USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 933 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: C 13 ASN : amide:sc= 0 X(o=0,f=0.3) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: C 11 SER OG : rot 180:sc= 0.43 USER MOD Set 2.2: C 21 THR OG1 : rot -68:sc= 0.472 USER MOD Set 3.1: A 35 ASN : amide:sc= 0 K(o=-0.077,f=-1.9) USER MOD Set 3.2: C 1 MET CE :methyl -166:sc= -0.0767 (180deg=-0.465) USER MOD Set 4.1: A 13 ASN : amide:sc= 0.789 K(o=0.79,f=-1.2) USER MOD Set 4.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 11 SER OG : rot 180:sc= 0.508 USER MOD Set 5.2: A 21 THR OG1 : rot -71:sc= 0.562 USER MOD Single : A 1 MET CE :methyl -179:sc= -0.859 (180deg=-0.902) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc=-0.00132 K(o=-0.0013,f=-1) USER MOD Single : A 29 GLN : amide:sc= -0.689 K(o=-0.69,f=-5.4!) USER MOD Single : A 38 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0688) USER MOD Single : A 43 HIS : no HD1:sc= -0.887 X(o=-0.89,f=-0.86) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 52 GLN : amide:sc= -2.92! K(o=-2.9!,f=-1.6) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET N :NH3+ -108:sc= 0.0282 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : C 29 GLN : amide:sc= -0.663 K(o=-0.66,f=-5!) USER MOD Single : C 35 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HE2:sc= -1.08 X(o=-1.1,f=-1.2) USER MOD Single : C 48 TYR OH : rot -151:sc= 0.771 USER MOD Single : C 49 GLN : amide:sc= 0.82 K(o=0.82,f=0) USER MOD Single : C 52 GLN : amide:sc= -3.22! K(o=-3.2!,f=-1.3) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.919 -8.077 -9.932 1.00 0.00 N ATOM 2 CA MET A 1 4.234 -7.123 -9.041 1.00 0.00 C ATOM 3 C MET A 1 2.889 -7.691 -8.610 1.00 0.00 C ATOM 4 O MET A 1 2.113 -8.112 -9.463 1.00 0.00 O ATOM 5 CB MET A 1 4.030 -5.779 -9.746 1.00 0.00 C ATOM 6 CG MET A 1 3.664 -4.693 -8.739 1.00 0.00 C ATOM 7 SD MET A 1 3.504 -3.034 -9.445 1.00 0.00 S ATOM 8 CE MET A 1 1.998 -3.264 -10.424 1.00 0.00 C ATOM 0 H1 MET A 1 5.837 -7.683 -10.223 1.00 0.00 H new ATOM 0 H2 MET A 1 5.071 -8.974 -9.429 1.00 0.00 H new ATOM 0 H3 MET A 1 4.333 -8.248 -10.774 1.00 0.00 H new ATOM 0 HA MET A 1 4.856 -6.962 -8.160 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.940 -5.499 -10.276 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.241 -5.870 -10.493 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.723 -4.962 -8.260 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.424 -4.669 -7.958 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.759 -2.338 -10.947 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.155 -4.061 -11.151 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.173 -3.532 -9.764 1.00 0.00 H new ATOM 20 N LEU A 2 2.603 -7.712 -7.305 1.00 0.00 N ATOM 21 CA LEU A 2 1.313 -8.177 -6.816 1.00 0.00 C ATOM 22 C LEU A 2 0.343 -6.995 -6.846 1.00 0.00 C ATOM 23 O LEU A 2 0.714 -5.882 -6.482 1.00 0.00 O ATOM 24 CB LEU A 2 1.490 -8.718 -5.388 1.00 0.00 C ATOM 25 CG LEU A 2 0.470 -9.785 -4.948 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.285 -9.718 -3.437 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.913 -9.657 -5.568 1.00 0.00 C ATOM 0 H LEU A 2 3.249 -7.412 -6.574 1.00 0.00 H new ATOM 0 HA LEU A 2 0.915 -8.979 -7.437 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.491 -9.140 -5.300 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.435 -7.881 -4.692 1.00 0.00 H new ATOM 0 HG LEU A 2 0.894 -10.729 -5.291 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -0.437 -10.473 -3.125 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.240 -9.904 -2.945 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -0.081 -8.730 -3.159 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.555 -10.455 -5.194 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.343 -8.691 -5.303 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.834 -9.734 -6.652 1.00 0.00 H new ATOM 39 N ILE A 3 -0.894 -7.226 -7.279 1.00 0.00 N ATOM 40 CA ILE A 3 -1.948 -6.226 -7.260 1.00 0.00 C ATOM 41 C ILE A 3 -3.075 -6.758 -6.394 1.00 0.00 C ATOM 42 O ILE A 3 -3.400 -7.940 -6.444 1.00 0.00 O ATOM 43 CB ILE A 3 -2.451 -5.913 -8.681 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.432 -5.063 -9.443 1.00 0.00 C ATOM 45 CG2 ILE A 3 -3.760 -5.124 -8.629 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.386 -5.918 -10.150 1.00 0.00 C ATOM 0 H ILE A 3 -1.192 -8.125 -7.657 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.563 -5.292 -6.851 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.601 -6.867 -9.186 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.951 -4.446 -10.176 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.936 -4.384 -8.749 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.098 -4.913 -9.643 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.518 -5.710 -8.108 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -3.599 -4.186 -8.098 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.316 -5.272 -10.678 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.153 -6.516 -9.415 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.878 -6.579 -10.864 1.00 0.00 H new ATOM 58 N LEU A 4 -3.668 -5.871 -5.601 1.00 0.00 N ATOM 59 CA LEU A 4 -4.748 -6.220 -4.697 1.00 0.00 C ATOM 60 C LEU A 4 -5.810 -5.129 -4.788 1.00 0.00 C ATOM 61 O LEU A 4 -5.565 -4.054 -5.342 1.00 0.00 O ATOM 62 CB LEU A 4 -4.209 -6.358 -3.264 1.00 0.00 C ATOM 63 CG LEU A 4 -3.192 -7.493 -3.063 1.00 0.00 C ATOM 64 CD1 LEU A 4 -2.722 -7.497 -1.613 1.00 0.00 C ATOM 65 CD2 LEU A 4 -3.826 -8.856 -3.347 1.00 0.00 C ATOM 0 H LEU A 4 -3.408 -4.885 -5.571 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.189 -7.178 -4.973 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.743 -5.416 -2.974 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.049 -6.519 -2.589 1.00 0.00 H new ATOM 0 HG LEU A 4 -2.362 -7.325 -3.749 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -2.000 -8.301 -1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -2.253 -6.541 -1.380 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.576 -7.652 -0.954 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -3.084 -9.641 -3.197 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -4.665 -9.015 -2.669 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -4.181 -8.885 -4.377 1.00 0.00 H new ATOM 77 N THR A 5 -6.990 -5.406 -4.244 1.00 0.00 N ATOM 78 CA THR A 5 -8.106 -4.475 -4.288 1.00 0.00 C ATOM 79 C THR A 5 -8.616 -4.308 -2.869 1.00 0.00 C ATOM 80 O THR A 5 -8.692 -5.278 -2.112 1.00 0.00 O ATOM 81 CB THR A 5 -9.171 -5.019 -5.248 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.583 -5.177 -6.520 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.369 -4.085 -5.407 1.00 0.00 C ATOM 0 H THR A 5 -7.197 -6.281 -3.762 1.00 0.00 H new ATOM 0 HA THR A 5 -7.814 -3.494 -4.664 1.00 0.00 H new ATOM 0 HB THR A 5 -9.531 -5.959 -4.830 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.250 -5.526 -7.148 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.086 -4.527 -6.099 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.845 -3.935 -4.438 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.032 -3.125 -5.798 1.00 0.00 H new ATOM 91 N ARG A 6 -8.962 -3.076 -2.501 1.00 0.00 N ATOM 92 CA ARG A 6 -9.284 -2.737 -1.124 1.00 0.00 C ATOM 93 C ARG A 6 -10.410 -1.710 -1.116 1.00 0.00 C ATOM 94 O ARG A 6 -10.788 -1.216 -2.175 1.00 0.00 O ATOM 95 CB ARG A 6 -8.003 -2.202 -0.479 1.00 0.00 C ATOM 96 CG ARG A 6 -8.002 -2.172 1.052 1.00 0.00 C ATOM 97 CD ARG A 6 -8.005 -3.574 1.665 1.00 0.00 C ATOM 98 NE ARG A 6 -9.336 -4.186 1.647 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.599 -5.462 1.352 1.00 0.00 C ATOM 100 NH1 ARG A 6 -8.628 -6.313 1.029 1.00 0.00 N ATOM 101 NH2 ARG A 6 -10.857 -5.885 1.383 1.00 0.00 N ATOM 0 H ARG A 6 -9.026 -2.291 -3.149 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.633 -3.600 -0.556 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -7.165 -2.813 -0.814 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -7.827 -1.191 -0.846 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.124 -1.628 1.401 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -8.877 -1.624 1.402 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -7.308 -4.209 1.118 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -7.647 -3.519 2.693 1.00 0.00 H new ATOM 0 HE ARG A 6 -10.129 -3.587 1.879 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -7.659 -5.995 1.003 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -8.853 -7.283 0.808 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -11.606 -5.239 1.630 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -11.074 -6.856 1.160 1.00 0.00 H new ATOM 115 N LYS A 7 -10.951 -1.385 0.058 1.00 0.00 N ATOM 116 CA LYS A 7 -12.039 -0.426 0.156 1.00 0.00 C ATOM 117 C LYS A 7 -11.771 0.545 1.300 1.00 0.00 C ATOM 118 O LYS A 7 -11.051 0.218 2.242 1.00 0.00 O ATOM 119 CB LYS A 7 -13.367 -1.177 0.338 1.00 0.00 C ATOM 120 CG LYS A 7 -13.430 -2.405 -0.582 1.00 0.00 C ATOM 121 CD LYS A 7 -14.795 -3.084 -0.534 1.00 0.00 C ATOM 122 CE LYS A 7 -14.664 -4.479 -1.146 1.00 0.00 C ATOM 123 NZ LYS A 7 -15.930 -5.230 -1.074 1.00 0.00 N ATOM 0 H LYS A 7 -10.650 -1.774 0.951 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.108 0.159 -0.761 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.474 -1.489 1.377 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.200 -0.510 0.119 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.211 -2.103 -1.606 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.660 -3.118 -0.289 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.148 -3.153 0.495 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -15.530 -2.496 -1.084 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -14.352 -4.391 -2.187 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -13.883 -5.033 -0.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.800 -6.170 -1.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -16.215 -5.336 -0.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -16.669 -4.715 -1.593 1.00 0.00 H new ATOM 137 N VAL A 8 -12.358 1.741 1.211 1.00 0.00 N ATOM 138 CA VAL A 8 -12.154 2.806 2.185 1.00 0.00 C ATOM 139 C VAL A 8 -12.408 2.280 3.596 1.00 0.00 C ATOM 140 O VAL A 8 -13.529 1.892 3.924 1.00 0.00 O ATOM 141 CB VAL A 8 -13.097 3.971 1.866 1.00 0.00 C ATOM 142 CG1 VAL A 8 -12.970 5.047 2.940 1.00 0.00 C ATOM 143 CG2 VAL A 8 -12.726 4.563 0.511 1.00 0.00 C ATOM 0 H VAL A 8 -12.992 1.995 0.454 1.00 0.00 H new ATOM 0 HA VAL A 8 -11.124 3.158 2.132 1.00 0.00 H new ATOM 0 HB VAL A 8 -14.124 3.607 1.841 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -13.642 5.873 2.709 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -13.233 4.626 3.910 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -11.943 5.412 2.970 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.395 5.392 0.281 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.698 4.924 0.541 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.820 3.797 -0.259 1.00 0.00 H new ATOM 153 N GLY A 9 -11.362 2.262 4.429 1.00 0.00 N ATOM 154 CA GLY A 9 -11.477 1.848 5.822 1.00 0.00 C ATOM 155 C GLY A 9 -10.825 0.495 6.086 1.00 0.00 C ATOM 156 O GLY A 9 -11.018 -0.079 7.158 1.00 0.00 O ATOM 0 H GLY A 9 -10.418 2.534 4.154 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -11.015 2.601 6.461 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.531 1.800 6.097 1.00 0.00 H new ATOM 160 N GLU A 10 -10.053 -0.023 5.124 1.00 0.00 N ATOM 161 CA GLU A 10 -9.402 -1.324 5.240 1.00 0.00 C ATOM 162 C GLU A 10 -7.899 -1.196 5.003 1.00 0.00 C ATOM 163 O GLU A 10 -7.403 -0.100 4.743 1.00 0.00 O ATOM 164 CB GLU A 10 -10.038 -2.300 4.253 1.00 0.00 C ATOM 165 CG GLU A 10 -11.540 -2.460 4.494 1.00 0.00 C ATOM 166 CD GLU A 10 -12.157 -3.419 3.478 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.803 -3.305 2.280 1.00 0.00 O ATOM 168 OE2 GLU A 10 -12.979 -4.262 3.898 1.00 0.00 O ATOM 0 H GLU A 10 -9.864 0.453 4.242 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.542 -1.709 6.250 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.869 -1.948 3.235 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.551 -3.272 4.339 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.712 -2.833 5.503 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.029 -1.488 4.426 1.00 0.00 H new ATOM 175 N SER A 11 -7.165 -2.310 5.088 1.00 0.00 N ATOM 176 CA SER A 11 -5.710 -2.286 5.046 1.00 0.00 C ATOM 177 C SER A 11 -5.119 -3.467 4.279 1.00 0.00 C ATOM 178 O SER A 11 -5.810 -4.430 3.948 1.00 0.00 O ATOM 179 CB SER A 11 -5.174 -2.279 6.481 1.00 0.00 C ATOM 180 OG SER A 11 -5.604 -1.124 7.175 1.00 0.00 O ATOM 0 H SER A 11 -7.564 -3.244 5.187 1.00 0.00 H new ATOM 0 HA SER A 11 -5.408 -1.384 4.514 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.516 -3.171 7.005 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.085 -2.315 6.467 1.00 0.00 H new ATOM 0 HG SER A 11 -5.251 -1.141 8.089 1.00 0.00 H new ATOM 186 N ILE A 12 -3.814 -3.372 4.004 1.00 0.00 N ATOM 187 CA ILE A 12 -3.009 -4.357 3.294 1.00 0.00 C ATOM 188 C ILE A 12 -1.744 -4.575 4.127 1.00 0.00 C ATOM 189 O ILE A 12 -1.433 -3.748 4.982 1.00 0.00 O ATOM 190 CB ILE A 12 -2.681 -3.828 1.885 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.945 -3.686 1.027 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.672 -4.716 1.154 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.638 -5.022 0.746 1.00 0.00 C ATOM 0 H ILE A 12 -3.266 -2.560 4.289 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.535 -5.304 3.168 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.234 -2.844 2.030 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.645 -3.020 1.531 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.682 -3.214 0.080 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.473 -4.302 0.165 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.744 -4.758 1.724 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.080 -5.722 1.051 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.524 -4.851 0.135 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.953 -5.683 0.215 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.931 -5.485 1.688 1.00 0.00 H new ATOM 205 N ASN A 13 -1.013 -5.671 3.895 1.00 0.00 N ATOM 206 CA ASN A 13 0.103 -6.020 4.761 1.00 0.00 C ATOM 207 C ASN A 13 1.312 -6.491 3.957 1.00 0.00 C ATOM 208 O ASN A 13 1.162 -7.125 2.914 1.00 0.00 O ATOM 209 CB ASN A 13 -0.390 -7.095 5.729 1.00 0.00 C ATOM 210 CG ASN A 13 0.382 -7.090 7.039 1.00 0.00 C ATOM 211 OD1 ASN A 13 1.596 -7.276 7.065 1.00 0.00 O ATOM 212 ND2 ASN A 13 -0.324 -6.873 8.143 1.00 0.00 N ATOM 0 H ASN A 13 -1.176 -6.319 3.125 1.00 0.00 H new ATOM 0 HA ASN A 13 0.440 -5.144 5.315 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.449 -6.938 5.933 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.297 -8.074 5.259 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.141 -6.857 9.051 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -1.331 -6.722 8.083 1.00 0.00 H new ATOM 219 N ILE A 14 2.511 -6.176 4.457 1.00 0.00 N ATOM 220 CA ILE A 14 3.768 -6.529 3.805 1.00 0.00 C ATOM 221 C ILE A 14 4.804 -6.921 4.864 1.00 0.00 C ATOM 222 O ILE A 14 4.812 -6.385 5.972 1.00 0.00 O ATOM 223 CB ILE A 14 4.287 -5.337 2.981 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.213 -4.836 2.004 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.553 -5.739 2.220 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.682 -3.610 1.218 1.00 0.00 C ATOM 0 H ILE A 14 2.633 -5.665 5.332 1.00 0.00 H new ATOM 0 HA ILE A 14 3.599 -7.373 3.136 1.00 0.00 H new ATOM 0 HB ILE A 14 4.527 -4.523 3.665 1.00 0.00 H new ATOM 0 HG12 ILE A 14 2.954 -5.635 1.309 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.307 -4.588 2.557 1.00 0.00 H new ATOM 0 HG21 ILE A 14 5.914 -4.890 1.640 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.322 -6.046 2.929 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.326 -6.567 1.549 1.00 0.00 H new ATOM 0 HD11 ILE A 14 2.892 -3.289 0.539 1.00 0.00 H new ATOM 0 HD12 ILE A 14 3.916 -2.802 1.911 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.573 -3.865 0.644 1.00 0.00 H new ATOM 238 N GLY A 15 5.688 -7.863 4.521 1.00 0.00 N ATOM 239 CA GLY A 15 6.721 -8.327 5.433 1.00 0.00 C ATOM 240 C GLY A 15 6.100 -8.801 6.740 1.00 0.00 C ATOM 241 O GLY A 15 5.075 -9.481 6.737 1.00 0.00 O ATOM 0 H GLY A 15 5.703 -8.318 3.608 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.282 -9.141 4.973 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.429 -7.522 5.630 1.00 0.00 H new ATOM 245 N ASP A 16 6.731 -8.434 7.853 1.00 0.00 N ATOM 246 CA ASP A 16 6.246 -8.744 9.188 1.00 0.00 C ATOM 247 C ASP A 16 6.233 -7.492 10.071 1.00 0.00 C ATOM 248 O ASP A 16 5.982 -7.591 11.271 1.00 0.00 O ATOM 249 CB ASP A 16 7.057 -9.893 9.795 1.00 0.00 C ATOM 250 CG ASP A 16 8.520 -9.523 10.056 1.00 0.00 C ATOM 251 OD1 ASP A 16 9.186 -9.052 9.107 1.00 0.00 O ATOM 252 OD2 ASP A 16 8.958 -9.718 11.213 1.00 0.00 O ATOM 0 H ASP A 16 7.604 -7.907 7.849 1.00 0.00 H new ATOM 0 HA ASP A 16 5.212 -9.083 9.122 1.00 0.00 H new ATOM 0 HB2 ASP A 16 6.594 -10.201 10.732 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.020 -10.751 9.123 1.00 0.00 H new ATOM 257 N ASP A 17 6.510 -6.319 9.485 1.00 0.00 N ATOM 258 CA ASP A 17 6.556 -5.052 10.202 1.00 0.00 C ATOM 259 C ASP A 17 5.977 -3.901 9.373 1.00 0.00 C ATOM 260 O ASP A 17 6.126 -2.743 9.759 1.00 0.00 O ATOM 261 CB ASP A 17 8.004 -4.722 10.591 1.00 0.00 C ATOM 262 CG ASP A 17 8.553 -5.667 11.657 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.020 -5.629 12.788 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.504 -6.412 11.337 1.00 0.00 O ATOM 0 H ASP A 17 6.710 -6.230 8.489 1.00 0.00 H new ATOM 0 HA ASP A 17 5.944 -5.163 11.097 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.636 -4.774 9.704 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.053 -3.697 10.958 1.00 0.00 H new ATOM 269 N ILE A 18 5.322 -4.183 8.241 1.00 0.00 N ATOM 270 CA ILE A 18 4.781 -3.133 7.384 1.00 0.00 C ATOM 271 C ILE A 18 3.303 -3.390 7.111 1.00 0.00 C ATOM 272 O ILE A 18 2.892 -4.515 6.849 1.00 0.00 O ATOM 273 CB ILE A 18 5.580 -3.076 6.074 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.058 -2.792 6.366 1.00 0.00 C ATOM 275 CG2 ILE A 18 4.998 -2.001 5.150 1.00 0.00 C ATOM 276 CD1 ILE A 18 7.910 -2.881 5.100 1.00 0.00 C ATOM 0 H ILE A 18 5.156 -5.130 7.901 1.00 0.00 H new ATOM 0 HA ILE A 18 4.870 -2.170 7.887 1.00 0.00 H new ATOM 0 HB ILE A 18 5.507 -4.041 5.573 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.158 -1.799 6.804 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.427 -3.504 7.104 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.571 -1.968 4.224 1.00 0.00 H new ATOM 0 HG22 ILE A 18 3.958 -2.239 4.925 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.050 -1.030 5.643 1.00 0.00 H new ATOM 0 HD11 ILE A 18 8.951 -2.674 5.347 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.830 -3.882 4.677 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.557 -2.150 4.372 1.00 0.00 H new ATOM 288 N THR A 19 2.498 -2.328 7.178 1.00 0.00 N ATOM 289 CA THR A 19 1.068 -2.386 6.932 1.00 0.00 C ATOM 290 C THR A 19 0.653 -1.085 6.259 1.00 0.00 C ATOM 291 O THR A 19 1.269 -0.050 6.501 1.00 0.00 O ATOM 292 CB THR A 19 0.323 -2.577 8.264 1.00 0.00 C ATOM 293 OG1 THR A 19 0.834 -3.694 8.957 1.00 0.00 O ATOM 294 CG2 THR A 19 -1.173 -2.810 8.055 1.00 0.00 C ATOM 0 H THR A 19 2.833 -1.392 7.409 1.00 0.00 H new ATOM 0 HA THR A 19 0.819 -3.227 6.284 1.00 0.00 H new ATOM 0 HB THR A 19 0.471 -1.661 8.835 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.352 -3.803 9.803 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.660 -2.940 9.022 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.607 -1.951 7.543 1.00 0.00 H new ATOM 0 HG23 THR A 19 -1.321 -3.705 7.451 1.00 0.00 H new ATOM 302 N ILE A 20 -0.385 -1.132 5.418 1.00 0.00 N ATOM 303 CA ILE A 20 -0.817 0.015 4.627 1.00 0.00 C ATOM 304 C ILE A 20 -2.330 0.163 4.759 1.00 0.00 C ATOM 305 O ILE A 20 -3.020 -0.834 4.956 1.00 0.00 O ATOM 306 CB ILE A 20 -0.425 -0.196 3.155 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.024 -0.671 2.992 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.629 1.097 2.360 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.066 0.357 3.412 1.00 0.00 C ATOM 0 H ILE A 20 -0.947 -1.970 5.269 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.333 0.923 4.988 1.00 0.00 H new ATOM 0 HB ILE A 20 -1.075 -0.980 2.768 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.166 -1.578 3.580 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.192 -0.938 1.949 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.348 0.933 1.320 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.677 1.393 2.410 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -0.008 1.886 2.784 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.064 -0.056 3.266 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.954 1.257 2.807 1.00 0.00 H new ATOM 0 HD13 ILE A 20 1.927 0.607 4.464 1.00 0.00 H new ATOM 321 N THR A 21 -2.857 1.387 4.656 1.00 0.00 N ATOM 322 CA THR A 21 -4.280 1.643 4.862 1.00 0.00 C ATOM 323 C THR A 21 -4.808 2.647 3.840 1.00 0.00 C ATOM 324 O THR A 21 -4.075 3.520 3.375 1.00 0.00 O ATOM 325 CB THR A 21 -4.485 2.175 6.287 1.00 0.00 C ATOM 326 OG1 THR A 21 -3.888 1.293 7.213 1.00 0.00 O ATOM 327 CG2 THR A 21 -5.963 2.294 6.650 1.00 0.00 C ATOM 0 H THR A 21 -2.312 2.219 4.429 1.00 0.00 H new ATOM 0 HA THR A 21 -4.835 0.714 4.730 1.00 0.00 H new ATOM 0 HB THR A 21 -4.029 3.164 6.325 1.00 0.00 H new ATOM 0 HG1 THR A 21 -4.407 0.463 7.256 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.058 2.674 7.667 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.453 2.979 5.959 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.434 1.313 6.584 1.00 0.00 H new ATOM 335 N ILE A 22 -6.094 2.513 3.496 1.00 0.00 N ATOM 336 CA ILE A 22 -6.789 3.409 2.584 1.00 0.00 C ATOM 337 C ILE A 22 -7.792 4.233 3.389 1.00 0.00 C ATOM 338 O ILE A 22 -8.887 3.769 3.706 1.00 0.00 O ATOM 339 CB ILE A 22 -7.425 2.611 1.430 1.00 0.00 C ATOM 340 CG1 ILE A 22 -8.350 3.467 0.558 1.00 0.00 C ATOM 341 CG2 ILE A 22 -8.217 1.398 1.918 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.582 4.594 -0.128 1.00 0.00 C ATOM 0 H ILE A 22 -6.686 1.763 3.854 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.096 4.105 2.110 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.578 2.273 0.833 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.827 2.839 -0.194 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.145 3.888 1.173 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.643 0.873 1.063 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.554 0.726 2.463 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.020 1.729 2.577 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.267 5.182 -0.739 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.126 5.236 0.626 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.803 4.170 -0.762 1.00 0.00 H new ATOM 354 N LEU A 23 -7.408 5.468 3.725 1.00 0.00 N ATOM 355 CA LEU A 23 -8.226 6.324 4.571 1.00 0.00 C ATOM 356 C LEU A 23 -9.456 6.829 3.827 1.00 0.00 C ATOM 357 O LEU A 23 -10.493 7.075 4.441 1.00 0.00 O ATOM 358 CB LEU A 23 -7.401 7.519 5.050 1.00 0.00 C ATOM 359 CG LEU A 23 -6.072 7.126 5.696 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.467 8.375 6.317 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.230 6.050 6.763 1.00 0.00 C ATOM 0 H LEU A 23 -6.532 5.893 3.420 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.558 5.732 5.424 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.203 8.176 4.203 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.989 8.091 5.767 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.426 6.708 4.924 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.516 8.124 6.786 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.303 9.124 5.542 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.148 8.774 7.069 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.254 5.811 7.186 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.889 6.414 7.552 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.660 5.154 6.315 1.00 0.00 H new ATOM 373 N GLY A 24 -9.351 6.983 2.504 1.00 0.00 N ATOM 374 CA GLY A 24 -10.473 7.403 1.681 1.00 0.00 C ATOM 375 C GLY A 24 -10.054 7.802 0.271 1.00 0.00 C ATOM 376 O GLY A 24 -8.903 7.612 -0.128 1.00 0.00 O ATOM 0 H GLY A 24 -8.490 6.820 1.983 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -11.199 6.592 1.624 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.973 8.246 2.159 1.00 0.00 H new ATOM 380 N VAL A 25 -11.007 8.361 -0.481 1.00 0.00 N ATOM 381 CA VAL A 25 -10.803 8.759 -1.870 1.00 0.00 C ATOM 382 C VAL A 25 -11.342 10.169 -2.092 1.00 0.00 C ATOM 383 O VAL A 25 -12.145 10.666 -1.301 1.00 0.00 O ATOM 384 CB VAL A 25 -11.494 7.766 -2.817 1.00 0.00 C ATOM 385 CG1 VAL A 25 -10.964 6.349 -2.616 1.00 0.00 C ATOM 386 CG2 VAL A 25 -13.008 7.754 -2.590 1.00 0.00 C ATOM 0 H VAL A 25 -11.948 8.550 -0.136 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.734 8.753 -2.085 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.276 8.095 -3.833 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.472 5.670 -3.300 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -9.892 6.330 -2.815 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -11.148 6.034 -1.589 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -13.473 7.043 -3.273 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -13.219 7.461 -1.562 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.411 8.750 -2.773 1.00 0.00 H new ATOM 396 N SER A 26 -10.896 10.809 -3.177 1.00 0.00 N ATOM 397 CA SER A 26 -11.253 12.186 -3.507 1.00 0.00 C ATOM 398 C SER A 26 -11.243 12.364 -5.023 1.00 0.00 C ATOM 399 O SER A 26 -10.491 13.181 -5.552 1.00 0.00 O ATOM 400 CB SER A 26 -10.260 13.158 -2.856 1.00 0.00 C ATOM 401 OG SER A 26 -10.294 13.039 -1.446 1.00 0.00 O ATOM 0 H SER A 26 -10.270 10.378 -3.857 1.00 0.00 H new ATOM 0 HA SER A 26 -12.251 12.400 -3.126 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.253 12.954 -3.219 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.502 14.181 -3.145 1.00 0.00 H new ATOM 0 HG SER A 26 -9.653 13.665 -1.049 1.00 0.00 H new ATOM 407 N GLY A 27 -12.080 11.599 -5.726 1.00 0.00 N ATOM 408 CA GLY A 27 -12.141 11.664 -7.179 1.00 0.00 C ATOM 409 C GLY A 27 -10.910 11.006 -7.784 1.00 0.00 C ATOM 410 O GLY A 27 -10.571 9.874 -7.435 1.00 0.00 O ATOM 0 H GLY A 27 -12.724 10.928 -5.308 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.042 11.165 -7.536 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.203 12.703 -7.502 1.00 0.00 H new ATOM 414 N GLN A 28 -10.235 11.712 -8.693 1.00 0.00 N ATOM 415 CA GLN A 28 -9.015 11.220 -9.314 1.00 0.00 C ATOM 416 C GLN A 28 -7.861 11.191 -8.305 1.00 0.00 C ATOM 417 O GLN A 28 -6.753 10.770 -8.637 1.00 0.00 O ATOM 418 CB GLN A 28 -8.692 12.101 -10.526 1.00 0.00 C ATOM 419 CG GLN A 28 -7.627 11.465 -11.419 1.00 0.00 C ATOM 420 CD GLN A 28 -7.405 12.256 -12.704 1.00 0.00 C ATOM 421 OE1 GLN A 28 -8.241 13.057 -13.114 1.00 0.00 O ATOM 422 NE2 GLN A 28 -6.263 12.030 -13.350 1.00 0.00 N ATOM 0 H GLN A 28 -10.521 12.637 -9.015 1.00 0.00 H new ATOM 0 HA GLN A 28 -9.158 10.194 -9.652 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.600 12.270 -11.106 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.346 13.077 -10.185 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.688 11.397 -10.870 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -7.925 10.447 -11.668 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.592 11.357 -12.979 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -6.059 12.530 -14.216 1.00 0.00 H new ATOM 431 N GLN A 29 -8.107 11.638 -7.067 1.00 0.00 N ATOM 432 CA GLN A 29 -7.102 11.645 -6.012 1.00 0.00 C ATOM 433 C GLN A 29 -7.499 10.668 -4.907 1.00 0.00 C ATOM 434 O GLN A 29 -8.640 10.221 -4.828 1.00 0.00 O ATOM 435 CB GLN A 29 -6.927 13.057 -5.456 1.00 0.00 C ATOM 436 CG GLN A 29 -6.679 14.070 -6.577 1.00 0.00 C ATOM 437 CD GLN A 29 -6.286 15.425 -6.007 1.00 0.00 C ATOM 438 OE1 GLN A 29 -5.226 15.963 -6.314 1.00 0.00 O ATOM 439 NE2 GLN A 29 -7.142 15.990 -5.166 1.00 0.00 N ATOM 0 H GLN A 29 -9.013 12.005 -6.774 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.147 11.325 -6.428 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.817 13.342 -4.896 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.091 13.074 -4.757 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.890 13.705 -7.235 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.578 14.173 -7.185 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -8.014 15.516 -4.932 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.928 16.898 -4.754 1.00 0.00 H new ATOM 448 N VAL A 30 -6.535 10.338 -4.047 1.00 0.00 N ATOM 449 CA VAL A 30 -6.672 9.298 -3.041 1.00 0.00 C ATOM 450 C VAL A 30 -5.909 9.683 -1.771 1.00 0.00 C ATOM 451 O VAL A 30 -4.914 10.408 -1.835 1.00 0.00 O ATOM 452 CB VAL A 30 -6.137 7.987 -3.635 1.00 0.00 C ATOM 453 CG1 VAL A 30 -6.110 6.872 -2.592 1.00 0.00 C ATOM 454 CG2 VAL A 30 -7.015 7.516 -4.795 1.00 0.00 C ATOM 0 H VAL A 30 -5.624 10.797 -4.034 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.719 9.172 -2.764 1.00 0.00 H new ATOM 0 HB VAL A 30 -5.125 8.193 -3.983 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.726 5.958 -3.046 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.465 7.164 -1.763 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -7.120 6.696 -2.221 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.616 6.586 -5.199 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -8.031 7.350 -4.438 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -7.025 8.276 -5.576 1.00 0.00 H new ATOM 464 N ARG A 31 -6.379 9.193 -0.622 1.00 0.00 N ATOM 465 CA ARG A 31 -5.791 9.472 0.686 1.00 0.00 C ATOM 466 C ARG A 31 -5.436 8.143 1.343 1.00 0.00 C ATOM 467 O ARG A 31 -6.317 7.344 1.655 1.00 0.00 O ATOM 468 CB ARG A 31 -6.803 10.263 1.526 1.00 0.00 C ATOM 469 CG ARG A 31 -6.242 11.591 2.045 1.00 0.00 C ATOM 470 CD ARG A 31 -5.173 11.411 3.128 1.00 0.00 C ATOM 471 NE ARG A 31 -4.834 12.710 3.724 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.414 13.216 4.818 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.326 12.522 5.490 1.00 0.00 N ATOM 474 NH2 ARG A 31 -5.084 14.428 5.255 1.00 0.00 N ATOM 0 H ARG A 31 -7.193 8.581 -0.576 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.885 10.071 0.595 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.691 10.460 0.925 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -7.120 9.653 2.372 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.815 12.149 1.211 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -7.059 12.192 2.446 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -5.537 10.732 3.899 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.281 10.956 2.697 1.00 0.00 H new ATOM 0 HE ARG A 31 -4.106 13.264 3.273 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.593 11.590 5.173 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.759 12.921 6.322 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.385 14.977 4.755 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.530 14.808 6.090 1.00 0.00 H new ATOM 488 N ILE A 32 -4.141 7.906 1.550 1.00 0.00 N ATOM 489 CA ILE A 32 -3.626 6.636 2.047 1.00 0.00 C ATOM 490 C ILE A 32 -2.572 6.873 3.121 1.00 0.00 C ATOM 491 O ILE A 32 -1.978 7.946 3.197 1.00 0.00 O ATOM 492 CB ILE A 32 -3.021 5.814 0.902 1.00 0.00 C ATOM 493 CG1 ILE A 32 -2.136 6.692 0.005 1.00 0.00 C ATOM 494 CG2 ILE A 32 -4.135 5.141 0.096 1.00 0.00 C ATOM 495 CD1 ILE A 32 -1.367 5.838 -1.001 1.00 0.00 C ATOM 0 H ILE A 32 -3.414 8.600 1.375 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.457 6.080 2.480 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.386 5.036 1.326 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.754 7.418 -0.524 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.435 7.257 0.619 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.697 4.559 -0.715 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.708 4.481 0.748 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.795 5.903 -0.319 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.747 6.481 -1.625 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.733 5.130 -0.468 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -2.072 5.293 -1.629 1.00 0.00 H new ATOM 507 N GLY A 33 -2.346 5.855 3.955 1.00 0.00 N ATOM 508 CA GLY A 33 -1.378 5.945 5.033 1.00 0.00 C ATOM 509 C GLY A 33 -0.565 4.669 5.133 1.00 0.00 C ATOM 510 O GLY A 33 -0.935 3.636 4.574 1.00 0.00 O ATOM 0 H GLY A 33 -2.827 4.957 3.898 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.714 6.792 4.862 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.893 6.129 5.976 1.00 0.00 H new ATOM 514 N ILE A 34 0.551 4.752 5.859 1.00 0.00 N ATOM 515 CA ILE A 34 1.504 3.660 5.969 1.00 0.00 C ATOM 516 C ILE A 34 1.879 3.453 7.428 1.00 0.00 C ATOM 517 O ILE A 34 1.975 4.410 8.192 1.00 0.00 O ATOM 518 CB ILE A 34 2.745 4.011 5.132 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.346 4.111 3.656 1.00 0.00 C ATOM 520 CG2 ILE A 34 3.860 2.975 5.336 1.00 0.00 C ATOM 521 CD1 ILE A 34 3.510 4.500 2.747 1.00 0.00 C ATOM 0 H ILE A 34 0.815 5.584 6.387 1.00 0.00 H new ATOM 0 HA ILE A 34 1.067 2.734 5.596 1.00 0.00 H new ATOM 0 HB ILE A 34 3.137 4.973 5.461 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.942 3.153 3.329 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.548 4.846 3.550 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.725 3.248 4.732 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.145 2.949 6.388 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.502 1.991 5.033 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.163 4.554 1.715 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.900 5.472 3.050 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.299 3.752 2.826 1.00 0.00 H new ATOM 533 N ASN A 35 2.091 2.193 7.805 1.00 0.00 N ATOM 534 CA ASN A 35 2.417 1.793 9.159 1.00 0.00 C ATOM 535 C ASN A 35 3.636 0.878 9.124 1.00 0.00 C ATOM 536 O ASN A 35 3.540 -0.334 9.315 1.00 0.00 O ATOM 537 CB ASN A 35 1.209 1.114 9.811 1.00 0.00 C ATOM 538 CG ASN A 35 0.081 2.102 10.079 1.00 0.00 C ATOM 539 OD1 ASN A 35 0.292 3.145 10.694 1.00 0.00 O ATOM 540 ND2 ASN A 35 -1.123 1.781 9.617 1.00 0.00 N ATOM 0 H ASN A 35 2.038 1.408 7.156 1.00 0.00 H new ATOM 0 HA ASN A 35 2.661 2.666 9.764 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.847 0.316 9.163 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.515 0.649 10.748 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -1.912 2.410 9.768 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -1.258 0.906 9.111 1.00 0.00 H new ATOM 547 N ALA A 36 4.790 1.496 8.877 1.00 0.00 N ATOM 548 CA ALA A 36 6.094 0.855 8.906 1.00 0.00 C ATOM 549 C ALA A 36 6.909 1.526 10.006 1.00 0.00 C ATOM 550 O ALA A 36 6.609 2.660 10.388 1.00 0.00 O ATOM 551 CB ALA A 36 6.764 1.032 7.549 1.00 0.00 C ATOM 0 H ALA A 36 4.839 2.488 8.644 1.00 0.00 H new ATOM 0 HA ALA A 36 6.012 -0.213 9.108 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.743 0.554 7.562 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.147 0.574 6.776 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.882 2.095 7.337 1.00 0.00 H new ATOM 557 N PRO A 37 7.940 0.854 10.531 1.00 0.00 N ATOM 558 CA PRO A 37 8.733 1.399 11.603 1.00 0.00 C ATOM 559 C PRO A 37 9.524 2.587 11.073 1.00 0.00 C ATOM 560 O PRO A 37 9.905 2.611 9.904 1.00 0.00 O ATOM 561 CB PRO A 37 9.637 0.255 12.058 1.00 0.00 C ATOM 562 CG PRO A 37 9.763 -0.617 10.812 1.00 0.00 C ATOM 563 CD PRO A 37 8.411 -0.455 10.136 1.00 0.00 C ATOM 0 HA PRO A 37 8.141 1.765 12.442 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.608 0.620 12.393 1.00 0.00 H new ATOM 0 HB3 PRO A 37 9.199 -0.296 12.891 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.577 -0.284 10.168 1.00 0.00 H new ATOM 0 HG3 PRO A 37 9.963 -1.658 11.067 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.502 -0.530 9.052 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.718 -1.234 10.452 1.00 0.00 H new ATOM 571 N LYS A 38 9.777 3.574 11.930 1.00 0.00 N ATOM 572 CA LYS A 38 10.536 4.750 11.540 1.00 0.00 C ATOM 573 C LYS A 38 11.999 4.367 11.283 1.00 0.00 C ATOM 574 O LYS A 38 12.811 5.207 10.904 1.00 0.00 O ATOM 575 CB LYS A 38 10.373 5.836 12.602 1.00 0.00 C ATOM 576 CG LYS A 38 8.877 6.124 12.772 1.00 0.00 C ATOM 577 CD LYS A 38 8.647 7.321 13.695 1.00 0.00 C ATOM 578 CE LYS A 38 7.158 7.622 13.851 1.00 0.00 C ATOM 579 NZ LYS A 38 6.437 6.553 14.557 1.00 0.00 N ATOM 0 H LYS A 38 9.464 3.578 12.901 1.00 0.00 H new ATOM 0 HA LYS A 38 10.154 5.159 10.605 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.807 5.510 13.548 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.902 6.741 12.304 1.00 0.00 H new ATOM 0 HG2 LYS A 38 8.429 6.321 11.798 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.379 5.245 13.181 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.084 7.118 14.673 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.157 8.196 13.293 1.00 0.00 H new ATOM 0 HE2 LYS A 38 7.035 8.559 14.395 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.715 7.765 12.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.465 6.863 14.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.413 5.699 13.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.922 6.339 15.452 1.00 0.00 H new ATOM 593 N ASP A 39 12.320 3.087 11.501 1.00 0.00 N ATOM 594 CA ASP A 39 13.619 2.513 11.209 1.00 0.00 C ATOM 595 C ASP A 39 13.782 2.212 9.718 1.00 0.00 C ATOM 596 O ASP A 39 14.899 1.941 9.278 1.00 0.00 O ATOM 597 CB ASP A 39 13.797 1.229 12.028 1.00 0.00 C ATOM 598 CG ASP A 39 13.752 1.521 13.523 1.00 0.00 C ATOM 599 OD1 ASP A 39 14.804 1.928 14.063 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.667 1.336 14.118 1.00 0.00 O ATOM 0 H ASP A 39 11.662 2.414 11.895 1.00 0.00 H new ATOM 0 HA ASP A 39 14.385 3.239 11.481 1.00 0.00 H new ATOM 0 HB2 ASP A 39 13.013 0.518 11.770 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.748 0.761 11.774 1.00 0.00 H new ATOM 605 N VAL A 40 12.696 2.253 8.930 1.00 0.00 N ATOM 606 CA VAL A 40 12.785 2.113 7.481 1.00 0.00 C ATOM 607 C VAL A 40 12.218 3.349 6.798 1.00 0.00 C ATOM 608 O VAL A 40 11.260 3.960 7.267 1.00 0.00 O ATOM 609 CB VAL A 40 12.095 0.837 6.984 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.698 -0.401 7.654 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.585 0.860 7.216 1.00 0.00 C ATOM 0 H VAL A 40 11.747 2.383 9.280 1.00 0.00 H new ATOM 0 HA VAL A 40 13.839 2.022 7.218 1.00 0.00 H new ATOM 0 HB VAL A 40 12.265 0.791 5.908 1.00 0.00 H new ATOM 0 HG11 VAL A 40 12.194 -1.295 7.287 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.761 -0.461 7.418 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.569 -0.329 8.734 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.146 -0.067 6.846 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.382 0.957 8.283 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.148 1.706 6.685 1.00 0.00 H new ATOM 621 N ALA A 41 12.828 3.713 5.669 1.00 0.00 N ATOM 622 CA ALA A 41 12.473 4.902 4.917 1.00 0.00 C ATOM 623 C ALA A 41 11.105 4.745 4.261 1.00 0.00 C ATOM 624 O ALA A 41 10.735 3.655 3.828 1.00 0.00 O ATOM 625 CB ALA A 41 13.540 5.152 3.850 1.00 0.00 C ATOM 0 H ALA A 41 13.591 3.179 5.252 1.00 0.00 H new ATOM 0 HA ALA A 41 12.422 5.751 5.599 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.282 6.044 3.279 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.508 5.296 4.330 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.592 4.294 3.179 1.00 0.00 H new ATOM 631 N VAL A 42 10.357 5.850 4.188 1.00 0.00 N ATOM 632 CA VAL A 42 9.051 5.909 3.544 1.00 0.00 C ATOM 633 C VAL A 42 8.875 7.313 2.971 1.00 0.00 C ATOM 634 O VAL A 42 8.783 8.272 3.734 1.00 0.00 O ATOM 635 CB VAL A 42 7.944 5.619 4.569 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.573 5.690 3.904 1.00 0.00 C ATOM 637 CG2 VAL A 42 8.076 4.228 5.187 1.00 0.00 C ATOM 0 H VAL A 42 10.652 6.743 4.584 1.00 0.00 H new ATOM 0 HA VAL A 42 8.986 5.163 2.752 1.00 0.00 H new ATOM 0 HB VAL A 42 8.047 6.373 5.349 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.799 5.482 4.643 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.421 6.687 3.489 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.518 4.952 3.104 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.271 4.071 5.905 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.015 3.474 4.402 1.00 0.00 H new ATOM 0 HG23 VAL A 42 9.037 4.145 5.696 1.00 0.00 H new ATOM 647 N HIS A 43 8.828 7.422 1.640 1.00 0.00 N ATOM 648 CA HIS A 43 8.725 8.693 0.923 1.00 0.00 C ATOM 649 C HIS A 43 8.000 8.493 -0.407 1.00 0.00 C ATOM 650 O HIS A 43 7.797 7.355 -0.827 1.00 0.00 O ATOM 651 CB HIS A 43 10.131 9.226 0.614 1.00 0.00 C ATOM 652 CG HIS A 43 10.987 9.482 1.827 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.130 10.716 2.465 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.748 8.549 2.471 1.00 0.00 C ATOM 655 CE1 HIS A 43 11.984 10.491 3.482 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.364 9.203 3.511 1.00 0.00 N ATOM 0 H HIS A 43 8.861 6.613 1.020 1.00 0.00 H new ATOM 0 HA HIS A 43 8.174 9.395 1.549 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.642 8.511 -0.031 1.00 0.00 H new ATOM 0 HB3 HIS A 43 10.037 10.154 0.050 1.00 0.00 H new ATOM 0 HD2 HIS A 43 11.846 7.505 2.214 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.318 11.244 4.180 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.000 8.783 4.188 1.00 0.00 H new ATOM 664 N ARG A 44 7.608 9.584 -1.082 1.00 0.00 N ATOM 665 CA ARG A 44 6.997 9.458 -2.400 1.00 0.00 C ATOM 666 C ARG A 44 8.068 9.423 -3.482 1.00 0.00 C ATOM 667 O ARG A 44 9.170 9.923 -3.275 1.00 0.00 O ATOM 668 CB ARG A 44 5.953 10.557 -2.645 1.00 0.00 C ATOM 669 CG ARG A 44 6.444 11.910 -3.163 1.00 0.00 C ATOM 670 CD ARG A 44 6.956 12.853 -2.083 1.00 0.00 C ATOM 671 NE ARG A 44 7.066 14.210 -2.625 1.00 0.00 N ATOM 672 CZ ARG A 44 6.984 15.327 -1.896 1.00 0.00 C ATOM 673 NH1 ARG A 44 6.828 15.273 -0.577 1.00 0.00 N ATOM 674 NH2 ARG A 44 7.057 16.518 -2.482 1.00 0.00 N ATOM 0 H ARG A 44 7.703 10.541 -0.741 1.00 0.00 H new ATOM 0 HA ARG A 44 6.459 8.511 -2.441 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.223 10.172 -3.357 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.424 10.730 -1.708 1.00 0.00 H new ATOM 0 HG2 ARG A 44 7.241 11.740 -3.886 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.628 12.398 -3.696 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.279 12.846 -1.229 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.927 12.515 -1.722 1.00 0.00 H new ATOM 0 HE ARG A 44 7.216 14.309 -3.629 1.00 0.00 H new ATOM 0 HH11 ARG A 44 6.769 14.370 -0.107 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.767 16.135 -0.035 1.00 0.00 H new ATOM 0 HH21 ARG A 44 7.176 16.583 -3.493 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.994 17.367 -1.921 1.00 0.00 H new ATOM 688 N GLU A 45 7.757 8.834 -4.642 1.00 0.00 N ATOM 689 CA GLU A 45 8.747 8.656 -5.703 1.00 0.00 C ATOM 690 C GLU A 45 9.208 9.988 -6.286 1.00 0.00 C ATOM 691 O GLU A 45 10.297 10.062 -6.850 1.00 0.00 O ATOM 692 CB GLU A 45 8.220 7.701 -6.782 1.00 0.00 C ATOM 693 CG GLU A 45 6.896 8.127 -7.425 1.00 0.00 C ATOM 694 CD GLU A 45 7.007 9.395 -8.261 1.00 0.00 C ATOM 695 OE1 GLU A 45 7.908 9.447 -9.127 1.00 0.00 O ATOM 696 OE2 GLU A 45 6.181 10.307 -8.027 1.00 0.00 O ATOM 0 H GLU A 45 6.829 8.474 -4.867 1.00 0.00 H new ATOM 0 HA GLU A 45 9.631 8.197 -5.260 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.974 7.607 -7.564 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.092 6.712 -6.341 1.00 0.00 H new ATOM 0 HG2 GLU A 45 6.530 7.317 -8.055 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.154 8.282 -6.642 1.00 0.00 H new ATOM 703 N GLU A 46 8.393 11.037 -6.160 1.00 0.00 N ATOM 704 CA GLU A 46 8.744 12.366 -6.646 1.00 0.00 C ATOM 705 C GLU A 46 9.913 12.945 -5.845 1.00 0.00 C ATOM 706 O GLU A 46 10.463 13.986 -6.200 1.00 0.00 O ATOM 707 CB GLU A 46 7.503 13.263 -6.542 1.00 0.00 C ATOM 708 CG GLU A 46 7.656 14.595 -7.281 1.00 0.00 C ATOM 709 CD GLU A 46 7.847 14.386 -8.781 1.00 0.00 C ATOM 710 OE1 GLU A 46 6.818 14.238 -9.477 1.00 0.00 O ATOM 711 OE2 GLU A 46 9.017 14.371 -9.225 1.00 0.00 O ATOM 0 H GLU A 46 7.475 10.986 -5.719 1.00 0.00 H new ATOM 0 HA GLU A 46 9.065 12.308 -7.686 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.642 12.729 -6.944 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.293 13.460 -5.491 1.00 0.00 H new ATOM 0 HG2 GLU A 46 6.774 15.211 -7.108 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.509 15.140 -6.877 1.00 0.00 H new ATOM 718 N ILE A 47 10.299 12.270 -4.755 1.00 0.00 N ATOM 719 CA ILE A 47 11.359 12.728 -3.876 1.00 0.00 C ATOM 720 C ILE A 47 12.314 11.599 -3.508 1.00 0.00 C ATOM 721 O ILE A 47 13.480 11.862 -3.228 1.00 0.00 O ATOM 722 CB ILE A 47 10.721 13.353 -2.625 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.462 14.843 -2.879 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.573 13.154 -1.372 1.00 0.00 C ATOM 725 CD1 ILE A 47 10.087 15.564 -1.584 1.00 0.00 C ATOM 0 H ILE A 47 9.877 11.388 -4.465 1.00 0.00 H new ATOM 0 HA ILE A 47 11.957 13.477 -4.394 1.00 0.00 H new ATOM 0 HB ILE A 47 9.777 12.842 -2.437 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.352 15.302 -3.310 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.660 14.957 -3.608 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.077 13.614 -0.518 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.702 12.088 -1.185 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.549 13.618 -1.518 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.909 16.619 -1.793 1.00 0.00 H new ATOM 0 HD12 ILE A 47 9.183 15.119 -1.168 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.901 15.469 -0.866 1.00 0.00 H new ATOM 737 N TYR A 48 11.866 10.344 -3.495 1.00 0.00 N ATOM 738 CA TYR A 48 12.744 9.266 -3.070 1.00 0.00 C ATOM 739 C TYR A 48 13.944 9.152 -3.999 1.00 0.00 C ATOM 740 O TYR A 48 15.040 8.790 -3.578 1.00 0.00 O ATOM 741 CB TYR A 48 11.976 7.952 -3.026 1.00 0.00 C ATOM 742 CG TYR A 48 12.864 6.817 -2.583 1.00 0.00 C ATOM 743 CD1 TYR A 48 13.597 6.097 -3.536 1.00 0.00 C ATOM 744 CD2 TYR A 48 12.967 6.497 -1.225 1.00 0.00 C ATOM 745 CE1 TYR A 48 14.439 5.052 -3.138 1.00 0.00 C ATOM 746 CE2 TYR A 48 13.806 5.453 -0.814 1.00 0.00 C ATOM 747 CZ TYR A 48 14.533 4.714 -1.771 1.00 0.00 C ATOM 748 OH TYR A 48 15.329 3.675 -1.380 1.00 0.00 O ATOM 0 H TYR A 48 10.925 10.058 -3.767 1.00 0.00 H new ATOM 0 HA TYR A 48 13.111 9.491 -2.068 1.00 0.00 H new ATOM 0 HB2 TYR A 48 11.131 8.044 -2.344 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.567 7.734 -4.012 1.00 0.00 H new ATOM 0 HD1 TYR A 48 13.512 6.350 -4.583 1.00 0.00 H new ATOM 0 HD2 TYR A 48 12.400 7.054 -0.494 1.00 0.00 H new ATOM 0 HE1 TYR A 48 15.013 4.508 -3.873 1.00 0.00 H new ATOM 0 HE2 TYR A 48 13.896 5.214 0.235 1.00 0.00 H new ATOM 0 HH TYR A 48 15.282 3.575 -0.406 1.00 0.00 H new ATOM 758 N GLN A 49 13.728 9.472 -5.277 1.00 0.00 N ATOM 759 CA GLN A 49 14.761 9.405 -6.292 1.00 0.00 C ATOM 760 C GLN A 49 15.751 10.557 -6.136 1.00 0.00 C ATOM 761 O GLN A 49 16.804 10.560 -6.769 1.00 0.00 O ATOM 762 CB GLN A 49 14.090 9.425 -7.668 1.00 0.00 C ATOM 763 CG GLN A 49 13.067 8.285 -7.736 1.00 0.00 C ATOM 764 CD GLN A 49 12.365 8.229 -9.086 1.00 0.00 C ATOM 765 OE1 GLN A 49 12.946 7.813 -10.088 1.00 0.00 O ATOM 766 NE2 GLN A 49 11.104 8.652 -9.129 1.00 0.00 N ATOM 0 H GLN A 49 12.824 9.786 -5.630 1.00 0.00 H new ATOM 0 HA GLN A 49 15.331 8.482 -6.183 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.598 10.384 -7.834 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.837 9.309 -8.454 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.569 7.336 -7.549 1.00 0.00 H new ATOM 0 HG3 GLN A 49 12.326 8.415 -6.947 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.651 8.991 -8.281 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.591 8.637 -10.010 1.00 0.00 H new ATOM 775 N ARG A 50 15.416 11.538 -5.290 1.00 0.00 N ATOM 776 CA ARG A 50 16.295 12.651 -4.964 1.00 0.00 C ATOM 777 C ARG A 50 17.020 12.397 -3.646 1.00 0.00 C ATOM 778 O ARG A 50 18.110 12.921 -3.435 1.00 0.00 O ATOM 779 CB ARG A 50 15.485 13.955 -4.951 1.00 0.00 C ATOM 780 CG ARG A 50 15.194 14.493 -3.546 1.00 0.00 C ATOM 781 CD ARG A 50 14.226 15.675 -3.632 1.00 0.00 C ATOM 782 NE ARG A 50 14.847 16.832 -4.289 1.00 0.00 N ATOM 783 CZ ARG A 50 14.215 17.989 -4.506 1.00 0.00 C ATOM 784 NH1 ARG A 50 12.955 18.168 -4.123 1.00 0.00 N ATOM 785 NH2 ARG A 50 14.854 18.985 -5.112 1.00 0.00 N ATOM 0 H ARG A 50 14.516 11.576 -4.811 1.00 0.00 H new ATOM 0 HA ARG A 50 17.067 12.747 -5.727 1.00 0.00 H new ATOM 0 HB2 ARG A 50 16.028 14.714 -5.514 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.540 13.789 -5.468 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.766 13.705 -2.927 1.00 0.00 H new ATOM 0 HG3 ARG A 50 16.122 14.806 -3.067 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.334 15.377 -4.184 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.902 15.955 -2.630 1.00 0.00 H new ATOM 0 HE ARG A 50 15.816 16.748 -4.597 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.453 17.414 -3.654 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.490 19.059 -4.298 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.822 18.864 -5.409 1.00 0.00 H new ATOM 0 HH22 ARG A 50 14.376 19.870 -5.280 1.00 0.00 H new ATOM 799 N ILE A 51 16.418 11.596 -2.757 1.00 0.00 N ATOM 800 CA ILE A 51 17.032 11.226 -1.488 1.00 0.00 C ATOM 801 C ILE A 51 18.173 10.257 -1.752 1.00 0.00 C ATOM 802 O ILE A 51 19.289 10.443 -1.268 1.00 0.00 O ATOM 803 CB ILE A 51 15.987 10.555 -0.590 1.00 0.00 C ATOM 804 CG1 ILE A 51 14.906 11.564 -0.203 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.610 10.004 0.692 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.735 10.872 0.486 1.00 0.00 C ATOM 0 H ILE A 51 15.494 11.190 -2.903 1.00 0.00 H new ATOM 0 HA ILE A 51 17.414 12.117 -0.991 1.00 0.00 H new ATOM 0 HB ILE A 51 15.559 9.729 -1.157 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.329 12.319 0.460 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.553 12.084 -1.094 1.00 0.00 H new ATOM 0 HG21 ILE A 51 15.836 9.537 1.301 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.369 9.264 0.439 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.070 10.818 1.252 1.00 0.00 H new ATOM 0 HD11 ILE A 51 12.980 11.612 0.751 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.300 10.135 -0.189 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.087 10.374 1.389 1.00 0.00 H new ATOM 818 N GLN A 52 17.886 9.212 -2.529 1.00 0.00 N ATOM 819 CA GLN A 52 18.846 8.158 -2.816 1.00 0.00 C ATOM 820 C GLN A 52 19.915 8.629 -3.795 1.00 0.00 C ATOM 821 O GLN A 52 20.748 7.836 -4.231 1.00 0.00 O ATOM 822 CB GLN A 52 18.101 6.909 -3.303 1.00 0.00 C ATOM 823 CG GLN A 52 17.193 6.397 -2.187 1.00 0.00 C ATOM 824 CD GLN A 52 17.916 6.352 -0.843 1.00 0.00 C ATOM 825 OE1 GLN A 52 18.943 5.691 -0.693 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.382 7.062 0.143 1.00 0.00 N ATOM 0 H GLN A 52 16.979 9.077 -2.975 1.00 0.00 H new ATOM 0 HA GLN A 52 19.379 7.895 -1.902 1.00 0.00 H new ATOM 0 HB2 GLN A 52 17.511 7.145 -4.188 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.813 6.136 -3.592 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.317 7.041 -2.107 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.833 5.400 -2.440 1.00 0.00 H new ATOM 0 HE21 GLN A 52 16.529 7.598 -0.018 1.00 0.00 H new ATOM 0 HE22 GLN A 52 17.824 7.072 1.062 1.00 0.00 H new ATOM 835 N ALA A 53 19.898 9.916 -4.150 1.00 0.00 N ATOM 836 CA ALA A 53 20.900 10.480 -5.031 1.00 0.00 C ATOM 837 C ALA A 53 22.255 10.588 -4.324 1.00 0.00 C ATOM 838 O ALA A 53 23.284 10.698 -4.991 1.00 0.00 O ATOM 839 CB ALA A 53 20.437 11.855 -5.509 1.00 0.00 C ATOM 0 H ALA A 53 19.194 10.583 -3.834 1.00 0.00 H new ATOM 0 HA ALA A 53 21.025 9.820 -5.890 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.189 12.282 -6.172 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.494 11.755 -6.047 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.297 12.511 -4.650 1.00 0.00 H new ATOM 845 N GLY A 54 22.266 10.561 -2.985 1.00 0.00 N ATOM 846 CA GLY A 54 23.500 10.634 -2.215 1.00 0.00 C ATOM 847 C GLY A 54 23.377 11.570 -1.012 1.00 0.00 C ATOM 848 O GLY A 54 24.390 11.982 -0.450 1.00 0.00 O ATOM 0 H GLY A 54 21.423 10.488 -2.415 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.770 9.636 -1.870 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.309 10.978 -2.860 1.00 0.00 H new ATOM 852 N LEU A 55 22.148 11.906 -0.617 1.00 0.00 N ATOM 853 CA LEU A 55 21.879 12.870 0.441 1.00 0.00 C ATOM 854 C LEU A 55 20.755 12.385 1.357 1.00 0.00 C ATOM 855 O LEU A 55 20.305 11.246 1.244 1.00 0.00 O ATOM 856 CB LEU A 55 21.541 14.213 -0.215 1.00 0.00 C ATOM 857 CG LEU A 55 20.368 14.132 -1.202 1.00 0.00 C ATOM 858 CD1 LEU A 55 19.020 13.973 -0.502 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.336 15.417 -2.024 1.00 0.00 C ATOM 0 H LEU A 55 21.304 11.509 -1.030 1.00 0.00 H new ATOM 0 HA LEU A 55 22.758 12.987 1.074 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.302 14.939 0.562 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.422 14.585 -0.739 1.00 0.00 H new ATOM 0 HG LEU A 55 20.523 13.253 -1.827 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.227 13.921 -1.248 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.023 13.057 0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 55 18.847 14.827 0.153 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.508 15.376 -2.731 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.204 16.271 -1.359 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.274 15.523 -2.569 1.00 0.00 H new ATOM 871 N THR A 56 20.300 13.251 2.267 1.00 0.00 N ATOM 872 CA THR A 56 19.203 12.938 3.178 1.00 0.00 C ATOM 873 C THR A 56 18.276 14.147 3.309 1.00 0.00 C ATOM 874 O THR A 56 18.569 15.220 2.785 1.00 0.00 O ATOM 875 CB THR A 56 19.759 12.502 4.534 1.00 0.00 C ATOM 876 OG1 THR A 56 20.564 13.522 5.084 1.00 0.00 O ATOM 877 CG2 THR A 56 20.606 11.237 4.372 1.00 0.00 C ATOM 0 H THR A 56 20.684 14.188 2.390 1.00 0.00 H new ATOM 0 HA THR A 56 18.618 12.110 2.777 1.00 0.00 H new ATOM 0 HB THR A 56 18.920 12.301 5.200 1.00 0.00 H new ATOM 0 HG1 THR A 56 20.912 13.231 5.953 1.00 0.00 H new ATOM 0 HG21 THR A 56 20.998 10.934 5.343 1.00 0.00 H new ATOM 0 HG22 THR A 56 19.989 10.436 3.964 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.435 11.439 3.693 1.00 0.00 H new ATOM 885 N ALA A 57 17.149 13.974 4.011 1.00 0.00 N ATOM 886 CA ALA A 57 16.127 15.002 4.143 1.00 0.00 C ATOM 887 C ALA A 57 16.694 16.324 4.676 1.00 0.00 C ATOM 888 O ALA A 57 17.603 16.325 5.506 1.00 0.00 O ATOM 889 CB ALA A 57 15.037 14.492 5.077 1.00 0.00 C ATOM 0 H ALA A 57 16.926 13.109 4.504 1.00 0.00 H new ATOM 0 HA ALA A 57 15.721 15.206 3.152 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.264 15.253 5.185 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.597 13.585 4.662 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.468 14.272 6.054 1.00 0.00 H new ATOM 895 N PRO A 58 16.148 17.450 4.203 1.00 0.00 N ATOM 896 CA PRO A 58 16.510 18.789 4.625 1.00 0.00 C ATOM 897 C PRO A 58 15.722 19.192 5.865 1.00 0.00 C ATOM 898 O PRO A 58 14.806 18.492 6.301 1.00 0.00 O ATOM 899 CB PRO A 58 16.103 19.673 3.448 1.00 0.00 C ATOM 900 CG PRO A 58 14.830 18.988 2.950 1.00 0.00 C ATOM 901 CD PRO A 58 15.113 17.504 3.186 1.00 0.00 C ATOM 0 HA PRO A 58 17.567 18.871 4.878 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.917 20.701 3.757 1.00 0.00 H new ATOM 0 HB3 PRO A 58 16.874 19.706 2.679 1.00 0.00 H new ATOM 0 HG2 PRO A 58 13.951 19.322 3.501 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.645 19.200 1.897 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.214 16.983 3.516 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.443 17.019 2.267 1.00 0.00 H new ATOM 909 N ASP A 59 16.094 20.339 6.432 1.00 0.00 N ATOM 910 CA ASP A 59 15.370 20.962 7.520 1.00 0.00 C ATOM 911 C ASP A 59 14.012 21.470 7.021 1.00 0.00 C ATOM 912 O ASP A 59 13.806 21.629 5.819 1.00 0.00 O ATOM 913 CB ASP A 59 16.239 22.107 8.032 1.00 0.00 C ATOM 914 CG ASP A 59 15.510 22.948 9.077 1.00 0.00 C ATOM 915 OD1 ASP A 59 15.590 22.581 10.270 1.00 0.00 O ATOM 916 OD2 ASP A 59 14.879 23.948 8.669 1.00 0.00 O ATOM 0 H ASP A 59 16.919 20.862 6.139 1.00 0.00 H new ATOM 0 HA ASP A 59 15.170 20.255 8.325 1.00 0.00 H new ATOM 0 HB2 ASP A 59 17.154 21.703 8.464 1.00 0.00 H new ATOM 0 HB3 ASP A 59 16.534 22.741 7.196 1.00 0.00 H new ATOM 1635 N MET C 1 1.758 6.254 11.988 1.00 0.00 N ATOM 1636 CA MET C 1 1.351 6.248 10.570 1.00 0.00 C ATOM 1637 C MET C 1 1.931 7.453 9.840 1.00 0.00 C ATOM 1638 O MET C 1 2.052 8.530 10.423 1.00 0.00 O ATOM 1639 CB MET C 1 -0.176 6.258 10.433 1.00 0.00 C ATOM 1640 CG MET C 1 -0.589 5.875 9.009 1.00 0.00 C ATOM 1641 SD MET C 1 -2.336 6.117 8.606 1.00 0.00 S ATOM 1642 CE MET C 1 -3.082 5.389 10.081 1.00 0.00 C ATOM 0 H1 MET C 1 2.458 5.503 12.151 1.00 0.00 H new ATOM 0 H2 MET C 1 2.177 7.176 12.225 1.00 0.00 H new ATOM 0 H3 MET C 1 0.926 6.088 12.589 1.00 0.00 H new ATOM 0 HA MET C 1 1.738 5.333 10.122 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.616 5.560 11.146 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.562 7.248 10.676 1.00 0.00 H new ATOM 0 HG2 MET C 1 0.010 6.456 8.308 1.00 0.00 H new ATOM 0 HG3 MET C 1 -0.340 4.826 8.848 1.00 0.00 H new ATOM 0 HE1 MET C 1 -4.145 5.222 9.907 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.597 4.438 10.303 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.955 6.067 10.925 1.00 0.00 H new ATOM 1654 N LEU C 2 2.285 7.268 8.568 1.00 0.00 N ATOM 1655 CA LEU C 2 2.761 8.336 7.701 1.00 0.00 C ATOM 1656 C LEU C 2 1.791 8.403 6.519 1.00 0.00 C ATOM 1657 O LEU C 2 1.838 7.565 5.619 1.00 0.00 O ATOM 1658 CB LEU C 2 4.210 8.035 7.286 1.00 0.00 C ATOM 1659 CG LEU C 2 4.971 9.194 6.615 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.950 8.618 5.596 1.00 0.00 C ATOM 1661 CD2 LEU C 2 4.096 10.226 5.913 1.00 0.00 C ATOM 0 H LEU C 2 2.247 6.358 8.109 1.00 0.00 H new ATOM 0 HA LEU C 2 2.781 9.309 8.192 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.765 7.726 8.172 1.00 0.00 H new ATOM 0 HB3 LEU C 2 4.203 7.186 6.602 1.00 0.00 H new ATOM 0 HG LEU C 2 5.470 9.724 7.426 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.494 9.431 5.115 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.655 7.958 6.102 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.401 8.053 4.843 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.726 10.999 5.474 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.518 9.739 5.127 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.417 10.679 6.635 1.00 0.00 H new ATOM 1673 N ILE C 3 0.910 9.405 6.532 1.00 0.00 N ATOM 1674 CA ILE C 3 -0.112 9.596 5.514 1.00 0.00 C ATOM 1675 C ILE C 3 0.438 10.421 4.360 1.00 0.00 C ATOM 1676 O ILE C 3 1.324 11.253 4.547 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.336 10.296 6.125 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.083 9.349 7.073 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.341 10.720 5.050 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.518 9.369 8.490 1.00 0.00 C ATOM 0 H ILE C 3 0.890 10.115 7.264 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.413 8.620 5.133 1.00 0.00 H new ATOM 0 HB ILE C 3 -0.955 11.170 6.654 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.137 9.627 7.102 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -2.032 8.334 6.680 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.192 11.211 5.521 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.862 11.411 4.356 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.685 9.840 4.506 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.084 8.681 9.117 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.472 9.063 8.469 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -1.593 10.377 8.898 1.00 0.00 H new ATOM 1692 N LEU C 4 -0.103 10.175 3.164 1.00 0.00 N ATOM 1693 CA LEU C 4 0.216 10.910 1.955 1.00 0.00 C ATOM 1694 C LEU C 4 -1.047 10.984 1.098 1.00 0.00 C ATOM 1695 O LEU C 4 -2.031 10.289 1.352 1.00 0.00 O ATOM 1696 CB LEU C 4 1.335 10.200 1.185 1.00 0.00 C ATOM 1697 CG LEU C 4 2.661 10.152 1.953 1.00 0.00 C ATOM 1698 CD1 LEU C 4 3.660 9.289 1.194 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.274 11.545 2.092 1.00 0.00 C ATOM 0 H LEU C 4 -0.792 9.438 3.015 1.00 0.00 H new ATOM 0 HA LEU C 4 0.560 11.913 2.205 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.019 9.183 0.954 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.492 10.709 0.234 1.00 0.00 H new ATOM 0 HG LEU C 4 2.452 9.743 2.941 1.00 0.00 H new ATOM 0 HD11 LEU C 4 4.602 9.256 1.741 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.264 8.279 1.092 1.00 0.00 H new ATOM 0 HD13 LEU C 4 3.830 9.714 0.205 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.213 11.476 2.641 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.462 11.960 1.102 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.584 12.194 2.632 1.00 0.00 H new ATOM 1711 N THR C 5 -1.005 11.834 0.074 1.00 0.00 N ATOM 1712 CA THR C 5 -2.119 12.033 -0.837 1.00 0.00 C ATOM 1713 C THR C 5 -1.579 11.886 -2.250 1.00 0.00 C ATOM 1714 O THR C 5 -0.604 12.543 -2.614 1.00 0.00 O ATOM 1715 CB THR C 5 -2.739 13.411 -0.583 1.00 0.00 C ATOM 1716 OG1 THR C 5 -3.205 13.456 0.748 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.917 13.703 -1.505 1.00 0.00 C ATOM 0 H THR C 5 -0.189 12.406 -0.144 1.00 0.00 H new ATOM 0 HA THR C 5 -2.910 11.299 -0.686 1.00 0.00 H new ATOM 0 HB THR C 5 -1.968 14.157 -0.774 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.603 14.334 0.926 1.00 0.00 H new ATOM 0 HG21 THR C 5 -4.318 14.692 -1.281 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.583 13.673 -2.542 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.694 12.954 -1.352 1.00 0.00 H new ATOM 1725 N ARG C 6 -2.208 11.024 -3.051 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.693 10.666 -4.366 1.00 0.00 C ATOM 1727 C ARG C 6 -2.844 10.566 -5.357 1.00 0.00 C ATOM 1728 O ARG C 6 -4.006 10.663 -4.967 1.00 0.00 O ATOM 1729 CB ARG C 6 -0.903 9.355 -4.279 1.00 0.00 C ATOM 1730 CG ARG C 6 0.301 9.497 -3.339 1.00 0.00 C ATOM 1731 CD ARG C 6 1.318 10.532 -3.834 1.00 0.00 C ATOM 1732 NE ARG C 6 2.282 9.936 -4.763 1.00 0.00 N ATOM 1733 CZ ARG C 6 3.183 10.630 -5.462 1.00 0.00 C ATOM 1734 NH1 ARG C 6 3.193 11.956 -5.443 1.00 0.00 N ATOM 1735 NH2 ARG C 6 4.090 9.988 -6.193 1.00 0.00 N ATOM 0 H ARG C 6 -3.082 10.559 -2.805 1.00 0.00 H new ATOM 0 HA ARG C 6 -1.012 11.440 -4.719 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -1.555 8.557 -3.922 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -0.560 9.067 -5.273 1.00 0.00 H new ATOM 0 HG2 ARG C 6 -0.049 9.783 -2.347 1.00 0.00 H new ATOM 0 HG3 ARG C 6 0.793 8.530 -3.237 1.00 0.00 H new ATOM 0 HD2 ARG C 6 0.794 11.351 -4.327 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.848 10.959 -2.983 1.00 0.00 H new ATOM 0 HE ARG C 6 2.263 8.923 -4.884 1.00 0.00 H new ATOM 0 HH11 ARG C 6 2.504 12.463 -4.888 1.00 0.00 H new ATOM 0 HH12 ARG C 6 3.890 12.469 -5.984 1.00 0.00 H new ATOM 0 HH21 ARG C 6 4.096 8.968 -6.218 1.00 0.00 H new ATOM 0 HH22 ARG C 6 4.780 10.515 -6.728 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.523 10.372 -6.634 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.522 10.361 -7.690 1.00 0.00 C ATOM 1751 C LYS C 7 -3.305 9.145 -8.579 1.00 0.00 C ATOM 1752 O LYS C 7 -2.204 8.602 -8.630 1.00 0.00 O ATOM 1753 CB LYS C 7 -3.437 11.675 -8.478 1.00 0.00 C ATOM 1754 CG LYS C 7 -3.172 12.864 -7.543 1.00 0.00 C ATOM 1755 CD LYS C 7 -3.255 14.195 -8.284 1.00 0.00 C ATOM 1756 CE LYS C 7 -2.532 15.259 -7.450 1.00 0.00 C ATOM 1757 NZ LYS C 7 -2.535 16.568 -8.125 1.00 0.00 N ATOM 0 H LYS C 7 -1.569 10.219 -6.960 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.525 10.288 -7.269 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.641 11.607 -9.220 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -4.367 11.837 -9.023 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -3.897 12.855 -6.729 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -2.185 12.759 -7.092 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -2.797 14.110 -9.269 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -4.296 14.478 -8.440 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -3.014 15.349 -6.477 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -1.504 14.944 -7.269 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -2.038 17.265 -7.534 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -2.053 16.486 -9.043 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -3.516 16.879 -8.275 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.357 8.720 -9.276 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.309 7.526 -10.116 1.00 0.00 C ATOM 1773 C VAL C 8 -3.104 7.576 -11.054 1.00 0.00 C ATOM 1774 O VAL C 8 -3.023 8.449 -11.918 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.615 7.415 -10.905 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.556 6.209 -11.839 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.788 7.257 -9.937 1.00 0.00 C ATOM 0 H VAL C 8 -5.262 9.191 -9.274 1.00 0.00 H new ATOM 0 HA VAL C 8 -4.198 6.643 -9.486 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.753 8.320 -11.497 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.489 6.136 -12.398 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.725 6.328 -12.534 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.412 5.301 -11.253 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.717 7.178 -10.501 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.648 6.356 -9.340 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.836 8.124 -9.279 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.172 6.635 -10.879 1.00 0.00 N ATOM 1788 CA GLY C 9 -0.990 6.510 -11.718 1.00 0.00 C ATOM 1789 C GLY C 9 0.299 6.798 -10.952 1.00 0.00 C ATOM 1790 O GLY C 9 1.380 6.440 -11.420 1.00 0.00 O ATOM 0 H GLY C 9 -2.223 5.933 -10.141 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -0.946 5.503 -12.132 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -1.071 7.198 -12.560 1.00 0.00 H new ATOM 1794 N GLU C 10 0.201 7.437 -9.783 1.00 0.00 N ATOM 1795 CA GLU C 10 1.368 7.747 -8.965 1.00 0.00 C ATOM 1796 C GLU C 10 1.807 6.531 -8.146 1.00 0.00 C ATOM 1797 O GLU C 10 1.132 5.500 -8.125 1.00 0.00 O ATOM 1798 CB GLU C 10 1.054 8.918 -8.034 1.00 0.00 C ATOM 1799 CG GLU C 10 0.849 10.204 -8.841 1.00 0.00 C ATOM 1800 CD GLU C 10 0.720 11.428 -7.936 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.107 11.284 -6.858 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.236 12.495 -8.333 1.00 0.00 O ATOM 0 H GLU C 10 -0.683 7.750 -9.383 1.00 0.00 H new ATOM 0 HA GLU C 10 2.187 8.022 -9.630 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.158 8.699 -7.454 1.00 0.00 H new ATOM 0 HB3 GLU C 10 1.869 9.054 -7.323 1.00 0.00 H new ATOM 0 HG2 GLU C 10 1.688 10.343 -9.523 1.00 0.00 H new ATOM 0 HG3 GLU C 10 -0.047 10.109 -9.454 1.00 0.00 H new ATOM 1809 N SER C 11 2.949 6.666 -7.465 1.00 0.00 N ATOM 1810 CA SER C 11 3.537 5.603 -6.657 1.00 0.00 C ATOM 1811 C SER C 11 4.177 6.163 -5.390 1.00 0.00 C ATOM 1812 O SER C 11 4.342 7.374 -5.253 1.00 0.00 O ATOM 1813 CB SER C 11 4.587 4.860 -7.484 1.00 0.00 C ATOM 1814 OG SER C 11 3.982 4.237 -8.602 1.00 0.00 O ATOM 0 H SER C 11 3.494 7.528 -7.462 1.00 0.00 H new ATOM 0 HA SER C 11 2.745 4.916 -6.359 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.355 5.557 -7.819 1.00 0.00 H new ATOM 0 HB3 SER C 11 5.083 4.111 -6.866 1.00 0.00 H new ATOM 0 HG SER C 11 4.665 3.766 -9.124 1.00 0.00 H new ATOM 1820 N ILE C 12 4.536 5.267 -4.465 1.00 0.00 N ATOM 1821 CA ILE C 12 5.179 5.567 -3.192 1.00 0.00 C ATOM 1822 C ILE C 12 6.264 4.513 -2.973 1.00 0.00 C ATOM 1823 O ILE C 12 6.261 3.490 -3.653 1.00 0.00 O ATOM 1824 CB ILE C 12 4.126 5.540 -2.067 1.00 0.00 C ATOM 1825 CG1 ILE C 12 3.042 6.607 -2.270 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.754 5.737 -0.683 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.599 8.031 -2.200 1.00 0.00 C ATOM 0 H ILE C 12 4.377 4.268 -4.594 1.00 0.00 H new ATOM 0 HA ILE C 12 5.630 6.559 -3.192 1.00 0.00 H new ATOM 0 HB ILE C 12 3.671 4.551 -2.115 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.564 6.455 -3.238 1.00 0.00 H new ATOM 0 HG13 ILE C 12 2.270 6.485 -1.510 1.00 0.00 H new ATOM 0 HG21 ILE C 12 3.974 5.711 0.078 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.473 4.940 -0.493 1.00 0.00 H new ATOM 0 HG23 ILE C 12 5.262 6.701 -0.648 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.790 8.746 -2.350 1.00 0.00 H new ATOM 0 HD12 ILE C 12 4.053 8.197 -1.223 1.00 0.00 H new ATOM 0 HD13 ILE C 12 4.351 8.166 -2.977 1.00 0.00 H new ATOM 1839 N ASN C 13 7.195 4.739 -2.042 1.00 0.00 N ATOM 1840 CA ASN C 13 8.305 3.823 -1.840 1.00 0.00 C ATOM 1841 C ASN C 13 8.564 3.579 -0.354 1.00 0.00 C ATOM 1842 O ASN C 13 8.324 4.456 0.478 1.00 0.00 O ATOM 1843 CB ASN C 13 9.534 4.414 -2.534 1.00 0.00 C ATOM 1844 CG ASN C 13 10.648 3.391 -2.668 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.417 3.163 -1.735 1.00 0.00 O ATOM 1846 ND2 ASN C 13 10.742 2.765 -3.836 1.00 0.00 N ATOM 0 H ASN C 13 7.196 5.548 -1.421 1.00 0.00 H new ATOM 0 HA ASN C 13 8.068 2.850 -2.271 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.254 4.779 -3.522 1.00 0.00 H new ATOM 0 HB3 ASN C 13 9.894 5.273 -1.968 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.471 2.067 -3.983 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.085 2.982 -4.585 1.00 0.00 H new ATOM 1853 N ILE C 14 9.058 2.379 -0.029 1.00 0.00 N ATOM 1854 CA ILE C 14 9.339 1.958 1.337 1.00 0.00 C ATOM 1855 C ILE C 14 10.647 1.166 1.372 1.00 0.00 C ATOM 1856 O ILE C 14 10.989 0.474 0.414 1.00 0.00 O ATOM 1857 CB ILE C 14 8.187 1.085 1.871 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.861 1.853 1.812 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.486 0.626 3.303 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.688 1.006 2.312 1.00 0.00 C ATOM 0 H ILE C 14 9.275 1.665 -0.724 1.00 0.00 H new ATOM 0 HA ILE C 14 9.434 2.842 1.968 1.00 0.00 H new ATOM 0 HB ILE C 14 8.097 0.201 1.239 1.00 0.00 H new ATOM 0 HG12 ILE C 14 6.938 2.758 2.415 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.670 2.169 0.786 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.663 0.010 3.667 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.407 0.044 3.314 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.600 1.497 3.948 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.768 1.588 2.253 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.593 0.114 1.693 1.00 0.00 H new ATOM 0 HD13 ILE C 14 5.866 0.712 3.346 1.00 0.00 H new ATOM 1872 N GLY C 15 11.380 1.267 2.487 1.00 0.00 N ATOM 1873 CA GLY C 15 12.624 0.541 2.664 1.00 0.00 C ATOM 1874 C GLY C 15 13.609 0.898 1.554 1.00 0.00 C ATOM 1875 O GLY C 15 13.786 2.071 1.231 1.00 0.00 O ATOM 0 H GLY C 15 11.122 1.852 3.282 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.058 0.780 3.635 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.431 -0.532 2.657 1.00 0.00 H new ATOM 1879 N ASP C 16 14.246 -0.123 0.973 1.00 0.00 N ATOM 1880 CA ASP C 16 15.209 0.054 -0.103 1.00 0.00 C ATOM 1881 C ASP C 16 14.892 -0.889 -1.269 1.00 0.00 C ATOM 1882 O ASP C 16 15.658 -0.952 -2.231 1.00 0.00 O ATOM 1883 CB ASP C 16 16.623 -0.196 0.429 1.00 0.00 C ATOM 1884 CG ASP C 16 17.002 0.796 1.525 1.00 0.00 C ATOM 1885 OD1 ASP C 16 16.737 0.480 2.706 1.00 0.00 O ATOM 1886 OD2 ASP C 16 17.559 1.863 1.178 1.00 0.00 O ATOM 0 H ASP C 16 14.103 -1.097 1.241 1.00 0.00 H new ATOM 0 HA ASP C 16 15.147 1.077 -0.474 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.690 -1.211 0.819 1.00 0.00 H new ATOM 0 HB3 ASP C 16 17.338 -0.122 -0.391 1.00 0.00 H new ATOM 1891 N ASP C 17 13.774 -1.621 -1.198 1.00 0.00 N ATOM 1892 CA ASP C 17 13.414 -2.599 -2.219 1.00 0.00 C ATOM 1893 C ASP C 17 11.901 -2.693 -2.448 1.00 0.00 C ATOM 1894 O ASP C 17 11.466 -3.502 -3.263 1.00 0.00 O ATOM 1895 CB ASP C 17 13.947 -3.976 -1.813 1.00 0.00 C ATOM 1896 CG ASP C 17 15.473 -4.009 -1.754 1.00 0.00 C ATOM 1897 OD1 ASP C 17 16.092 -4.121 -2.836 1.00 0.00 O ATOM 1898 OD2 ASP C 17 16.007 -3.921 -0.625 1.00 0.00 O ATOM 0 H ASP C 17 13.101 -1.550 -0.435 1.00 0.00 H new ATOM 0 HA ASP C 17 13.864 -2.266 -3.154 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.541 -4.248 -0.839 1.00 0.00 H new ATOM 0 HB3 ASP C 17 13.596 -4.724 -2.524 1.00 0.00 H new ATOM 1903 N ILE C 18 11.088 -1.888 -1.749 1.00 0.00 N ATOM 1904 CA ILE C 18 9.641 -1.962 -1.880 1.00 0.00 C ATOM 1905 C ILE C 18 9.100 -0.701 -2.539 1.00 0.00 C ATOM 1906 O ILE C 18 9.554 0.405 -2.250 1.00 0.00 O ATOM 1907 CB ILE C 18 8.972 -2.146 -0.512 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.496 -3.366 0.256 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.462 -2.305 -0.705 1.00 0.00 C ATOM 1910 CD1 ILE C 18 10.699 -2.996 1.122 1.00 0.00 C ATOM 0 H ILE C 18 11.415 -1.182 -1.090 1.00 0.00 H new ATOM 0 HA ILE C 18 9.410 -2.825 -2.504 1.00 0.00 H new ATOM 0 HB ILE C 18 9.209 -1.260 0.076 1.00 0.00 H new ATOM 0 HG12 ILE C 18 8.703 -3.772 0.884 1.00 0.00 H new ATOM 0 HG13 ILE C 18 9.778 -4.149 -0.448 1.00 0.00 H new ATOM 0 HG21 ILE C 18 6.983 -2.436 0.265 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.061 -1.415 -1.190 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.265 -3.178 -1.328 1.00 0.00 H new ATOM 0 HD11 ILE C 18 11.049 -3.880 1.655 1.00 0.00 H new ATOM 0 HD12 ILE C 18 11.499 -2.613 0.489 1.00 0.00 H new ATOM 0 HD13 ILE C 18 10.408 -2.230 1.841 1.00 0.00 H new ATOM 1922 N THR C 19 8.118 -0.871 -3.429 1.00 0.00 N ATOM 1923 CA THR C 19 7.433 0.247 -4.064 1.00 0.00 C ATOM 1924 C THR C 19 5.941 -0.064 -4.127 1.00 0.00 C ATOM 1925 O THR C 19 5.556 -1.229 -4.191 1.00 0.00 O ATOM 1926 CB THR C 19 8.012 0.484 -5.468 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.423 0.424 -5.438 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.619 1.861 -5.993 1.00 0.00 C ATOM 0 H THR C 19 7.780 -1.786 -3.726 1.00 0.00 H new ATOM 0 HA THR C 19 7.579 1.159 -3.485 1.00 0.00 H new ATOM 0 HB THR C 19 7.611 -0.293 -6.118 1.00 0.00 H new ATOM 0 HG1 THR C 19 9.776 0.576 -6.340 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.041 2.005 -6.988 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.533 1.934 -6.045 1.00 0.00 H new ATOM 0 HG23 THR C 19 8.002 2.629 -5.322 1.00 0.00 H new ATOM 1936 N ILE C 20 5.096 0.971 -4.107 1.00 0.00 N ATOM 1937 CA ILE C 20 3.646 0.832 -4.072 1.00 0.00 C ATOM 1938 C ILE C 20 3.040 1.753 -5.131 1.00 0.00 C ATOM 1939 O ILE C 20 3.638 2.779 -5.451 1.00 0.00 O ATOM 1940 CB ILE C 20 3.120 1.211 -2.678 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.922 0.582 -1.527 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.650 0.804 -2.545 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.792 -0.938 -1.455 1.00 0.00 C ATOM 0 H ILE C 20 5.410 1.942 -4.115 1.00 0.00 H new ATOM 0 HA ILE C 20 3.365 -0.201 -4.280 1.00 0.00 H new ATOM 0 HB ILE C 20 3.233 2.292 -2.594 1.00 0.00 H new ATOM 0 HG12 ILE C 20 4.974 0.844 -1.642 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.587 1.013 -0.583 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.285 1.076 -1.555 1.00 0.00 H new ATOM 0 HG22 ILE C 20 1.060 1.319 -3.303 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.557 -0.273 -2.683 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.383 -1.315 -0.620 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.746 -1.207 -1.309 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.154 -1.379 -2.384 1.00 0.00 H new ATOM 1955 N THR C 21 1.870 1.408 -5.676 1.00 0.00 N ATOM 1956 CA THR C 21 1.259 2.170 -6.759 1.00 0.00 C ATOM 1957 C THR C 21 -0.257 2.239 -6.588 1.00 0.00 C ATOM 1958 O THR C 21 -0.862 1.328 -6.025 1.00 0.00 O ATOM 1959 CB THR C 21 1.611 1.493 -8.088 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.009 1.420 -8.231 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.054 2.245 -9.297 1.00 0.00 C ATOM 0 H THR C 21 1.326 0.598 -5.379 1.00 0.00 H new ATOM 0 HA THR C 21 1.641 3.191 -6.745 1.00 0.00 H new ATOM 0 HB THR C 21 1.161 0.500 -8.060 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.374 2.323 -8.341 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.333 1.721 -10.211 1.00 0.00 H new ATOM 0 HG22 THR C 21 -0.032 2.296 -9.225 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.464 3.255 -9.318 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.869 3.323 -7.079 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.308 3.521 -7.049 1.00 0.00 C ATOM 1971 C ILE C 22 -2.823 3.405 -8.483 1.00 0.00 C ATOM 1972 O ILE C 22 -2.901 4.384 -9.224 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.662 4.838 -6.332 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -4.148 5.192 -6.450 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -1.833 6.021 -6.833 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -5.027 4.100 -5.846 1.00 0.00 C ATOM 0 H ILE C 22 -0.363 4.095 -7.513 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.813 2.755 -6.460 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.424 4.657 -5.284 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.340 6.138 -5.944 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.408 5.333 -7.499 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.123 6.923 -6.294 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.775 5.822 -6.663 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -2.009 6.163 -7.899 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.076 4.381 -5.945 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -4.852 3.160 -6.370 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -4.782 3.978 -4.791 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.174 2.175 -8.861 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.561 1.824 -10.220 1.00 0.00 C ATOM 1990 C LEU C 23 -4.892 2.459 -10.616 1.00 0.00 C ATOM 1991 O LEU C 23 -5.155 2.635 -11.805 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.679 0.300 -10.316 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.363 -0.400 -9.977 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.621 -1.895 -9.880 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -1.311 -0.142 -11.049 1.00 0.00 C ATOM 0 H LEU C 23 -3.196 1.384 -8.217 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.799 2.201 -10.902 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.459 -0.046 -9.638 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.987 0.023 -11.324 1.00 0.00 H new ATOM 0 HG LEU C 23 -1.989 -0.009 -9.031 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.691 -2.410 -9.638 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.356 -2.087 -9.098 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -3.001 -2.261 -10.834 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.386 -0.652 -10.781 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -1.668 -0.518 -12.008 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -1.125 0.929 -11.126 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.729 2.806 -9.635 1.00 0.00 N ATOM 2008 CA GLY C 24 -7.000 3.454 -9.910 1.00 0.00 C ATOM 2009 C GLY C 24 -7.958 3.404 -8.728 1.00 0.00 C ATOM 2010 O GLY C 24 -7.595 2.982 -7.631 1.00 0.00 O ATOM 0 H GLY C 24 -5.543 2.646 -8.645 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.820 4.494 -10.182 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.467 2.976 -10.771 1.00 0.00 H new ATOM 2014 N VAL C 25 -9.191 3.848 -8.968 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.230 3.915 -7.951 1.00 0.00 C ATOM 2016 C VAL C 25 -11.563 3.491 -8.566 1.00 0.00 C ATOM 2017 O VAL C 25 -11.758 3.598 -9.776 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.284 5.342 -7.386 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -10.622 6.359 -8.479 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -11.308 5.467 -6.259 1.00 0.00 C ATOM 0 H VAL C 25 -9.496 4.174 -9.885 1.00 0.00 H new ATOM 0 HA VAL C 25 -10.013 3.235 -7.127 1.00 0.00 H new ATOM 0 HB VAL C 25 -9.292 5.554 -6.987 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -10.653 7.360 -8.048 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -9.860 6.323 -9.258 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -11.594 6.120 -8.911 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -11.316 6.491 -5.886 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -12.298 5.211 -6.637 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.042 4.788 -5.449 1.00 0.00 H new ATOM 2030 N SER C 26 -12.478 3.014 -7.720 1.00 0.00 N ATOM 2031 CA SER C 26 -13.774 2.491 -8.129 1.00 0.00 C ATOM 2032 C SER C 26 -14.803 2.822 -7.052 1.00 0.00 C ATOM 2033 O SER C 26 -15.409 1.927 -6.464 1.00 0.00 O ATOM 2034 CB SER C 26 -13.681 0.978 -8.349 1.00 0.00 C ATOM 2035 OG SER C 26 -12.763 0.689 -9.384 1.00 0.00 O ATOM 0 H SER C 26 -12.331 2.982 -6.711 1.00 0.00 H new ATOM 0 HA SER C 26 -14.082 2.950 -9.069 1.00 0.00 H new ATOM 0 HB2 SER C 26 -13.367 0.488 -7.427 1.00 0.00 H new ATOM 0 HB3 SER C 26 -14.663 0.579 -8.603 1.00 0.00 H new ATOM 0 HG SER C 26 -12.711 -0.281 -9.514 1.00 0.00 H new ATOM 2041 N GLY C 27 -15.005 4.118 -6.793 1.00 0.00 N ATOM 2042 CA GLY C 27 -15.929 4.551 -5.759 1.00 0.00 C ATOM 2043 C GLY C 27 -15.322 4.279 -4.388 1.00 0.00 C ATOM 2044 O GLY C 27 -14.179 4.645 -4.129 1.00 0.00 O ATOM 0 H GLY C 27 -14.539 4.878 -7.288 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.143 5.614 -5.869 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -16.877 4.023 -5.860 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.089 3.629 -3.508 1.00 0.00 N ATOM 2049 CA GLN C 28 -15.623 3.269 -2.179 1.00 0.00 C ATOM 2050 C GLN C 28 -14.575 2.151 -2.253 1.00 0.00 C ATOM 2051 O GLN C 28 -14.075 1.715 -1.217 1.00 0.00 O ATOM 2052 CB GLN C 28 -16.835 2.865 -1.330 1.00 0.00 C ATOM 2053 CG GLN C 28 -16.493 2.850 0.164 1.00 0.00 C ATOM 2054 CD GLN C 28 -17.716 2.557 1.029 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -18.854 2.676 0.588 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -17.481 2.169 2.279 1.00 0.00 N ATOM 0 H GLN C 28 -17.048 3.341 -3.703 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.133 4.122 -1.710 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -17.655 3.560 -1.510 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.182 1.878 -1.635 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -15.727 2.098 0.353 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.070 3.814 0.449 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -16.522 2.080 2.614 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -18.260 1.960 2.903 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.229 1.681 -3.458 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.210 0.653 -3.628 1.00 0.00 C ATOM 2067 C GLN C 29 -12.004 1.240 -4.353 1.00 0.00 C ATOM 2068 O GLN C 29 -12.101 2.286 -4.991 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.775 -0.560 -4.368 1.00 0.00 C ATOM 2070 CG GLN C 29 -15.093 -1.028 -3.742 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.546 -2.356 -4.337 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -15.828 -3.311 -3.623 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -15.621 -2.421 -5.662 1.00 0.00 N ATOM 0 H GLN C 29 -14.646 2.003 -4.331 1.00 0.00 H new ATOM 0 HA GLN C 29 -12.887 0.307 -2.646 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -13.937 -0.307 -5.416 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -13.050 -1.373 -4.345 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -14.969 -1.133 -2.664 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -15.863 -0.273 -3.903 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -15.379 -1.607 -6.227 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -15.921 -3.285 -6.114 1.00 0.00 H new ATOM 2082 N VAL C 30 -10.862 0.559 -4.256 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.583 1.067 -4.732 1.00 0.00 C ATOM 2084 C VAL C 30 -8.740 -0.072 -5.302 1.00 0.00 C ATOM 2085 O VAL C 30 -8.838 -1.209 -4.849 1.00 0.00 O ATOM 2086 CB VAL C 30 -8.870 1.743 -3.553 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.424 2.095 -3.888 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.590 3.033 -3.162 1.00 0.00 C ATOM 0 H VAL C 30 -10.802 -0.370 -3.840 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.736 1.792 -5.532 1.00 0.00 H new ATOM 0 HB VAL C 30 -8.884 1.029 -2.729 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -6.956 2.571 -3.026 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -6.878 1.186 -4.141 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.403 2.779 -4.736 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.071 3.500 -2.324 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -9.598 3.717 -4.011 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.615 2.804 -2.872 1.00 0.00 H new ATOM 2098 N ARG C 31 -7.904 0.249 -6.299 1.00 0.00 N ATOM 2099 CA ARG C 31 -7.026 -0.702 -6.972 1.00 0.00 C ATOM 2100 C ARG C 31 -5.587 -0.229 -6.796 1.00 0.00 C ATOM 2101 O ARG C 31 -5.228 0.857 -7.249 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.411 -0.765 -8.457 1.00 0.00 C ATOM 2103 CG ARG C 31 -7.764 -2.177 -8.938 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.563 -3.130 -8.992 1.00 0.00 C ATOM 2105 NE ARG C 31 -6.951 -4.376 -9.660 1.00 0.00 N ATOM 2106 CZ ARG C 31 -6.804 -4.604 -10.969 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -6.203 -3.710 -11.752 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -7.256 -5.731 -11.504 1.00 0.00 N ATOM 0 H ARG C 31 -7.822 1.198 -6.663 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.125 -1.701 -6.548 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.262 -0.107 -8.632 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.584 -0.382 -9.055 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -8.521 -2.598 -8.276 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.210 -2.112 -9.931 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -5.738 -2.661 -9.528 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.209 -3.342 -7.983 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.359 -5.116 -9.089 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -5.849 -2.840 -11.354 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -6.097 -3.895 -12.749 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -7.717 -6.426 -10.916 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -7.143 -5.903 -12.503 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.768 -1.046 -6.137 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.394 -0.692 -5.800 1.00 0.00 C ATOM 2124 C ILE C 32 -2.470 -1.872 -6.056 1.00 0.00 C ATOM 2125 O ILE C 32 -2.900 -3.024 -6.075 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.302 -0.266 -4.328 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.082 -1.236 -3.431 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -3.809 1.169 -4.177 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -3.923 -0.881 -1.951 1.00 0.00 C ATOM 0 H ILE C 32 -5.042 -1.976 -5.821 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.085 0.142 -6.430 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.260 -0.299 -4.009 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.138 -1.213 -3.700 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -3.731 -2.254 -3.602 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -3.743 1.470 -3.131 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.199 1.836 -4.786 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -4.847 1.225 -4.506 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.488 -1.588 -1.344 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -2.869 -0.929 -1.677 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.298 0.128 -1.776 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.189 -1.567 -6.257 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.182 -2.579 -6.513 1.00 0.00 C ATOM 2143 C GLY C 33 0.931 -2.474 -5.486 1.00 0.00 C ATOM 2144 O GLY C 33 1.119 -1.428 -4.862 1.00 0.00 O ATOM 0 H GLY C 33 -0.827 -0.613 -6.246 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.633 -3.571 -6.473 1.00 0.00 H new ATOM 0 HA3 GLY C 33 0.225 -2.454 -7.517 1.00 0.00 H new ATOM 2148 N ILE C 34 1.673 -3.567 -5.321 1.00 0.00 N ATOM 2149 CA ILE C 34 2.750 -3.672 -4.354 1.00 0.00 C ATOM 2150 C ILE C 34 3.925 -4.339 -5.057 1.00 0.00 C ATOM 2151 O ILE C 34 3.754 -5.334 -5.762 1.00 0.00 O ATOM 2152 CB ILE C 34 2.314 -4.497 -3.134 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.152 -3.860 -2.360 1.00 0.00 C ATOM 2154 CG2 ILE C 34 3.508 -4.637 -2.188 1.00 0.00 C ATOM 2155 CD1 ILE C 34 -0.212 -4.298 -2.897 1.00 0.00 C ATOM 0 H ILE C 34 1.536 -4.417 -5.868 1.00 0.00 H new ATOM 0 HA ILE C 34 3.029 -2.684 -3.989 1.00 0.00 H new ATOM 0 HB ILE C 34 1.969 -5.463 -3.503 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.229 -4.129 -1.307 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.231 -2.774 -2.418 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.215 -5.221 -1.316 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.324 -5.142 -2.705 1.00 0.00 H new ATOM 0 HG23 ILE C 34 3.837 -3.648 -1.869 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -1.002 -3.821 -2.317 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -0.302 -4.005 -3.943 1.00 0.00 H new ATOM 0 HD13 ILE C 34 -0.305 -5.381 -2.814 1.00 0.00 H new ATOM 2167 N ASN C 35 5.118 -3.784 -4.859 1.00 0.00 N ATOM 2168 CA ASN C 35 6.313 -4.218 -5.553 1.00 0.00 C ATOM 2169 C ASN C 35 7.457 -4.381 -4.555 1.00 0.00 C ATOM 2170 O ASN C 35 8.535 -3.806 -4.709 1.00 0.00 O ATOM 2171 CB ASN C 35 6.621 -3.210 -6.658 1.00 0.00 C ATOM 2172 CG ASN C 35 7.491 -3.802 -7.759 1.00 0.00 C ATOM 2173 OD1 ASN C 35 8.190 -4.790 -7.561 1.00 0.00 O ATOM 2174 ND2 ASN C 35 7.445 -3.186 -8.939 1.00 0.00 N ATOM 0 H ASN C 35 5.277 -3.016 -4.207 1.00 0.00 H new ATOM 0 HA ASN C 35 6.169 -5.192 -6.020 1.00 0.00 H new ATOM 0 HB2 ASN C 35 5.687 -2.852 -7.090 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.125 -2.345 -6.227 1.00 0.00 H new ATOM 0 HD21 ASN C 35 8.004 -3.534 -9.718 1.00 0.00 H new ATOM 0 HD22 ASN C 35 6.851 -2.367 -9.064 1.00 0.00 H new ATOM 2181 N ALA C 36 7.192 -5.181 -3.524 1.00 0.00 N ATOM 2182 CA ALA C 36 8.186 -5.646 -2.576 1.00 0.00 C ATOM 2183 C ALA C 36 8.891 -6.854 -3.185 1.00 0.00 C ATOM 2184 O ALA C 36 8.331 -7.511 -4.067 1.00 0.00 O ATOM 2185 CB ALA C 36 7.485 -6.049 -1.280 1.00 0.00 C ATOM 0 H ALA C 36 6.254 -5.529 -3.325 1.00 0.00 H new ATOM 0 HA ALA C 36 8.913 -4.863 -2.358 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.224 -6.400 -0.560 1.00 0.00 H new ATOM 0 HB2 ALA C 36 6.958 -5.188 -0.868 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.771 -6.847 -1.485 1.00 0.00 H new ATOM 2191 N PRO C 37 10.110 -7.169 -2.737 1.00 0.00 N ATOM 2192 CA PRO C 37 10.841 -8.298 -3.263 1.00 0.00 C ATOM 2193 C PRO C 37 10.122 -9.552 -2.802 1.00 0.00 C ATOM 2194 O PRO C 37 9.524 -9.566 -1.727 1.00 0.00 O ATOM 2195 CB PRO C 37 12.251 -8.177 -2.682 1.00 0.00 C ATOM 2196 CG PRO C 37 12.039 -7.403 -1.385 1.00 0.00 C ATOM 2197 CD PRO C 37 10.861 -6.487 -1.702 1.00 0.00 C ATOM 0 HA PRO C 37 10.902 -8.334 -4.351 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.694 -9.156 -2.497 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.920 -7.647 -3.360 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.816 -8.070 -0.552 1.00 0.00 H new ATOM 0 HG3 PRO C 37 12.926 -6.834 -1.108 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.246 -6.317 -0.818 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.204 -5.510 -2.044 1.00 0.00 H new ATOM 2205 N LYS C 38 10.163 -10.616 -3.600 1.00 0.00 N ATOM 2206 CA LYS C 38 9.457 -11.841 -3.256 1.00 0.00 C ATOM 2207 C LYS C 38 10.124 -12.546 -2.075 1.00 0.00 C ATOM 2208 O LYS C 38 9.661 -13.597 -1.633 1.00 0.00 O ATOM 2209 CB LYS C 38 9.298 -12.706 -4.506 1.00 0.00 C ATOM 2210 CG LYS C 38 8.609 -11.842 -5.569 1.00 0.00 C ATOM 2211 CD LYS C 38 8.169 -12.642 -6.791 1.00 0.00 C ATOM 2212 CE LYS C 38 7.680 -11.669 -7.860 1.00 0.00 C ATOM 2213 NZ LYS C 38 7.317 -12.369 -9.103 1.00 0.00 N ATOM 0 H LYS C 38 10.674 -10.652 -4.482 1.00 0.00 H new ATOM 0 HA LYS C 38 8.449 -11.613 -2.909 1.00 0.00 H new ATOM 0 HB2 LYS C 38 10.269 -13.052 -4.861 1.00 0.00 H new ATOM 0 HB3 LYS C 38 8.704 -13.593 -4.287 1.00 0.00 H new ATOM 0 HG2 LYS C 38 7.739 -11.356 -5.127 1.00 0.00 H new ATOM 0 HG3 LYS C 38 9.290 -11.051 -5.885 1.00 0.00 H new ATOM 0 HD2 LYS C 38 8.999 -13.237 -7.172 1.00 0.00 H new ATOM 0 HD3 LYS C 38 7.375 -13.338 -6.521 1.00 0.00 H new ATOM 0 HE2 LYS C 38 6.816 -11.120 -7.485 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.459 -10.935 -8.069 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 6.989 -11.678 -9.808 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 8.148 -12.873 -9.473 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 6.557 -13.051 -8.908 1.00 0.00 H new ATOM 2227 N ASP C 39 11.212 -11.956 -1.567 1.00 0.00 N ATOM 2228 CA ASP C 39 11.857 -12.373 -0.334 1.00 0.00 C ATOM 2229 C ASP C 39 11.050 -11.914 0.884 1.00 0.00 C ATOM 2230 O ASP C 39 11.304 -12.388 1.992 1.00 0.00 O ATOM 2231 CB ASP C 39 13.266 -11.774 -0.276 1.00 0.00 C ATOM 2232 CG ASP C 39 14.126 -12.283 -1.430 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.653 -13.411 -1.307 1.00 0.00 O ATOM 2234 OD2 ASP C 39 14.252 -11.540 -2.427 1.00 0.00 O ATOM 0 H ASP C 39 11.671 -11.163 -2.015 1.00 0.00 H new ATOM 0 HA ASP C 39 11.914 -13.461 -0.317 1.00 0.00 H new ATOM 0 HB2 ASP C 39 13.204 -10.686 -0.316 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.736 -12.032 0.673 1.00 0.00 H new ATOM 2239 N VAL C 40 10.080 -11.003 0.698 1.00 0.00 N ATOM 2240 CA VAL C 40 9.165 -10.603 1.761 1.00 0.00 C ATOM 2241 C VAL C 40 7.723 -10.760 1.287 1.00 0.00 C ATOM 2242 O VAL C 40 7.404 -10.565 0.112 1.00 0.00 O ATOM 2243 CB VAL C 40 9.439 -9.172 2.244 1.00 0.00 C ATOM 2244 CG1 VAL C 40 10.886 -9.029 2.715 1.00 0.00 C ATOM 2245 CG2 VAL C 40 9.164 -8.139 1.156 1.00 0.00 C ATOM 0 H VAL C 40 9.915 -10.530 -0.191 1.00 0.00 H new ATOM 0 HA VAL C 40 9.329 -11.258 2.616 1.00 0.00 H new ATOM 0 HB VAL C 40 8.760 -8.985 3.076 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.059 -8.007 3.053 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.071 -9.720 3.538 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.561 -9.258 1.891 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.371 -7.141 1.541 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.805 -8.336 0.297 1.00 0.00 H new ATOM 0 HG23 VAL C 40 8.119 -8.201 0.851 1.00 0.00 H new ATOM 2255 N ALA C 41 6.847 -11.122 2.222 1.00 0.00 N ATOM 2256 CA ALA C 41 5.459 -11.435 1.930 1.00 0.00 C ATOM 2257 C ALA C 41 4.618 -10.183 1.681 1.00 0.00 C ATOM 2258 O ALA C 41 4.948 -9.098 2.151 1.00 0.00 O ATOM 2259 CB ALA C 41 4.887 -12.206 3.113 1.00 0.00 C ATOM 0 H ALA C 41 7.087 -11.206 3.210 1.00 0.00 H new ATOM 0 HA ALA C 41 5.425 -12.028 1.016 1.00 0.00 H new ATOM 0 HB1 ALA C 41 3.844 -12.453 2.916 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.456 -13.124 3.258 1.00 0.00 H new ATOM 0 HB3 ALA C 41 4.952 -11.593 4.012 1.00 0.00 H new ATOM 2265 N VAL C 42 3.524 -10.351 0.938 1.00 0.00 N ATOM 2266 CA VAL C 42 2.472 -9.354 0.798 1.00 0.00 C ATOM 2267 C VAL C 42 1.161 -10.092 0.550 1.00 0.00 C ATOM 2268 O VAL C 42 1.059 -10.917 -0.358 1.00 0.00 O ATOM 2269 CB VAL C 42 2.761 -8.317 -0.302 1.00 0.00 C ATOM 2270 CG1 VAL C 42 3.354 -8.916 -1.568 1.00 0.00 C ATOM 2271 CG2 VAL C 42 1.480 -7.603 -0.731 1.00 0.00 C ATOM 0 H VAL C 42 3.344 -11.203 0.407 1.00 0.00 H new ATOM 0 HA VAL C 42 2.413 -8.772 1.717 1.00 0.00 H new ATOM 0 HB VAL C 42 3.482 -7.636 0.150 1.00 0.00 H new ATOM 0 HG11 VAL C 42 3.530 -8.125 -2.297 1.00 0.00 H new ATOM 0 HG12 VAL C 42 4.297 -9.408 -1.331 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.660 -9.645 -1.985 1.00 0.00 H new ATOM 0 HG21 VAL C 42 1.712 -6.876 -1.509 1.00 0.00 H new ATOM 0 HG22 VAL C 42 0.768 -8.333 -1.117 1.00 0.00 H new ATOM 0 HG23 VAL C 42 1.044 -7.090 0.127 1.00 0.00 H new ATOM 2281 N HIS C 43 0.168 -9.767 1.382 1.00 0.00 N ATOM 2282 CA HIS C 43 -1.180 -10.339 1.371 1.00 0.00 C ATOM 2283 C HIS C 43 -2.172 -9.283 1.860 1.00 0.00 C ATOM 2284 O HIS C 43 -1.786 -8.140 2.102 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.273 -11.563 2.298 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.234 -12.630 2.082 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.460 -13.856 1.453 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.074 -12.569 2.471 1.00 0.00 C ATOM 2289 CE1 HIS C 43 0.719 -14.499 1.473 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.656 -13.750 2.078 1.00 0.00 N ATOM 0 H HIS C 43 0.288 -9.067 2.114 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.411 -10.652 0.353 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -1.204 -11.219 3.330 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -2.259 -12.013 2.177 1.00 0.00 H new ATOM 0 HD1 HIS C 43 -1.339 -14.193 1.060 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.557 -11.752 2.987 1.00 0.00 H new ATOM 0 HE1 HIS C 43 0.890 -15.482 1.060 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.453 -9.649 2.009 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.460 -8.740 2.546 1.00 0.00 C ATOM 2300 C ARG C 44 -4.923 -9.204 3.924 1.00 0.00 C ATOM 2301 O ARG C 44 -4.860 -10.390 4.237 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.595 -8.520 1.537 1.00 0.00 C ATOM 2303 CG ARG C 44 -6.221 -9.758 0.884 1.00 0.00 C ATOM 2304 CD ARG C 44 -6.730 -10.776 1.899 1.00 0.00 C ATOM 2305 NE ARG C 44 -7.904 -11.507 1.397 1.00 0.00 N ATOM 2306 CZ ARG C 44 -7.898 -12.486 0.490 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -6.777 -12.879 -0.106 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -9.039 -13.086 0.170 1.00 0.00 N ATOM 0 H ARG C 44 -3.811 -10.572 1.763 1.00 0.00 H new ATOM 0 HA ARG C 44 -4.017 -7.756 2.700 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.389 -7.970 2.041 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.217 -7.877 0.742 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -7.047 -9.446 0.245 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -5.482 -10.234 0.239 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -5.935 -11.483 2.135 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -6.989 -10.266 2.827 1.00 0.00 H new ATOM 0 HE ARG C 44 -8.811 -11.239 1.779 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -5.891 -12.430 0.126 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -6.802 -13.630 -0.796 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -9.910 -12.797 0.616 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -9.045 -13.835 -0.522 1.00 0.00 H new ATOM 2322 N GLU C 45 -5.390 -8.258 4.746 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.686 -8.475 6.162 1.00 0.00 C ATOM 2324 C GLU C 45 -6.707 -9.578 6.407 1.00 0.00 C ATOM 2325 O GLU C 45 -6.640 -10.261 7.425 1.00 0.00 O ATOM 2326 CB GLU C 45 -6.251 -7.185 6.744 1.00 0.00 C ATOM 2327 CG GLU C 45 -5.215 -6.069 6.751 1.00 0.00 C ATOM 2328 CD GLU C 45 -4.238 -6.210 7.916 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -3.203 -6.883 7.725 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -4.535 -5.645 8.990 1.00 0.00 O ATOM 0 H GLU C 45 -5.575 -7.303 4.438 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.752 -8.776 6.636 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -7.118 -6.873 6.162 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -6.598 -7.366 7.761 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -4.664 -6.079 5.811 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -5.720 -5.105 6.814 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.642 -9.755 5.475 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.669 -10.787 5.565 1.00 0.00 C ATOM 2339 C GLU C 46 -8.041 -12.181 5.650 1.00 0.00 C ATOM 2340 O GLU C 46 -8.721 -13.147 6.001 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.590 -10.632 4.352 1.00 0.00 C ATOM 2342 CG GLU C 46 -10.689 -11.697 4.265 1.00 0.00 C ATOM 2343 CD GLU C 46 -11.490 -11.527 2.978 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -10.885 -11.733 1.900 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -12.693 -11.190 3.079 1.00 0.00 O ATOM 0 H GLU C 46 -7.707 -9.183 4.633 1.00 0.00 H new ATOM 0 HA GLU C 46 -9.254 -10.671 6.477 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -10.055 -9.647 4.385 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -8.988 -10.670 3.444 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -10.244 -12.692 4.296 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -11.351 -11.617 5.127 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.748 -12.296 5.327 1.00 0.00 N ATOM 2353 CA ILE C 47 -6.050 -13.570 5.309 1.00 0.00 C ATOM 2354 C ILE C 47 -4.678 -13.471 5.969 1.00 0.00 C ATOM 2355 O ILE C 47 -4.165 -14.477 6.451 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.953 -14.037 3.853 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -7.133 -14.963 3.546 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.609 -14.701 3.537 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.986 -15.597 2.165 1.00 0.00 C ATOM 0 H ILE C 47 -6.162 -11.501 5.071 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.606 -14.305 5.892 1.00 0.00 H new ATOM 0 HB ILE C 47 -6.005 -13.162 3.205 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.194 -15.744 4.304 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -8.065 -14.399 3.594 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.594 -15.013 2.493 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.801 -13.991 3.715 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.474 -15.572 4.178 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.837 -16.250 1.972 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.950 -14.814 1.407 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.066 -16.180 2.128 1.00 0.00 H new ATOM 2371 N TYR C 48 -4.056 -12.290 6.008 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.717 -12.187 6.559 1.00 0.00 C ATOM 2373 C TYR C 48 -2.719 -12.570 8.031 1.00 0.00 C ATOM 2374 O TYR C 48 -1.744 -13.114 8.545 1.00 0.00 O ATOM 2375 CB TYR C 48 -2.183 -10.765 6.385 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.797 -10.619 6.962 1.00 0.00 C ATOM 2377 CD1 TYR C 48 -0.645 -10.258 8.308 1.00 0.00 C ATOM 2378 CD2 TYR C 48 0.330 -10.860 6.164 1.00 0.00 C ATOM 2379 CE1 TYR C 48 0.633 -10.153 8.864 1.00 0.00 C ATOM 2380 CE2 TYR C 48 1.615 -10.750 6.713 1.00 0.00 C ATOM 2381 CZ TYR C 48 1.771 -10.383 8.066 1.00 0.00 C ATOM 2382 OH TYR C 48 3.015 -10.263 8.602 1.00 0.00 O ATOM 0 H TYR C 48 -4.453 -11.413 5.671 1.00 0.00 H new ATOM 0 HA TYR C 48 -2.066 -12.876 6.021 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -2.166 -10.509 5.326 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.857 -10.060 6.872 1.00 0.00 H new ATOM 0 HD1 TYR C 48 -1.516 -10.061 8.916 1.00 0.00 H new ATOM 0 HD2 TYR C 48 0.208 -11.131 5.126 1.00 0.00 H new ATOM 0 HE1 TYR C 48 0.748 -9.895 9.906 1.00 0.00 H new ATOM 0 HE2 TYR C 48 2.483 -10.946 6.102 1.00 0.00 H new ATOM 0 HH TYR C 48 3.648 -9.996 7.903 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.831 -12.287 8.708 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.981 -12.570 10.124 1.00 0.00 C ATOM 2394 C GLN C 49 -4.174 -14.068 10.359 1.00 0.00 C ATOM 2395 O GLN C 49 -4.099 -14.529 11.496 1.00 0.00 O ATOM 2396 CB GLN C 49 -5.169 -11.766 10.657 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.929 -10.286 10.354 1.00 0.00 C ATOM 2398 CD GLN C 49 -6.053 -9.415 10.896 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -6.054 -9.044 12.068 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -7.021 -9.084 10.049 1.00 0.00 N ATOM 0 H GLN C 49 -4.652 -11.854 8.284 1.00 0.00 H new ATOM 0 HA GLN C 49 -3.078 -12.277 10.659 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -6.094 -12.103 10.190 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -5.279 -11.920 11.730 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.981 -9.973 10.792 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.844 -10.143 9.277 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -6.987 -9.410 9.083 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -7.798 -8.504 10.364 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.423 -14.830 9.286 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.532 -16.278 9.364 1.00 0.00 C ATOM 2411 C ARG C 50 -3.181 -16.922 9.065 1.00 0.00 C ATOM 2412 O ARG C 50 -2.879 -17.983 9.603 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.634 -16.750 8.406 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.112 -17.419 7.133 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.284 -17.771 6.222 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.206 -18.724 6.856 1.00 0.00 N ATOM 2417 CZ ARG C 50 -6.914 -19.985 7.197 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -5.722 -20.516 6.944 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -7.833 -20.728 7.805 1.00 0.00 N ATOM 0 H ARG C 50 -4.553 -14.454 8.347 1.00 0.00 H new ATOM 0 HA ARG C 50 -4.811 -16.585 10.372 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.282 -17.451 8.932 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.249 -15.894 8.128 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.424 -16.751 6.615 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.552 -18.319 7.387 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -6.825 -16.862 5.960 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -5.906 -18.196 5.292 1.00 0.00 H new ATOM 0 HE ARG C 50 -8.151 -18.396 7.053 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -5.004 -19.960 6.480 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -5.525 -21.480 7.214 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -8.753 -20.336 8.008 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -7.619 -21.690 8.068 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.376 -16.286 8.210 1.00 0.00 N ATOM 2434 CA ILE C 51 -1.031 -16.752 7.889 1.00 0.00 C ATOM 2435 C ILE C 51 -0.157 -16.619 9.131 1.00 0.00 C ATOM 2436 O ILE C 51 0.536 -17.556 9.518 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.464 -15.903 6.746 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.279 -16.128 5.474 1.00 0.00 C ATOM 2439 CG2 ILE C 51 1.002 -16.245 6.461 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.899 -15.112 4.404 1.00 0.00 C ATOM 0 H ILE C 51 -2.643 -15.431 7.721 1.00 0.00 H new ATOM 0 HA ILE C 51 -1.054 -17.796 7.575 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.524 -14.859 7.054 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -1.108 -17.138 5.101 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.343 -16.047 5.698 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.369 -15.623 5.645 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.599 -16.061 7.354 1.00 0.00 H new ATOM 0 HG23 ILE C 51 1.083 -17.295 6.181 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.491 -15.290 3.506 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -1.093 -14.105 4.773 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.160 -15.213 4.166 1.00 0.00 H new ATOM 2452 N GLN C 52 -0.196 -15.443 9.757 1.00 0.00 N ATOM 2453 CA GLN C 52 0.629 -15.164 10.919 1.00 0.00 C ATOM 2454 C GLN C 52 0.089 -15.858 12.168 1.00 0.00 C ATOM 2455 O GLN C 52 0.610 -15.649 13.264 1.00 0.00 O ATOM 2456 CB GLN C 52 0.761 -13.647 11.085 1.00 0.00 C ATOM 2457 CG GLN C 52 1.480 -13.068 9.867 1.00 0.00 C ATOM 2458 CD GLN C 52 2.782 -13.802 9.571 1.00 0.00 C ATOM 2459 OE1 GLN C 52 3.739 -13.730 10.339 1.00 0.00 O ATOM 2460 NE2 GLN C 52 2.823 -14.515 8.450 1.00 0.00 N ATOM 0 H GLN C 52 -0.795 -14.668 9.472 1.00 0.00 H new ATOM 0 HA GLN C 52 1.627 -15.575 10.769 1.00 0.00 H new ATOM 0 HB2 GLN C 52 -0.225 -13.194 11.190 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.316 -13.416 11.994 1.00 0.00 H new ATOM 0 HG2 GLN C 52 0.825 -13.126 8.998 1.00 0.00 H new ATOM 0 HG3 GLN C 52 1.690 -12.012 10.038 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.008 -14.550 7.838 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.670 -15.027 8.202 1.00 0.00 H new ATOM 2469 N ALA C 53 -0.949 -16.685 12.015 1.00 0.00 N ATOM 2470 CA ALA C 53 -1.496 -17.438 13.126 1.00 0.00 C ATOM 2471 C ALA C 53 -0.577 -18.600 13.513 1.00 0.00 C ATOM 2472 O ALA C 53 -0.710 -19.143 14.608 1.00 0.00 O ATOM 2473 CB ALA C 53 -2.880 -17.968 12.755 1.00 0.00 C ATOM 0 H ALA C 53 -1.423 -16.844 11.126 1.00 0.00 H new ATOM 0 HA ALA C 53 -1.577 -16.772 13.985 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.289 -18.534 13.592 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -3.540 -17.132 12.525 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -2.799 -18.617 11.883 1.00 0.00 H new ATOM 2479 N GLY C 54 0.352 -18.983 12.629 1.00 0.00 N ATOM 2480 CA GLY C 54 1.289 -20.066 12.901 1.00 0.00 C ATOM 2481 C GLY C 54 1.401 -21.043 11.729 1.00 0.00 C ATOM 2482 O GLY C 54 1.887 -22.159 11.907 1.00 0.00 O ATOM 0 H GLY C 54 0.471 -18.551 11.713 1.00 0.00 H new ATOM 0 HA2 GLY C 54 2.272 -19.648 13.118 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.969 -20.606 13.792 1.00 0.00 H new ATOM 2486 N LEU C 55 0.955 -20.630 10.540 1.00 0.00 N ATOM 2487 CA LEU C 55 0.874 -21.487 9.367 1.00 0.00 C ATOM 2488 C LEU C 55 1.290 -20.724 8.109 1.00 0.00 C ATOM 2489 O LEU C 55 1.764 -19.593 8.194 1.00 0.00 O ATOM 2490 CB LEU C 55 -0.553 -22.043 9.283 1.00 0.00 C ATOM 2491 CG LEU C 55 -1.630 -20.949 9.229 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -1.776 -20.353 7.827 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -2.970 -21.555 9.623 1.00 0.00 C ATOM 0 H LEU C 55 0.637 -19.676 10.368 1.00 0.00 H new ATOM 0 HA LEU C 55 1.568 -22.323 9.449 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -0.639 -22.672 8.397 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -0.738 -22.682 10.146 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.328 -20.156 9.913 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.548 -19.584 7.837 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -0.828 -19.911 7.519 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.055 -21.139 7.125 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -3.742 -20.786 9.588 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.225 -22.357 8.930 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -2.904 -21.957 10.634 1.00 0.00 H new ATOM 2505 N THR C 56 1.113 -21.338 6.935 1.00 0.00 N ATOM 2506 CA THR C 56 1.461 -20.712 5.664 1.00 0.00 C ATOM 2507 C THR C 56 0.432 -21.065 4.593 1.00 0.00 C ATOM 2508 O THR C 56 -0.424 -21.925 4.799 1.00 0.00 O ATOM 2509 CB THR C 56 2.861 -21.150 5.224 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.923 -22.556 5.125 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.921 -20.675 6.218 1.00 0.00 C ATOM 0 H THR C 56 0.726 -22.277 6.843 1.00 0.00 H new ATOM 0 HA THR C 56 1.459 -19.630 5.798 1.00 0.00 H new ATOM 0 HB THR C 56 3.059 -20.701 4.251 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.822 -22.825 4.841 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.906 -20.999 5.882 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.899 -19.587 6.281 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.715 -21.100 7.200 1.00 0.00 H new ATOM 2519 N ALA C 57 0.521 -20.393 3.441 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.371 -20.613 2.310 1.00 0.00 C ATOM 2521 C ALA C 57 -0.340 -22.074 1.857 1.00 0.00 C ATOM 2522 O ALA C 57 0.644 -22.777 2.086 1.00 0.00 O ATOM 2523 CB ALA C 57 0.073 -19.697 1.174 1.00 0.00 C ATOM 0 H ALA C 57 1.224 -19.674 3.271 1.00 0.00 H new ATOM 0 HA ALA C 57 -1.396 -20.387 2.604 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -0.580 -19.842 0.313 1.00 0.00 H new ATOM 0 HB2 ALA C 57 0.017 -18.659 1.501 1.00 0.00 H new ATOM 0 HB3 ALA C 57 1.100 -19.935 0.895 1.00 0.00 H new