.535 -6.706 1.00 0.00 C ATOM 1088 C VAL A 69 -7.910 2.419 -5.706 1.00 0.00 C ATOM 1089 O VAL A 69 -7.152 1.456 -5.593 1.00 0.00 O ATOM 1090 CB VAL A 69 -8.245 3.305 -8.076 1.00 0.00 C ATOM 1091 CG1 VAL A 69 -9.772 3.299 -7.971 1.00 0.00 C ATOM 1092 CG2 VAL A 69 -7.768 4.348 -9.088 1.00 0.00 C ATOM 0 H VAL A 69 -5.682 2.821 -7.146 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.036 4.454 -6.309 1.00 0.00 H new ATOM 0 HB VAL A 69 -7.930 2.325 -8.434 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -10.204 3.134 -8.958 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.087 2.501 -7.299 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -10.114 4.258 -7.581 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -8.240 4.161 -10.053 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -8.039 5.344 -8.739 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.685 4.283 -9.195 1.00 0.00 H new ATOM 1102 N VAL A 70 -9.023 2.583 -5.007 1.00 0.00 N ATOM 1103 CA VAL A 70 -9.439 1.601 -4.020 1.00 0.00 C ATOM 1104 C VAL A 70 -10.816 1.055 -4.401 1.00 0.00 C ATOM 1105 O VAL A 70 -11.696 1.810 -4.812 1.00 0.00 O ATOM 1106 CB VAL A 70 -9.407 2.219 -2.621 1.00 0.00 C ATOM 1107 CG1 VAL A 70 -10.195 1.364 -1.626 1.00 0.00 C ATOM 1108 CG2 VAL A 70 -7.967 2.426 -2.146 1.00 0.00 C ATOM 0 H VAL A 70 -9.650 3.382 -5.104 1.00 0.00 H new ATOM 0 HA VAL A 70 -8.748 0.758 -4.004 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.886 3.197 -2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -10.156 1.825 -0.639 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -11.233 1.290 -1.952 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.758 0.367 -1.577 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -7.973 2.867 -1.149 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -7.452 1.466 -2.116 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -7.449 3.094 -2.835 1.00 0.00 H new ATOM 1118 N THR A 71 -10.961 -0.254 -4.250 1.00 0.00 N ATOM 1119 CA THR A 71 -12.216 -0.910 -4.573 1.00 0.00 C ATOM 1120 C THR A 71 -12.318 -2.253 -3.846 1.00 0.00 C ATOM 1121 O THR A 71 -11.376 -2.674 -3.177 1.00 0.00 O ATOM 1122 CB THR A 71 -12.306 -1.036 -6.095 1.00 0.00 C ATOM 1123 OG1 THR A 71 -13.706 -1.092 -6.357 1.00 0.00 O ATOM 1124 CG2 THR A 71 -11.778 -2.378 -6.605 1.00 0.00 C ATOM 0 H THR A 71 -10.230 -0.877 -3.908 1.00 0.00 H new ATOM 0 HA THR A 71 -13.068 -0.324 -4.230 1.00 0.00 H new ATOM 0 HB THR A 71 -11.744 -0.225 -6.559 1.00 0.00 H new ATOM 0 HG1 THR A 71 -13.855 -1.172 -7.322 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.865 -2.414 -7.691 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.731 -2.489 -6.321 1.00 0.00 H new ATOM 0 HG23 THR A 71 -12.361 -3.188 -6.167 1.00 0.00 H new ATOM 1132 N SER A 72 -13.471 -2.887 -4.001 1.00 0.00 N ATOM 1133 CA SER A 72 -13.709 -4.173 -3.368 1.00 0.00 C ATOM 1134 C SER A 72 -13.799 -5.271 -4.430 1.00 0.00 C ATOM 1135 O SER A 72 -13.983 -4.983 -5.612 1.00 0.00 O ATOM 1136 CB SER A 72 -14.986 -4.144 -2.525 1.00 0.00 C ATOM 1137 OG SER A 72 -15.368 -2.815 -2.181 1.00 0.00 O ATOM 0 H SER A 72 -14.251 -2.534 -4.556 1.00 0.00 H new ATOM 0 HA SER A 72 -12.872 -4.387 -2.704 1.00 0.00 H new ATOM 0 HB2 SER A 72 -15.795 -4.623 -3.076 1.00 0.00 H new ATOM 0 HB3 SER A 72 -14.833 -4.724 -1.615 1.00 0.00 H new ATOM 0 HG SER A 72 -16.188 -2.839 -1.645 1.00 0.00 H new ATOM 1143 N VAL A 73 -13.664 -6.506 -3.971 1.00 0.00 N ATOM 1144 CA VAL A 73 -13.728 -7.649 -4.866 1.00 0.00 C ATOM 1145 C VAL A 73 -15.189 -8.063 -5.055 1.00 0.00 C ATOM 1146 O VAL A 73 -16.097 -7.257 -4.857 1.00 0.00 O ATOM 1147 CB VAL A 73 -12.850 -8.782 -4.332 1.00 0.00 C ATOM 1148 CG1 VAL A 73 -11.435 -8.283 -4.031 1.00 0.00 C ATOM 1149 CG2 VAL A 73 -13.478 -9.427 -3.095 1.00 0.00 C ATOM 0 H VAL A 73 -13.510 -6.741 -2.990 1.00 0.00 H new ATOM 0 HA VAL A 73 -13.335 -7.387 -5.848 1.00 0.00 H new ATOM 0 HB VAL A 73 -12.779 -9.545 -5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -10.831 -9.108 -3.653 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -10.985 -7.893 -4.944 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -11.480 -7.493 -3.282 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -12.833 -10.229 -2.736 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -13.594 -8.677 -2.313 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -14.455 -9.835 -3.354 1.00 0.00 H new ATOM 1159 N GLU A 74 -15.370 -9.319 -5.436 1.00 0.00 N ATOM 1160 CA GLU A 74 -16.705 -9.850 -5.653 1.00 0.00 C ATOM 1161 C GLU A 74 -16.948 -11.062 -4.752 1.00 0.00 C ATOM 1162 O GLU A 74 -17.616 -12.014 -5.152 1.00 0.00 O ATOM 1163 CB GLU A 74 -16.919 -10.209 -7.125 1.00 0.00 C ATOM 1164 CG GLU A 74 -16.308 -11.573 -7.451 1.00 0.00 C ATOM 1165 CD GLU A 74 -15.524 -11.523 -8.764 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -14.373 -11.039 -8.720 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -16.095 -11.969 -9.783 1.00 0.00 O ATOM 0 H GLU A 74 -14.614 -9.984 -5.600 1.00 0.00 H new ATOM 0 HA GLU A 74 -17.429 -9.078 -5.392 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -17.986 -10.222 -7.349 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -16.470 -9.444 -7.759 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -15.648 -11.883 -6.641 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -17.097 -12.321 -7.523 1.00 0.00 H new ATOM 1174 N SER A 75 -16.391 -10.988 -3.552 1.00 0.00 N ATOM 1175 CA SER A 75 -16.539 -12.067 -2.590 1.00 0.00 C ATOM 1176 C SER A 75 -17.975 -12.107 -2.064 1.00 0.00 C ATOM 1177 O SER A 75 -18.231 -11.734 -0.920 1.00 0.00 O ATOM 1178 CB SER A 75 -15.553 -11.911 -1.431 1.00 0.00 C ATOM 1179 OG SER A 75 -15.933 -12.687 -0.298 1.00 0.00 O ATOM 0 H SER A 75 -15.836 -10.197 -3.224 1.00 0.00 H new ATOM 0 HA SER A 75 -16.318 -13.007 -3.095 1.00 0.00 H new ATOM 0 HB2 SER A 75 -14.558 -12.212 -1.759 1.00 0.00 H new ATOM 0 HB3 SER A 75 -15.491 -10.861 -1.147 1.00 0.00 H new ATOM 0 HG SER A 75 -16.792 -12.364 0.047 1.00 0.00 H new ATOM 1185 N ASN A 76 -18.874 -12.562 -2.924 1.00 0.00 N ATOM 1186 CA ASN A 76 -20.278 -12.655 -2.559 1.00 0.00 C ATOM 1187 C ASN A 76 -20.566 -14.054 -2.011 1.00 0.00 C ATOM 1188 O ASN A 76 -20.973 -14.201 -0.859 1.00 0.00 O ATOM 1189 CB ASN A 76 -21.178 -12.429 -3.775 1.00 0.00 C ATOM 1190 CG ASN A 76 -21.458 -10.939 -3.982 1.00 0.00 C ATOM 1191 OD1 ASN A 76 -21.806 -10.213 -3.065 1.00 0.00 O ATOM 1192 ND2 ASN A 76 -21.287 -10.525 -5.234 1.00 0.00 N ATOM 0 H ASN A 76 -18.658 -12.870 -3.872 1.00 0.00 H new ATOM 0 HA ASN A 76 -20.484 -11.890 -1.810 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -20.702 -12.840 -4.665 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -22.118 -12.964 -3.640 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -21.449 -9.547 -5.474 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -20.994 -11.185 -5.954 1.00 0.00 H new ATOM 1199 N SER A 77 -20.344 -15.045 -2.861 1.00 0.00 N ATOM 1200 CA SER A 77 -20.575 -16.427 -2.475 1.00 0.00 C ATOM 1201 C SER A 77 -19.571 -17.342 -3.179 1.00 0.00 C ATOM 1202 O SER A 77 -19.063 -17.006 -4.248 1.00 0.00 O ATOM 1203 CB SER A 77 -22.006 -16.858 -2.803 1.00 0.00 C ATOM 1204 OG SER A 77 -22.973 -15.983 -2.229 1.00 0.00 O ATOM 0 H SER A 77 -20.007 -14.919 -3.815 1.00 0.00 H new ATOM 0 HA SER A 77 -20.437 -16.509 -1.397 1.00 0.00 H new ATOM 0 HB2 SER A 77 -22.138 -16.884 -3.885 1.00 0.00 H new ATOM 0 HB3 SER A 77 -22.172 -17.871 -2.437 1.00 0.00 H new ATOM 0 HG SER A 77 -23.873 -16.292 -2.463 1.00 0.00 H new ATOM 1210 N ASN A 78 -19.313 -18.479 -2.550 1.00 0.00 N ATOM 1211 CA ASN A 78 -18.379 -19.445 -3.103 1.00 0.00 C ATOM 1212 C ASN A 78 -18.223 -20.613 -2.128 1.00 0.00 C ATOM 1213 O ASN A 78 -17.910 -20.410 -0.956 1.00 0.00 O ATOM 1214 CB ASN A 78 -16.999 -18.817 -3.314 1.00 0.00 C ATOM 1215 CG ASN A 78 -16.487 -19.083 -4.731 1.00 0.00 C ATOM 1216 OD1 ASN A 78 -16.186 -20.202 -5.111 1.00 0.00 O ATOM 1217 ND2 ASN A 78 -16.404 -17.993 -5.489 1.00 0.00 N ATOM 0 H ASN A 78 -19.735 -18.753 -1.663 1.00 0.00 H new ATOM 0 HA ASN A 78 -18.772 -19.784 -4.062 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -17.054 -17.743 -3.139 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -16.296 -19.223 -2.587 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -16.072 -18.065 -6.451 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -16.672 -17.085 -5.108 1.00 0.00 H new ATOM 1224 N GLY A 79 -18.448 -21.811 -2.648 1.00 0.00 N ATOM 1225 CA GLY A 79 -18.336 -23.011 -1.838 1.00 0.00 C ATOM 1226 C GLY A 79 -19.416 -23.044 -0.754 1.00 0.00 C ATOM 1227 O GLY A 79 -20.605 -22.952 -1.054 1.00 0.00 O ATOM 0 H GLY A 79 -18.707 -21.976 -3.621 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -18.426 -23.892 -2.473 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -17.350 -23.051 -1.375 1.00 0.00 H new ATOM 1231 N ARG A 80 -18.963 -23.176 0.484 1.00 0.00 N ATOM 1232 CA ARG A 80 -19.875 -23.222 1.614 1.00 0.00 C ATOM 1233 C ARG A 80 -19.097 -23.140 2.929 1.00 0.00 C ATOM 1234 O ARG A 80 -19.352 -22.262 3.752 1.00 0.00 O ATOM 1235 CB ARG A 80 -20.705 -24.507 1.600 1.00 0.00 C ATOM 1236 CG ARG A 80 -21.763 -24.489 2.705 1.00 0.00 C ATOM 1237 CD ARG A 80 -23.168 -24.340 2.116 1.00 0.00 C ATOM 1238 NE ARG A 80 -24.176 -24.833 3.082 1.00 0.00 N ATOM 1239 CZ ARG A 80 -24.298 -26.116 3.451 1.00 0.00 C ATOM 1240 NH1 ARG A 80 -23.476 -27.042 2.938 1.00 0.00 N ATOM 1241 NH2 ARG A 80 -25.242 -26.472 4.333 1.00 0.00 N ATOM 0 H ARG A 80 -17.976 -23.253 0.729 1.00 0.00 H new ATOM 0 HA ARG A 80 -20.547 -22.368 1.532 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -21.189 -24.621 0.630 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -20.050 -25.368 1.733 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -21.704 -25.410 3.285 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -21.563 -23.666 3.391 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -23.362 -23.294 1.877 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -23.242 -24.899 1.183 1.00 0.00 H new ATOM 0 HE ARG A 80 -24.817 -24.154 3.492 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -22.758 -26.771 2.267 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -23.569 -28.018 3.219 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -25.867 -25.767 4.723 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -25.335 -27.448 4.614 1.00 0.00 H new ATOM 1255 N LYS A 81 -18.163 -24.067 3.085 1.00 0.00 N ATOM 1256 CA LYS A 81 -17.346 -24.111 4.285 1.00 0.00 C ATOM 1257 C LYS A 81 -16.574 -22.796 4.420 1.00 0.00 C ATOM 1258 O LYS A 81 -16.982 -21.907 5.166 1.00 0.00 O ATOM 1259 CB LYS A 81 -16.450 -25.351 4.279 1.00 0.00 C ATOM 1260 CG LYS A 81 -16.829 -26.307 5.412 1.00 0.00 C ATOM 1261 CD LYS A 81 -15.931 -26.093 6.633 1.00 0.00 C ATOM 1262 CE LYS A 81 -16.648 -26.506 7.920 1.00 0.00 C ATOM 1263 NZ LYS A 81 -15.984 -25.906 9.099 1.00 0.00 N ATOM 0 H LYS A 81 -17.954 -24.793 2.400 1.00 0.00 H new ATOM 0 HA LYS A 81 -17.975 -24.205 5.170 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -16.539 -25.863 3.321 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -15.407 -25.051 4.385 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -17.871 -26.151 5.691 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -16.742 -27.338 5.068 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -15.015 -26.673 6.521 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -15.640 -25.045 6.695 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -17.690 -26.188 7.881 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -16.650 -27.592 8.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -16.483 -26.196 9.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.997 -26.230 9.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.005 -24.869 9.019 1.00 0.00 H new ATOM 1277 N SER A 82 -15.473 -22.715 3.687 1.00 0.00 N ATOM 1278 CA SER A 82 -14.641 -21.524 3.716 1.00 0.00 C ATOM 1279 C SER A 82 -13.583 -21.599 2.614 1.00 0.00 C ATOM 1280 O SER A 82 -12.604 -22.334 2.737 1.00 0.00 O ATOM 1281 CB SER A 82 -13.974 -21.351 5.082 1.00 0.00 C ATOM 1282 OG SER A 82 -13.470 -20.031 5.266 1.00 0.00 O ATOM 0 H SER A 82 -15.138 -23.455 3.070 1.00 0.00 H new ATOM 0 HA SER A 82 -15.278 -20.657 3.541 1.00 0.00 H new ATOM 0 HB2 SER A 82 -14.694 -21.577 5.868 1.00 0.00 H new ATOM 0 HB3 SER A 82 -13.159 -22.068 5.181 1.00 0.00 H new ATOM 0 HG SER A 82 -13.053 -19.960 6.150 1.00 0.00 H new ATOM 1288 N GLU A 83 -13.815 -20.828 1.561 1.00 0.00 N ATOM 1289 CA GLU A 83 -12.893 -20.798 0.438 1.00 0.00 C ATOM 1290 C GLU A 83 -12.160 -19.456 0.390 1.00 0.00 C ATOM 1291 O GLU A 83 -10.930 -19.416 0.413 1.00 0.00 O ATOM 1292 CB GLU A 83 -13.624 -21.072 -0.878 1.00 0.00 C ATOM 1293 CG GLU A 83 -14.289 -22.449 -0.860 1.00 0.00 C ATOM 1294 CD GLU A 83 -13.243 -23.562 -0.768 1.00 0.00 C ATOM 1295 OE1 GLU A 83 -12.509 -23.735 -1.765 1.00 0.00 O ATOM 1296 OE2 GLU A 83 -13.201 -24.215 0.297 1.00 0.00 O ATOM 0 H GLU A 83 -14.628 -20.220 1.462 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.155 -21.588 0.576 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -14.378 -20.303 -1.046 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -12.920 -21.015 -1.708 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -14.972 -22.516 -0.013 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -14.886 -22.580 -1.762 1.00 0.00 H new ATOM 1303 N GLU A 84 -12.944 -18.391 0.323 1.00 0.00 N ATOM 1304 CA GLU A 84 -12.385 -17.051 0.271 1.00 0.00 C ATOM 1305 C GLU A 84 -13.167 -16.113 1.192 1.00 0.00 C ATOM 1306 O GLU A 84 -14.375 -15.945 1.032 1.00 0.00 O ATOM 1307 CB GLU A 84 -12.366 -16.520 -1.164 1.00 0.00 C ATOM 1308 CG GLU A 84 -11.511 -17.411 -2.067 1.00 0.00 C ATOM 1309 CD GLU A 84 -12.354 -18.030 -3.184 1.00 0.00 C ATOM 1310 OE1 GLU A 84 -13.053 -19.022 -2.885 1.00 0.00 O ATOM 1311 OE2 GLU A 84 -12.281 -17.496 -4.312 1.00 0.00 O ATOM 0 H GLU A 84 -13.963 -18.429 0.303 1.00 0.00 H new ATOM 0 HA GLU A 84 -11.354 -17.095 0.621 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -13.384 -16.473 -1.552 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.974 -15.503 -1.174 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -10.701 -16.825 -2.500 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -11.051 -18.201 -1.474 1.00 0.00 H new ATOM 1318 N GLU A 85 -12.446 -15.527 2.137 1.00 0.00 N ATOM 1319 CA GLU A 85 -13.057 -14.610 3.084 1.00 0.00 C ATOM 1320 C GLU A 85 -13.291 -13.247 2.429 1.00 0.00 C ATOM 1321 O GLU A 85 -13.570 -13.169 1.233 1.00 0.00 O ATOM 1322 CB GLU A 85 -12.201 -14.472 4.345 1.00 0.00 C ATOM 1323 CG GLU A 85 -11.695 -15.838 4.815 1.00 0.00 C ATOM 1324 CD GLU A 85 -11.338 -15.807 6.303 1.00 0.00 C ATOM 1325 OE1 GLU A 85 -10.328 -15.148 6.630 1.00 0.00 O ATOM 1326 OE2 GLU A 85 -12.084 -16.443 7.078 1.00 0.00 O ATOM 0 H GLU A 85 -11.444 -15.670 2.267 1.00 0.00 H new ATOM 0 HA GLU A 85 -14.022 -15.018 3.383 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -11.354 -13.816 4.144 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.786 -14.004 5.137 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.459 -16.594 4.636 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -10.819 -16.126 4.233 1.00 0.00 H new ATOM 1333 N ASN A 86 -13.168 -12.207 3.240 1.00 0.00 N ATOM 1334 CA ASN A 86 -13.362 -10.852 2.754 1.00 0.00 C ATOM 1335 C ASN A 86 -12.079 -10.370 2.074 1.00 0.00 C ATOM 1336 O ASN A 86 -11.001 -10.422 2.665 1.00 0.00 O ATOM 1337 CB ASN A 86 -13.675 -9.893 3.905 1.00 0.00 C ATOM 1338 CG ASN A 86 -14.966 -10.298 4.619 1.00 0.00 C ATOM 1339 OD1 ASN A 86 -16.035 -10.366 4.034 1.00 0.00 O ATOM 1340 ND2 ASN A 86 -14.809 -10.563 5.913 1.00 0.00 N ATOM 0 H ASN A 86 -12.936 -12.276 4.231 1.00 0.00 H new ATOM 0 HA ASN A 86 -14.198 -10.862 2.055 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -12.848 -9.889 4.615 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -13.770 -8.877 3.521 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -15.611 -10.842 6.477 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -13.886 -10.487 6.341 1.00 0.00 H new ATOM 1347 N LEU A 87 -12.237 -9.911 0.841 1.00 0.00 N ATOM 1348 CA LEU A 87 -11.105 -9.420 0.074 1.00 0.00 C ATOM 1349 C LEU A 87 -11.501 -8.127 -0.642 1.00 0.00 C ATOM 1350 O LEU A 87 -12.683 -7.797 -0.725 1.00 0.00 O ATOM 1351 CB LEU A 87 -10.582 -10.508 -0.866 1.00 0.00 C ATOM 1352 CG LEU A 87 -11.282 -11.865 -0.776 1.00 0.00 C ATOM 1353 CD1 LEU A 87 -11.320 -12.554 -2.141 1.00 0.00 C ATOM 1354 CD2 LEU A 87 -10.635 -12.747 0.293 1.00 0.00 C ATOM 0 H LEU A 87 -13.132 -9.869 0.354 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.274 -9.176 0.736 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.665 -10.146 -1.891 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.521 -10.655 -0.665 1.00 0.00 H new ATOM 0 HG LEU A 87 -12.315 -11.696 -0.471 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.823 -13.517 -2.049 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.862 -11.928 -2.850 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.302 -12.709 -2.499 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.152 -13.706 0.336 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.587 -12.911 0.044 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.704 -12.254 1.263 1.00 0.00 H new ATOM 1366 N PHE A 88 -10.490 -7.431 -1.140 1.00 0.00 N ATOM 1367 CA PHE A 88 -10.718 -6.182 -1.847 1.00 0.00 C ATOM 1368 C PHE A 88 -9.609 -5.918 -2.867 1.00 0.00 C ATOM 1369 O PHE A 88 -8.474 -6.352 -2.681 1.00 0.00 O ATOM 1370 CB PHE A 88 -10.706 -5.067 -0.799 1.00 0.00 C ATOM 1371 CG PHE A 88 -9.430 -5.019 0.044 1.00 0.00 C ATOM 1372 CD1 PHE A 88 -8.250 -4.661 -0.529 1.00 0.00 C ATOM 1373 CD2 PHE A 88 -9.477 -5.333 1.366 1.00 0.00 C ATOM 1374 CE1 PHE A 88 -7.066 -4.616 0.253 1.00 0.00 C ATOM 1375 CE2 PHE A 88 -8.292 -5.289 2.148 1.00 0.00 C ATOM 1376 CZ PHE A 88 -7.112 -4.931 1.575 1.00 0.00 C ATOM 0 H PHE A 88 -9.511 -7.708 -1.068 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.665 -6.226 -2.384 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -10.833 -4.108 -1.302 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -11.562 -5.196 -0.137 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.213 -4.411 -1.579 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -10.415 -5.616 1.821 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -6.129 -4.332 -0.202 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -8.328 -5.540 3.198 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.211 -4.897 2.170 1.00 0.00 H new ATOM 1386 N GLU A 89 -9.978 -5.208 -3.924 1.00 0.00 N ATOM 1387 CA GLU A 89 -9.028 -4.882 -4.974 1.00 0.00 C ATOM 1388 C GLU A 89 -8.517 -3.450 -4.801 1.00 0.00 C ATOM 1389 O GLU A 89 -9.259 -2.571 -4.366 1.00 0.00 O ATOM 1390 CB GLU A 89 -9.652 -5.079 -6.357 1.00 0.00 C ATOM 1391 CG GLU A 89 -8.588 -4.999 -7.455 1.00 0.00 C ATOM 1392 CD GLU A 89 -8.891 -5.985 -8.585 1.00 0.00 C ATOM 1393 OE1 GLU A 89 -9.901 -5.753 -9.284 1.00 0.00 O ATOM 1394 OE2 GLU A 89 -8.107 -6.948 -8.724 1.00 0.00 O ATOM 0 H GLU A 89 -10.921 -4.850 -4.075 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.179 -5.561 -4.894 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -10.152 -6.047 -6.400 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -10.414 -4.319 -6.528 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -8.547 -3.985 -7.853 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.607 -5.215 -7.032 1.00 0.00 H new ATOM 1401 N ILE A 90 -7.253 -3.261 -5.151 1.00 0.00 N ATOM 1402 CA ILE A 90 -6.634 -1.951 -5.040 1.00 0.00 C ATOM 1403 C ILE A 90 -5.772 -1.693 -6.277 1.00 0.00 C ATOM 1404 O ILE A 90 -4.694 -2.269 -6.418 1.00 0.00 O ATOM 1405 CB ILE A 90 -5.868 -1.831 -3.721 1.00 0.00 C ATOM 1406 CG1 ILE A 90 -6.808 -1.993 -2.525 1.00 0.00 C ATOM 1407 CG2 ILE A 90 -5.085 -0.518 -3.660 1.00 0.00 C ATOM 1408 CD1 ILE A 90 -6.022 -2.062 -1.214 1.00 0.00 C ATOM 0 H ILE A 90 -6.641 -3.993 -5.512 1.00 0.00 H new ATOM 0 HA ILE A 90 -7.395 -1.171 -5.013 1.00 0.00 H new ATOM 0 HB ILE A 90 -5.142 -2.642 -3.672 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -7.506 -1.157 -2.491 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -7.402 -2.899 -2.645 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.549 -0.457 -2.713 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -4.371 -0.481 -4.483 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.776 0.322 -3.741 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -6.715 -2.177 -0.380 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -5.342 -2.914 -1.242 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -5.448 -1.144 -1.085 1.00 0.00 H new ATOM 1420 N ILE A 91 -6.278 -0.827 -7.142 1.00 0.00 N ATOM 1421 CA ILE A 91 -5.568 -0.485 -8.363 1.00 0.00 C ATOM 1422 C ILE A 91 -4.597 0.663 -8.079 1.00 0.00 C ATOM 1423 O ILE A 91 -4.908 1.566 -7.304 1.00 0.00 O ATOM 1424 CB ILE A 91 -6.556 -0.190 -9.493 1.00 0.00 C ATOM 1425 CG1 ILE A 91 -7.657 -1.250 -9.549 1.00 0.00 C ATOM 1426 CG2 ILE A 91 -5.830 -0.045 -10.832 1.00 0.00 C ATOM 1427 CD1 ILE A 91 -9.038 -0.601 -9.667 1.00 0.00 C ATOM 0 H ILE A 91 -7.172 -0.351 -7.022 1.00 0.00 H new ATOM 0 HA ILE A 91 -4.971 -1.330 -8.706 1.00 0.00 H new ATOM 0 HB ILE A 91 -7.039 0.765 -9.284 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.488 -1.911 -10.399 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.617 -1.868 -8.652 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.555 0.164 -11.618 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.114 0.775 -10.771 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.303 -0.971 -11.062 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -9.803 -1.377 -9.705 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -9.214 0.040 -8.803 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -9.082 -0.003 -10.577 1.00 0.00 H new ATOM 1439 N THR A 92 -3.441 0.591 -8.721 1.00 0.00 N ATOM 1440 CA THR A 92 -2.423 1.613 -8.547 1.00 0.00 C ATOM 1441 C THR A 92 -2.338 2.498 -9.792 1.00 0.00 C ATOM 1442 O THR A 92 -3.064 2.284 -10.762 1.00 0.00 O ATOM 1443 CB THR A 92 -1.105 0.914 -8.208 1.00 0.00 C ATOM 1444 OG1 THR A 92 -0.868 0.058 -9.323 1.00 0.00 O ATOM 1445 CG2 THR A 92 -1.238 -0.045 -7.024 1.00 0.00 C ATOM 0 H THR A 92 -3.186 -0.160 -9.363 1.00 0.00 H new ATOM 0 HA THR A 92 -2.673 2.284 -7.725 1.00 0.00 H new ATOM 0 HB THR A 92 -0.345 1.663 -7.985 1.00 0.00 H new ATOM 0 HG1 THR A 92 0.085 0.072 -9.549 1.00 0.00 H new ATOM 0 HG21 THR A 92 -0.274 -0.514 -6.826 1.00 0.00 H new ATOM 0 HG22 THR A 92 -1.560 0.508 -6.142 1.00 0.00 H new ATOM 0 HG23 THR A 92 -1.974 -0.814 -7.259 1.00 0.00 H new ATOM 1453 N ALA A 93 -1.446 3.476 -9.724 1.00 0.00 N ATOM 1454 CA ALA A 93 -1.257 4.395 -10.833 1.00 0.00 C ATOM 1455 C ALA A 93 -0.743 3.622 -12.049 1.00 0.00 C ATOM 1456 O ALA A 93 -0.791 4.121 -13.172 1.00 0.00 O ATOM 1457 CB ALA A 93 -0.307 5.517 -10.411 1.00 0.00 C ATOM 0 H ALA A 93 -0.846 3.652 -8.918 1.00 0.00 H new ATOM 0 HA ALA A 93 -2.203 4.858 -11.113 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -0.165 6.206 -11.243 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -0.732 6.054 -9.563 1.00 0.00 H new ATOM 0 HB3 ALA A 93 0.655 5.091 -10.125 1.00 0.00 H new ATOM 1463 N ASP A 94 -0.262 2.416 -11.783 1.00 0.00 N ATOM 1464 CA ASP A 94 0.261 1.569 -12.841 1.00 0.00 C ATOM 1465 C ASP A 94 -0.833 0.605 -13.305 1.00 0.00 C ATOM 1466 O ASP A 94 -0.616 -0.195 -14.214 1.00 0.00 O ATOM 1467 CB ASP A 94 1.445 0.736 -12.346 1.00 0.00 C ATOM 1468 CG ASP A 94 2.211 -0.014 -13.438 1.00 0.00 C ATOM 1469 OD1 ASP A 94 2.538 0.640 -14.452 1.00 0.00 O ATOM 1470 OD2 ASP A 94 2.451 -1.223 -13.234 1.00 0.00 O ATOM 0 H ASP A 94 -0.224 2.006 -10.850 1.00 0.00 H new ATOM 0 HA ASP A 94 0.589 2.213 -13.657 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.139 1.394 -11.823 1.00 0.00 H new ATOM 0 HB3 ASP A 94 1.081 0.012 -11.617 1.00 0.00 H new ATOM 1475 N GLU A 95 -1.985 0.714 -12.660 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.114 -0.138 -12.995 1.00 0.00 C ATOM 1477 C GLU A 95 -2.942 -1.520 -12.363 1.00 0.00 C ATOM 1478 O GLU A 95 -3.745 -2.420 -12.601 1.00 0.00 O ATOM 1479 CB GLU A 95 -3.287 -0.247 -14.512 1.00 0.00 C ATOM 1480 CG GLU A 95 -2.972 1.085 -15.197 1.00 0.00 C ATOM 1481 CD GLU A 95 -3.750 1.225 -16.507 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -3.875 0.196 -17.205 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -4.202 2.358 -16.780 1.00 0.00 O ATOM 0 H GLU A 95 -2.161 1.379 -11.907 1.00 0.00 H new ATOM 0 HA GLU A 95 -4.019 0.315 -12.590 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.630 -1.025 -14.902 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -4.309 -0.547 -14.744 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -3.224 1.910 -14.530 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.902 1.152 -15.396 1.00 0.00 H new ATOM 1490 N VAL A 96 -1.889 -1.645 -11.568 1.00 0.00 N ATOM 1491 CA VAL A 96 -1.602 -2.903 -10.899 1.00 0.00 C ATOM 1492 C VAL A 96 -2.718 -3.210 -9.898 1.00 0.00 C ATOM 1493 O VAL A 96 -3.082 -2.358 -9.089 1.00 0.00 O ATOM 1494 CB VAL A 96 -0.217 -2.846 -10.251 1.00 0.00 C ATOM 1495 CG1 VAL A 96 0.151 -4.193 -9.624 1.00 0.00 C ATOM 1496 CG2 VAL A 96 0.844 -2.404 -11.262 1.00 0.00 C ATOM 0 H VAL A 96 -1.225 -0.896 -11.372 1.00 0.00 H new ATOM 0 HA VAL A 96 -1.577 -3.721 -11.619 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.251 -2.103 -9.454 1.00 0.00 H new ATOM 0 HG11 VAL A 96 1.140 -4.125 -9.170 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.582 -4.451 -8.860 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.158 -4.964 -10.395 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.819 -2.372 -10.776 1.00 0.00 H new ATOM 0 HG22 VAL A 96 0.875 -3.112 -12.090 1.00 0.00 H new ATOM 0 HG23 VAL A 96 0.595 -1.413 -11.641 1.00 0.00 H new ATOM 1506 N HIS A 97 -3.229 -4.429 -9.987 1.00 0.00 N ATOM 1507 CA HIS A 97 -4.296 -4.859 -9.099 1.00 0.00 C ATOM 1508 C HIS A 97 -3.723 -5.766 -8.009 1.00 0.00 C ATOM 1509 O HIS A 97 -2.806 -6.545 -8.264 1.00 0.00 O ATOM 1510 CB HIS A 97 -5.426 -5.522 -9.889 1.00 0.00 C ATOM 1511 CG HIS A 97 -5.829 -4.770 -11.135 1.00 0.00 C ATOM 1512 ND1 HIS A 97 -7.054 -4.139 -11.266 1.00 0.00 N ATOM 1513 CD2 HIS A 97 -5.157 -4.553 -12.302 1.00 0.00 C ATOM 1514 CE1 HIS A 97 -7.106 -3.572 -12.462 1.00 0.00 C ATOM 1515 NE2 HIS A 97 -5.930 -3.830 -13.103 1.00 0.00 N ATOM 0 H HIS A 97 -2.924 -5.132 -10.660 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.736 -3.992 -8.607 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.117 -6.529 -10.169 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -6.297 -5.624 -9.241 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -4.164 -4.909 -12.535 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -7.934 -3.005 -12.860 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -5.685 -3.519 -14.043 1.00 0.00 H new ATOM 1523 N TYR A 98 -4.286 -5.633 -6.817 1.00 0.00 N ATOM 1524 CA TYR A 98 -3.842 -6.431 -5.687 1.00 0.00 C ATOM 1525 C TYR A 98 -5.034 -6.968 -4.892 1.00 0.00 C ATOM 1526 O TYR A 98 -5.984 -6.235 -4.621 1.00 0.00 O ATOM 1527 CB TYR A 98 -3.034 -5.487 -4.795 1.00 0.00 C ATOM 1528 CG TYR A 98 -1.651 -5.138 -5.350 1.00 0.00 C ATOM 1529 CD1 TYR A 98 -0.566 -5.936 -5.051 1.00 0.00 C ATOM 1530 CD2 TYR A 98 -1.490 -4.025 -6.150 1.00 0.00 C ATOM 1531 CE1 TYR A 98 0.735 -5.607 -5.573 1.00 0.00 C ATOM 1532 CE2 TYR A 98 -0.189 -3.697 -6.673 1.00 0.00 C ATOM 1533 CZ TYR A 98 0.860 -4.504 -6.359 1.00 0.00 C ATOM 1534 OH TYR A 98 2.088 -4.194 -6.852 1.00 0.00 O ATOM 0 H TYR A 98 -5.046 -4.985 -6.609 1.00 0.00 H new ATOM 0 HA TYR A 98 -3.258 -7.286 -6.028 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -3.600 -4.566 -4.652 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -2.915 -5.945 -3.813 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -0.692 -6.807 -4.426 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -2.339 -3.400 -6.384 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.593 -6.223 -5.345 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -0.049 -2.829 -7.301 1.00 0.00 H new ATOM 0 HH TYR A 98 2.608 -5.016 -6.975 1.00 0.00 H new ATOM 1544 N PHE A 99 -4.946 -8.242 -4.541 1.00 0.00 N ATOM 1545 CA PHE A 99 -6.005 -8.885 -3.783 1.00 0.00 C ATOM 1546 C PHE A 99 -5.538 -9.223 -2.366 1.00 0.00 C ATOM 1547 O PHE A 99 -4.743 -10.141 -2.173 1.00 0.00 O ATOM 1548 CB PHE A 99 -6.355 -10.183 -4.515 1.00 0.00 C ATOM 1549 CG PHE A 99 -7.047 -9.970 -5.863 1.00 0.00 C ATOM 1550 CD1 PHE A 99 -8.288 -9.416 -5.910 1.00 0.00 C ATOM 1551 CD2 PHE A 99 -6.420 -10.333 -7.013 1.00 0.00 C ATOM 1552 CE1 PHE A 99 -8.931 -9.219 -7.161 1.00 0.00 C ATOM 1553 CE2 PHE A 99 -7.063 -10.136 -8.264 1.00 0.00 C ATOM 1554 CZ PHE A 99 -8.304 -9.583 -8.312 1.00 0.00 C ATOM 0 H PHE A 99 -4.157 -8.847 -4.768 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.863 -8.218 -3.704 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -5.442 -10.756 -4.674 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -7.002 -10.785 -3.877 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -8.785 -9.126 -4.996 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -5.433 -10.771 -6.976 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -9.917 -8.780 -7.198 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -6.566 -10.426 -9.178 1.00 0.00 H new ATOM 0 HZ PHE A 99 -8.792 -9.433 -9.264 1.00 0.00 H new ATOM 1564 N LEU A 100 -6.053 -8.463 -1.410 1.00 0.00 N ATOM 1565 CA LEU A 100 -5.698 -8.670 -0.016 1.00 0.00 C ATOM 1566 C LEU A 100 -6.942 -9.105 0.762 1.00 0.00 C ATOM 1567 O LEU A 100 -8.004 -8.498 0.632 1.00 0.00 O ATOM 1568 CB LEU A 100 -5.019 -7.423 0.555 1.00 0.00 C ATOM 1569 CG LEU A 100 -3.919 -6.803 -0.309 1.00 0.00 C ATOM 1570 CD1 LEU A 100 -2.884 -7.854 -0.715 1.00 0.00 C ATOM 1571 CD2 LEU A 100 -4.514 -6.086 -1.522 1.00 0.00 C ATOM 0 H LEU A 100 -6.713 -7.703 -1.574 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.966 -9.473 0.077 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.783 -6.667 0.733 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.591 -7.678 1.525 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.399 -6.052 0.286 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.113 -7.388 -1.328 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.428 -8.280 0.179 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.372 -8.644 -1.285 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.711 -5.654 -2.119 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.074 -6.799 -2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.182 -5.293 -1.185 1.00 0.00 H new ATOM 1583 N GLN A 101 -6.768 -10.152 1.555 1.00 0.00 N ATOM 1584 CA GLN A 101 -7.863 -10.675 2.354 1.00 0.00 C ATOM 1585 C GLN A 101 -7.794 -10.117 3.778 1.00 0.00 C ATOM 1586 O GLN A 101 -6.780 -10.267 4.458 1.00 0.00 O ATOM 1587 CB GLN A 101 -7.853 -12.205 2.364 1.00 0.00 C ATOM 1588 CG GLN A 101 -9.008 -12.755 3.203 1.00 0.00 C ATOM 1589 CD GLN A 101 -8.572 -13.994 3.989 1.00 0.00 C ATOM 1590 OE1 GLN A 101 -8.198 -13.925 5.148 1.00 0.00 O ATOM 1591 NE2 GLN A 101 -8.642 -15.127 3.296 1.00 0.00 N ATOM 0 H GLN A 101 -5.885 -10.652 1.661 1.00 0.00 H new ATOM 0 HA GLN A 101 -8.802 -10.354 1.903 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -7.930 -12.579 1.343 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -6.905 -12.563 2.765 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -9.359 -11.987 3.892 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -9.846 -13.008 2.554 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -8.964 -15.114 2.328 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -8.373 -16.009 3.732 1.00 0.00 H new ATOM 1600 N ALA A 102 -8.885 -9.487 4.185 1.00 0.00 N ATOM 1601 CA ALA A 102 -8.962 -8.906 5.515 1.00 0.00 C ATOM 1602 C ALA A 102 -9.566 -9.929 6.479 1.00 0.00 C ATOM 1603 O ALA A 102 -10.571 -10.565 6.165 1.00 0.00 O ATOM 1604 CB ALA A 102 -9.769 -7.608 5.460 1.00 0.00 C ATOM 0 H ALA A 102 -9.724 -9.366 3.617 1.00 0.00 H new ATOM 0 HA ALA A 102 -7.967 -8.655 5.882 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.826 -7.173 6.458 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -9.281 -6.905 4.785 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -10.775 -7.820 5.098 1.00 0.00 H new ATOM 1610 N ALA A 103 -8.929 -10.055 7.634 1.00 0.00 N ATOM 1611 CA ALA A 103 -9.392 -10.989 8.646 1.00 0.00 C ATOM 1612 C ALA A 103 -10.885 -10.767 8.895 1.00 0.00 C ATOM 1613 O ALA A 103 -11.703 -11.637 8.601 1.00 0.00 O ATOM 1614 CB ALA A 103 -8.558 -10.819 9.917 1.00 0.00 C ATOM 0 H ALA A 103 -8.096 -9.526 7.891 1.00 0.00 H new ATOM 0 HA ALA A 103 -9.264 -12.017 8.306 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -8.905 -11.520 10.676 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -7.510 -11.016 9.693 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -8.664 -9.800 10.288 1.00 0.00 H new ATOM 1620 N THR A 104 -11.195 -9.597 9.434 1.00 0.00 N ATOM 1621 CA THR A 104 -12.575 -9.249 9.725 1.00 0.00 C ATOM 1622 C THR A 104 -13.170 -8.423 8.583 1.00 0.00 C ATOM 1623 O THR A 104 -12.436 -7.872 7.763 1.00 0.00 O ATOM 1624 CB THR A 104 -12.607 -8.530 11.075 1.00 0.00 C ATOM 1625 OG1 THR A 104 -11.838 -7.350 10.859 1.00 0.00 O ATOM 1626 CG2 THR A 104 -11.834 -9.285 12.159 1.00 0.00 C ATOM 0 H THR A 104 -10.514 -8.878 9.677 1.00 0.00 H new ATOM 0 HA THR A 104 -13.199 -10.139 9.799 1.00 0.00 H new ATOM 0 HB THR A 104 -13.642 -8.399 11.391 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.808 -6.823 11.685 1.00 0.00 H new ATOM 0 HG21 THR A 104 -11.888 -8.732 13.097 1.00 0.00 H new ATOM 0 HG22 THR A 104 -12.271 -10.274 12.295 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.791 -9.387 11.858 1.00 0.00 H new ATOM 1634 N PRO A 105 -14.528 -8.361 8.565 1.00 0.00 N ATOM 1635 CA PRO A 105 -15.230 -7.611 7.537 1.00 0.00 C ATOM 1636 C PRO A 105 -15.130 -6.105 7.792 1.00 0.00 C ATOM 1637 O PRO A 105 -15.488 -5.302 6.932 1.00 0.00 O ATOM 1638 CB PRO A 105 -16.659 -8.127 7.579 1.00 0.00 C ATOM 1639 CG PRO A 105 -16.817 -8.805 8.930 1.00 0.00 C ATOM 1640 CD PRO A 105 -15.429 -9.000 9.519 1.00 0.00 C ATOM 0 HA PRO A 105 -14.799 -7.752 6.546 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -17.373 -7.311 7.466 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -16.845 -8.828 6.766 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -17.431 -8.196 9.593 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.323 -9.764 8.819 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -15.350 -8.543 10.505 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -15.194 -10.058 9.638 1.00 0.00 H new ATOM 1648 N LYS A 106 -14.641 -5.769 8.976 1.00 0.00 N ATOM 1649 CA LYS A 106 -14.489 -4.375 9.355 1.00 0.00 C ATOM 1650 C LYS A 106 -13.093 -3.892 8.958 1.00 0.00 C ATOM 1651 O LYS A 106 -12.894 -2.708 8.691 1.00 0.00 O ATOM 1652 CB LYS A 106 -14.806 -4.185 10.840 1.00 0.00 C ATOM 1653 CG LYS A 106 -14.813 -2.702 11.214 1.00 0.00 C ATOM 1654 CD LYS A 106 -14.460 -2.507 12.690 1.00 0.00 C ATOM 1655 CE LYS A 106 -14.828 -1.099 13.161 1.00 0.00 C ATOM 1656 NZ LYS A 106 -16.104 -1.120 13.911 1.00 0.00 N ATOM 0 H LYS A 106 -14.345 -6.439 9.686 1.00 0.00 H new ATOM 0 HA LYS A 106 -15.206 -3.755 8.818 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -15.777 -4.626 11.067 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -14.067 -4.712 11.444 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -14.099 -2.163 10.591 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -15.796 -2.277 11.012 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -14.987 -3.246 13.294 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -13.393 -2.677 12.838 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -14.034 -0.702 13.793 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -14.915 -0.433 12.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -16.339 -0.156 14.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -16.862 -1.479 13.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -16.009 -1.739 14.741 1.00 0.00 H new ATOM 1670 N GLU A 107 -12.161 -4.833 8.931 1.00 0.00 N ATOM 1671 CA GLU A 107 -10.789 -4.519 8.570 1.00 0.00 C ATOM 1672 C GLU A 107 -10.692 -4.204 7.076 1.00 0.00 C ATOM 1673 O GLU A 107 -9.912 -3.345 6.669 1.00 0.00 O ATOM 1674 CB GLU A 107 -9.846 -5.661 8.953 1.00 0.00 C ATOM 1675 CG GLU A 107 -8.447 -5.434 8.376 1.00 0.00 C ATOM 1676 CD GLU A 107 -7.387 -6.159 9.207 1.00 0.00 C ATOM 1677 OE1 GLU A 107 -7.440 -6.013 10.447 1.00 0.00 O ATOM 1678 OE2 GLU A 107 -6.547 -6.843 8.583 1.00 0.00 O ATOM 0 H GLU A 107 -12.329 -5.814 9.153 1.00 0.00 H new ATOM 0 HA GLU A 107 -10.480 -3.635 9.128 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -9.787 -5.740 10.039 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -10.246 -6.606 8.586 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -8.412 -5.789 7.346 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -8.228 -4.366 8.352 1.00 0.00 H new ATOM 1685 N ARG A 108 -11.495 -4.918 6.300 1.00 0.00 N ATOM 1686 CA ARG A 108 -11.509 -4.726 4.860 1.00 0.00 C ATOM 1687 C ARG A 108 -11.871 -3.278 4.521 1.00 0.00 C ATOM 1688 O ARG A 108 -11.237 -2.659 3.668 1.00 0.00 O ATOM 1689 CB ARG A 108 -12.511 -5.666 4.189 1.00 0.00 C ATOM 1690 CG ARG A 108 -12.651 -5.346 2.699 1.00 0.00 C ATOM 1691 CD ARG A 108 -14.100 -5.005 2.346 1.00 0.00 C ATOM 1692 NE ARG A 108 -14.873 -6.247 2.123 1.00 0.00 N ATOM 1693 CZ ARG A 108 -16.143 -6.276 1.697 1.00 0.00 C ATOM 1694 NH1 ARG A 108 -16.791 -5.131 1.444 1.00 0.00 N ATOM 1695 NH2 ARG A 108 -16.764 -7.450 1.522 1.00 0.00 N ATOM 0 H ARG A 108 -12.140 -5.630 6.642 1.00 0.00 H new ATOM 0 HA ARG A 108 -10.510 -4.951 4.486 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -12.186 -6.699 4.314 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -13.482 -5.576 4.677 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -12.003 -4.508 2.441 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -12.320 -6.199 2.107 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -14.552 -4.425 3.151 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -14.128 -4.384 1.451 1.00 0.00 H new ATOM 0 HE ARG A 108 -14.410 -7.137 2.305 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -16.318 -4.237 1.576 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -17.758 -5.153 1.120 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -16.270 -8.322 1.713 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -17.731 -7.472 1.198 1.00 0.00 H new ATOM 1709 N THR A 109 -12.890 -2.781 5.207 1.00 0.00 N ATOM 1710 CA THR A 109 -13.345 -1.419 4.989 1.00 0.00 C ATOM 1711 C THR A 109 -12.304 -0.421 5.501 1.00 0.00 C ATOM 1712 O THR A 109 -12.033 0.587 4.850 1.00 0.00 O ATOM 1713 CB THR A 109 -14.713 -1.265 5.656 1.00 0.00 C ATOM 1714 OG1 THR A 109 -15.638 -1.653 4.644 1.00 0.00 O ATOM 1715 CG2 THR A 109 -15.065 0.197 5.941 1.00 0.00 C ATOM 0 H THR A 109 -13.413 -3.298 5.914 1.00 0.00 H new ATOM 0 HA THR A 109 -13.460 -1.206 3.926 1.00 0.00 H new ATOM 0 HB THR A 109 -14.728 -1.830 6.588 1.00 0.00 H new ATOM 0 HG1 THR A 109 -16.552 -1.585 4.992 1.00 0.00 H new ATOM 0 HG21 THR A 109 -16.045 0.250 6.414 1.00 0.00 H new ATOM 0 HG22 THR A 109 -14.317 0.628 6.606 1.00 0.00 H new ATOM 0 HG23 THR A 109 -15.083 0.756 5.005 1.00 0.00 H new ATOM 1723 N GLU A 110 -11.749 -0.737 6.661 1.00 0.00 N ATOM 1724 CA GLU A 110 -10.744 0.119 7.268 1.00 0.00 C ATOM 1725 C GLU A 110 -9.549 0.285 6.326 1.00 0.00 C ATOM 1726 O GLU A 110 -9.221 1.400 5.924 1.00 0.00 O ATOM 1727 CB GLU A 110 -10.300 -0.432 8.624 1.00 0.00 C ATOM 1728 CG GLU A 110 -11.366 -0.183 9.693 1.00 0.00 C ATOM 1729 CD GLU A 110 -10.729 0.273 11.007 1.00 0.00 C ATOM 1730 OE1 GLU A 110 -9.671 -0.297 11.353 1.00 0.00 O ATOM 1731 OE2 GLU A 110 -11.314 1.180 11.637 1.00 0.00 O ATOM 0 H GLU A 110 -11.976 -1.574 7.197 1.00 0.00 H new ATOM 0 HA GLU A 110 -11.187 1.100 7.439 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -10.107 -1.501 8.540 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -9.363 0.039 8.923 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -12.067 0.574 9.343 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -11.939 -1.095 9.860 1.00 0.00 H new ATOM 1738 N TRP A 111 -8.932 -0.841 6.001 1.00 0.00 N ATOM 1739 CA TRP A 111 -7.781 -0.835 5.114 1.00 0.00 C ATOM 1740 C TRP A 111 -8.089 0.105 3.947 1.00 0.00 C ATOM 1741 O TRP A 111 -7.386 1.093 3.738 1.00 0.00 O ATOM 1742 CB TRP A 111 -7.429 -2.254 4.663 1.00 0.00 C ATOM 1743 CG TRP A 111 -6.244 -2.869 5.410 1.00 0.00 C ATOM 1744 CD1 TRP A 111 -6.264 -3.852 6.321 1.00 0.00 C ATOM 1745 CD2 TRP A 111 -4.856 -2.500 5.273 1.00 0.00 C ATOM 1746 NE1 TRP A 111 -4.995 -4.142 6.779 1.00 0.00 N ATOM 1747 CE2 TRP A 111 -4.111 -3.294 6.122 1.00 0.00 C ATOM 1748 CE3 TRP A 111 -4.249 -1.527 4.460 1.00 0.00 C ATOM 1749 CZ2 TRP A 111 -2.720 -3.197 6.238 1.00 0.00 C ATOM 1750 CZ3 TRP A 111 -2.857 -1.443 4.588 1.00 0.00 C ATOM 1751 CH2 TRP A 111 -2.093 -2.235 5.437 1.00 0.00 C ATOM 0 H TRP A 111 -9.207 -1.764 6.336 1.00 0.00 H new ATOM 0 HA TRP A 111 -6.896 -0.467 5.633 1.00 0.00 H new ATOM 0 HB2 TRP A 111 -8.301 -2.894 4.797 1.00 0.00 H new ATOM 0 HB3 TRP A 111 -7.205 -2.240 3.596 1.00 0.00 H new ATOM 0 HD1 TRP A 111 -7.160 -4.354 6.655 1.00 0.00 H new ATOM 0 HE1 TRP A 111 -4.751 -4.849 7.472 1.00 0.00 H new ATOM 0 HE3 TRP A 111 -4.812 -0.894 3.790 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -2.160 -3.831 6.910 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -2.341 -0.711 3.984 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -1.021 -2.109 5.479 1.00 0.00 H new ATOM 1762 N ILE A 112 -9.140 -0.236 3.216 1.00 0.00 N ATOM 1763 CA ILE A 112 -9.550 0.565 2.075 1.00 0.00 C ATOM 1764 C ILE A 112 -9.430 2.049 2.430 1.00 0.00 C ATOM 1765 O ILE A 112 -8.600 2.760 1.867 1.00 0.00 O ATOM 1766 CB ILE A 112 -10.948 0.156 1.607 1.00 0.00 C ATOM 1767 CG1 ILE A 112 -10.876 -1.013 0.623 1.00 0.00 C ATOM 1768 CG2 ILE A 112 -11.703 1.352 1.023 1.00 0.00 C ATOM 1769 CD1 ILE A 112 -12.077 -1.946 0.792 1.00 0.00 C ATOM 0 H ILE A 112 -9.720 -1.056 3.392 1.00 0.00 H new ATOM 0 HA ILE A 112 -8.890 0.385 1.226 1.00 0.00 H new ATOM 0 HB ILE A 112 -11.512 -0.187 2.474 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -10.847 -0.632 -0.398 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -9.953 -1.570 0.782 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -12.694 1.034 0.698 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -11.802 2.126 1.784 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -11.152 1.749 0.171 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -12.002 -2.769 0.081 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -12.089 -2.344 1.807 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -12.997 -1.391 0.609 1.00 0.00 H new ATOM 1781 N LYS A 113 -10.272 2.472 3.362 1.00 0.00 N ATOM 1782 CA LYS A 113 -10.271 3.858 3.798 1.00 0.00 C ATOM 1783 C LYS A 113 -8.854 4.254 4.218 1.00 0.00 C ATOM 1784 O LYS A 113 -8.464 5.413 4.084 1.00 0.00 O ATOM 1785 CB LYS A 113 -11.320 4.077 4.890 1.00 0.00 C ATOM 1786 CG LYS A 113 -12.665 3.469 4.487 1.00 0.00 C ATOM 1787 CD LYS A 113 -13.775 4.522 4.525 1.00 0.00 C ATOM 1788 CE LYS A 113 -14.626 4.376 5.788 1.00 0.00 C ATOM 1789 NZ LYS A 113 -14.910 5.704 6.377 1.00 0.00 N ATOM 0 H LYS A 113 -10.959 1.879 3.827 1.00 0.00 H new ATOM 0 HA LYS A 113 -10.557 4.516 2.977 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -10.979 3.628 5.823 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -11.440 5.144 5.075 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -12.592 3.048 3.484 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -12.914 2.648 5.160 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -13.336 5.519 4.491 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -14.407 4.421 3.643 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -15.561 3.871 5.547 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -14.105 3.753 6.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -15.488 5.587 7.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -14.015 6.172 6.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -15.426 6.286 5.687 1.00 0.00 H new ATOM 1803 N ALA A 114 -8.122 3.270 4.719 1.00 0.00 N ATOM 1804 CA ALA A 114 -6.757 3.502 5.159 1.00 0.00 C ATOM 1805 C ALA A 114 -5.889 3.857 3.951 1.00 0.00 C ATOM 1806 O ALA A 114 -5.247 4.906 3.929 1.00 0.00 O ATOM 1807 CB ALA A 114 -6.244 2.267 5.903 1.00 0.00 C ATOM 0 H ALA A 114 -8.449 2.310 4.830 1.00 0.00 H new ATOM 0 HA ALA A 114 -6.715 4.342 5.853 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.220 2.441 6.233 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.877 2.075 6.769 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -6.269 1.404 5.237 1.00 0.00 H new ATOM 1813 N ILE A 115 -5.897 2.962 2.973 1.00 0.00 N ATOM 1814 CA ILE A 115 -5.118 3.168 1.764 1.00 0.00 C ATOM 1815 C ILE A 115 -5.542 4.483 1.107 1.00 0.00 C ATOM 1816 O ILE A 115 -4.711 5.198 0.550 1.00 0.00 O ATOM 1817 CB ILE A 115 -5.233 1.954 0.840 1.00 0.00 C ATOM 1818 CG1 ILE A 115 -4.647 0.704 1.500 1.00 0.00 C ATOM 1819 CG2 ILE A 115 -4.593 2.238 -0.520 1.00 0.00 C ATOM 1820 CD1 ILE A 115 -5.663 -0.440 1.505 1.00 0.00 C ATOM 0 H ILE A 115 -6.431 2.093 2.994 1.00 0.00 H new ATOM 0 HA ILE A 115 -4.059 3.258 2.004 1.00 0.00 H new ATOM 0 HB ILE A 115 -6.291 1.758 0.664 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -3.748 0.394 0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -4.348 0.934 2.523 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -4.688 1.359 -1.158 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -5.096 3.083 -0.989 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -3.538 2.474 -0.383 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -5.222 -1.316 1.979 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -6.551 -0.136 2.059 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -5.941 -0.684 0.480 1.00 0.00 H new ATOM 1832 N GLN A 116 -6.834 4.762 1.195 1.00 0.00 N ATOM 1833 CA GLN A 116 -7.378 5.979 0.616 1.00 0.00 C ATOM 1834 C GLN A 116 -6.794 7.207 1.317 1.00 0.00 C ATOM 1835 O GLN A 116 -6.291 8.119 0.663 1.00 0.00 O ATOM 1836 CB GLN A 116 -8.906 5.983 0.685 1.00 0.00 C ATOM 1837 CG GLN A 116 -9.489 4.744 0.002 1.00 0.00 C ATOM 1838 CD GLN A 116 -10.449 5.139 -1.123 1.00 0.00 C ATOM 1839 OE1 GLN A 116 -10.241 6.101 -1.843 1.00 0.00 O ATOM 1840 NE2 GLN A 116 -11.509 4.344 -1.232 1.00 0.00 N ATOM 0 H GLN A 116 -7.520 4.166 1.658 1.00 0.00 H new ATOM 0 HA GLN A 116 -7.095 6.016 -0.436 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -9.226 6.013 1.726 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -9.293 6.883 0.206 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -8.682 4.133 -0.402 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -10.015 4.133 0.736 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -11.622 3.555 -0.596 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -12.209 4.523 -1.952 1.00 0.00 H new ATOM 1849 N MET A 117 -6.880 7.191 2.639 1.00 0.00 N ATOM 1850 CA MET A 117 -6.366 8.292 3.436 1.00 0.00 C ATOM 1851 C MET A 117 -4.949 8.669 3.001 1.00 0.00 C ATOM 1852 O MET A 117 -4.620 9.850 2.903 1.00 0.00 O ATOM 1853 CB MET A 117 -6.358 7.893 4.913 1.00 0.00 C ATOM 1854 CG MET A 117 -4.934 7.883 5.471 1.00 0.00 C ATOM 1855 SD MET A 117 -4.968 7.583 7.230 1.00 0.00 S ATOM 1856 CE MET A 117 -5.700 5.955 7.252 1.00 0.00 C ATOM 0 H MET A 117 -7.298 6.433 3.178 1.00 0.00 H new ATOM 0 HA MET A 117 -7.013 9.156 3.288 1.00 0.00 H new ATOM 0 HB2 MET A 117 -6.971 8.589 5.485 1.00 0.00 H new ATOM 0 HB3 MET A 117 -6.805 6.906 5.029 1.00 0.00 H new ATOM 0 HG2 MET A 117 -4.345 7.112 4.974 1.00 0.00 H new ATOM 0 HG3 MET A 117 -4.448 8.837 5.266 1.00 0.00 H new ATOM 0 HE1 MET A 117 -5.681 5.561 8.268 1.00 0.00 H new ATOM 0 HE2 MET A 117 -6.732 6.015 6.905 1.00 0.00 H new ATOM 0 HE3 MET A 117 -5.135 5.293 6.596 1.00 0.00 H new ATOM 1866 N ALA A 118 -4.148 7.643 2.753 1.00 0.00 N ATOM 1867 CA ALA A 118 -2.773 7.853 2.331 1.00 0.00 C ATOM 1868 C ALA A 118 -2.761 8.427 0.913 1.00 0.00 C ATOM 1869 O ALA A 118 -2.353 9.568 0.705 1.00 0.00 O ATOM 1870 CB ALA A 118 -2.001 6.535 2.434 1.00 0.00 C ATOM 0 H ALA A 118 -4.424 6.665 2.836 1.00 0.00 H new ATOM 0 HA ALA A 118 -2.277 8.573 2.982 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -0.970 6.692 2.118 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -2.015 6.185 3.466 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -2.468 5.789 1.792 1.00 0.00 H new ATOM 1876 N SER A 119 -3.215 7.609 -0.026 1.00 0.00 N ATOM 1877 CA SER A 119 -3.261 8.022 -1.418 1.00 0.00 C ATOM 1878 C SER A 119 -3.918 9.399 -1.534 1.00 0.00 C ATOM 1879 O SER A 119 -3.612 10.161 -2.450 1.00 0.00 O ATOM 1880 CB SER A 119 -4.017 7.000 -2.270 1.00 0.00 C ATOM 1881 OG SER A 119 -4.178 7.441 -3.615 1.00 0.00 O ATOM 0 H SER A 119 -3.554 6.663 0.150 1.00 0.00 H new ATOM 0 HA SER A 119 -2.239 8.082 -1.791 1.00 0.00 H new ATOM 0 HB2 SER A 119 -3.479 6.052 -2.261 1.00 0.00 H new ATOM 0 HB3 SER A 119 -4.997 6.815 -1.830 1.00 0.00 H new ATOM 0 HG SER A 119 -4.124 6.672 -4.220 1.00 0.00 H new ATOM 1887 N ARG A 120 -4.808 9.676 -0.593 1.00 0.00 N ATOM 1888 CA ARG A 120 -5.511 10.948 -0.579 1.00 0.00 C ATOM 1889 C ARG A 120 -4.516 12.102 -0.441 1.00 0.00 C ATOM 1890 O ARG A 120 -4.604 13.092 -1.165 1.00 0.00 O ATOM 1891 CB ARG A 120 -6.515 11.009 0.574 1.00 0.00 C ATOM 1892 CG ARG A 120 -7.870 10.438 0.151 1.00 0.00 C ATOM 1893 CD ARG A 120 -8.580 11.377 -0.826 1.00 0.00 C ATOM 1894 NE ARG A 120 -9.731 10.685 -1.448 1.00 0.00 N ATOM 1895 CZ ARG A 120 -9.618 9.670 -2.316 1.00 0.00 C ATOM 1896 NH1 ARG A 120 -8.405 9.224 -2.671 1.00 0.00 N ATOM 1897 NH2 ARG A 120 -10.718 9.102 -2.830 1.00 0.00 N ATOM 0 H ARG A 120 -5.059 9.042 0.165 1.00 0.00 H new ATOM 0 HA ARG A 120 -6.051 11.040 -1.521 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -6.130 10.449 1.426 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -6.637 12.042 0.900 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -7.728 9.463 -0.315 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -8.494 10.283 1.031 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -8.922 12.270 -0.302 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -7.884 11.707 -1.597 1.00 0.00 H new ATOM 0 HE ARG A 120 -10.669 11.000 -1.201 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -7.568 9.657 -2.281 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -8.319 8.452 -3.332 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -11.641 9.442 -2.561 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -10.632 8.330 -3.491 1.00 0.00 H new ATOM 1911 N THR A 121 -3.591 11.936 0.494 1.00 0.00 N ATOM 1912 CA THR A 121 -2.581 12.951 0.736 1.00 0.00 C ATOM 1913 C THR A 121 -2.120 13.571 -0.585 1.00 0.00 C ATOM 1914 O THR A 121 -1.989 12.873 -1.589 1.00 0.00 O ATOM 1915 CB THR A 121 -1.445 12.308 1.534 1.00 0.00 C ATOM 1916 OG1 THR A 121 -0.821 13.404 2.196 1.00 0.00 O ATOM 1917 CG2 THR A 121 -0.346 11.740 0.635 1.00 0.00 C ATOM 0 H THR A 121 -3.521 11.113 1.093 1.00 0.00 H new ATOM 0 HA THR A 121 -2.983 13.776 1.323 1.00 0.00 H new ATOM 0 HB THR A 121 -1.848 11.512 2.161 1.00 0.00 H new ATOM 0 HG1 THR A 121 -0.726 13.199 3.150 1.00 0.00 H new ATOM 0 HG21 THR A 121 0.435 11.296 1.252 1.00 0.00 H new ATOM 0 HG22 THR A 121 -0.769 10.978 -0.020 1.00 0.00 H new ATOM 0 HG23 THR A 121 0.080 12.541 0.031 1.00 0.00 H new ATOM 1925 N GLY A 122 -1.886 14.874 -0.540 1.00 0.00 N ATOM 1926 CA GLY A 122 -1.443 15.595 -1.721 1.00 0.00 C ATOM 1927 C GLY A 122 0.016 16.035 -1.579 1.00 0.00 C ATOM 1928 O GLY A 122 0.344 16.837 -0.706 1.00 0.00 O ATOM 0 H GLY A 122 -1.995 15.449 0.295 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -1.551 14.961 -2.601 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -2.076 16.468 -1.877 1.00 0.00 H new ATOM 1932 N LYS A 123 0.852 15.492 -2.451 1.00 0.00 N ATOM 1933 CA LYS A 123 2.268 15.818 -2.434 1.00 0.00 C ATOM 1934 C LYS A 123 2.437 17.323 -2.216 1.00 0.00 C ATOM 1935 O LYS A 123 2.100 18.122 -3.089 1.00 0.00 O ATOM 1936 CB LYS A 123 2.953 15.299 -3.700 1.00 0.00 C ATOM 1937 CG LYS A 123 4.427 15.709 -3.733 1.00 0.00 C ATOM 1938 CD LYS A 123 5.247 14.886 -2.738 1.00 0.00 C ATOM 1939 CE LYS A 123 6.641 14.586 -3.293 1.00 0.00 C ATOM 1940 NZ LYS A 123 7.339 13.601 -2.436 1.00 0.00 N ATOM 0 H LYS A 123 0.576 14.828 -3.174 1.00 0.00 H new ATOM 0 HA LYS A 123 2.765 15.317 -1.603 1.00 0.00 H new ATOM 0 HB2 LYS A 123 2.873 14.213 -3.742 1.00 0.00 H new ATOM 0 HB3 LYS A 123 2.443 15.690 -4.580 1.00 0.00 H new ATOM 0 HG2 LYS A 123 4.824 15.571 -4.739 1.00 0.00 H new ATOM 0 HG3 LYS A 123 4.519 16.769 -3.496 1.00 0.00 H new ATOM 0 HD2 LYS A 123 5.335 15.429 -1.797 1.00 0.00 H new ATOM 0 HD3 LYS A 123 4.730 13.952 -2.520 1.00 0.00 H new ATOM 0 HE2 LYS A 123 6.559 14.200 -4.309 1.00 0.00 H new ATOM 0 HE3 LYS A 123 7.223 15.506 -3.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 8.283 13.409 -2.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 7.434 13.984 -1.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 6.791 12.718 -2.405 1.00 0.00 H new ATOM 1954 N SER A 124 2.960 17.665 -1.048 1.00 0.00 N ATOM 1955 CA SER A 124 3.178 19.060 -0.704 1.00 0.00 C ATOM 1956 C SER A 124 4.666 19.398 -0.811 1.00 0.00 C ATOM 1957 O SER A 124 5.446 19.074 0.084 1.00 0.00 O ATOM 1958 CB SER A 124 2.663 19.367 0.704 1.00 0.00 C ATOM 1959 OG SER A 124 1.314 18.945 0.883 1.00 0.00 O ATOM 0 H SER A 124 3.239 17.000 -0.327 1.00 0.00 H new ATOM 0 HA SER A 124 2.620 19.678 -1.408 1.00 0.00 H new ATOM 0 HB2 SER A 124 3.298 18.872 1.438 1.00 0.00 H new ATOM 0 HB3 SER A 124 2.735 20.438 0.891 1.00 0.00 H new ATOM 0 HG SER A 124 1.112 18.221 0.255 1.00 0.00 H new ATOM 1965 N GLY A 125 5.015 20.046 -1.913 1.00 0.00 N ATOM 1966 CA GLY A 125 6.396 20.432 -2.148 1.00 0.00 C ATOM 1967 C GLY A 125 6.728 21.744 -1.433 1.00 0.00 C ATOM 1968 O GLY A 125 6.015 22.154 -0.519 1.00 0.00 O ATOM 0 H GLY A 125 4.365 20.313 -2.653 1.00 0.00 H new ATOM 0 HA2 GLY A 125 7.062 19.644 -1.797 1.00 0.00 H new ATOM 0 HA3 GLY A 125 6.569 20.543 -3.218 1.00 0.00 H new ATOM 1972 N PRO A 126 7.840 22.381 -1.888 1.00 0.00 N ATOM 1973 CA PRO A 126 8.275 23.637 -1.302 1.00 0.00 C ATOM 1974 C PRO A 126 7.383 24.793 -1.759 1.00 0.00 C ATOM 1975 O PRO A 126 7.017 25.653 -0.958 1.00 0.00 O ATOM 1976 CB PRO A 126 9.722 23.795 -1.739 1.00 0.00 C ATOM 1977 CG PRO A 126 9.902 22.865 -2.928 1.00 0.00 C ATOM 1978 CD PRO A 126 8.709 21.924 -2.969 1.00 0.00 C ATOM 0 HA PRO A 126 8.198 23.643 -0.215 1.00 0.00 H new ATOM 0 HB2 PRO A 126 9.936 24.828 -2.015 1.00 0.00 H new ATOM 0 HB3 PRO A 126 10.405 23.533 -0.931 1.00 0.00 H new ATOM 0 HG2 PRO A 126 9.969 23.437 -3.853 1.00 0.00 H new ATOM 0 HG3 PRO A 126 10.830 22.301 -2.834 1.00 0.00 H new ATOM 0 HD2 PRO A 126 8.201 21.970 -3.932 1.00 0.00 H new ATOM 0 HD3 PRO A 126 9.016 20.889 -2.820 1.00 0.00 H new ATOM 1986 N SER A 127 7.060 24.778 -3.043 1.00 0.00 N ATOM 1987 CA SER A 127 6.218 25.814 -3.616 1.00 0.00 C ATOM 1988 C SER A 127 6.903 27.176 -3.486 1.00 0.00 C ATOM 1989 O SER A 127 7.474 27.490 -2.443 1.00 0.00 O ATOM 1990 CB SER A 127 4.845 25.844 -2.941 1.00 0.00 C ATOM 1991 OG SER A 127 4.044 24.724 -3.311 1.00 0.00 O ATOM 0 H SER A 127 7.366 24.064 -3.704 1.00 0.00 H new ATOM 0 HA SER A 127 6.069 25.588 -4.672 1.00 0.00 H new ATOM 0 HB2 SER A 127 4.973 25.856 -1.859 1.00 0.00 H new ATOM 0 HB3 SER A 127 4.328 26.765 -3.211 1.00 0.00 H new ATOM 0 HG SER A 127 3.176 24.778 -2.858 1.00 0.00 H new ATOM 1997 N SER A 128 6.822 27.948 -4.559 1.00 0.00 N ATOM 1998 CA SER A 128 7.427 29.269 -4.578 1.00 0.00 C ATOM 1999 C SER A 128 6.486 30.266 -5.258 1.00 0.00 C ATOM 2000 O SER A 128 6.475 30.378 -6.483 1.00 0.00 O ATOM 2001 CB SER A 128 8.780 29.245 -5.291 1.00 0.00 C ATOM 2002 OG SER A 128 9.783 28.598 -4.512 1.00 0.00 O ATOM 0 H SER A 128 6.346 27.684 -5.422 1.00 0.00 H new ATOM 0 HA SER A 128 7.595 29.583 -3.548 1.00 0.00 H new ATOM 0 HB2 SER A 128 8.677 28.732 -6.247 1.00 0.00 H new ATOM 0 HB3 SER A 128 9.093 30.266 -5.509 1.00 0.00 H new ATOM 0 HG SER A 128 10.631 28.602 -5.003 1.00 0.00 H new ATOM 2008 N GLY A 129 5.720 30.965 -4.433 1.00 0.00 N ATOM 2009 CA GLY A 129 4.778 31.949 -4.940 1.00 0.00 C ATOM 2010 C GLY A 129 3.350 31.618 -4.500 1.00 0.00 C ATOM 2011 O GLY A 129 2.418 31.691 -5.299 1.00 0.00 O ATOM 0 H GLY A 129 5.732 30.870 -3.418 1.00 0.00 H new ATOM 0 HA2 GLY A 129 5.053 32.940 -4.580 1.00 0.00 H new ATOM 0 HA3 GLY A 129 4.829 31.980 -6.028 1.00 0.00 H new TER 2015 GLY A 129