USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 895 hydrogens (8 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 NoAdj-H: A 46 HIS HE2 : A 46 HIS NE2 : A 201 7BUZN :(H bumps) USER MOD Set 1.1: A 63 LYS NZ :NH3+ -145:sc= 1.08 (180deg=0.607) USER MOD Set 1.2: A 67 GLN : amide:sc=-0.00148 K(o=1.1,f=-0.096) USER MOD Single : A 1 SER N :NH3+ -165:sc= 0.926 (180deg=0.782) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 9 THR OG1 : rot -82:sc= 0.645 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 26 LYS NZ :NH3+ -168:sc= -0.0163 (180deg=-0.176) USER MOD Single : A 31 SER OG : rot 180:sc= -0.133 USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 44 GLN : amide:sc= -0.165 K(o=-0.16,f=-0.92) USER MOD Single : A 45 LYS NZ :NH3+ -165:sc= 1.29 (180deg=1.03) USER MOD Single : A 48 GLN : amide:sc= -0.336 K(o=-0.34,f=-1) USER MOD Single : A 52 ASN : amide:sc= 0.892 K(o=0.89,f=0) USER MOD Single : A 54 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0899 USER MOD Single : A 64 GLN : amide:sc= -3.75! C(o=-3.8!,f=-6!) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 73 GLN : amide:sc= -0.242 X(o=-0.24,f=-0.048) USER MOD Single : A 81 LYS NZ :NH3+ 167:sc= 1.22 (180deg=1.02) USER MOD Single : A 84 LYS NZ :NH3+ -122:sc= 0.102 (180deg=-0.851) USER MOD Single : A 86 SER OG : rot 65:sc= 1.15 USER MOD Single : A 89 GLN : amide:sc= -0.0182 K(o=-0.018,f=-0.53) USER MOD Single : A 96 GLN : amide:sc= -0.0869 K(o=-0.087,f=-0.6) USER MOD Single : A 99 GLN : amide:sc= -0.0294 X(o=-0.029,f=-0.4) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 165:sc= 1.24 (180deg=0.828) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.604 -2.714 -6.869 1.00 0.00 N ATOM 2 CA SER A 1 1.133 -2.768 -6.933 1.00 0.00 C ATOM 3 C SER A 1 0.639 -4.190 -6.701 1.00 0.00 C ATOM 4 O SER A 1 1.263 -5.148 -7.147 1.00 0.00 O ATOM 5 CB SER A 1 0.652 -2.262 -8.292 1.00 0.00 C ATOM 6 OG SER A 1 1.129 -0.950 -8.541 1.00 0.00 O ATOM 0 H1 SER A 1 2.911 -1.725 -6.774 1.00 0.00 H new ATOM 0 H2 SER A 1 2.936 -3.260 -6.049 1.00 0.00 H new ATOM 0 H3 SER A 1 3.004 -3.119 -7.739 1.00 0.00 H new ATOM 0 HA SER A 1 0.727 -2.129 -6.149 1.00 0.00 H new ATOM 0 HB2 SER A 1 0.997 -2.934 -9.078 1.00 0.00 H new ATOM 0 HB3 SER A 1 -0.438 -2.269 -8.322 1.00 0.00 H new ATOM 0 HG SER A 1 0.811 -0.647 -9.417 1.00 0.00 H new ATOM 14 N GLU A 2 -0.482 -4.321 -6.006 1.00 0.00 N ATOM 15 CA GLU A 2 -1.053 -5.627 -5.704 1.00 0.00 C ATOM 16 C GLU A 2 -1.604 -6.307 -6.953 1.00 0.00 C ATOM 17 O GLU A 2 -1.955 -5.644 -7.936 1.00 0.00 O ATOM 18 CB GLU A 2 -2.144 -5.499 -4.643 1.00 0.00 C ATOM 19 CG GLU A 2 -1.608 -5.194 -3.256 1.00 0.00 C ATOM 20 CD GLU A 2 -0.835 -6.356 -2.667 1.00 0.00 C ATOM 21 OE1 GLU A 2 0.286 -6.632 -3.135 1.00 0.00 O ATOM 22 OE2 GLU A 2 -1.347 -7.000 -1.732 1.00 0.00 O1- ATOM 0 H GLU A 2 -1.017 -3.534 -5.639 1.00 0.00 H new ATOM 0 HA GLU A 2 -0.251 -6.254 -5.315 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -2.836 -4.710 -4.938 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -2.715 -6.427 -4.607 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -0.961 -4.318 -3.304 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -2.438 -4.942 -2.596 1.00 0.00 H new ATOM 29 N PHE A 3 -1.679 -7.631 -6.902 1.00 0.00 N ATOM 30 CA PHE A 3 -2.165 -8.434 -8.019 1.00 0.00 C ATOM 31 C PHE A 3 -3.653 -8.172 -8.279 1.00 0.00 C ATOM 32 O PHE A 3 -4.153 -8.399 -9.386 1.00 0.00 O ATOM 33 CB PHE A 3 -1.919 -9.926 -7.737 1.00 0.00 C ATOM 34 CG PHE A 3 -2.233 -10.837 -8.892 1.00 0.00 C ATOM 35 CD1 PHE A 3 -1.408 -10.877 -10.005 1.00 0.00 C ATOM 36 CD2 PHE A 3 -3.349 -11.660 -8.859 1.00 0.00 C ATOM 37 CE1 PHE A 3 -1.691 -11.720 -11.064 1.00 0.00 C ATOM 38 CE2 PHE A 3 -3.636 -12.504 -9.914 1.00 0.00 C ATOM 39 CZ PHE A 3 -2.807 -12.533 -11.019 1.00 0.00 C ATOM 0 H PHE A 3 -1.405 -8.179 -6.086 1.00 0.00 H new ATOM 0 HA PHE A 3 -1.615 -8.148 -8.916 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -0.875 -10.063 -7.456 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -2.522 -10.225 -6.880 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -0.535 -10.243 -10.046 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -4.001 -11.641 -7.998 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -1.040 -11.743 -11.926 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -4.508 -13.141 -9.875 1.00 0.00 H new ATOM 0 HZ PHE A 3 -3.031 -13.190 -11.846 1.00 0.00 H new ATOM 49 N GLU A 4 -4.343 -7.666 -7.265 1.00 0.00 N ATOM 50 CA GLU A 4 -5.763 -7.357 -7.366 1.00 0.00 C ATOM 51 C GLU A 4 -5.992 -6.257 -8.396 1.00 0.00 C ATOM 52 O GLU A 4 -6.796 -6.407 -9.308 1.00 0.00 O ATOM 53 CB GLU A 4 -6.289 -6.916 -6.006 1.00 0.00 C ATOM 54 CG GLU A 4 -7.744 -6.495 -5.997 1.00 0.00 C ATOM 55 CD GLU A 4 -8.179 -6.022 -4.635 1.00 0.00 C ATOM 56 OE1 GLU A 4 -8.081 -4.808 -4.364 1.00 0.00 O ATOM 57 OE2 GLU A 4 -8.599 -6.862 -3.819 1.00 0.00 O1- ATOM 0 H GLU A 4 -3.936 -7.459 -6.353 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.299 -8.251 -7.686 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.157 -7.734 -5.298 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.682 -6.084 -5.649 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.897 -5.698 -6.725 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.367 -7.334 -6.307 1.00 0.00 H new ATOM 64 N LYS A 5 -5.251 -5.162 -8.250 1.00 0.00 N ATOM 65 CA LYS A 5 -5.342 -4.030 -9.170 1.00 0.00 C ATOM 66 C LYS A 5 -4.931 -4.445 -10.575 1.00 0.00 C ATOM 67 O LYS A 5 -5.378 -3.866 -11.570 1.00 0.00 O ATOM 68 CB LYS A 5 -4.480 -2.863 -8.695 1.00 0.00 C ATOM 69 CG LYS A 5 -4.929 -2.253 -7.382 1.00 0.00 C ATOM 70 CD LYS A 5 -4.143 -0.992 -7.077 1.00 0.00 C ATOM 71 CE LYS A 5 -4.593 -0.352 -5.776 1.00 0.00 C ATOM 72 NZ LYS A 5 -3.816 0.872 -5.474 1.00 0.00 N1+ ATOM 0 H LYS A 5 -4.575 -5.034 -7.497 1.00 0.00 H new ATOM 0 HA LYS A 5 -6.381 -3.702 -9.190 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -3.450 -3.205 -8.590 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.482 -2.089 -9.462 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -5.993 -2.021 -7.429 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -4.795 -2.974 -6.576 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -3.081 -1.230 -7.017 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -4.265 -0.281 -7.894 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.653 -0.105 -5.839 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -4.480 -1.066 -4.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -4.150 1.283 -4.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -2.808 0.631 -5.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -3.944 1.563 -6.241 1.00 0.00 H new ATOM 86 N LEU A 6 -4.119 -5.482 -10.649 1.00 0.00 N ATOM 87 CA LEU A 6 -3.622 -5.947 -11.922 1.00 0.00 C ATOM 88 C LEU A 6 -4.762 -6.625 -12.656 1.00 0.00 C ATOM 89 O LEU A 6 -5.027 -6.344 -13.825 1.00 0.00 O ATOM 90 CB LEU A 6 -2.452 -6.915 -11.737 1.00 0.00 C ATOM 91 CG LEU A 6 -1.791 -7.407 -13.028 1.00 0.00 C ATOM 92 CD1 LEU A 6 -1.163 -6.249 -13.787 1.00 0.00 C ATOM 93 CD2 LEU A 6 -0.754 -8.469 -12.724 1.00 0.00 C ATOM 0 H LEU A 6 -3.792 -6.015 -9.843 1.00 0.00 H new ATOM 0 HA LEU A 6 -3.252 -5.101 -12.501 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -1.694 -6.428 -11.124 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -2.805 -7.781 -11.178 1.00 0.00 H new ATOM 0 HG LEU A 6 -2.562 -7.849 -13.658 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -0.699 -6.621 -14.700 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -1.933 -5.521 -14.042 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -0.406 -5.773 -13.164 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.295 -8.806 -13.653 1.00 0.00 H new ATOM 0 HD22 LEU A 6 0.013 -8.052 -12.071 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.233 -9.314 -12.228 1.00 0.00 H new ATOM 105 N ARG A 7 -5.445 -7.513 -11.949 1.00 0.00 N ATOM 106 CA ARG A 7 -6.605 -8.190 -12.490 1.00 0.00 C ATOM 107 C ARG A 7 -7.757 -7.228 -12.714 1.00 0.00 C ATOM 108 O ARG A 7 -8.477 -7.339 -13.697 1.00 0.00 O ATOM 109 CB ARG A 7 -7.063 -9.320 -11.578 1.00 0.00 C ATOM 110 CG ARG A 7 -6.286 -10.607 -11.744 1.00 0.00 C ATOM 111 CD ARG A 7 -7.198 -11.805 -11.561 1.00 0.00 C ATOM 112 NE ARG A 7 -8.403 -11.695 -12.399 1.00 0.00 N ATOM 113 CZ ARG A 7 -9.260 -12.687 -12.635 1.00 0.00 C ATOM 114 NH1 ARG A 7 -9.036 -13.906 -12.147 1.00 0.00 N1+ ATOM 115 NH2 ARG A 7 -10.339 -12.456 -13.370 1.00 0.00 N ATOM 0 H ARG A 7 -5.210 -7.780 -10.993 1.00 0.00 H new ATOM 0 HA ARG A 7 -6.304 -8.608 -13.450 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -6.981 -8.991 -10.542 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -8.118 -9.519 -11.767 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -5.829 -10.638 -12.733 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -5.475 -10.645 -11.017 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -6.658 -12.717 -11.815 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -7.488 -11.887 -10.513 1.00 0.00 H new ATOM 0 HE ARG A 7 -8.596 -10.792 -12.831 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -8.203 -14.086 -11.587 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -9.698 -14.659 -12.333 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -10.508 -11.524 -13.750 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -11.001 -13.210 -13.556 1.00 0.00 H new ATOM 129 N GLN A 8 -7.905 -6.270 -11.815 1.00 0.00 N ATOM 130 CA GLN A 8 -9.001 -5.310 -11.875 1.00 0.00 C ATOM 131 C GLN A 8 -8.940 -4.470 -13.148 1.00 0.00 C ATOM 132 O GLN A 8 -9.969 -4.074 -13.682 1.00 0.00 O ATOM 133 CB GLN A 8 -8.976 -4.404 -10.641 1.00 0.00 C ATOM 134 CG GLN A 8 -10.132 -3.424 -10.567 1.00 0.00 C ATOM 135 CD GLN A 8 -10.066 -2.535 -9.343 1.00 0.00 C ATOM 136 OE1 GLN A 8 -8.986 -2.217 -8.843 1.00 0.00 O ATOM 137 NE2 GLN A 8 -11.219 -2.133 -8.850 1.00 0.00 N ATOM 0 H GLN A 8 -7.274 -6.133 -11.025 1.00 0.00 H new ATOM 0 HA GLN A 8 -9.936 -5.870 -11.890 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -8.984 -5.027 -9.746 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -8.040 -3.846 -10.632 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -10.134 -2.803 -11.463 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.072 -3.976 -10.560 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -12.091 -2.419 -9.295 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -11.240 -1.535 -8.024 1.00 0.00 H new ATOM 146 N THR A 9 -7.742 -4.227 -13.652 1.00 0.00 N ATOM 147 CA THR A 9 -7.593 -3.444 -14.858 1.00 0.00 C ATOM 148 C THR A 9 -7.670 -4.345 -16.082 1.00 0.00 C ATOM 149 O THR A 9 -7.912 -3.887 -17.197 1.00 0.00 O ATOM 150 CB THR A 9 -6.269 -2.663 -14.857 1.00 0.00 C ATOM 151 OG1 THR A 9 -5.191 -3.533 -14.475 1.00 0.00 O ATOM 152 CG2 THR A 9 -6.344 -1.487 -13.898 1.00 0.00 C ATOM 0 H THR A 9 -6.867 -4.559 -13.246 1.00 0.00 H new ATOM 0 HA THR A 9 -8.409 -2.722 -14.893 1.00 0.00 H new ATOM 0 HB THR A 9 -6.089 -2.282 -15.862 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.163 -3.610 -13.498 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.398 -0.946 -13.911 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.148 -0.818 -14.204 1.00 0.00 H new ATOM 0 HG23 THR A 9 -6.540 -1.852 -12.890 1.00 0.00 H new ATOM 160 N GLY A 10 -7.475 -5.636 -15.856 1.00 0.00 N ATOM 161 CA GLY A 10 -7.575 -6.597 -16.922 1.00 0.00 C ATOM 162 C GLY A 10 -9.016 -6.939 -17.180 1.00 0.00 C ATOM 163 O GLY A 10 -9.472 -6.922 -18.319 1.00 0.00 O ATOM 0 H GLY A 10 -7.248 -6.032 -14.944 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -7.122 -6.195 -17.828 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -7.021 -7.499 -16.662 1.00 0.00 H new ATOM 167 N ASP A 11 -9.739 -7.237 -16.106 1.00 0.00 N ATOM 168 CA ASP A 11 -11.164 -7.517 -16.184 1.00 0.00 C ATOM 169 C ASP A 11 -11.919 -6.317 -16.729 1.00 0.00 C ATOM 170 O ASP A 11 -12.870 -6.468 -17.500 1.00 0.00 O ATOM 171 CB ASP A 11 -11.718 -7.931 -14.810 1.00 0.00 C ATOM 172 CG ASP A 11 -11.487 -9.401 -14.501 1.00 0.00 C ATOM 173 OD1 ASP A 11 -10.494 -9.733 -13.814 1.00 0.00 O ATOM 174 OD2 ASP A 11 -12.302 -10.239 -14.947 1.00 0.00 O1- ATOM 0 H ASP A 11 -9.354 -7.291 -15.163 1.00 0.00 H new ATOM 0 HA ASP A 11 -11.307 -8.351 -16.871 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -11.249 -7.324 -14.036 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -12.787 -7.721 -14.776 1.00 0.00 H new ATOM 179 N GLU A 12 -11.475 -5.122 -16.343 1.00 0.00 N ATOM 180 CA GLU A 12 -12.061 -3.891 -16.827 1.00 0.00 C ATOM 181 C GLU A 12 -11.875 -3.780 -18.342 1.00 0.00 C ATOM 182 O GLU A 12 -12.815 -3.450 -19.073 1.00 0.00 O ATOM 183 CB GLU A 12 -11.416 -2.700 -16.119 1.00 0.00 C ATOM 184 CG GLU A 12 -11.950 -1.359 -16.557 1.00 0.00 C ATOM 185 CD GLU A 12 -11.382 -0.215 -15.747 1.00 0.00 C ATOM 186 OE1 GLU A 12 -10.212 0.148 -15.958 1.00 0.00 O ATOM 187 OE2 GLU A 12 -12.106 0.331 -14.893 1.00 0.00 O1- ATOM 0 H GLU A 12 -10.703 -4.989 -15.690 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.129 -3.892 -16.611 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -11.566 -2.805 -15.045 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -10.341 -2.726 -16.295 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -11.716 -1.205 -17.610 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -13.036 -1.358 -16.468 1.00 0.00 H new ATOM 194 N LEU A 13 -10.661 -4.079 -18.804 1.00 0.00 N ATOM 195 CA LEU A 13 -10.343 -4.057 -20.226 1.00 0.00 C ATOM 196 C LEU A 13 -11.197 -5.068 -20.983 1.00 0.00 C ATOM 197 O LEU A 13 -11.676 -4.791 -22.077 1.00 0.00 O ATOM 198 CB LEU A 13 -8.851 -4.365 -20.432 1.00 0.00 C ATOM 199 CG LEU A 13 -8.375 -4.494 -21.885 1.00 0.00 C ATOM 200 CD1 LEU A 13 -8.540 -3.182 -22.630 1.00 0.00 C ATOM 201 CD2 LEU A 13 -6.925 -4.954 -21.928 1.00 0.00 C ATOM 0 H LEU A 13 -9.878 -4.341 -18.206 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.560 -3.063 -20.617 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.270 -3.578 -19.951 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.619 -5.295 -19.913 1.00 0.00 H new ATOM 0 HG LEU A 13 -8.993 -5.242 -22.381 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -8.195 -3.301 -23.657 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.591 -2.894 -22.631 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -7.952 -2.407 -22.137 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -6.601 -5.041 -22.965 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -6.297 -4.228 -21.412 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.836 -5.923 -21.438 1.00 0.00 H new ATOM 213 N VAL A 14 -11.399 -6.232 -20.381 1.00 0.00 N ATOM 214 CA VAL A 14 -12.207 -7.276 -20.992 1.00 0.00 C ATOM 215 C VAL A 14 -13.657 -6.823 -21.137 1.00 0.00 C ATOM 216 O VAL A 14 -14.252 -6.972 -22.196 1.00 0.00 O ATOM 217 CB VAL A 14 -12.146 -8.594 -20.178 1.00 0.00 C ATOM 218 CG1 VAL A 14 -13.079 -9.646 -20.769 1.00 0.00 C ATOM 219 CG2 VAL A 14 -10.719 -9.117 -20.133 1.00 0.00 C ATOM 0 H VAL A 14 -11.013 -6.476 -19.469 1.00 0.00 H new ATOM 0 HA VAL A 14 -11.793 -7.467 -21.982 1.00 0.00 H new ATOM 0 HB VAL A 14 -12.477 -8.383 -19.161 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -13.017 -10.560 -20.179 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -14.103 -9.274 -20.754 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -12.785 -9.857 -21.797 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -10.689 -10.043 -19.559 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -10.369 -9.308 -21.148 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.075 -8.376 -19.660 1.00 0.00 H new ATOM 229 N GLN A 15 -14.212 -6.259 -20.070 1.00 0.00 N ATOM 230 CA GLN A 15 -15.578 -5.764 -20.088 1.00 0.00 C ATOM 231 C GLN A 15 -15.762 -4.700 -21.181 1.00 0.00 C ATOM 232 O GLN A 15 -16.737 -4.735 -21.938 1.00 0.00 O ATOM 233 CB GLN A 15 -15.950 -5.202 -18.722 1.00 0.00 C ATOM 234 CG GLN A 15 -17.392 -4.784 -18.624 1.00 0.00 C ATOM 235 CD GLN A 15 -17.768 -4.299 -17.244 1.00 0.00 C ATOM 236 OE1 GLN A 15 -17.669 -3.110 -16.938 1.00 0.00 O ATOM 237 NE2 GLN A 15 -18.201 -5.212 -16.397 1.00 0.00 N ATOM 0 H GLN A 15 -13.732 -6.134 -19.179 1.00 0.00 H new ATOM 0 HA GLN A 15 -16.243 -6.597 -20.316 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -15.744 -5.953 -17.959 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -15.314 -4.344 -18.504 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -17.586 -3.992 -19.348 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -18.029 -5.626 -18.894 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -18.269 -6.187 -16.689 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -18.468 -4.943 -15.450 1.00 0.00 H new ATOM 246 N ALA A 16 -14.817 -3.772 -21.265 1.00 0.00 N ATOM 247 CA ALA A 16 -14.844 -2.736 -22.297 1.00 0.00 C ATOM 248 C ALA A 16 -14.707 -3.366 -23.683 1.00 0.00 C ATOM 249 O ALA A 16 -15.312 -2.912 -24.647 1.00 0.00 O ATOM 250 CB ALA A 16 -13.739 -1.722 -22.055 1.00 0.00 C ATOM 0 H ALA A 16 -14.020 -3.713 -20.631 1.00 0.00 H new ATOM 0 HA ALA A 16 -15.801 -2.217 -22.249 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -13.771 -0.957 -22.831 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -13.880 -1.256 -21.080 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -12.772 -2.224 -22.081 1.00 0.00 H new ATOM 256 N PHE A 17 -13.913 -4.427 -23.755 1.00 0.00 N ATOM 257 CA PHE A 17 -13.700 -5.155 -25.001 1.00 0.00 C ATOM 258 C PHE A 17 -14.999 -5.834 -25.437 1.00 0.00 C ATOM 259 O PHE A 17 -15.327 -5.874 -26.622 1.00 0.00 O ATOM 260 CB PHE A 17 -12.580 -6.193 -24.848 1.00 0.00 C ATOM 261 CG PHE A 17 -12.281 -6.954 -26.112 1.00 0.00 C ATOM 262 CD1 PHE A 17 -11.455 -6.411 -27.084 1.00 0.00 C ATOM 263 CD2 PHE A 17 -12.825 -8.212 -26.328 1.00 0.00 C ATOM 264 CE1 PHE A 17 -11.180 -7.106 -28.246 1.00 0.00 C ATOM 265 CE2 PHE A 17 -12.553 -8.910 -27.488 1.00 0.00 C ATOM 266 CZ PHE A 17 -11.729 -8.358 -28.447 1.00 0.00 C ATOM 0 H PHE A 17 -13.402 -4.806 -22.958 1.00 0.00 H new ATOM 0 HA PHE A 17 -13.395 -4.443 -25.768 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -11.673 -5.689 -24.515 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -12.857 -6.900 -24.066 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -11.022 -5.434 -26.931 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -13.469 -8.651 -25.580 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -10.537 -6.671 -28.997 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -12.985 -9.887 -27.644 1.00 0.00 H new ATOM 0 HZ PHE A 17 -11.513 -8.904 -29.354 1.00 0.00 H new ATOM 276 N GLN A 18 -15.732 -6.361 -24.469 1.00 0.00 N ATOM 277 CA GLN A 18 -17.005 -7.008 -24.739 1.00 0.00 C ATOM 278 C GLN A 18 -18.003 -5.988 -25.264 1.00 0.00 C ATOM 279 O GLN A 18 -18.770 -6.269 -26.189 1.00 0.00 O ATOM 280 CB GLN A 18 -17.537 -7.686 -23.480 1.00 0.00 C ATOM 281 CG GLN A 18 -16.615 -8.767 -22.946 1.00 0.00 C ATOM 282 CD GLN A 18 -17.118 -9.396 -21.669 1.00 0.00 C ATOM 283 OE1 GLN A 18 -17.799 -8.757 -20.869 1.00 0.00 O ATOM 284 NE2 GLN A 18 -16.790 -10.652 -21.468 1.00 0.00 N ATOM 0 H GLN A 18 -15.465 -6.353 -23.485 1.00 0.00 H new ATOM 0 HA GLN A 18 -16.858 -7.775 -25.499 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -17.689 -6.933 -22.707 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -18.512 -8.123 -23.695 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -16.496 -9.542 -23.703 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -15.628 -8.340 -22.769 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -16.223 -11.148 -22.156 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -17.102 -11.132 -20.624 1.00 0.00 H new ATOM 293 N ARG A 19 -17.979 -4.796 -24.681 1.00 0.00 N ATOM 294 CA ARG A 19 -18.827 -3.703 -25.136 1.00 0.00 C ATOM 295 C ARG A 19 -18.387 -3.264 -26.526 1.00 0.00 C ATOM 296 O ARG A 19 -19.209 -2.907 -27.373 1.00 0.00 O ATOM 297 CB ARG A 19 -18.757 -2.527 -24.161 1.00 0.00 C ATOM 298 CG ARG A 19 -19.667 -1.368 -24.531 1.00 0.00 C ATOM 299 CD ARG A 19 -19.568 -0.242 -23.519 1.00 0.00 C ATOM 300 NE ARG A 19 -19.975 -0.670 -22.180 1.00 0.00 N ATOM 301 CZ ARG A 19 -19.923 0.101 -21.096 1.00 0.00 C ATOM 302 NH1 ARG A 19 -19.466 1.348 -21.182 1.00 0.00 N1+ ATOM 303 NH2 ARG A 19 -20.325 -0.373 -19.926 1.00 0.00 N ATOM 0 H ARG A 19 -17.379 -4.562 -23.890 1.00 0.00 H new ATOM 0 HA ARG A 19 -19.860 -4.049 -25.178 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -19.019 -2.878 -23.163 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -17.729 -2.168 -24.112 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -19.400 -0.995 -25.520 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -20.698 -1.717 -24.590 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -18.543 0.126 -23.486 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -20.195 0.590 -23.840 1.00 0.00 H new ATOM 0 HE ARG A 19 -20.322 -1.623 -22.070 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -19.154 1.716 -22.081 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -19.428 1.936 -20.349 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -20.674 -1.329 -19.856 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -20.285 0.218 -19.095 1.00 0.00 H new ATOM 317 N LEU A 20 -17.078 -3.318 -26.751 1.00 0.00 N ATOM 318 CA LEU A 20 -16.489 -2.971 -28.036 1.00 0.00 C ATOM 319 C LEU A 20 -17.014 -3.926 -29.097 1.00 0.00 C ATOM 320 O LEU A 20 -17.274 -3.537 -30.230 1.00 0.00 O ATOM 321 CB LEU A 20 -14.958 -3.071 -27.957 1.00 0.00 C ATOM 322 CG LEU A 20 -14.190 -2.707 -29.227 1.00 0.00 C ATOM 323 CD1 LEU A 20 -14.238 -1.210 -29.470 1.00 0.00 C ATOM 324 CD2 LEU A 20 -12.752 -3.193 -29.139 1.00 0.00 C ATOM 0 H LEU A 20 -16.398 -3.604 -26.047 1.00 0.00 H new ATOM 0 HA LEU A 20 -16.760 -1.948 -28.296 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -14.614 -2.423 -27.151 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -14.696 -4.092 -27.679 1.00 0.00 H new ATOM 0 HG LEU A 20 -14.667 -3.204 -30.072 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -13.686 -0.971 -30.379 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -15.275 -0.893 -29.582 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -13.788 -0.690 -28.624 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -12.221 -2.925 -30.052 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -12.262 -2.727 -28.284 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -12.741 -4.276 -29.018 1.00 0.00 H new ATOM 336 N ARG A 21 -17.181 -5.182 -28.698 1.00 0.00 N ATOM 337 CA ARG A 21 -17.705 -6.215 -29.574 1.00 0.00 C ATOM 338 C ARG A 21 -19.144 -5.895 -29.977 1.00 0.00 C ATOM 339 O ARG A 21 -19.501 -5.988 -31.146 1.00 0.00 O ATOM 340 CB ARG A 21 -17.649 -7.582 -28.877 1.00 0.00 C ATOM 341 CG ARG A 21 -18.308 -8.699 -29.668 1.00 0.00 C ATOM 342 CD ARG A 21 -17.500 -9.063 -30.897 1.00 0.00 C ATOM 343 NE ARG A 21 -18.347 -9.554 -31.985 1.00 0.00 N ATOM 344 CZ ARG A 21 -18.049 -10.585 -32.777 1.00 0.00 C ATOM 345 NH1 ARG A 21 -16.998 -11.369 -32.507 1.00 0.00 N1+ ATOM 346 NH2 ARG A 21 -18.825 -10.848 -33.821 1.00 0.00 N ATOM 0 H ARG A 21 -16.956 -5.509 -27.758 1.00 0.00 H new ATOM 0 HA ARG A 21 -17.089 -6.249 -30.472 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -16.607 -7.844 -28.694 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -18.133 -7.504 -27.904 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -18.421 -9.578 -29.033 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -19.310 -8.391 -29.968 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -16.944 -8.189 -31.237 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -16.767 -9.826 -30.636 1.00 0.00 H new ATOM 0 HE ARG A 21 -19.231 -9.072 -32.150 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -16.417 -11.180 -31.690 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -16.778 -12.155 -33.118 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -19.640 -10.264 -34.011 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -18.607 -11.634 -34.434 1.00 0.00 H new ATOM 360 N GLU A 22 -19.951 -5.503 -28.998 1.00 0.00 N ATOM 361 CA GLU A 22 -21.358 -5.185 -29.242 1.00 0.00 C ATOM 362 C GLU A 22 -21.483 -4.034 -30.226 1.00 0.00 C ATOM 363 O GLU A 22 -22.202 -4.129 -31.219 1.00 0.00 O ATOM 364 CB GLU A 22 -22.047 -4.817 -27.933 1.00 0.00 C ATOM 365 CG GLU A 22 -21.968 -5.898 -26.876 1.00 0.00 C ATOM 366 CD GLU A 22 -22.662 -7.172 -27.294 1.00 0.00 C ATOM 367 OE1 GLU A 22 -23.888 -7.267 -27.104 1.00 0.00 O ATOM 368 OE2 GLU A 22 -21.983 -8.091 -27.812 1.00 0.00 O1- ATOM 0 H GLU A 22 -19.658 -5.397 -28.027 1.00 0.00 H new ATOM 0 HA GLU A 22 -21.840 -6.065 -29.668 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -21.598 -3.905 -27.541 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -23.095 -4.595 -28.135 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -20.922 -6.113 -26.659 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -22.416 -5.531 -25.952 1.00 0.00 H new ATOM 375 N ILE A 23 -20.778 -2.953 -29.946 1.00 0.00 N ATOM 376 CA ILE A 23 -20.733 -1.797 -30.829 1.00 0.00 C ATOM 377 C ILE A 23 -20.242 -2.197 -32.224 1.00 0.00 C ATOM 378 O ILE A 23 -20.714 -1.677 -33.240 1.00 0.00 O ATOM 379 CB ILE A 23 -19.814 -0.709 -30.243 1.00 0.00 C ATOM 380 CG1 ILE A 23 -20.322 -0.288 -28.864 1.00 0.00 C ATOM 381 CG2 ILE A 23 -19.752 0.491 -31.171 1.00 0.00 C ATOM 382 CD1 ILE A 23 -19.373 0.610 -28.116 1.00 0.00 C ATOM 0 H ILE A 23 -20.219 -2.850 -29.099 1.00 0.00 H new ATOM 0 HA ILE A 23 -21.744 -1.399 -30.916 1.00 0.00 H new ATOM 0 HB ILE A 23 -18.808 -1.116 -30.141 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -21.277 0.224 -28.980 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -20.509 -1.181 -28.268 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -19.098 1.250 -30.741 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -19.361 0.182 -32.140 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -20.753 0.904 -31.299 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -19.802 0.866 -27.147 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -18.424 0.094 -27.968 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -19.205 1.521 -28.691 1.00 0.00 H new ATOM 394 N PHE A 24 -19.314 -3.142 -32.255 1.00 0.00 N ATOM 395 CA PHE A 24 -18.745 -3.611 -33.506 1.00 0.00 C ATOM 396 C PHE A 24 -19.803 -4.376 -34.297 1.00 0.00 C ATOM 397 O PHE A 24 -19.980 -4.148 -35.492 1.00 0.00 O ATOM 398 CB PHE A 24 -17.517 -4.496 -33.266 1.00 0.00 C ATOM 399 CG PHE A 24 -16.789 -4.867 -34.531 1.00 0.00 C ATOM 400 CD1 PHE A 24 -15.707 -4.119 -34.964 1.00 0.00 C ATOM 401 CD2 PHE A 24 -17.190 -5.957 -35.289 1.00 0.00 C ATOM 402 CE1 PHE A 24 -15.040 -4.451 -36.127 1.00 0.00 C ATOM 403 CE2 PHE A 24 -16.526 -6.293 -36.450 1.00 0.00 C ATOM 404 CZ PHE A 24 -15.450 -5.541 -36.870 1.00 0.00 C ATOM 0 H PHE A 24 -18.939 -3.599 -31.424 1.00 0.00 H new ATOM 0 HA PHE A 24 -18.419 -2.743 -34.080 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -16.829 -3.976 -32.599 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -17.829 -5.407 -32.755 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -15.381 -3.267 -34.386 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -18.033 -6.550 -34.966 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -14.199 -3.859 -36.455 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -16.849 -7.145 -37.030 1.00 0.00 H new ATOM 0 HZ PHE A 24 -14.928 -5.803 -37.778 1.00 0.00 H new ATOM 414 N ASP A 25 -20.506 -5.284 -33.614 1.00 0.00 N ATOM 415 CA ASP A 25 -21.586 -6.059 -34.242 1.00 0.00 C ATOM 416 C ASP A 25 -22.698 -5.133 -34.726 1.00 0.00 C ATOM 417 O ASP A 25 -23.362 -5.413 -35.725 1.00 0.00 O ATOM 418 CB ASP A 25 -22.180 -7.100 -33.268 1.00 0.00 C ATOM 419 CG ASP A 25 -21.245 -8.263 -32.953 1.00 0.00 C ATOM 420 OD1 ASP A 25 -20.860 -9.006 -33.886 1.00 0.00 O ATOM 421 OD2 ASP A 25 -20.922 -8.463 -31.764 1.00 0.00 O1- ATOM 0 H ASP A 25 -20.349 -5.502 -32.630 1.00 0.00 H new ATOM 0 HA ASP A 25 -21.152 -6.586 -35.091 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -22.447 -6.600 -32.337 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -23.103 -7.495 -33.693 1.00 0.00 H new ATOM 426 N LYS A 26 -22.885 -4.022 -34.025 1.00 0.00 N ATOM 427 CA LYS A 26 -23.897 -3.034 -34.399 1.00 0.00 C ATOM 428 C LYS A 26 -23.377 -2.100 -35.494 1.00 0.00 C ATOM 429 O LYS A 26 -24.105 -1.224 -35.974 1.00 0.00 O ATOM 430 CB LYS A 26 -24.337 -2.219 -33.180 1.00 0.00 C ATOM 431 CG LYS A 26 -25.067 -3.029 -32.119 1.00 0.00 C ATOM 432 CD LYS A 26 -25.460 -2.157 -30.937 1.00 0.00 C ATOM 433 CE LYS A 26 -26.229 -2.944 -29.884 1.00 0.00 C ATOM 434 NZ LYS A 26 -27.525 -3.455 -30.401 1.00 0.00 N1+ ATOM 0 H LYS A 26 -22.349 -3.779 -33.192 1.00 0.00 H new ATOM 0 HA LYS A 26 -24.759 -3.575 -34.789 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -23.458 -1.758 -32.729 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -24.986 -1.409 -33.513 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -25.959 -3.482 -32.553 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -24.429 -3.844 -31.777 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -24.564 -1.728 -30.488 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -26.071 -1.325 -31.287 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -25.620 -3.781 -29.542 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -26.411 -2.308 -29.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -28.102 -3.804 -29.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -28.032 -2.688 -30.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -27.350 -4.232 -31.070 1.00 0.00 H new ATOM 448 N GLY A 27 -22.122 -2.306 -35.894 1.00 0.00 N ATOM 449 CA GLY A 27 -21.503 -1.493 -36.930 1.00 0.00 C ATOM 450 C GLY A 27 -21.491 -0.006 -36.628 1.00 0.00 C ATOM 451 O GLY A 27 -21.498 0.812 -37.547 1.00 0.00 O ATOM 0 H GLY A 27 -21.516 -3.032 -35.512 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -20.477 -1.831 -37.077 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -22.031 -1.658 -37.869 1.00 0.00 H new ATOM 455 N ASP A 28 -21.488 0.361 -35.360 1.00 0.00 N ATOM 456 CA ASP A 28 -21.499 1.773 -35.017 1.00 0.00 C ATOM 457 C ASP A 28 -20.098 2.316 -34.851 1.00 0.00 C ATOM 458 O ASP A 28 -19.544 2.321 -33.754 1.00 0.00 O ATOM 459 CB ASP A 28 -22.336 2.062 -33.779 1.00 0.00 C ATOM 460 CG ASP A 28 -22.578 3.548 -33.617 1.00 0.00 C ATOM 461 OD1 ASP A 28 -21.901 4.184 -32.798 1.00 0.00 O ATOM 462 OD2 ASP A 28 -23.441 4.091 -34.340 1.00 0.00 O1- ATOM 0 H ASP A 28 -21.478 -0.280 -34.567 1.00 0.00 H new ATOM 0 HA ASP A 28 -21.968 2.289 -35.855 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -23.291 1.541 -33.852 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -21.829 1.675 -32.895 1.00 0.00 H new ATOM 467 N ASP A 29 -19.522 2.751 -35.958 1.00 0.00 N ATOM 468 CA ASP A 29 -18.174 3.317 -35.974 1.00 0.00 C ATOM 469 C ASP A 29 -18.041 4.519 -35.048 1.00 0.00 C ATOM 470 O ASP A 29 -16.968 4.772 -34.511 1.00 0.00 O ATOM 471 CB ASP A 29 -17.775 3.727 -37.395 1.00 0.00 C ATOM 472 CG ASP A 29 -17.395 2.554 -38.266 1.00 0.00 C ATOM 473 OD1 ASP A 29 -16.202 2.209 -38.307 1.00 0.00 O ATOM 474 OD2 ASP A 29 -18.285 1.976 -38.926 1.00 0.00 O1- ATOM 0 H ASP A 29 -19.971 2.724 -36.874 1.00 0.00 H new ATOM 0 HA ASP A 29 -17.504 2.536 -35.614 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -18.604 4.262 -37.858 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -16.936 4.421 -37.344 1.00 0.00 H new ATOM 479 N ASP A 30 -19.136 5.241 -34.848 1.00 0.00 N ATOM 480 CA ASP A 30 -19.122 6.456 -34.027 1.00 0.00 C ATOM 481 C ASP A 30 -18.815 6.143 -32.574 1.00 0.00 C ATOM 482 O ASP A 30 -17.957 6.770 -31.960 1.00 0.00 O ATOM 483 CB ASP A 30 -20.462 7.179 -34.119 1.00 0.00 C ATOM 484 CG ASP A 30 -20.732 7.733 -35.490 1.00 0.00 C ATOM 485 OD1 ASP A 30 -20.279 8.854 -35.780 1.00 0.00 O ATOM 486 OD2 ASP A 30 -21.406 7.056 -36.287 1.00 0.00 O1- ATOM 0 H ASP A 30 -20.048 5.010 -35.241 1.00 0.00 H new ATOM 0 HA ASP A 30 -18.333 7.101 -34.415 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -21.261 6.489 -33.847 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -20.482 7.992 -33.393 1.00 0.00 H new ATOM 491 N SER A 31 -19.523 5.191 -32.025 1.00 0.00 N ATOM 492 CA SER A 31 -19.294 4.774 -30.663 1.00 0.00 C ATOM 493 C SER A 31 -18.015 3.936 -30.579 1.00 0.00 C ATOM 494 O SER A 31 -17.285 3.987 -29.585 1.00 0.00 O ATOM 495 CB SER A 31 -20.506 3.989 -30.145 1.00 0.00 C ATOM 496 OG SER A 31 -20.373 3.676 -28.771 1.00 0.00 O ATOM 0 H SER A 31 -20.269 4.685 -32.503 1.00 0.00 H new ATOM 0 HA SER A 31 -19.164 5.654 -30.033 1.00 0.00 H new ATOM 0 HB2 SER A 31 -21.413 4.574 -30.300 1.00 0.00 H new ATOM 0 HB3 SER A 31 -20.618 3.069 -30.720 1.00 0.00 H new ATOM 0 HG SER A 31 -21.162 3.177 -28.471 1.00 0.00 H new ATOM 502 N LEU A 32 -17.737 3.198 -31.650 1.00 0.00 N ATOM 503 CA LEU A 32 -16.588 2.303 -31.714 1.00 0.00 C ATOM 504 C LEU A 32 -15.273 3.070 -31.569 1.00 0.00 C ATOM 505 O LEU A 32 -14.418 2.688 -30.775 1.00 0.00 O ATOM 506 CB LEU A 32 -16.601 1.561 -33.058 1.00 0.00 C ATOM 507 CG LEU A 32 -15.613 0.406 -33.211 1.00 0.00 C ATOM 508 CD1 LEU A 32 -16.055 -0.785 -32.380 1.00 0.00 C ATOM 509 CD2 LEU A 32 -15.474 0.017 -34.675 1.00 0.00 C ATOM 0 H LEU A 32 -18.303 3.204 -32.498 1.00 0.00 H new ATOM 0 HA LEU A 32 -16.659 1.595 -30.889 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.606 1.174 -33.224 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.404 2.285 -33.849 1.00 0.00 H new ATOM 0 HG LEU A 32 -14.638 0.733 -32.849 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.340 -1.599 -32.501 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.104 -0.498 -31.330 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -17.039 -1.115 -32.712 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.767 -0.807 -34.767 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.444 -0.293 -35.063 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.111 0.872 -35.246 1.00 0.00 H new ATOM 521 N GLU A 33 -15.132 4.162 -32.316 1.00 0.00 N ATOM 522 CA GLU A 33 -13.900 4.953 -32.300 1.00 0.00 C ATOM 523 C GLU A 33 -13.592 5.506 -30.904 1.00 0.00 C ATOM 524 O GLU A 33 -12.445 5.483 -30.457 1.00 0.00 O ATOM 525 CB GLU A 33 -13.974 6.088 -33.327 1.00 0.00 C ATOM 526 CG GLU A 33 -15.179 6.991 -33.155 1.00 0.00 C ATOM 527 CD GLU A 33 -15.265 8.060 -34.208 1.00 0.00 C ATOM 528 OE1 GLU A 33 -14.884 9.210 -33.918 1.00 0.00 O ATOM 529 OE2 GLU A 33 -15.709 7.763 -35.328 1.00 0.00 O1- ATOM 0 H GLU A 33 -15.854 4.521 -32.940 1.00 0.00 H new ATOM 0 HA GLU A 33 -13.082 4.286 -32.573 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -13.068 6.690 -33.256 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -13.994 5.658 -34.329 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -16.086 6.387 -33.183 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -15.138 7.459 -32.172 1.00 0.00 H new ATOM 536 N GLN A 34 -14.620 5.988 -30.224 1.00 0.00 N ATOM 537 CA GLN A 34 -14.458 6.543 -28.888 1.00 0.00 C ATOM 538 C GLN A 34 -14.075 5.454 -27.889 1.00 0.00 C ATOM 539 O GLN A 34 -13.211 5.658 -27.033 1.00 0.00 O ATOM 540 CB GLN A 34 -15.732 7.263 -28.460 1.00 0.00 C ATOM 541 CG GLN A 34 -16.098 8.420 -29.380 1.00 0.00 C ATOM 542 CD GLN A 34 -17.404 9.083 -29.008 1.00 0.00 C ATOM 543 OE1 GLN A 34 -17.789 9.115 -27.840 1.00 0.00 O ATOM 544 NE2 GLN A 34 -18.091 9.615 -29.994 1.00 0.00 N ATOM 0 H GLN A 34 -15.577 6.006 -30.575 1.00 0.00 H new ATOM 0 HA GLN A 34 -13.646 7.269 -28.908 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -16.556 6.550 -28.437 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.607 7.639 -27.444 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -15.300 9.163 -29.355 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -16.162 8.055 -30.405 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -17.735 9.566 -30.948 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -18.980 10.077 -29.805 1.00 0.00 H new ATOM 553 N VAL A 35 -14.703 4.292 -28.017 1.00 0.00 N ATOM 554 CA VAL A 35 -14.398 3.156 -27.157 1.00 0.00 C ATOM 555 C VAL A 35 -12.975 2.642 -27.408 1.00 0.00 C ATOM 556 O VAL A 35 -12.307 2.178 -26.489 1.00 0.00 O ATOM 557 CB VAL A 35 -15.437 2.008 -27.307 1.00 0.00 C ATOM 558 CG1 VAL A 35 -14.979 0.749 -26.581 1.00 0.00 C ATOM 559 CG2 VAL A 35 -16.778 2.453 -26.753 1.00 0.00 C ATOM 0 H VAL A 35 -15.429 4.111 -28.710 1.00 0.00 H new ATOM 0 HA VAL A 35 -14.459 3.511 -26.128 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.533 1.776 -28.368 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.726 -0.035 -26.705 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.029 0.414 -26.998 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.853 0.966 -25.520 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.502 1.645 -26.860 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -16.670 2.706 -25.698 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -17.126 3.328 -27.302 1.00 0.00 H new ATOM 569 N LEU A 36 -12.508 2.746 -28.655 1.00 0.00 N ATOM 570 CA LEU A 36 -11.153 2.307 -28.999 1.00 0.00 C ATOM 571 C LEU A 36 -10.126 3.065 -28.176 1.00 0.00 C ATOM 572 O LEU A 36 -9.160 2.485 -27.695 1.00 0.00 O ATOM 573 CB LEU A 36 -10.861 2.540 -30.484 1.00 0.00 C ATOM 574 CG LEU A 36 -11.692 1.735 -31.474 1.00 0.00 C ATOM 575 CD1 LEU A 36 -11.387 2.182 -32.891 1.00 0.00 C ATOM 576 CD2 LEU A 36 -11.418 0.246 -31.318 1.00 0.00 C ATOM 0 H LEU A 36 -13.042 3.126 -29.436 1.00 0.00 H new ATOM 0 HA LEU A 36 -11.088 1.241 -28.782 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -11.006 3.599 -30.698 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -9.809 2.320 -30.663 1.00 0.00 H new ATOM 0 HG LEU A 36 -12.748 1.911 -31.267 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.986 1.601 -33.593 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -11.627 3.240 -32.998 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -10.329 2.027 -33.102 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -12.021 -0.312 -32.034 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -10.362 0.049 -31.502 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -11.674 -0.067 -30.306 1.00 0.00 H new ATOM 588 N GLU A 37 -10.367 4.356 -27.981 1.00 0.00 N ATOM 589 CA GLU A 37 -9.463 5.189 -27.203 1.00 0.00 C ATOM 590 C GLU A 37 -9.484 4.757 -25.748 1.00 0.00 C ATOM 591 O GLU A 37 -8.475 4.842 -25.043 1.00 0.00 O ATOM 592 CB GLU A 37 -9.852 6.655 -27.318 1.00 0.00 C ATOM 593 CG GLU A 37 -9.804 7.195 -28.734 1.00 0.00 C ATOM 594 CD GLU A 37 -10.161 8.658 -28.799 1.00 0.00 C ATOM 595 OE1 GLU A 37 -10.074 9.247 -29.895 1.00 0.00 O ATOM 596 OE2 GLU A 37 -10.536 9.230 -27.750 1.00 0.00 O1- ATOM 0 H GLU A 37 -11.181 4.847 -28.351 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.454 5.068 -27.597 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -10.860 6.785 -26.924 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.186 7.248 -26.691 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -8.804 7.048 -29.143 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -10.491 6.627 -29.361 1.00 0.00 H new ATOM 603 N GLU A 38 -10.645 4.297 -25.304 1.00 0.00 N ATOM 604 CA GLU A 38 -10.809 3.793 -23.959 1.00 0.00 C ATOM 605 C GLU A 38 -10.006 2.505 -23.813 1.00 0.00 C ATOM 606 O GLU A 38 -9.289 2.315 -22.839 1.00 0.00 O ATOM 607 CB GLU A 38 -12.297 3.530 -23.688 1.00 0.00 C ATOM 608 CG GLU A 38 -12.610 3.067 -22.278 1.00 0.00 C ATOM 609 CD GLU A 38 -12.280 4.109 -21.240 1.00 0.00 C ATOM 610 OE1 GLU A 38 -13.034 5.100 -21.123 1.00 0.00 O ATOM 611 OE2 GLU A 38 -11.281 3.943 -20.524 1.00 0.00 O1- ATOM 0 H GLU A 38 -11.494 4.265 -25.868 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.448 4.525 -23.237 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.856 4.444 -23.889 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -12.653 2.777 -24.391 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.668 2.813 -22.209 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.049 2.157 -22.065 1.00 0.00 H new ATOM 618 N ILE A 39 -10.107 1.651 -24.825 1.00 0.00 N ATOM 619 CA ILE A 39 -9.393 0.382 -24.838 1.00 0.00 C ATOM 620 C ILE A 39 -7.889 0.634 -24.820 1.00 0.00 C ATOM 621 O ILE A 39 -7.162 0.046 -24.016 1.00 0.00 O ATOM 622 CB ILE A 39 -9.748 -0.464 -26.090 1.00 0.00 C ATOM 623 CG1 ILE A 39 -11.246 -0.786 -26.122 1.00 0.00 C ATOM 624 CG2 ILE A 39 -8.929 -1.752 -26.117 1.00 0.00 C ATOM 625 CD1 ILE A 39 -11.723 -1.624 -24.955 1.00 0.00 C ATOM 0 H ILE A 39 -10.681 1.817 -25.652 1.00 0.00 H new ATOM 0 HA ILE A 39 -9.695 -0.174 -23.950 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.503 0.123 -26.976 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -11.807 0.148 -26.138 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -11.474 -1.311 -27.050 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -9.192 -2.332 -27.002 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -7.867 -1.507 -26.146 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.143 -2.338 -25.223 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -12.793 -1.808 -25.052 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -11.191 -2.575 -24.949 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -11.529 -1.093 -24.023 1.00 0.00 H new ATOM 637 N GLU A 40 -7.433 1.531 -25.697 1.00 0.00 N ATOM 638 CA GLU A 40 -6.023 1.903 -25.772 1.00 0.00 C ATOM 639 C GLU A 40 -5.511 2.418 -24.427 1.00 0.00 C ATOM 640 O GLU A 40 -4.402 2.078 -24.005 1.00 0.00 O ATOM 641 CB GLU A 40 -5.814 2.975 -26.855 1.00 0.00 C ATOM 642 CG GLU A 40 -6.139 2.510 -28.273 1.00 0.00 C ATOM 643 CD GLU A 40 -6.023 3.624 -29.304 1.00 0.00 C ATOM 644 OE1 GLU A 40 -4.903 4.154 -29.487 1.00 0.00 O ATOM 645 OE2 GLU A 40 -7.044 3.966 -29.950 1.00 0.00 O1- ATOM 0 H GLU A 40 -8.028 2.015 -26.369 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.456 1.010 -26.033 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.434 3.839 -26.618 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.777 3.309 -26.824 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -5.466 1.697 -28.547 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.151 2.106 -28.294 1.00 0.00 H new ATOM 652 N GLU A 41 -6.320 3.222 -23.754 1.00 0.00 N ATOM 653 CA GLU A 41 -5.955 3.768 -22.480 1.00 0.00 C ATOM 654 C GLU A 41 -5.946 2.681 -21.400 1.00 0.00 C ATOM 655 O GLU A 41 -5.106 2.695 -20.498 1.00 0.00 O ATOM 656 CB GLU A 41 -6.921 4.874 -22.114 1.00 0.00 C ATOM 657 CG GLU A 41 -6.549 5.613 -20.867 1.00 0.00 C ATOM 658 CD GLU A 41 -5.244 6.379 -21.000 1.00 0.00 C ATOM 659 OE1 GLU A 41 -4.163 5.750 -20.949 1.00 0.00 O ATOM 660 OE2 GLU A 41 -5.293 7.614 -21.136 1.00 0.00 O1- ATOM 0 H GLU A 41 -7.242 3.506 -24.084 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.947 4.177 -22.546 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -6.979 5.582 -22.941 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.916 4.448 -21.989 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -7.348 6.309 -20.611 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.466 4.905 -20.042 1.00 0.00 H new ATOM 667 N LEU A 42 -6.869 1.731 -21.509 1.00 0.00 N ATOM 668 CA LEU A 42 -6.974 0.648 -20.543 1.00 0.00 C ATOM 669 C LEU A 42 -5.778 -0.276 -20.639 1.00 0.00 C ATOM 670 O LEU A 42 -5.313 -0.808 -19.632 1.00 0.00 O ATOM 671 CB LEU A 42 -8.273 -0.133 -20.725 1.00 0.00 C ATOM 672 CG LEU A 42 -9.555 0.624 -20.380 1.00 0.00 C ATOM 673 CD1 LEU A 42 -10.771 -0.260 -20.581 1.00 0.00 C ATOM 674 CD2 LEU A 42 -9.501 1.140 -18.953 1.00 0.00 C ATOM 0 H LEU A 42 -7.557 1.691 -22.261 1.00 0.00 H new ATOM 0 HA LEU A 42 -6.987 1.092 -19.548 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.335 -0.462 -21.762 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.225 -1.030 -20.108 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.639 1.478 -21.052 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -11.673 0.299 -20.330 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.820 -0.580 -21.622 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.695 -1.135 -19.936 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.422 1.676 -18.725 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.390 0.301 -18.267 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -8.652 1.814 -18.842 1.00 0.00 H new ATOM 686 N ILE A 43 -5.280 -0.468 -21.856 1.00 0.00 N ATOM 687 CA ILE A 43 -4.104 -1.293 -22.074 1.00 0.00 C ATOM 688 C ILE A 43 -2.929 -0.709 -21.301 1.00 0.00 C ATOM 689 O ILE A 43 -2.203 -1.428 -20.613 1.00 0.00 O ATOM 690 CB ILE A 43 -3.731 -1.365 -23.579 1.00 0.00 C ATOM 691 CG1 ILE A 43 -4.865 -2.005 -24.385 1.00 0.00 C ATOM 692 CG2 ILE A 43 -2.431 -2.145 -23.776 1.00 0.00 C ATOM 693 CD1 ILE A 43 -4.636 -1.984 -25.884 1.00 0.00 C ATOM 0 H ILE A 43 -5.675 -0.062 -22.705 1.00 0.00 H new ATOM 0 HA ILE A 43 -4.330 -2.301 -21.726 1.00 0.00 H new ATOM 0 HB ILE A 43 -3.581 -0.348 -23.942 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -4.991 -3.038 -24.060 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -5.796 -1.484 -24.161 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -2.187 -2.184 -24.838 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -1.624 -1.649 -23.236 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -2.554 -3.159 -23.395 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -5.480 -2.454 -26.388 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.540 -0.953 -26.223 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.723 -2.530 -26.120 1.00 0.00 H new ATOM 705 N GLN A 44 -2.780 0.608 -21.384 1.00 0.00 N ATOM 706 CA GLN A 44 -1.713 1.301 -20.682 1.00 0.00 C ATOM 707 C GLN A 44 -1.963 1.279 -19.182 1.00 0.00 C ATOM 708 O GLN A 44 -1.046 1.090 -18.400 1.00 0.00 O ATOM 709 CB GLN A 44 -1.597 2.749 -21.162 1.00 0.00 C ATOM 710 CG GLN A 44 -1.370 2.896 -22.657 1.00 0.00 C ATOM 711 CD GLN A 44 -0.163 2.124 -23.156 1.00 0.00 C ATOM 712 OE1 GLN A 44 0.797 1.898 -22.420 1.00 0.00 O ATOM 713 NE2 GLN A 44 -0.197 1.739 -24.416 1.00 0.00 N ATOM 0 H GLN A 44 -3.388 1.216 -21.933 1.00 0.00 H new ATOM 0 HA GLN A 44 -0.778 0.784 -20.897 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -2.507 3.283 -20.890 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -0.775 3.230 -20.632 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.258 2.553 -23.188 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -1.243 3.952 -22.897 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -1.013 1.947 -24.991 1.00 0.00 H new ATOM 0 HE22 GLN A 44 0.593 1.233 -24.816 1.00 0.00 H new ATOM 722 N LYS A 45 -3.221 1.443 -18.800 1.00 0.00 N ATOM 723 CA LYS A 45 -3.629 1.464 -17.394 1.00 0.00 C ATOM 724 C LYS A 45 -3.320 0.122 -16.729 1.00 0.00 C ATOM 725 O LYS A 45 -2.779 0.064 -15.625 1.00 0.00 O ATOM 726 CB LYS A 45 -5.132 1.760 -17.318 1.00 0.00 C ATOM 727 CG LYS A 45 -5.709 1.822 -15.916 1.00 0.00 C ATOM 728 CD LYS A 45 -7.209 2.061 -15.974 1.00 0.00 C ATOM 729 CE LYS A 45 -7.832 2.131 -14.592 1.00 0.00 C ATOM 730 NZ LYS A 45 -9.309 2.253 -14.670 1.00 0.00 N1+ ATOM 0 H LYS A 45 -3.993 1.566 -19.455 1.00 0.00 H new ATOM 0 HA LYS A 45 -3.075 2.240 -16.866 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -5.324 2.711 -17.815 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -5.666 0.993 -17.880 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -5.502 0.891 -15.389 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.228 2.621 -15.352 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -7.407 2.991 -16.507 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -7.681 1.260 -16.543 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -7.568 1.237 -14.027 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -7.423 2.983 -14.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -9.682 2.551 -13.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -9.561 2.960 -15.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -9.720 1.334 -14.929 1.00 0.00 H new ATOM 744 N HIS A 46 -3.647 -0.942 -17.430 1.00 0.00 N ATOM 745 CA HIS A 46 -3.420 -2.300 -16.963 1.00 0.00 C ATOM 746 C HIS A 46 -1.925 -2.618 -16.958 1.00 0.00 C ATOM 747 O HIS A 46 -1.410 -3.218 -16.012 1.00 0.00 O ATOM 748 CB HIS A 46 -4.205 -3.258 -17.878 1.00 0.00 C ATOM 749 CG HIS A 46 -3.970 -4.728 -17.682 1.00 0.00 C ATOM 750 ND1 HIS A 46 -4.137 -5.395 -16.485 1.00 0.00 N ATOM 751 CD2 HIS A 46 -3.621 -5.662 -18.582 1.00 0.00 C ATOM 752 CE1 HIS A 46 -3.896 -6.689 -16.674 1.00 0.00 C ATOM 753 NE2 HIS A 46 -3.581 -6.871 -17.949 1.00 0.00 N ATOM 0 H HIS A 46 -4.083 -0.892 -18.351 1.00 0.00 H new ATOM 0 HA HIS A 46 -3.771 -2.417 -15.938 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -5.269 -3.063 -17.741 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -3.966 -3.011 -18.913 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -4.402 -4.965 -15.599 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -3.409 -5.487 -19.626 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -3.948 -7.459 -15.919 1.00 0.00 H new ATOM 761 N ARG A 47 -1.238 -2.203 -18.013 1.00 0.00 N ATOM 762 CA ARG A 47 0.199 -2.420 -18.131 1.00 0.00 C ATOM 763 C ARG A 47 0.978 -1.616 -17.084 1.00 0.00 C ATOM 764 O ARG A 47 2.011 -2.062 -16.606 1.00 0.00 O ATOM 765 CB ARG A 47 0.685 -2.057 -19.535 1.00 0.00 C ATOM 766 CG ARG A 47 2.152 -2.374 -19.780 1.00 0.00 C ATOM 767 CD ARG A 47 2.618 -1.840 -21.121 1.00 0.00 C ATOM 768 NE ARG A 47 4.029 -2.133 -21.362 1.00 0.00 N ATOM 769 CZ ARG A 47 5.029 -1.273 -21.146 1.00 0.00 C ATOM 770 NH1 ARG A 47 4.781 -0.076 -20.631 1.00 0.00 N1+ ATOM 771 NH2 ARG A 47 6.276 -1.618 -21.431 1.00 0.00 N ATOM 0 H ARG A 47 -1.654 -1.712 -18.804 1.00 0.00 H new ATOM 0 HA ARG A 47 0.385 -3.479 -17.952 1.00 0.00 H new ATOM 0 HB2 ARG A 47 0.081 -2.592 -20.268 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.521 -0.992 -19.702 1.00 0.00 H new ATOM 0 HG2 ARG A 47 2.757 -1.940 -18.984 1.00 0.00 H new ATOM 0 HG3 ARG A 47 2.303 -3.453 -19.744 1.00 0.00 H new ATOM 0 HD2 ARG A 47 2.015 -2.278 -21.916 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.459 -0.762 -21.158 1.00 0.00 H new ATOM 0 HE ARG A 47 4.267 -3.058 -21.720 1.00 0.00 H new ATOM 0 HH11 ARG A 47 3.824 0.191 -20.398 1.00 0.00 H new ATOM 0 HH12 ARG A 47 5.547 0.578 -20.468 1.00 0.00 H new ATOM 0 HH21 ARG A 47 6.474 -2.541 -21.816 1.00 0.00 H new ATOM 0 HH22 ARG A 47 7.038 -0.960 -21.265 1.00 0.00 H new ATOM 785 N GLN A 48 0.456 -0.442 -16.707 1.00 0.00 N ATOM 786 CA GLN A 48 1.133 0.426 -15.735 1.00 0.00 C ATOM 787 C GLN A 48 1.301 -0.267 -14.401 1.00 0.00 C ATOM 788 O GLN A 48 2.316 -0.098 -13.724 1.00 0.00 O ATOM 789 CB GLN A 48 0.371 1.744 -15.535 1.00 0.00 C ATOM 790 CG GLN A 48 0.656 2.799 -16.594 1.00 0.00 C ATOM 791 CD GLN A 48 2.120 3.188 -16.647 1.00 0.00 C ATOM 792 OE1 GLN A 48 2.830 3.124 -15.642 1.00 0.00 O ATOM 793 NE2 GLN A 48 2.577 3.599 -17.812 1.00 0.00 N ATOM 0 H GLN A 48 -0.428 -0.073 -17.058 1.00 0.00 H new ATOM 0 HA GLN A 48 2.119 0.648 -16.143 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -0.699 1.534 -15.527 1.00 0.00 H new ATOM 0 HB3 GLN A 48 0.624 2.151 -14.556 1.00 0.00 H new ATOM 0 HG2 GLN A 48 0.348 2.422 -17.569 1.00 0.00 H new ATOM 0 HG3 GLN A 48 0.055 3.685 -16.390 1.00 0.00 H new ATOM 0 HE21 GLN A 48 1.955 3.637 -18.619 1.00 0.00 H new ATOM 0 HE22 GLN A 48 3.553 3.879 -17.907 1.00 0.00 H new ATOM 802 N LEU A 49 0.314 -1.050 -14.020 1.00 0.00 N ATOM 803 CA LEU A 49 0.364 -1.755 -12.768 1.00 0.00 C ATOM 804 C LEU A 49 1.306 -2.936 -12.875 1.00 0.00 C ATOM 805 O LEU A 49 1.921 -3.345 -11.896 1.00 0.00 O ATOM 806 CB LEU A 49 -1.035 -2.186 -12.359 1.00 0.00 C ATOM 807 CG LEU A 49 -2.003 -1.031 -12.093 1.00 0.00 C ATOM 808 CD1 LEU A 49 -3.399 -1.547 -11.872 1.00 0.00 C ATOM 809 CD2 LEU A 49 -1.545 -0.208 -10.896 1.00 0.00 C ATOM 0 H LEU A 49 -0.533 -1.211 -14.565 1.00 0.00 H new ATOM 0 HA LEU A 49 0.749 -1.093 -11.992 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.451 -2.818 -13.144 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.964 -2.799 -11.460 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.009 -0.386 -12.972 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -4.071 -0.710 -11.685 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.731 -2.088 -12.758 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.407 -2.218 -11.013 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.248 0.608 -10.725 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.505 -0.844 -10.011 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.555 0.202 -11.094 1.00 0.00 H new ATOM 821 N PHE A 50 1.423 -3.469 -14.089 1.00 0.00 N ATOM 822 CA PHE A 50 2.335 -4.570 -14.373 1.00 0.00 C ATOM 823 C PHE A 50 3.776 -4.084 -14.264 1.00 0.00 C ATOM 824 O PHE A 50 4.675 -4.842 -13.903 1.00 0.00 O ATOM 825 CB PHE A 50 2.062 -5.158 -15.765 1.00 0.00 C ATOM 826 CG PHE A 50 2.939 -6.333 -16.111 1.00 0.00 C ATOM 827 CD1 PHE A 50 2.822 -7.529 -15.419 1.00 0.00 C ATOM 828 CD2 PHE A 50 3.878 -6.240 -17.127 1.00 0.00 C ATOM 829 CE1 PHE A 50 3.626 -8.608 -15.732 1.00 0.00 C ATOM 830 CE2 PHE A 50 4.684 -7.318 -17.444 1.00 0.00 C ATOM 831 CZ PHE A 50 4.557 -8.503 -16.745 1.00 0.00 C ATOM 0 H PHE A 50 0.890 -3.151 -14.899 1.00 0.00 H new ATOM 0 HA PHE A 50 2.173 -5.361 -13.641 1.00 0.00 H new ATOM 0 HB2 PHE A 50 1.018 -5.467 -15.820 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.204 -4.378 -16.513 1.00 0.00 H new ATOM 0 HD1 PHE A 50 2.094 -7.618 -14.626 1.00 0.00 H new ATOM 0 HD2 PHE A 50 3.981 -5.316 -17.677 1.00 0.00 H new ATOM 0 HE1 PHE A 50 3.526 -9.533 -15.184 1.00 0.00 H new ATOM 0 HE2 PHE A 50 5.412 -7.234 -18.237 1.00 0.00 H new ATOM 0 HZ PHE A 50 5.186 -9.346 -16.991 1.00 0.00 H new ATOM 841 N ASP A 51 3.976 -2.794 -14.538 1.00 0.00 N ATOM 842 CA ASP A 51 5.298 -2.176 -14.442 1.00 0.00 C ATOM 843 C ASP A 51 5.679 -2.029 -12.980 1.00 0.00 C ATOM 844 O ASP A 51 6.823 -1.737 -12.646 1.00 0.00 O ATOM 845 CB ASP A 51 5.318 -0.786 -15.099 1.00 0.00 C ATOM 846 CG ASP A 51 5.177 -0.809 -16.609 1.00 0.00 C ATOM 847 OD1 ASP A 51 6.024 -1.429 -17.281 1.00 0.00 O ATOM 848 OD2 ASP A 51 4.246 -0.151 -17.131 1.00 0.00 O1- ATOM 0 H ASP A 51 3.236 -2.155 -14.829 1.00 0.00 H new ATOM 0 HA ASP A 51 6.008 -2.818 -14.964 1.00 0.00 H new ATOM 0 HB2 ASP A 51 4.510 -0.187 -14.679 1.00 0.00 H new ATOM 0 HB3 ASP A 51 6.252 -0.288 -14.840 1.00 0.00 H new ATOM 853 N ASN A 52 4.699 -2.226 -12.113 1.00 0.00 N ATOM 854 CA ASN A 52 4.883 -2.102 -10.678 1.00 0.00 C ATOM 855 C ASN A 52 4.654 -3.448 -10.005 1.00 0.00 C ATOM 856 O ASN A 52 4.495 -3.532 -8.785 1.00 0.00 O ATOM 857 CB ASN A 52 3.915 -1.061 -10.105 1.00 0.00 C ATOM 858 CG ASN A 52 4.316 0.369 -10.422 1.00 0.00 C ATOM 859 OD1 ASN A 52 5.024 1.007 -9.646 1.00 0.00 O ATOM 860 ND2 ASN A 52 3.866 0.884 -11.552 1.00 0.00 N ATOM 0 H ASN A 52 3.749 -2.478 -12.387 1.00 0.00 H new ATOM 0 HA ASN A 52 5.905 -1.775 -10.484 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.916 -1.247 -10.500 1.00 0.00 H new ATOM 0 HB3 ASN A 52 3.858 -1.184 -9.023 1.00 0.00 H new ATOM 0 HD21 ASN A 52 4.104 1.843 -11.806 1.00 0.00 H new ATOM 0 HD22 ASN A 52 3.280 0.323 -12.171 1.00 0.00 H new ATOM 867 N ARG A 53 4.613 -4.494 -10.812 1.00 0.00 N ATOM 868 CA ARG A 53 4.425 -5.843 -10.311 1.00 0.00 C ATOM 869 C ARG A 53 5.751 -6.541 -10.143 1.00 0.00 C ATOM 870 O ARG A 53 6.661 -6.375 -10.962 1.00 0.00 O ATOM 871 CB ARG A 53 3.540 -6.663 -11.255 1.00 0.00 C ATOM 872 CG ARG A 53 2.058 -6.354 -11.156 1.00 0.00 C ATOM 873 CD ARG A 53 1.498 -6.746 -9.797 1.00 0.00 C ATOM 874 NE ARG A 53 1.717 -8.166 -9.494 1.00 0.00 N ATOM 875 CZ ARG A 53 1.714 -8.682 -8.258 1.00 0.00 C ATOM 876 NH1 ARG A 53 1.526 -7.895 -7.208 1.00 0.00 N1+ ATOM 877 NH2 ARG A 53 1.919 -9.979 -8.078 1.00 0.00 N ATOM 0 H ARG A 53 4.708 -4.433 -11.826 1.00 0.00 H new ATOM 0 HA ARG A 53 3.933 -5.765 -9.341 1.00 0.00 H new ATOM 0 HB2 ARG A 53 3.866 -6.490 -12.280 1.00 0.00 H new ATOM 0 HB3 ARG A 53 3.692 -7.722 -11.047 1.00 0.00 H new ATOM 0 HG2 ARG A 53 1.895 -5.290 -11.325 1.00 0.00 H new ATOM 0 HG3 ARG A 53 1.521 -6.887 -11.940 1.00 0.00 H new ATOM 0 HD2 ARG A 53 1.965 -6.135 -9.024 1.00 0.00 H new ATOM 0 HD3 ARG A 53 0.430 -6.531 -9.771 1.00 0.00 H new ATOM 0 HE ARG A 53 1.882 -8.801 -10.275 1.00 0.00 H new ATOM 0 HH11 ARG A 53 1.383 -6.894 -7.340 1.00 0.00 H new ATOM 0 HH12 ARG A 53 1.524 -8.291 -6.268 1.00 0.00 H new ATOM 0 HH21 ARG A 53 2.079 -10.586 -8.882 1.00 0.00 H new ATOM 0 HH22 ARG A 53 1.916 -10.370 -7.136 1.00 0.00 H new ATOM 891 N GLN A 54 5.869 -7.302 -9.076 1.00 0.00 N ATOM 892 CA GLN A 54 7.056 -8.093 -8.843 1.00 0.00 C ATOM 893 C GLN A 54 7.003 -9.327 -9.730 1.00 0.00 C ATOM 894 O GLN A 54 5.917 -9.856 -9.991 1.00 0.00 O ATOM 895 CB GLN A 54 7.154 -8.488 -7.367 1.00 0.00 C ATOM 896 CG GLN A 54 7.160 -7.297 -6.420 1.00 0.00 C ATOM 897 CD GLN A 54 7.246 -7.698 -4.961 1.00 0.00 C ATOM 898 OE1 GLN A 54 7.857 -8.711 -4.616 1.00 0.00 O ATOM 899 NE2 GLN A 54 6.637 -6.910 -4.099 1.00 0.00 N ATOM 0 H GLN A 54 5.154 -7.389 -8.354 1.00 0.00 H new ATOM 0 HA GLN A 54 7.943 -7.508 -9.089 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.315 -9.137 -7.116 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.064 -9.069 -7.214 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.004 -6.651 -6.663 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.254 -6.711 -6.577 1.00 0.00 H new ATOM 0 HE21 GLN A 54 6.142 -6.081 -4.427 1.00 0.00 H new ATOM 0 HE22 GLN A 54 6.660 -7.129 -3.103 1.00 0.00 H new ATOM 908 N GLU A 55 8.168 -9.794 -10.175 1.00 0.00 N ATOM 909 CA GLU A 55 8.255 -10.913 -11.114 1.00 0.00 C ATOM 910 C GLU A 55 7.481 -10.605 -12.402 1.00 0.00 C ATOM 911 O GLU A 55 7.209 -9.442 -12.710 1.00 0.00 O ATOM 912 CB GLU A 55 7.740 -12.207 -10.468 1.00 0.00 C ATOM 913 CG GLU A 55 8.534 -12.633 -9.248 1.00 0.00 C ATOM 914 CD GLU A 55 10.008 -12.766 -9.543 1.00 0.00 C ATOM 915 OE1 GLU A 55 10.393 -13.715 -10.257 1.00 0.00 O ATOM 916 OE2 GLU A 55 10.793 -11.923 -9.062 1.00 0.00 O1- ATOM 0 H GLU A 55 9.072 -9.412 -9.898 1.00 0.00 H new ATOM 0 HA GLU A 55 9.304 -11.056 -11.374 1.00 0.00 H new ATOM 0 HB2 GLU A 55 6.697 -12.071 -10.183 1.00 0.00 H new ATOM 0 HB3 GLU A 55 7.767 -13.008 -11.207 1.00 0.00 H new ATOM 0 HG2 GLU A 55 8.389 -11.904 -8.450 1.00 0.00 H new ATOM 0 HG3 GLU A 55 8.151 -13.586 -8.882 1.00 0.00 H new ATOM 923 N ALA A 56 7.166 -11.630 -13.167 1.00 0.00 N ATOM 924 CA ALA A 56 6.396 -11.444 -14.381 1.00 0.00 C ATOM 925 C ALA A 56 5.032 -12.097 -14.257 1.00 0.00 C ATOM 926 O ALA A 56 4.156 -11.873 -15.093 1.00 0.00 O ATOM 927 CB ALA A 56 7.145 -12.000 -15.584 1.00 0.00 C ATOM 0 H ALA A 56 7.429 -12.596 -12.972 1.00 0.00 H new ATOM 0 HA ALA A 56 6.252 -10.374 -14.530 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.549 -11.850 -16.485 1.00 0.00 H new ATOM 0 HB2 ALA A 56 8.099 -11.483 -15.690 1.00 0.00 H new ATOM 0 HB3 ALA A 56 7.324 -13.066 -15.441 1.00 0.00 H new ATOM 933 N ALA A 57 4.863 -12.911 -13.194 1.00 0.00 N ATOM 934 CA ALA A 57 3.618 -13.661 -12.922 1.00 0.00 C ATOM 935 C ALA A 57 3.413 -14.780 -13.944 1.00 0.00 C ATOM 936 O ALA A 57 3.251 -15.953 -13.583 1.00 0.00 O ATOM 937 CB ALA A 57 2.403 -12.732 -12.879 1.00 0.00 C ATOM 0 H ALA A 57 5.590 -13.067 -12.496 1.00 0.00 H new ATOM 0 HA ALA A 57 3.721 -14.118 -11.938 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.505 -13.316 -12.677 1.00 0.00 H new ATOM 0 HB2 ALA A 57 2.539 -11.991 -12.091 1.00 0.00 H new ATOM 0 HB3 ALA A 57 2.298 -12.226 -13.838 1.00 0.00 H new ATOM 943 N ASP A 58 3.425 -14.413 -15.202 1.00 0.00 N ATOM 944 CA ASP A 58 3.286 -15.352 -16.286 1.00 0.00 C ATOM 945 C ASP A 58 3.943 -14.783 -17.529 1.00 0.00 C ATOM 946 O ASP A 58 3.563 -13.712 -18.010 1.00 0.00 O ATOM 947 CB ASP A 58 1.815 -15.659 -16.557 1.00 0.00 C ATOM 948 CG ASP A 58 1.640 -16.898 -17.402 1.00 0.00 C ATOM 949 OD1 ASP A 58 1.989 -16.867 -18.597 1.00 0.00 O ATOM 950 OD2 ASP A 58 1.164 -17.921 -16.864 1.00 0.00 O1- ATOM 0 H ASP A 58 3.533 -13.445 -15.504 1.00 0.00 H new ATOM 0 HA ASP A 58 3.776 -16.285 -16.009 1.00 0.00 H new ATOM 0 HB2 ASP A 58 1.292 -15.790 -15.610 1.00 0.00 H new ATOM 0 HB3 ASP A 58 1.354 -14.809 -17.061 1.00 0.00 H new ATOM 955 N THR A 59 4.920 -15.491 -18.046 1.00 0.00 N ATOM 956 CA THR A 59 5.662 -15.032 -19.196 1.00 0.00 C ATOM 957 C THR A 59 4.834 -15.140 -20.469 1.00 0.00 C ATOM 958 O THR A 59 4.849 -14.238 -21.308 1.00 0.00 O ATOM 959 CB THR A 59 6.957 -15.832 -19.346 1.00 0.00 C ATOM 960 OG1 THR A 59 6.707 -17.200 -18.992 1.00 0.00 O ATOM 961 CG2 THR A 59 8.044 -15.265 -18.450 1.00 0.00 C ATOM 0 H THR A 59 5.221 -16.396 -17.684 1.00 0.00 H new ATOM 0 HA THR A 59 5.905 -13.981 -19.038 1.00 0.00 H new ATOM 0 HB THR A 59 7.295 -15.769 -20.380 1.00 0.00 H new ATOM 0 HG1 THR A 59 7.533 -17.719 -19.088 1.00 0.00 H new ATOM 0 HG21 THR A 59 8.957 -15.848 -18.572 1.00 0.00 H new ATOM 0 HG22 THR A 59 8.237 -14.228 -18.724 1.00 0.00 H new ATOM 0 HG23 THR A 59 7.720 -15.311 -17.410 1.00 0.00 H new ATOM 969 N GLU A 60 4.094 -16.233 -20.592 1.00 0.00 N ATOM 970 CA GLU A 60 3.260 -16.471 -21.755 1.00 0.00 C ATOM 971 C GLU A 60 2.141 -15.437 -21.822 1.00 0.00 C ATOM 972 O GLU A 60 1.820 -14.933 -22.888 1.00 0.00 O ATOM 973 CB GLU A 60 2.669 -17.880 -21.707 1.00 0.00 C ATOM 974 CG GLU A 60 2.019 -18.326 -23.003 1.00 0.00 C ATOM 975 CD GLU A 60 3.019 -18.459 -24.127 1.00 0.00 C ATOM 976 OE1 GLU A 60 3.789 -19.449 -24.131 1.00 0.00 O ATOM 977 OE2 GLU A 60 3.043 -17.591 -25.013 1.00 0.00 O1- ATOM 0 H GLU A 60 4.057 -16.974 -19.892 1.00 0.00 H new ATOM 0 HA GLU A 60 3.878 -16.381 -22.649 1.00 0.00 H new ATOM 0 HB2 GLU A 60 3.459 -18.585 -21.449 1.00 0.00 H new ATOM 0 HB3 GLU A 60 1.929 -17.924 -20.908 1.00 0.00 H new ATOM 0 HG2 GLU A 60 1.521 -19.283 -22.847 1.00 0.00 H new ATOM 0 HG3 GLU A 60 1.249 -17.609 -23.287 1.00 0.00 H new ATOM 984 N ALA A 61 1.571 -15.112 -20.667 1.00 0.00 N ATOM 985 CA ALA A 61 0.495 -14.132 -20.597 1.00 0.00 C ATOM 986 C ALA A 61 0.984 -12.766 -21.056 1.00 0.00 C ATOM 987 O ALA A 61 0.320 -12.091 -21.843 1.00 0.00 O ATOM 988 CB ALA A 61 -0.069 -14.050 -19.188 1.00 0.00 C ATOM 0 H ALA A 61 1.836 -15.513 -19.767 1.00 0.00 H new ATOM 0 HA ALA A 61 -0.303 -14.455 -21.266 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -0.871 -13.312 -19.159 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -0.462 -15.024 -18.896 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.720 -13.755 -18.497 1.00 0.00 H new ATOM 994 N ALA A 62 2.159 -12.372 -20.577 1.00 0.00 N ATOM 995 CA ALA A 62 2.752 -11.101 -20.964 1.00 0.00 C ATOM 996 C ALA A 62 3.115 -11.111 -22.446 1.00 0.00 C ATOM 997 O ALA A 62 2.875 -10.140 -23.159 1.00 0.00 O ATOM 998 CB ALA A 62 3.980 -10.809 -20.115 1.00 0.00 C ATOM 0 H ALA A 62 2.718 -12.916 -19.920 1.00 0.00 H new ATOM 0 HA ALA A 62 2.020 -10.311 -20.795 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.412 -9.855 -20.417 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.693 -10.762 -19.064 1.00 0.00 H new ATOM 0 HB3 ALA A 62 4.716 -11.601 -20.255 1.00 0.00 H new ATOM 1004 N LYS A 63 3.666 -12.233 -22.898 1.00 0.00 N ATOM 1005 CA LYS A 63 4.048 -12.415 -24.296 1.00 0.00 C ATOM 1006 C LYS A 63 2.824 -12.342 -25.211 1.00 0.00 C ATOM 1007 O LYS A 63 2.858 -11.689 -26.262 1.00 0.00 O ATOM 1008 CB LYS A 63 4.769 -13.761 -24.453 1.00 0.00 C ATOM 1009 CG LYS A 63 4.847 -14.286 -25.873 1.00 0.00 C ATOM 1010 CD LYS A 63 5.650 -15.572 -25.928 1.00 0.00 C ATOM 1011 CE LYS A 63 5.398 -16.338 -27.215 1.00 0.00 C ATOM 1012 NZ LYS A 63 3.992 -16.803 -27.305 1.00 0.00 N1+ ATOM 0 H LYS A 63 3.861 -13.041 -22.307 1.00 0.00 H new ATOM 0 HA LYS A 63 4.723 -11.611 -24.589 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.782 -13.661 -24.063 1.00 0.00 H new ATOM 0 HB3 LYS A 63 4.261 -14.502 -23.835 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.842 -14.463 -26.256 1.00 0.00 H new ATOM 0 HG3 LYS A 63 5.307 -13.537 -26.518 1.00 0.00 H new ATOM 0 HD2 LYS A 63 6.712 -15.342 -25.844 1.00 0.00 H new ATOM 0 HD3 LYS A 63 5.391 -16.199 -25.075 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.627 -15.701 -28.069 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.070 -17.195 -27.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 3.962 -17.727 -27.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 3.594 -16.893 -26.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.433 -16.115 -27.849 1.00 0.00 H new ATOM 1026 N GLN A 64 1.751 -13.008 -24.812 1.00 0.00 N ATOM 1027 CA GLN A 64 0.511 -12.950 -25.569 1.00 0.00 C ATOM 1028 C GLN A 64 -0.048 -11.542 -25.535 1.00 0.00 C ATOM 1029 O GLN A 64 -0.632 -11.078 -26.507 1.00 0.00 O ATOM 1030 CB GLN A 64 -0.524 -13.948 -25.055 1.00 0.00 C ATOM 1031 CG GLN A 64 -0.105 -15.397 -25.202 1.00 0.00 C ATOM 1032 CD GLN A 64 -1.276 -16.348 -25.118 1.00 0.00 C ATOM 1033 OE1 GLN A 64 -1.874 -16.695 -26.130 1.00 0.00 O ATOM 1034 NE2 GLN A 64 -1.616 -16.771 -23.920 1.00 0.00 N ATOM 0 H GLN A 64 1.714 -13.590 -23.975 1.00 0.00 H new ATOM 0 HA GLN A 64 0.738 -13.226 -26.599 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -0.722 -13.742 -24.003 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -1.460 -13.794 -25.592 1.00 0.00 H new ATOM 0 HG2 GLN A 64 0.400 -15.531 -26.159 1.00 0.00 H new ATOM 0 HG3 GLN A 64 0.617 -15.644 -24.423 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -1.093 -16.459 -23.102 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -2.403 -17.411 -23.809 1.00 0.00 H new ATOM 1043 N GLY A 65 0.148 -10.862 -24.409 1.00 0.00 N ATOM 1044 CA GLY A 65 -0.278 -9.485 -24.293 1.00 0.00 C ATOM 1045 C GLY A 65 0.424 -8.597 -25.297 1.00 0.00 C ATOM 1046 O GLY A 65 -0.211 -7.762 -25.930 1.00 0.00 O ATOM 0 H GLY A 65 0.595 -11.244 -23.576 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -1.356 -9.423 -24.443 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -0.076 -9.125 -23.284 1.00 0.00 H new ATOM 1050 N ASP A 66 1.733 -8.793 -25.465 1.00 0.00 N ATOM 1051 CA ASP A 66 2.501 -8.037 -26.463 1.00 0.00 C ATOM 1052 C ASP A 66 1.919 -8.259 -27.850 1.00 0.00 C ATOM 1053 O ASP A 66 1.722 -7.307 -28.619 1.00 0.00 O ATOM 1054 CB ASP A 66 3.981 -8.449 -26.463 1.00 0.00 C ATOM 1055 CG ASP A 66 4.768 -7.859 -25.315 1.00 0.00 C ATOM 1056 OD1 ASP A 66 5.205 -6.695 -25.426 1.00 0.00 O ATOM 1057 OD2 ASP A 66 4.970 -8.553 -24.309 1.00 0.00 O1- ATOM 0 H ASP A 66 2.283 -9.464 -24.928 1.00 0.00 H new ATOM 0 HA ASP A 66 2.435 -6.982 -26.199 1.00 0.00 H new ATOM 0 HB2 ASP A 66 4.048 -9.536 -26.419 1.00 0.00 H new ATOM 0 HB3 ASP A 66 4.437 -8.139 -27.403 1.00 0.00 H new ATOM 1062 N GLN A 67 1.634 -9.519 -28.161 1.00 0.00 N ATOM 1063 CA GLN A 67 1.042 -9.876 -29.442 1.00 0.00 C ATOM 1064 C GLN A 67 -0.347 -9.269 -29.585 1.00 0.00 C ATOM 1065 O GLN A 67 -0.694 -8.746 -30.642 1.00 0.00 O ATOM 1066 CB GLN A 67 0.953 -11.393 -29.604 1.00 0.00 C ATOM 1067 CG GLN A 67 2.292 -12.089 -29.755 1.00 0.00 C ATOM 1068 CD GLN A 67 2.139 -13.570 -30.040 1.00 0.00 C ATOM 1069 OE1 GLN A 67 1.149 -13.999 -30.631 1.00 0.00 O ATOM 1070 NE2 GLN A 67 3.118 -14.354 -29.645 1.00 0.00 N ATOM 0 H GLN A 67 1.804 -10.311 -27.541 1.00 0.00 H new ATOM 0 HA GLN A 67 1.689 -9.476 -30.223 1.00 0.00 H new ATOM 0 HB2 GLN A 67 0.437 -11.809 -28.738 1.00 0.00 H new ATOM 0 HB3 GLN A 67 0.341 -11.617 -30.477 1.00 0.00 H new ATOM 0 HG2 GLN A 67 2.853 -11.621 -30.564 1.00 0.00 H new ATOM 0 HG3 GLN A 67 2.874 -11.954 -28.843 1.00 0.00 H new ATOM 0 HE21 GLN A 67 3.922 -13.959 -29.158 1.00 0.00 H new ATOM 0 HE22 GLN A 67 3.073 -15.357 -29.826 1.00 0.00 H new ATOM 1079 N TRP A 68 -1.127 -9.330 -28.511 1.00 0.00 N ATOM 1080 CA TRP A 68 -2.484 -8.804 -28.505 1.00 0.00 C ATOM 1081 C TRP A 68 -2.471 -7.300 -28.741 1.00 0.00 C ATOM 1082 O TRP A 68 -3.311 -6.773 -29.458 1.00 0.00 O ATOM 1083 CB TRP A 68 -3.178 -9.133 -27.178 1.00 0.00 C ATOM 1084 CG TRP A 68 -4.656 -8.854 -27.176 1.00 0.00 C ATOM 1085 CD1 TRP A 68 -5.643 -9.733 -27.505 1.00 0.00 C ATOM 1086 CD2 TRP A 68 -5.316 -7.628 -26.820 1.00 0.00 C ATOM 1087 NE1 TRP A 68 -6.871 -9.139 -27.380 1.00 0.00 N ATOM 1088 CE2 TRP A 68 -6.701 -7.846 -26.961 1.00 0.00 C ATOM 1089 CE3 TRP A 68 -4.872 -6.373 -26.397 1.00 0.00 C ATOM 1090 CZ2 TRP A 68 -7.643 -6.857 -26.696 1.00 0.00 C ATOM 1091 CZ3 TRP A 68 -5.809 -5.392 -26.134 1.00 0.00 C ATOM 1092 CH2 TRP A 68 -7.178 -5.639 -26.283 1.00 0.00 C ATOM 0 H TRP A 68 -0.837 -9.744 -27.625 1.00 0.00 H new ATOM 0 HA TRP A 68 -3.043 -9.275 -29.313 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -3.017 -10.186 -26.947 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -2.708 -8.556 -26.381 1.00 0.00 H new ATOM 0 HD1 TRP A 68 -5.481 -10.753 -27.820 1.00 0.00 H new ATOM 0 HE1 TRP A 68 -7.768 -9.587 -27.569 1.00 0.00 H new ATOM 0 HE3 TRP A 68 -3.817 -6.173 -26.278 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 -8.700 -7.044 -26.812 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 -5.479 -4.417 -25.808 1.00 0.00 H new ATOM 0 HH2 TRP A 68 -7.883 -4.850 -26.067 1.00 0.00 H new ATOM 1103 N VAL A 69 -1.497 -6.615 -28.148 1.00 0.00 N ATOM 1104 CA VAL A 69 -1.376 -5.173 -28.321 1.00 0.00 C ATOM 1105 C VAL A 69 -1.056 -4.859 -29.772 1.00 0.00 C ATOM 1106 O VAL A 69 -1.622 -3.943 -30.357 1.00 0.00 O ATOM 1107 CB VAL A 69 -0.290 -4.553 -27.407 1.00 0.00 C ATOM 1108 CG1 VAL A 69 -0.110 -3.070 -27.718 1.00 0.00 C ATOM 1109 CG2 VAL A 69 -0.654 -4.742 -25.942 1.00 0.00 C ATOM 0 H VAL A 69 -0.786 -7.033 -27.548 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.331 -4.732 -28.037 1.00 0.00 H new ATOM 0 HB VAL A 69 0.652 -5.066 -27.601 1.00 0.00 H new ATOM 0 HG11 VAL A 69 0.657 -2.652 -27.066 1.00 0.00 H new ATOM 0 HG12 VAL A 69 0.194 -2.951 -28.758 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -1.052 -2.547 -27.552 1.00 0.00 H new ATOM 0 HG21 VAL A 69 0.120 -4.300 -25.315 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.608 -4.255 -25.738 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.736 -5.806 -25.722 1.00 0.00 H new ATOM 1119 N GLN A 70 -0.168 -5.655 -30.362 1.00 0.00 N ATOM 1120 CA GLN A 70 0.212 -5.489 -31.743 1.00 0.00 C ATOM 1121 C GLN A 70 -0.977 -5.811 -32.643 1.00 0.00 C ATOM 1122 O GLN A 70 -1.176 -5.196 -33.688 1.00 0.00 O ATOM 1123 CB GLN A 70 1.378 -6.414 -32.071 1.00 0.00 C ATOM 1124 CG GLN A 70 1.933 -6.214 -33.458 1.00 0.00 C ATOM 1125 CD GLN A 70 2.953 -7.265 -33.841 1.00 0.00 C ATOM 1126 OE1 GLN A 70 3.653 -7.812 -32.991 1.00 0.00 O ATOM 1127 NE2 GLN A 70 3.052 -7.548 -35.124 1.00 0.00 N ATOM 0 H GLN A 70 0.301 -6.428 -29.890 1.00 0.00 H new ATOM 0 HA GLN A 70 0.519 -4.457 -31.912 1.00 0.00 H new ATOM 0 HB2 GLN A 70 2.174 -6.254 -31.343 1.00 0.00 H new ATOM 0 HB3 GLN A 70 1.052 -7.449 -31.965 1.00 0.00 H new ATOM 0 HG2 GLN A 70 1.114 -6.230 -34.177 1.00 0.00 H new ATOM 0 HG3 GLN A 70 2.393 -5.228 -33.521 1.00 0.00 H new ATOM 0 HE21 GLN A 70 2.453 -7.072 -35.799 1.00 0.00 H new ATOM 0 HE22 GLN A 70 3.728 -8.243 -35.442 1.00 0.00 H new ATOM 1136 N LEU A 71 -1.756 -6.791 -32.227 1.00 0.00 N ATOM 1137 CA LEU A 71 -2.927 -7.208 -32.951 1.00 0.00 C ATOM 1138 C LEU A 71 -4.000 -6.126 -32.877 1.00 0.00 C ATOM 1139 O LEU A 71 -4.645 -5.811 -33.873 1.00 0.00 O ATOM 1140 CB LEU A 71 -3.428 -8.525 -32.365 1.00 0.00 C ATOM 1141 CG LEU A 71 -4.661 -9.126 -33.007 1.00 0.00 C ATOM 1142 CD1 LEU A 71 -4.425 -9.404 -34.486 1.00 0.00 C ATOM 1143 CD2 LEU A 71 -5.053 -10.398 -32.282 1.00 0.00 C ATOM 0 H LEU A 71 -1.587 -7.319 -31.371 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.683 -7.361 -34.002 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.621 -9.255 -32.428 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.636 -8.370 -31.306 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.477 -8.408 -32.928 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.325 -9.835 -34.923 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.184 -8.472 -34.997 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -3.597 -10.104 -34.597 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.941 -10.824 -32.749 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.234 -11.115 -32.337 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.267 -10.170 -31.238 1.00 0.00 H new ATOM 1155 N PHE A 72 -4.164 -5.549 -31.696 1.00 0.00 N ATOM 1156 CA PHE A 72 -5.116 -4.468 -31.502 1.00 0.00 C ATOM 1157 C PHE A 72 -4.646 -3.220 -32.237 1.00 0.00 C ATOM 1158 O PHE A 72 -5.449 -2.474 -32.783 1.00 0.00 O ATOM 1159 CB PHE A 72 -5.337 -4.163 -30.017 1.00 0.00 C ATOM 1160 CG PHE A 72 -6.386 -3.109 -29.794 1.00 0.00 C ATOM 1161 CD1 PHE A 72 -7.732 -3.420 -29.907 1.00 0.00 C ATOM 1162 CD2 PHE A 72 -6.028 -1.805 -29.492 1.00 0.00 C ATOM 1163 CE1 PHE A 72 -8.700 -2.453 -29.724 1.00 0.00 C ATOM 1164 CE2 PHE A 72 -6.992 -0.835 -29.303 1.00 0.00 C ATOM 1165 CZ PHE A 72 -8.328 -1.158 -29.422 1.00 0.00 C ATOM 0 H PHE A 72 -3.648 -5.813 -30.856 1.00 0.00 H new ATOM 0 HA PHE A 72 -6.073 -4.789 -31.914 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -5.631 -5.078 -29.502 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.397 -3.835 -29.573 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -8.027 -4.432 -30.141 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -4.984 -1.545 -29.404 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -9.745 -2.709 -29.817 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -6.700 0.177 -29.062 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.082 -0.398 -29.279 1.00 0.00 H new ATOM 1175 N GLN A 73 -3.336 -2.999 -32.232 1.00 0.00 N ATOM 1176 CA GLN A 73 -2.733 -1.886 -32.938 1.00 0.00 C ATOM 1177 C GLN A 73 -3.082 -1.988 -34.424 1.00 0.00 C ATOM 1178 O GLN A 73 -3.476 -1.006 -35.056 1.00 0.00 O ATOM 1179 CB GLN A 73 -1.218 -1.955 -32.755 1.00 0.00 C ATOM 1180 CG GLN A 73 -0.488 -0.675 -33.062 1.00 0.00 C ATOM 1181 CD GLN A 73 -0.714 0.390 -32.010 1.00 0.00 C ATOM 1182 OE1 GLN A 73 0.023 0.474 -31.031 1.00 0.00 O ATOM 1183 NE2 GLN A 73 -1.726 1.209 -32.206 1.00 0.00 N ATOM 0 H GLN A 73 -2.667 -3.589 -31.737 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.107 -0.940 -32.546 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.003 -2.242 -31.726 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -0.824 -2.744 -33.395 1.00 0.00 H new ATOM 0 HG2 GLN A 73 0.579 -0.880 -33.143 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -0.814 -0.298 -34.031 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -2.314 1.105 -33.033 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -1.922 1.948 -31.531 1.00 0.00 H new ATOM 1192 N ARG A 74 -2.952 -3.199 -34.954 1.00 0.00 N ATOM 1193 CA ARG A 74 -3.325 -3.494 -36.334 1.00 0.00 C ATOM 1194 C ARG A 74 -4.826 -3.303 -36.532 1.00 0.00 C ATOM 1195 O ARG A 74 -5.267 -2.794 -37.559 1.00 0.00 O ATOM 1196 CB ARG A 74 -2.924 -4.926 -36.702 1.00 0.00 C ATOM 1197 CG ARG A 74 -1.442 -5.100 -36.991 1.00 0.00 C ATOM 1198 CD ARG A 74 -1.067 -6.570 -37.127 1.00 0.00 C ATOM 1199 NE ARG A 74 -0.966 -7.237 -35.821 1.00 0.00 N ATOM 1200 CZ ARG A 74 -0.947 -8.569 -35.647 1.00 0.00 C ATOM 1201 NH1 ARG A 74 -1.130 -9.381 -36.680 1.00 0.00 N1+ ATOM 1202 NH2 ARG A 74 -0.764 -9.082 -34.434 1.00 0.00 N ATOM 0 H ARG A 74 -2.586 -4.002 -34.442 1.00 0.00 H new ATOM 0 HA ARG A 74 -2.794 -2.803 -36.989 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -3.205 -5.592 -35.886 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.493 -5.238 -37.578 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -1.185 -4.572 -37.909 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -0.859 -4.648 -36.189 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -1.813 -7.079 -37.737 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -0.115 -6.654 -37.651 1.00 0.00 H new ATOM 0 HE ARG A 74 -0.906 -6.648 -34.990 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -1.286 -8.995 -37.611 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -1.115 -10.392 -36.543 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -0.638 -8.464 -33.633 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -0.750 -10.094 -34.305 1.00 0.00 H new ATOM 1216 N PHE A 75 -5.597 -3.710 -35.531 1.00 0.00 N ATOM 1217 CA PHE A 75 -7.049 -3.581 -35.565 1.00 0.00 C ATOM 1218 C PHE A 75 -7.453 -2.109 -35.628 1.00 0.00 C ATOM 1219 O PHE A 75 -8.266 -1.721 -36.461 1.00 0.00 O ATOM 1220 CB PHE A 75 -7.665 -4.259 -34.336 1.00 0.00 C ATOM 1221 CG PHE A 75 -9.168 -4.221 -34.284 1.00 0.00 C ATOM 1222 CD1 PHE A 75 -9.925 -4.965 -35.173 1.00 0.00 C ATOM 1223 CD2 PHE A 75 -9.823 -3.454 -33.333 1.00 0.00 C ATOM 1224 CE1 PHE A 75 -11.305 -4.944 -35.118 1.00 0.00 C ATOM 1225 CE2 PHE A 75 -11.203 -3.428 -33.274 1.00 0.00 C ATOM 1226 CZ PHE A 75 -11.944 -4.174 -34.168 1.00 0.00 C ATOM 0 H PHE A 75 -5.236 -4.136 -34.677 1.00 0.00 H new ATOM 0 HA PHE A 75 -7.425 -4.075 -36.461 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -7.340 -5.299 -34.311 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -7.272 -3.781 -33.439 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -9.430 -5.569 -35.919 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -9.248 -2.870 -32.630 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -11.883 -5.529 -35.818 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -11.701 -2.825 -32.529 1.00 0.00 H new ATOM 0 HZ PHE A 75 -13.023 -4.155 -34.124 1.00 0.00 H new ATOM 1236 N ARG A 76 -6.871 -1.292 -34.749 1.00 0.00 N ATOM 1237 CA ARG A 76 -7.135 0.144 -34.744 1.00 0.00 C ATOM 1238 C ARG A 76 -6.777 0.762 -36.090 1.00 0.00 C ATOM 1239 O ARG A 76 -7.571 1.503 -36.668 1.00 0.00 O ATOM 1240 CB ARG A 76 -6.342 0.837 -33.619 1.00 0.00 C ATOM 1241 CG ARG A 76 -6.359 2.364 -33.697 1.00 0.00 C ATOM 1242 CD ARG A 76 -7.750 2.929 -33.458 1.00 0.00 C ATOM 1243 NE ARG A 76 -7.923 4.248 -34.078 1.00 0.00 N ATOM 1244 CZ ARG A 76 -8.379 5.333 -33.455 1.00 0.00 C ATOM 1245 NH1 ARG A 76 -8.572 5.326 -32.131 1.00 0.00 N1+ ATOM 1246 NH2 ARG A 76 -8.603 6.441 -34.149 1.00 0.00 N ATOM 0 H ARG A 76 -6.214 -1.602 -34.033 1.00 0.00 H new ATOM 0 HA ARG A 76 -8.200 0.291 -34.565 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.750 0.528 -32.657 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.308 0.493 -33.652 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -5.669 2.773 -32.958 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -6.002 2.681 -34.677 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.494 2.240 -33.858 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -7.930 3.006 -32.386 1.00 0.00 H new ATOM 0 HE ARG A 76 -7.675 4.341 -35.063 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -8.370 4.485 -31.591 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -8.922 6.162 -31.662 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -8.426 6.458 -35.153 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -8.952 7.276 -33.678 1.00 0.00 H new ATOM 1260 N GLU A 77 -5.605 0.407 -36.602 1.00 0.00 N ATOM 1261 CA GLU A 77 -5.118 0.936 -37.861 1.00 0.00 C ATOM 1262 C GLU A 77 -6.055 0.552 -38.994 1.00 0.00 C ATOM 1263 O GLU A 77 -6.270 1.322 -39.928 1.00 0.00 O ATOM 1264 CB GLU A 77 -3.720 0.386 -38.142 1.00 0.00 C ATOM 1265 CG GLU A 77 -3.092 0.930 -39.403 1.00 0.00 C ATOM 1266 CD GLU A 77 -1.842 0.182 -39.804 1.00 0.00 C ATOM 1267 OE1 GLU A 77 -0.787 0.386 -39.165 1.00 0.00 O ATOM 1268 OE2 GLU A 77 -1.904 -0.610 -40.773 1.00 0.00 O1- ATOM 0 H GLU A 77 -4.970 -0.254 -36.154 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.076 2.023 -37.793 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -3.072 0.617 -37.296 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -3.775 -0.700 -38.214 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.817 0.879 -40.216 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -2.849 1.983 -39.258 1.00 0.00 H new ATOM 1275 N ALA A 78 -6.638 -0.629 -38.888 1.00 0.00 N ATOM 1276 CA ALA A 78 -7.528 -1.130 -39.903 1.00 0.00 C ATOM 1277 C ALA A 78 -8.839 -0.360 -39.893 1.00 0.00 C ATOM 1278 O ALA A 78 -9.471 -0.180 -40.932 1.00 0.00 O ATOM 1279 CB ALA A 78 -7.768 -2.620 -39.720 1.00 0.00 C ATOM 0 H ALA A 78 -6.504 -1.260 -38.098 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.058 -0.983 -40.875 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -8.443 -2.978 -40.497 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -6.820 -3.153 -39.790 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.214 -2.799 -38.742 1.00 0.00 H new ATOM 1285 N ILE A 79 -9.241 0.117 -38.709 1.00 0.00 N ATOM 1286 CA ILE A 79 -10.489 0.845 -38.565 1.00 0.00 C ATOM 1287 C ILE A 79 -10.331 2.238 -39.145 1.00 0.00 C ATOM 1288 O ILE A 79 -11.213 2.741 -39.843 1.00 0.00 O ATOM 1289 CB ILE A 79 -10.923 0.946 -37.076 1.00 0.00 C ATOM 1290 CG1 ILE A 79 -11.176 -0.449 -36.508 1.00 0.00 C ATOM 1291 CG2 ILE A 79 -12.167 1.818 -36.930 1.00 0.00 C ATOM 1292 CD1 ILE A 79 -11.594 -0.462 -35.060 1.00 0.00 C ATOM 0 H ILE A 79 -8.714 0.008 -37.842 1.00 0.00 H new ATOM 0 HA ILE A 79 -11.264 0.300 -39.104 1.00 0.00 H new ATOM 0 HB ILE A 79 -10.116 1.414 -36.512 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -11.950 -0.936 -37.102 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -10.269 -1.043 -36.618 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -12.451 1.873 -35.879 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -11.954 2.820 -37.302 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -12.985 1.384 -37.505 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -11.753 -1.491 -34.736 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -10.812 -0.007 -34.452 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -12.519 0.102 -34.943 1.00 0.00 H new ATOM 1304 N ASP A 80 -9.175 2.842 -38.872 1.00 0.00 N ATOM 1305 CA ASP A 80 -8.860 4.179 -39.366 1.00 0.00 C ATOM 1306 C ASP A 80 -8.787 4.171 -40.884 1.00 0.00 C ATOM 1307 O ASP A 80 -9.120 5.155 -41.545 1.00 0.00 O ATOM 1308 CB ASP A 80 -7.518 4.670 -38.790 1.00 0.00 C ATOM 1309 CG ASP A 80 -7.553 4.936 -37.294 1.00 0.00 C ATOM 1310 OD1 ASP A 80 -8.205 5.913 -36.862 1.00 0.00 O ATOM 1311 OD2 ASP A 80 -6.908 4.192 -36.546 1.00 0.00 O1- ATOM 0 H ASP A 80 -8.437 2.422 -38.307 1.00 0.00 H new ATOM 0 HA ASP A 80 -9.651 4.856 -39.044 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -6.749 3.926 -38.999 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -7.225 5.585 -39.305 1.00 0.00 H new ATOM 1316 N LYS A 81 -8.356 3.045 -41.429 1.00 0.00 N ATOM 1317 CA LYS A 81 -8.234 2.882 -42.867 1.00 0.00 C ATOM 1318 C LYS A 81 -9.553 2.451 -43.503 1.00 0.00 C ATOM 1319 O LYS A 81 -9.643 2.335 -44.722 1.00 0.00 O ATOM 1320 CB LYS A 81 -7.140 1.865 -43.198 1.00 0.00 C ATOM 1321 CG LYS A 81 -5.735 2.348 -42.882 1.00 0.00 C ATOM 1322 CD LYS A 81 -4.707 1.257 -43.113 1.00 0.00 C ATOM 1323 CE LYS A 81 -3.295 1.790 -42.947 1.00 0.00 C ATOM 1324 NZ LYS A 81 -2.272 0.733 -43.137 1.00 0.00 N1+ ATOM 0 H LYS A 81 -8.083 2.223 -40.890 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.963 3.853 -43.282 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -7.331 0.947 -42.643 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.198 1.615 -44.257 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -5.497 3.211 -43.504 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -5.688 2.680 -41.845 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -4.875 0.440 -42.411 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -4.828 0.846 -44.115 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -3.124 2.592 -43.665 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -3.187 2.224 -41.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -1.334 1.171 -43.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -2.273 0.097 -42.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -2.491 0.189 -43.996 1.00 0.00 H new ATOM 1338 N GLY A 82 -10.575 2.225 -42.682 1.00 0.00 N ATOM 1339 CA GLY A 82 -11.857 1.788 -43.208 1.00 0.00 C ATOM 1340 C GLY A 82 -11.805 0.388 -43.788 1.00 0.00 C ATOM 1341 O GLY A 82 -12.599 0.043 -44.666 1.00 0.00 O ATOM 0 H GLY A 82 -10.540 2.336 -41.669 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -12.601 1.820 -42.412 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -12.185 2.485 -43.980 1.00 0.00 H new ATOM 1345 N ASP A 83 -10.881 -0.423 -43.304 1.00 0.00 N ATOM 1346 CA ASP A 83 -10.707 -1.759 -43.849 1.00 0.00 C ATOM 1347 C ASP A 83 -11.531 -2.781 -43.074 1.00 0.00 C ATOM 1348 O ASP A 83 -11.021 -3.503 -42.211 1.00 0.00 O ATOM 1349 CB ASP A 83 -9.232 -2.159 -43.882 1.00 0.00 C ATOM 1350 CG ASP A 83 -8.984 -3.386 -44.742 1.00 0.00 C ATOM 1351 OD1 ASP A 83 -9.408 -4.485 -44.362 1.00 0.00 O ATOM 1352 OD2 ASP A 83 -8.351 -3.249 -45.810 1.00 0.00 O1- ATOM 0 H ASP A 83 -10.245 -0.184 -42.543 1.00 0.00 H new ATOM 0 HA ASP A 83 -11.070 -1.744 -44.877 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.641 -1.326 -44.263 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -8.889 -2.355 -42.866 1.00 0.00 H new ATOM 1357 N LYS A 84 -12.821 -2.777 -43.349 1.00 0.00 N ATOM 1358 CA LYS A 84 -13.762 -3.724 -42.747 1.00 0.00 C ATOM 1359 C LYS A 84 -13.347 -5.179 -43.005 1.00 0.00 C ATOM 1360 O LYS A 84 -13.685 -6.073 -42.224 1.00 0.00 O ATOM 1361 CB LYS A 84 -15.173 -3.489 -43.296 1.00 0.00 C ATOM 1362 CG LYS A 84 -15.666 -2.050 -43.177 1.00 0.00 C ATOM 1363 CD LYS A 84 -15.736 -1.595 -41.728 1.00 0.00 C ATOM 1364 CE LYS A 84 -16.277 -0.179 -41.620 1.00 0.00 C ATOM 1365 NZ LYS A 84 -16.320 0.290 -40.213 1.00 0.00 N1+ ATOM 0 H LYS A 84 -13.255 -2.119 -43.996 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.753 -3.554 -41.670 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -15.194 -3.781 -44.346 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.868 -4.143 -42.769 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -15.000 -1.390 -43.733 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -16.652 -1.965 -43.633 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -16.373 -2.274 -41.162 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -14.743 -1.642 -41.281 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -15.653 0.494 -42.208 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -17.279 -0.140 -42.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -17.295 0.555 -39.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -15.997 -0.472 -39.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -15.698 1.116 -40.103 1.00 0.00 H new ATOM 1379 N ASP A 85 -12.599 -5.401 -44.083 1.00 0.00 N ATOM 1380 CA ASP A 85 -12.135 -6.747 -44.453 1.00 0.00 C ATOM 1381 C ASP A 85 -11.277 -7.332 -43.344 1.00 0.00 C ATOM 1382 O ASP A 85 -11.487 -8.458 -42.895 1.00 0.00 O ATOM 1383 CB ASP A 85 -11.284 -6.691 -45.724 1.00 0.00 C ATOM 1384 CG ASP A 85 -12.044 -6.248 -46.943 1.00 0.00 C ATOM 1385 OD1 ASP A 85 -11.867 -5.080 -47.361 1.00 0.00 O ATOM 1386 OD2 ASP A 85 -12.814 -7.051 -47.494 1.00 0.00 O1- ATOM 0 H ASP A 85 -12.297 -4.666 -44.722 1.00 0.00 H new ATOM 0 HA ASP A 85 -13.016 -7.367 -44.618 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -10.448 -6.011 -45.561 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -10.860 -7.678 -45.910 1.00 0.00 H new ATOM 1391 N SER A 86 -10.309 -6.553 -42.918 1.00 0.00 N ATOM 1392 CA SER A 86 -9.378 -6.961 -41.885 1.00 0.00 C ATOM 1393 C SER A 86 -10.034 -6.980 -40.510 1.00 0.00 C ATOM 1394 O SER A 86 -9.688 -7.801 -39.666 1.00 0.00 O ATOM 1395 CB SER A 86 -8.160 -6.035 -41.880 1.00 0.00 C ATOM 1396 OG SER A 86 -7.608 -5.922 -43.185 1.00 0.00 O ATOM 0 H SER A 86 -10.143 -5.614 -43.279 1.00 0.00 H new ATOM 0 HA SER A 86 -9.056 -7.978 -42.109 1.00 0.00 H new ATOM 0 HB2 SER A 86 -8.448 -5.049 -41.515 1.00 0.00 H new ATOM 0 HB3 SER A 86 -7.407 -6.421 -41.193 1.00 0.00 H new ATOM 0 HG SER A 86 -8.256 -5.486 -43.778 1.00 0.00 H new ATOM 1402 N LEU A 87 -11.006 -6.103 -40.305 1.00 0.00 N ATOM 1403 CA LEU A 87 -11.639 -5.953 -38.996 1.00 0.00 C ATOM 1404 C LEU A 87 -12.301 -7.236 -38.521 1.00 0.00 C ATOM 1405 O LEU A 87 -12.108 -7.642 -37.380 1.00 0.00 O ATOM 1406 CB LEU A 87 -12.667 -4.823 -39.015 1.00 0.00 C ATOM 1407 CG LEU A 87 -12.120 -3.435 -39.320 1.00 0.00 C ATOM 1408 CD1 LEU A 87 -13.200 -2.384 -39.138 1.00 0.00 C ATOM 1409 CD2 LEU A 87 -10.926 -3.134 -38.439 1.00 0.00 C ATOM 0 H LEU A 87 -11.376 -5.483 -41.026 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.842 -5.709 -38.294 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -13.430 -5.063 -39.756 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.163 -4.792 -38.045 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.795 -3.412 -40.360 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -12.790 -1.399 -39.360 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -14.029 -2.593 -39.814 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -13.558 -2.404 -38.109 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.546 -2.139 -38.669 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.227 -3.175 -37.392 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.144 -3.872 -38.621 1.00 0.00 H new ATOM 1421 N GLU A 88 -13.067 -7.875 -39.391 1.00 0.00 N ATOM 1422 CA GLU A 88 -13.767 -9.102 -39.023 1.00 0.00 C ATOM 1423 C GLU A 88 -12.793 -10.195 -38.566 1.00 0.00 C ATOM 1424 O GLU A 88 -13.027 -10.859 -37.551 1.00 0.00 O ATOM 1425 CB GLU A 88 -14.625 -9.600 -40.187 1.00 0.00 C ATOM 1426 CG GLU A 88 -15.654 -8.589 -40.666 1.00 0.00 C ATOM 1427 CD GLU A 88 -16.582 -9.156 -41.716 1.00 0.00 C ATOM 1428 OE1 GLU A 88 -16.123 -9.428 -42.840 1.00 0.00 O ATOM 1429 OE2 GLU A 88 -17.782 -9.327 -41.423 1.00 0.00 O1- ATOM 0 H GLU A 88 -13.221 -7.569 -40.352 1.00 0.00 H new ATOM 0 HA GLU A 88 -14.419 -8.869 -38.181 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -13.973 -9.864 -41.020 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -15.139 -10.512 -39.883 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -16.242 -8.244 -39.815 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -15.140 -7.718 -41.073 1.00 0.00 H new ATOM 1436 N GLN A 89 -11.712 -10.379 -39.312 1.00 0.00 N ATOM 1437 CA GLN A 89 -10.711 -11.386 -38.975 1.00 0.00 C ATOM 1438 C GLN A 89 -9.919 -11.001 -37.715 1.00 0.00 C ATOM 1439 O GLN A 89 -9.730 -11.823 -36.814 1.00 0.00 O ATOM 1440 CB GLN A 89 -9.759 -11.612 -40.156 1.00 0.00 C ATOM 1441 CG GLN A 89 -8.637 -12.606 -39.875 1.00 0.00 C ATOM 1442 CD GLN A 89 -9.148 -13.980 -39.472 1.00 0.00 C ATOM 1443 OE1 GLN A 89 -10.222 -14.410 -39.892 1.00 0.00 O ATOM 1444 NE2 GLN A 89 -8.384 -14.674 -38.653 1.00 0.00 N ATOM 0 H GLN A 89 -11.504 -9.844 -40.155 1.00 0.00 H new ATOM 0 HA GLN A 89 -11.239 -12.316 -38.762 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -10.336 -11.965 -41.011 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -9.319 -10.656 -40.441 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -8.014 -12.703 -40.764 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -8.002 -12.213 -39.081 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.500 -14.284 -38.326 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -8.676 -15.602 -38.346 1.00 0.00 H new ATOM 1453 N LEU A 90 -9.479 -9.746 -37.650 1.00 0.00 N ATOM 1454 CA LEU A 90 -8.676 -9.272 -36.521 1.00 0.00 C ATOM 1455 C LEU A 90 -9.472 -9.288 -35.223 1.00 0.00 C ATOM 1456 O LEU A 90 -8.920 -9.538 -34.153 1.00 0.00 O ATOM 1457 CB LEU A 90 -8.127 -7.867 -36.791 1.00 0.00 C ATOM 1458 CG LEU A 90 -7.157 -7.742 -37.973 1.00 0.00 C ATOM 1459 CD1 LEU A 90 -6.699 -6.303 -38.137 1.00 0.00 C ATOM 1460 CD2 LEU A 90 -5.961 -8.665 -37.794 1.00 0.00 C ATOM 0 H LEU A 90 -9.663 -9.040 -38.363 1.00 0.00 H new ATOM 0 HA LEU A 90 -7.836 -9.958 -36.409 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -8.969 -7.196 -36.964 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -7.620 -7.517 -35.892 1.00 0.00 H new ATOM 0 HG LEU A 90 -7.685 -8.043 -38.878 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.012 -6.234 -38.980 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.563 -5.665 -38.320 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -6.193 -5.976 -37.229 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.288 -8.558 -38.645 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -5.432 -8.402 -36.878 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.304 -9.698 -37.731 1.00 0.00 H new ATOM 1472 N LEU A 91 -10.767 -9.038 -35.324 1.00 0.00 N ATOM 1473 CA LEU A 91 -11.638 -9.044 -34.158 1.00 0.00 C ATOM 1474 C LEU A 91 -11.682 -10.435 -33.542 1.00 0.00 C ATOM 1475 O LEU A 91 -11.612 -10.591 -32.319 1.00 0.00 O ATOM 1476 CB LEU A 91 -13.048 -8.609 -34.534 1.00 0.00 C ATOM 1477 CG LEU A 91 -14.061 -8.599 -33.391 1.00 0.00 C ATOM 1478 CD1 LEU A 91 -13.756 -7.481 -32.403 1.00 0.00 C ATOM 1479 CD2 LEU A 91 -15.466 -8.477 -33.932 1.00 0.00 C ATOM 0 H LEU A 91 -11.240 -8.828 -36.203 1.00 0.00 H new ATOM 0 HA LEU A 91 -11.235 -8.339 -33.431 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -12.998 -7.607 -34.961 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -13.417 -9.271 -35.317 1.00 0.00 H new ATOM 0 HG LEU A 91 -13.983 -9.545 -32.855 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -14.492 -7.495 -31.599 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -12.759 -7.626 -31.986 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -13.798 -6.520 -32.916 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -16.175 -8.471 -33.104 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -15.559 -7.549 -34.496 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -15.679 -9.322 -34.586 1.00 0.00 H new ATOM 1491 N GLU A 92 -11.786 -11.442 -34.402 1.00 0.00 N ATOM 1492 CA GLU A 92 -11.832 -12.824 -33.963 1.00 0.00 C ATOM 1493 C GLU A 92 -10.541 -13.190 -33.252 1.00 0.00 C ATOM 1494 O GLU A 92 -10.559 -13.806 -32.183 1.00 0.00 O ATOM 1495 CB GLU A 92 -12.059 -13.755 -35.152 1.00 0.00 C ATOM 1496 CG GLU A 92 -12.219 -15.214 -34.766 1.00 0.00 C ATOM 1497 CD GLU A 92 -12.320 -16.121 -35.965 1.00 0.00 C ATOM 1498 OE1 GLU A 92 -13.420 -16.244 -36.534 1.00 0.00 O ATOM 1499 OE2 GLU A 92 -11.305 -16.713 -36.351 1.00 0.00 O1- ATOM 0 H GLU A 92 -11.840 -11.321 -35.413 1.00 0.00 H new ATOM 0 HA GLU A 92 -12.664 -12.940 -33.268 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -12.950 -13.431 -35.690 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -11.219 -13.661 -35.841 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -11.370 -15.520 -34.154 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -13.112 -15.328 -34.152 1.00 0.00 H new ATOM 1506 N GLU A 93 -9.417 -12.787 -33.838 1.00 0.00 N ATOM 1507 CA GLU A 93 -8.110 -13.048 -33.262 1.00 0.00 C ATOM 1508 C GLU A 93 -7.980 -12.384 -31.897 1.00 0.00 C ATOM 1509 O GLU A 93 -7.473 -12.987 -30.953 1.00 0.00 O ATOM 1510 CB GLU A 93 -7.020 -12.527 -34.196 1.00 0.00 C ATOM 1511 CG GLU A 93 -6.937 -13.252 -35.525 1.00 0.00 C ATOM 1512 CD GLU A 93 -6.464 -14.675 -35.375 1.00 0.00 C ATOM 1513 OE1 GLU A 93 -5.325 -14.877 -34.914 1.00 0.00 O ATOM 1514 OE2 GLU A 93 -7.217 -15.604 -35.730 1.00 0.00 O1- ATOM 0 H GLU A 93 -9.390 -12.274 -34.719 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.996 -14.125 -33.136 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -7.195 -11.468 -34.384 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.057 -12.607 -33.691 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.918 -13.246 -36.001 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.258 -12.714 -36.187 1.00 0.00 H new ATOM 1521 N LEU A 94 -8.464 -11.149 -31.795 1.00 0.00 N ATOM 1522 CA LEU A 94 -8.408 -10.404 -30.543 1.00 0.00 C ATOM 1523 C LEU A 94 -9.204 -11.117 -29.470 1.00 0.00 C ATOM 1524 O LEU A 94 -8.734 -11.295 -28.347 1.00 0.00 O ATOM 1525 CB LEU A 94 -8.968 -8.990 -30.729 1.00 0.00 C ATOM 1526 CG LEU A 94 -8.081 -8.000 -31.479 1.00 0.00 C ATOM 1527 CD1 LEU A 94 -8.859 -6.737 -31.793 1.00 0.00 C ATOM 1528 CD2 LEU A 94 -6.850 -7.664 -30.657 1.00 0.00 C ATOM 0 H LEU A 94 -8.900 -10.643 -32.566 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.364 -10.338 -30.238 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -9.918 -9.066 -31.258 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -9.184 -8.576 -29.744 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.760 -8.459 -32.414 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -8.217 -6.038 -32.328 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.721 -6.985 -32.413 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.200 -6.279 -30.864 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.228 -6.957 -31.206 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.155 -7.220 -29.710 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.282 -8.574 -30.464 1.00 0.00 H new ATOM 1540 N GLU A 95 -10.411 -11.521 -29.827 1.00 0.00 N ATOM 1541 CA GLU A 95 -11.308 -12.190 -28.909 1.00 0.00 C ATOM 1542 C GLU A 95 -10.723 -13.517 -28.404 1.00 0.00 C ATOM 1543 O GLU A 95 -10.727 -13.782 -27.204 1.00 0.00 O ATOM 1544 CB GLU A 95 -12.650 -12.431 -29.598 1.00 0.00 C ATOM 1545 CG GLU A 95 -13.753 -12.899 -28.673 1.00 0.00 C ATOM 1546 CD GLU A 95 -15.051 -13.143 -29.406 1.00 0.00 C ATOM 1547 OE1 GLU A 95 -15.513 -14.298 -29.430 1.00 0.00 O ATOM 1548 OE2 GLU A 95 -15.625 -12.179 -29.957 1.00 0.00 O1- ATOM 0 H GLU A 95 -10.794 -11.393 -30.763 1.00 0.00 H new ATOM 0 HA GLU A 95 -11.448 -11.547 -28.040 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -12.967 -11.508 -30.083 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -12.513 -13.173 -30.384 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -13.441 -13.817 -28.175 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -13.913 -12.153 -27.895 1.00 0.00 H new ATOM 1555 N GLN A 96 -10.186 -14.322 -29.318 1.00 0.00 N ATOM 1556 CA GLN A 96 -9.636 -15.634 -28.960 1.00 0.00 C ATOM 1557 C GLN A 96 -8.366 -15.498 -28.126 1.00 0.00 C ATOM 1558 O GLN A 96 -8.165 -16.226 -27.154 1.00 0.00 O ATOM 1559 CB GLN A 96 -9.355 -16.461 -30.215 1.00 0.00 C ATOM 1560 CG GLN A 96 -10.597 -16.763 -31.041 1.00 0.00 C ATOM 1561 CD GLN A 96 -11.647 -17.536 -30.266 1.00 0.00 C ATOM 1562 OE1 GLN A 96 -11.330 -18.328 -29.375 1.00 0.00 O ATOM 1563 NE2 GLN A 96 -12.904 -17.311 -30.595 1.00 0.00 N ATOM 0 H GLN A 96 -10.118 -14.093 -30.310 1.00 0.00 H new ATOM 0 HA GLN A 96 -10.383 -16.150 -28.357 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -8.637 -15.927 -30.837 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -8.887 -17.401 -29.922 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -11.029 -15.827 -31.394 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -10.310 -17.334 -31.924 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -13.126 -16.648 -31.338 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -13.654 -17.800 -30.107 1.00 0.00 H new ATOM 1572 N ALA A 97 -7.526 -14.552 -28.507 1.00 0.00 N ATOM 1573 CA ALA A 97 -6.274 -14.313 -27.799 1.00 0.00 C ATOM 1574 C ALA A 97 -6.555 -13.793 -26.393 1.00 0.00 C ATOM 1575 O ALA A 97 -5.859 -14.137 -25.438 1.00 0.00 O ATOM 1576 CB ALA A 97 -5.399 -13.338 -28.572 1.00 0.00 C ATOM 0 H ALA A 97 -7.685 -13.935 -29.303 1.00 0.00 H new ATOM 0 HA ALA A 97 -5.735 -15.257 -27.716 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -4.469 -13.173 -28.027 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -5.175 -13.751 -29.555 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -5.925 -12.390 -28.688 1.00 0.00 H new ATOM 1582 N LEU A 98 -7.605 -12.993 -26.277 1.00 0.00 N ATOM 1583 CA LEU A 98 -7.999 -12.422 -25.000 1.00 0.00 C ATOM 1584 C LEU A 98 -8.489 -13.514 -24.055 1.00 0.00 C ATOM 1585 O LEU A 98 -8.116 -13.548 -22.874 1.00 0.00 O ATOM 1586 CB LEU A 98 -9.080 -11.336 -25.205 1.00 0.00 C ATOM 1587 CG LEU A 98 -9.640 -10.670 -23.934 1.00 0.00 C ATOM 1588 CD1 LEU A 98 -10.049 -9.239 -24.229 1.00 0.00 C ATOM 1589 CD2 LEU A 98 -10.839 -11.448 -23.402 1.00 0.00 C ATOM 0 H LEU A 98 -8.202 -12.724 -27.059 1.00 0.00 H new ATOM 0 HA LEU A 98 -7.128 -11.950 -24.545 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -8.663 -10.556 -25.842 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -9.912 -11.782 -25.750 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.857 -10.671 -23.175 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.443 -8.779 -23.323 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.181 -8.676 -24.574 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -10.817 -9.232 -25.003 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -11.219 -10.961 -22.504 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -11.622 -11.474 -24.160 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.534 -12.466 -23.161 1.00 0.00 H new ATOM 1601 N GLN A 99 -9.320 -14.409 -24.579 1.00 0.00 N ATOM 1602 CA GLN A 99 -9.862 -15.501 -23.784 1.00 0.00 C ATOM 1603 C GLN A 99 -8.753 -16.412 -23.270 1.00 0.00 C ATOM 1604 O GLN A 99 -8.819 -16.890 -22.138 1.00 0.00 O ATOM 1605 CB GLN A 99 -10.866 -16.332 -24.595 1.00 0.00 C ATOM 1606 CG GLN A 99 -12.043 -15.542 -25.157 1.00 0.00 C ATOM 1607 CD GLN A 99 -12.877 -14.853 -24.090 1.00 0.00 C ATOM 1608 OE1 GLN A 99 -12.984 -15.320 -22.955 1.00 0.00 O ATOM 1609 NE2 GLN A 99 -13.482 -13.739 -24.458 1.00 0.00 N ATOM 0 H GLN A 99 -9.632 -14.398 -25.550 1.00 0.00 H new ATOM 0 HA GLN A 99 -10.376 -15.053 -22.934 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -10.338 -16.808 -25.421 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -11.252 -17.130 -23.961 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -11.667 -14.792 -25.853 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -12.682 -16.215 -25.728 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -13.367 -13.386 -25.408 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -14.064 -13.231 -23.792 1.00 0.00 H new ATOM 1618 N LYS A 100 -7.715 -16.620 -24.081 1.00 0.00 N ATOM 1619 CA LYS A 100 -6.634 -17.524 -23.721 1.00 0.00 C ATOM 1620 C LYS A 100 -5.776 -16.947 -22.600 1.00 0.00 C ATOM 1621 O LYS A 100 -5.330 -17.675 -21.708 1.00 0.00 O ATOM 1622 CB LYS A 100 -5.783 -17.834 -24.954 1.00 0.00 C ATOM 1623 CG LYS A 100 -4.685 -18.853 -24.719 1.00 0.00 C ATOM 1624 CD LYS A 100 -4.363 -19.623 -25.993 1.00 0.00 C ATOM 1625 CE LYS A 100 -3.985 -18.700 -27.138 1.00 0.00 C ATOM 1626 NZ LYS A 100 -3.728 -19.452 -28.390 1.00 0.00 N1+ ATOM 0 H LYS A 100 -7.605 -16.172 -24.991 1.00 0.00 H new ATOM 0 HA LYS A 100 -7.071 -18.451 -23.351 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -6.435 -18.198 -25.748 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -5.332 -16.908 -25.311 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -3.788 -18.348 -24.360 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -4.993 -19.549 -23.939 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -3.543 -20.315 -25.800 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -5.226 -20.223 -26.281 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -4.786 -17.980 -27.304 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -3.096 -18.130 -26.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -3.473 -18.787 -29.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -2.946 -20.121 -28.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -4.584 -19.976 -28.662 1.00 0.00 H new ATOM 1640 N ILE A 101 -5.544 -15.640 -22.645 1.00 0.00 N ATOM 1641 CA ILE A 101 -4.768 -14.977 -21.604 1.00 0.00 C ATOM 1642 C ILE A 101 -5.484 -15.108 -20.265 1.00 0.00 C ATOM 1643 O ILE A 101 -4.858 -15.372 -19.235 1.00 0.00 O ATOM 1644 CB ILE A 101 -4.519 -13.482 -21.933 1.00 0.00 C ATOM 1645 CG1 ILE A 101 -3.708 -13.360 -23.228 1.00 0.00 C ATOM 1646 CG2 ILE A 101 -3.792 -12.788 -20.780 1.00 0.00 C ATOM 1647 CD1 ILE A 101 -3.454 -11.934 -23.665 1.00 0.00 C ATOM 0 H ILE A 101 -5.879 -15.023 -23.385 1.00 0.00 H new ATOM 0 HA ILE A 101 -3.795 -15.466 -21.549 1.00 0.00 H new ATOM 0 HB ILE A 101 -5.482 -12.991 -22.071 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.751 -13.864 -23.093 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -4.235 -13.885 -24.025 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -3.627 -11.740 -21.032 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -4.398 -12.853 -19.876 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -2.832 -13.275 -20.609 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -2.875 -11.934 -24.588 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -4.406 -11.430 -23.834 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -2.898 -11.409 -22.888 1.00 0.00 H new ATOM 1659 N ARG A 102 -6.807 -14.946 -20.286 1.00 0.00 N ATOM 1660 CA ARG A 102 -7.604 -15.111 -19.081 1.00 0.00 C ATOM 1661 C ARG A 102 -7.490 -16.526 -18.548 1.00 0.00 C ATOM 1662 O ARG A 102 -7.413 -16.730 -17.346 1.00 0.00 O ATOM 1663 CB ARG A 102 -9.073 -14.781 -19.328 1.00 0.00 C ATOM 1664 CG ARG A 102 -9.361 -13.309 -19.526 1.00 0.00 C ATOM 1665 CD ARG A 102 -10.852 -13.030 -19.411 1.00 0.00 C ATOM 1666 NE ARG A 102 -11.381 -13.423 -18.096 1.00 0.00 N ATOM 1667 CZ ARG A 102 -11.822 -12.568 -17.164 1.00 0.00 C ATOM 1668 NH1 ARG A 102 -11.767 -11.260 -17.370 1.00 0.00 N1+ ATOM 1669 NH2 ARG A 102 -12.312 -13.021 -16.022 1.00 0.00 N ATOM 0 H ARG A 102 -7.342 -14.703 -21.120 1.00 0.00 H new ATOM 0 HA ARG A 102 -7.211 -14.413 -18.342 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -9.412 -15.326 -20.209 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -9.660 -15.143 -18.484 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -8.819 -12.725 -18.783 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -9.002 -12.992 -20.505 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -11.037 -11.968 -19.575 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.384 -13.571 -20.193 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.414 -14.419 -17.878 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -11.387 -10.897 -18.244 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -12.105 -10.616 -16.655 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.355 -14.025 -15.848 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -12.647 -12.366 -15.315 1.00 0.00 H new ATOM 1683 N GLU A 103 -7.449 -17.502 -19.452 1.00 0.00 N ATOM 1684 CA GLU A 103 -7.354 -18.900 -19.056 1.00 0.00 C ATOM 1685 C GLU A 103 -6.083 -19.152 -18.262 1.00 0.00 C ATOM 1686 O GLU A 103 -6.092 -19.906 -17.293 1.00 0.00 O ATOM 1687 CB GLU A 103 -7.403 -19.825 -20.271 1.00 0.00 C ATOM 1688 CG GLU A 103 -8.714 -19.774 -21.035 1.00 0.00 C ATOM 1689 CD GLU A 103 -8.755 -20.764 -22.173 1.00 0.00 C ATOM 1690 OE1 GLU A 103 -9.325 -21.864 -21.991 1.00 0.00 O ATOM 1691 OE2 GLU A 103 -8.209 -20.466 -23.247 1.00 0.00 O1- ATOM 0 H GLU A 103 -7.480 -17.349 -20.460 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.213 -19.120 -18.423 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -6.590 -19.562 -20.948 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.226 -20.849 -19.942 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.538 -19.976 -20.351 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -8.864 -18.768 -21.427 1.00 0.00 H new ATOM 1698 N LEU A 104 -4.996 -18.508 -18.665 1.00 0.00 N ATOM 1699 CA LEU A 104 -3.724 -18.645 -17.970 1.00 0.00 C ATOM 1700 C LEU A 104 -3.799 -18.028 -16.576 1.00 0.00 C ATOM 1701 O LEU A 104 -3.255 -18.572 -15.614 1.00 0.00 O ATOM 1702 CB LEU A 104 -2.605 -17.980 -18.776 1.00 0.00 C ATOM 1703 CG LEU A 104 -2.307 -18.594 -20.145 1.00 0.00 C ATOM 1704 CD1 LEU A 104 -1.182 -17.839 -20.827 1.00 0.00 C ATOM 1705 CD2 LEU A 104 -1.954 -20.070 -20.012 1.00 0.00 C ATOM 0 H LEU A 104 -4.970 -17.884 -19.472 1.00 0.00 H new ATOM 0 HA LEU A 104 -3.505 -19.708 -17.867 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.862 -16.930 -18.919 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.692 -18.006 -18.182 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.204 -18.514 -20.759 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.981 -18.287 -21.800 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.472 -16.797 -20.960 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.284 -17.890 -20.211 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -1.746 -20.485 -20.998 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.073 -20.178 -19.380 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -2.790 -20.605 -19.562 1.00 0.00 H new ATOM 1717 N ALA A 105 -4.487 -16.898 -16.474 1.00 0.00 N ATOM 1718 CA ALA A 105 -4.640 -16.198 -15.201 1.00 0.00 C ATOM 1719 C ALA A 105 -5.614 -16.936 -14.283 1.00 0.00 C ATOM 1720 O ALA A 105 -5.476 -16.911 -13.058 1.00 0.00 O ATOM 1721 CB ALA A 105 -5.109 -14.769 -15.436 1.00 0.00 C ATOM 0 H ALA A 105 -4.951 -16.443 -17.261 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.668 -16.171 -14.709 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -5.219 -14.260 -14.478 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -4.376 -14.241 -16.046 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.069 -14.781 -15.952 1.00 0.00 H new ATOM 1727 N GLU A 106 -6.590 -17.598 -14.888 1.00 0.00 N ATOM 1728 CA GLU A 106 -7.595 -18.349 -14.148 1.00 0.00 C ATOM 1729 C GLU A 106 -7.091 -19.760 -13.840 1.00 0.00 C ATOM 1730 O GLU A 106 -7.754 -20.526 -13.135 1.00 0.00 O ATOM 1731 CB GLU A 106 -8.909 -18.402 -14.940 1.00 0.00 C ATOM 1732 CG GLU A 106 -9.587 -17.041 -15.100 1.00 0.00 C ATOM 1733 CD GLU A 106 -10.798 -17.088 -16.012 1.00 0.00 C ATOM 1734 OE1 GLU A 106 -10.875 -16.271 -16.964 1.00 0.00 O ATOM 1735 OE2 GLU A 106 -11.677 -17.952 -15.798 1.00 0.00 O1- ATOM 0 H GLU A 106 -6.708 -17.630 -15.901 1.00 0.00 H new ATOM 0 HA GLU A 106 -7.783 -17.841 -13.202 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -8.711 -18.817 -15.928 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -9.597 -19.084 -14.440 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -9.891 -16.675 -14.119 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -8.866 -16.326 -15.498 1.00 0.00 H new ATOM 1742 N LYS A 107 -5.916 -20.092 -14.395 1.00 0.00 N ATOM 1743 CA LYS A 107 -5.248 -21.386 -14.174 1.00 0.00 C ATOM 1744 C LYS A 107 -5.980 -22.533 -14.866 1.00 0.00 C ATOM 1745 O LYS A 107 -5.839 -23.700 -14.471 1.00 0.00 O ATOM 1746 CB LYS A 107 -5.082 -21.674 -12.673 1.00 0.00 C ATOM 1747 CG LYS A 107 -4.100 -20.749 -11.968 1.00 0.00 C ATOM 1748 CD LYS A 107 -2.701 -20.908 -12.535 1.00 0.00 C ATOM 1749 CE LYS A 107 -1.688 -20.074 -11.776 1.00 0.00 C ATOM 1750 NZ LYS A 107 -0.314 -20.302 -12.281 1.00 0.00 N1+ ATOM 0 H LYS A 107 -5.398 -19.468 -15.014 1.00 0.00 H new ATOM 0 HA LYS A 107 -4.257 -21.314 -14.622 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -6.055 -21.591 -12.188 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -4.749 -22.704 -12.546 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.426 -19.715 -12.078 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -4.091 -20.968 -10.900 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -2.410 -21.958 -12.496 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -2.699 -20.616 -13.585 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -1.941 -19.018 -11.869 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.733 -20.320 -10.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 0.356 -19.717 -11.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -0.065 -21.306 -12.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -0.267 -20.043 -13.287 1.00 0.00 H new ATOM 1764 N LYS A 108 -6.733 -22.198 -15.920 1.00 0.00 N ATOM 1765 CA LYS A 108 -7.481 -23.181 -16.708 1.00 0.00 C ATOM 1766 C LYS A 108 -8.557 -23.896 -15.894 1.00 0.00 C ATOM 1767 O LYS A 108 -8.662 -23.736 -14.673 1.00 0.00 O ATOM 1768 CB LYS A 108 -6.533 -24.207 -17.347 1.00 0.00 C ATOM 1769 CG LYS A 108 -5.956 -23.785 -18.689 1.00 0.00 C ATOM 1770 CD LYS A 108 -7.016 -23.832 -19.781 1.00 0.00 C ATOM 1771 CE LYS A 108 -6.414 -23.579 -21.154 1.00 0.00 C ATOM 1772 NZ LYS A 108 -7.416 -23.743 -22.237 1.00 0.00 N1+ ATOM 0 H LYS A 108 -6.840 -21.239 -16.249 1.00 0.00 H new ATOM 0 HA LYS A 108 -7.989 -22.622 -17.494 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -5.711 -24.401 -16.658 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -7.070 -25.147 -17.476 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -5.552 -22.775 -18.613 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -5.127 -24.441 -18.954 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -7.507 -24.805 -19.772 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -7.784 -23.086 -19.576 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -6.003 -22.570 -21.190 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -5.585 -24.267 -21.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -7.050 -23.324 -23.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -7.602 -24.755 -22.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -8.300 -23.265 -21.968 1.00 0.00 H new ATOM 1786 N ASN A 109 -9.359 -24.671 -16.583 1.00 0.00 N ATOM 1787 CA ASN A 109 -10.403 -25.448 -15.957 1.00 0.00 C ATOM 1788 C ASN A 109 -10.076 -26.921 -16.084 1.00 0.00 C ATOM 1789 O ASN A 109 -9.509 -27.487 -15.136 1.00 0.00 O ATOM 1790 CB ASN A 109 -11.751 -25.149 -16.608 1.00 0.00 C ATOM 1791 CG ASN A 109 -12.877 -25.997 -16.045 1.00 0.00 C ATOM 1792 OD1 ASN A 109 -12.872 -26.363 -14.868 1.00 0.00 O ATOM 1793 ND2 ASN A 109 -13.842 -26.319 -16.882 1.00 0.00 N ATOM 1794 OXT ASN A 109 -10.341 -27.499 -17.157 1.00 0.00 O ATOM 0 H ASN A 109 -9.307 -24.781 -17.596 1.00 0.00 H new ATOM 0 HA ASN A 109 -10.465 -25.181 -14.902 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -11.991 -24.095 -16.468 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -11.676 -25.319 -17.682 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -14.623 -26.892 -16.563 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -13.808 -25.995 -17.849 1.00 0.00 H new TER 1801 ASN A 109 HETATM 1802 NA1 7BU A 201 -1.056 -8.799 -18.755 1.00 0.00 N HETATM 1803 NB2 7BU A 201 -2.891 -8.167 -20.865 1.00 0.00 N HETATM 1804 ND4 7BU A 201 -3.162 -10.044 -17.233 1.00 0.00 N HETATM 1805 CHA 7BU A 201 -0.742 -10.421 -16.890 1.00 0.00 C HETATM 1806 CHB 7BU A 201 -0.666 -7.151 -20.568 1.00 0.00 C HETATM 1807 CHC 7BU A 201 -5.011 -8.986 -21.813 1.00 0.00 C HETATM 1808 CHD 7BU A 201 -5.633 -10.176 -17.099 1.00 0.00 C HETATM 1809 C1A 7BU A 201 -0.264 -9.511 -17.889 1.00 0.00 C HETATM 1810 C1B 7BU A 201 -1.856 -7.378 -21.307 1.00 0.00 C HETATM 1811 C1C 7BU A 201 -5.599 -9.457 -20.605 1.00 0.00 C HETATM 1812 C1D 7BU A 201 -4.322 -10.418 -16.591 1.00 0.00 C HETATM 1813 C1FA 7BU A 201 0.357 -11.189 -16.123 1.00 0.00 C HETATM 1814 C1FB 7BU A 201 0.365 -6.160 -21.129 1.00 0.00 C HETATM 1815 C1FC 7BU A 201 -5.878 -9.170 -23.062 1.00 0.00 C HETATM 1816 C1FD 7BU A 201 -6.832 -10.561 -16.219 1.00 0.00 C HETATM 1817 C2A 7BU A 201 1.130 -9.112 -18.086 1.00 0.00 C HETATM 1818 C2B 7BU A 201 -2.103 -6.989 -22.687 1.00 0.00 C HETATM 1819 C2C 7BU A 201 -6.982 -9.905 -20.451 1.00 0.00 C HETATM 1820 C2D 7BU A 201 -3.984 -11.249 -15.443 1.00 0.00 C HETATM 1821 C3A 7BU A 201 1.144 -8.163 -19.055 1.00 0.00 C HETATM 1822 C3B 7BU A 201 -3.276 -7.552 -23.054 1.00 0.00 C HETATM 1823 C3C 7BU A 201 -7.172 -10.171 -19.140 1.00 0.00 C HETATM 1824 C3D 7BU A 201 -2.632 -11.372 -15.422 1.00 0.00 C HETATM 1825 C4A 7BU A 201 -0.233 -7.970 -19.482 1.00 0.00 C HETATM 1826 C4B 7BU A 201 -3.781 -8.294 -21.906 1.00 0.00 C HETATM 1827 C4C 7BU A 201 -5.914 -9.894 -18.462 1.00 0.00 C HETATM 1828 C4D 7BU A 201 -2.108 -10.617 -16.550 1.00 0.00 C HETATM 1829 NC3 7BU A 201 -4.986 -9.466 -19.378 1.00 0.00 N HETATM 1830 F21A 7BU A 201 0.856 -10.455 -15.105 1.00 0.00 F HETATM 1831 F21B 7BU A 201 -0.228 -5.091 -21.720 1.00 0.00 F HETATM 1832 F21C 7BU A 201 -5.204 -9.172 -24.220 1.00 0.00 F HETATM 1833 F21D 7BU A 201 -7.957 -9.864 -16.507 1.00 0.00 F HETATM 1834 F22A 7BU A 201 1.420 -11.483 -16.906 1.00 0.00 F HETATM 1835 F22B 7BU A 201 1.166 -6.697 -22.079 1.00 0.00 F HETATM 1836 F22C 7BU A 201 -6.547 -10.348 -23.048 1.00 0.00 F HETATM 1837 F22D 7BU A 201 -6.588 -10.316 -14.917 1.00 0.00 F HETATM 1838 F23A 7BU A 201 -0.040 -12.362 -15.580 1.00 0.00 F HETATM 1839 F23B 7BU A 201 1.175 -5.667 -20.163 1.00 0.00 F HETATM 1840 F23C 7BU A 201 -6.810 -8.193 -23.163 1.00 0.00 F HETATM 1841 F23D 7BU A 201 -7.142 -11.875 -16.325 1.00 0.00 F HETATM 1842 ZN 7BU A 201 -3.119 -8.736 -18.871 1.00 0.00 ZN