USER MOD reduce.3.24.130724 H: found=0, std=0, add=743, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 741 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 28 HIS HE2 : A 28 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD NoAdj-H: A 32 HIS HE2 : A 32 HIS NE2 : A 101 ZNZN :(H bumps) USER MOD NoAdj-H: A 56 HIS HE2 : A 56 HIS NE2 : A 102 ZNZN :(H bumps) USER MOD NoAdj-H: A 60 HIS HE2 : A 60 HIS NE2 : A 102 ZNZN :(H bumps) USER MOD NoAdj-H: A 83 HIS HE2 : A 83 HIS NE2 : A 103 ZNZN :(H bumps) USER MOD NoAdj-H: A 88 HIS HE2 : A 88 HIS NE2 : A 103 ZNZN :(H bumps) USER MOD Set 1.1: A 74 CYS SG : rot -124:sc= 1.33 USER MOD Set 1.2: A 79 HIS : no HE2:sc= 0.758 K(o=2.1,f=-3.7!) USER MOD Set 2.1: A 45 TYR OH : rot -179:sc= 0.802 USER MOD Set 2.2: A 47 SER OG : rot 141:sc= 0.452 USER MOD Set 2.3: A 52 ASN : amide:sc= 1.05 K(o=2.3,f=0.99) USER MOD Set 3.1: A 34 ASN : amide:sc= 0.869 K(o=1.9,f=-5.3!) USER MOD Set 3.2: A 39 LYS NZ :NH3+ 170:sc= 0.996 (180deg=0) USER MOD Set 4.1: A 23 HIS : no HD1:sc= -0.0571 X(o=-0.057,f=-0.047) USER MOD Set 4.2: A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 145:sc= 0.00678 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0.0628 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.118 X(o=-0.12,f=-0.12) USER MOD Single : A 17 LYS NZ :NH3+ 166:sc= 1.36 (180deg=0.785) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 33 THR OG1 : rot -78:sc= 0.0948 USER MOD Single : A 36 LYS NZ :NH3+ -160:sc= 2.15 (180deg=1.59) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=-0.0012) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.986 K(o=0.99,f=-3.6!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -159:sc= 0.871 (180deg=0.639) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 180:sc= 0.00218 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 164:sc= 1.27 (180deg=1.14) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.349 41.084 -8.874 1.00 0.00 N ATOM 2 CA GLY A 1 -4.906 39.734 -8.646 1.00 0.00 C ATOM 3 C GLY A 1 -5.447 39.134 -9.936 1.00 0.00 C ATOM 4 O GLY A 1 -6.088 39.837 -10.722 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.534 41.681 -8.042 1.00 0.00 H new ATOM 0 H2 GLY A 1 -3.323 41.015 -9.029 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.798 41.508 -9.711 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.133 39.084 -8.236 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -5.703 39.788 -7.905 1.00 0.00 H new ATOM 10 N SER A 2 -5.202 37.837 -10.154 1.00 0.00 N ATOM 11 CA SER A 2 -5.561 37.099 -11.382 1.00 0.00 C ATOM 12 C SER A 2 -6.143 35.711 -11.072 1.00 0.00 C ATOM 13 O SER A 2 -5.837 35.114 -10.036 1.00 0.00 O ATOM 14 CB SER A 2 -4.331 36.939 -12.290 1.00 0.00 C ATOM 15 OG SER A 2 -3.799 38.203 -12.663 1.00 0.00 O ATOM 0 H SER A 2 -4.735 37.250 -9.463 1.00 0.00 H new ATOM 0 HA SER A 2 -6.327 37.684 -11.892 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.567 36.358 -11.773 1.00 0.00 H new ATOM 0 HB3 SER A 2 -4.606 36.379 -13.184 1.00 0.00 H new ATOM 0 HG SER A 2 -3.017 38.072 -13.239 1.00 0.00 H new ATOM 21 N SER A 3 -6.953 35.171 -11.988 1.00 0.00 N ATOM 22 CA SER A 3 -7.665 33.884 -11.857 1.00 0.00 C ATOM 23 C SER A 3 -6.772 32.660 -12.153 1.00 0.00 C ATOM 24 O SER A 3 -7.099 31.813 -12.990 1.00 0.00 O ATOM 25 CB SER A 3 -8.934 33.890 -12.724 1.00 0.00 C ATOM 26 OG SER A 3 -9.763 34.999 -12.395 1.00 0.00 O ATOM 0 H SER A 3 -7.142 35.632 -12.878 1.00 0.00 H new ATOM 0 HA SER A 3 -7.956 33.782 -10.812 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.660 33.935 -13.778 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.485 32.961 -12.577 1.00 0.00 H new ATOM 0 HG SER A 3 -10.565 34.987 -12.958 1.00 0.00 H new ATOM 32 N GLY A 4 -5.612 32.581 -11.492 1.00 0.00 N ATOM 33 CA GLY A 4 -4.636 31.492 -11.630 1.00 0.00 C ATOM 34 C GLY A 4 -5.087 30.152 -11.024 1.00 0.00 C ATOM 35 O GLY A 4 -6.077 30.077 -10.289 1.00 0.00 O ATOM 0 H GLY A 4 -5.316 33.294 -10.826 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.422 31.344 -12.689 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.703 31.795 -11.156 1.00 0.00 H new ATOM 39 N SER A 5 -4.341 29.087 -11.330 1.00 0.00 N ATOM 40 CA SER A 5 -4.576 27.715 -10.848 1.00 0.00 C ATOM 41 C SER A 5 -3.262 26.951 -10.642 1.00 0.00 C ATOM 42 O SER A 5 -2.278 27.175 -11.354 1.00 0.00 O ATOM 43 CB SER A 5 -5.468 26.965 -11.847 1.00 0.00 C ATOM 44 OG SER A 5 -5.714 25.635 -11.411 1.00 0.00 O ATOM 0 H SER A 5 -3.527 29.154 -11.941 1.00 0.00 H new ATOM 0 HA SER A 5 -5.075 27.778 -9.881 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.414 27.494 -11.964 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.989 26.948 -12.826 1.00 0.00 H new ATOM 0 HG SER A 5 -6.286 25.178 -12.062 1.00 0.00 H new ATOM 50 N SER A 6 -3.253 26.014 -9.690 1.00 0.00 N ATOM 51 CA SER A 6 -2.130 25.100 -9.420 1.00 0.00 C ATOM 52 C SER A 6 -2.025 23.940 -10.428 1.00 0.00 C ATOM 53 O SER A 6 -1.021 23.223 -10.434 1.00 0.00 O ATOM 54 CB SER A 6 -2.249 24.524 -8.001 1.00 0.00 C ATOM 55 OG SER A 6 -2.317 25.566 -7.034 1.00 0.00 O ATOM 0 H SER A 6 -4.046 25.863 -9.067 1.00 0.00 H new ATOM 0 HA SER A 6 -1.223 25.696 -9.521 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.139 23.899 -7.931 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.393 23.883 -7.791 1.00 0.00 H new ATOM 0 HG SER A 6 -2.394 25.176 -6.138 1.00 0.00 H new ATOM 61 N GLY A 7 -3.042 23.734 -11.277 1.00 0.00 N ATOM 62 CA GLY A 7 -3.111 22.610 -12.219 1.00 0.00 C ATOM 63 C GLY A 7 -3.217 21.252 -11.510 1.00 0.00 C ATOM 64 O GLY A 7 -3.915 21.125 -10.498 1.00 0.00 O ATOM 0 H GLY A 7 -3.851 24.353 -11.329 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.972 22.742 -12.874 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.224 22.617 -12.853 1.00 0.00 H new ATOM 68 N LYS A 8 -2.511 20.237 -12.029 1.00 0.00 N ATOM 69 CA LYS A 8 -2.374 18.899 -11.423 1.00 0.00 C ATOM 70 C LYS A 8 -0.900 18.496 -11.290 1.00 0.00 C ATOM 71 O LYS A 8 -0.080 18.818 -12.151 1.00 0.00 O ATOM 72 CB LYS A 8 -3.210 17.880 -12.221 1.00 0.00 C ATOM 73 CG LYS A 8 -3.328 16.526 -11.504 1.00 0.00 C ATOM 74 CD LYS A 8 -4.327 15.605 -12.215 1.00 0.00 C ATOM 75 CE LYS A 8 -4.439 14.273 -11.460 1.00 0.00 C ATOM 76 NZ LYS A 8 -5.449 13.378 -12.082 1.00 0.00 N ATOM 0 H LYS A 8 -2.003 20.324 -12.909 1.00 0.00 H new ATOM 0 HA LYS A 8 -2.767 18.920 -10.407 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -4.207 18.286 -12.390 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -2.756 17.730 -13.201 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -2.350 16.046 -11.466 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -3.646 16.684 -10.473 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -5.304 16.086 -12.268 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -4.003 15.426 -13.240 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -3.469 13.777 -11.450 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -4.711 14.464 -10.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -5.499 12.487 -11.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -6.379 13.843 -12.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -5.176 13.177 -13.065 1.00 0.00 H new ATOM 90 N ILE A 9 -0.576 17.819 -10.188 1.00 0.00 N ATOM 91 CA ILE A 9 0.787 17.470 -9.751 1.00 0.00 C ATOM 92 C ILE A 9 0.823 15.983 -9.358 1.00 0.00 C ATOM 93 O ILE A 9 -0.148 15.462 -8.800 1.00 0.00 O ATOM 94 CB ILE A 9 1.227 18.402 -8.589 1.00 0.00 C ATOM 95 CG1 ILE A 9 1.177 19.892 -9.016 1.00 0.00 C ATOM 96 CG2 ILE A 9 2.634 18.028 -8.096 1.00 0.00 C ATOM 97 CD1 ILE A 9 1.512 20.896 -7.908 1.00 0.00 C ATOM 0 H ILE A 9 -1.288 17.480 -9.541 1.00 0.00 H new ATOM 0 HA ILE A 9 1.498 17.619 -10.564 1.00 0.00 H new ATOM 0 HB ILE A 9 0.525 18.265 -7.767 1.00 0.00 H new ATOM 0 HG12 ILE A 9 1.872 20.041 -9.842 1.00 0.00 H new ATOM 0 HG13 ILE A 9 0.179 20.112 -9.395 1.00 0.00 H new ATOM 0 HG21 ILE A 9 2.923 18.693 -7.282 1.00 0.00 H new ATOM 0 HG22 ILE A 9 2.633 16.998 -7.740 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.345 18.128 -8.916 1.00 0.00 H new ATOM 0 HD11 ILE A 9 1.450 21.909 -8.304 1.00 0.00 H new ATOM 0 HD12 ILE A 9 0.803 20.783 -7.088 1.00 0.00 H new ATOM 0 HD13 ILE A 9 2.522 20.711 -7.542 1.00 0.00 H new ATOM 109 N PHE A 10 1.931 15.298 -9.654 1.00 0.00 N ATOM 110 CA PHE A 10 2.079 13.844 -9.527 1.00 0.00 C ATOM 111 C PHE A 10 3.263 13.509 -8.605 1.00 0.00 C ATOM 112 O PHE A 10 4.359 14.037 -8.793 1.00 0.00 O ATOM 113 CB PHE A 10 2.224 13.243 -10.939 1.00 0.00 C ATOM 114 CG PHE A 10 1.117 13.648 -11.903 1.00 0.00 C ATOM 115 CD1 PHE A 10 1.228 14.844 -12.641 1.00 0.00 C ATOM 116 CD2 PHE A 10 -0.042 12.858 -12.035 1.00 0.00 C ATOM 117 CE1 PHE A 10 0.190 15.253 -13.494 1.00 0.00 C ATOM 118 CE2 PHE A 10 -1.082 13.268 -12.889 1.00 0.00 C ATOM 119 CZ PHE A 10 -0.965 14.463 -13.621 1.00 0.00 C ATOM 0 H PHE A 10 2.776 15.753 -9.999 1.00 0.00 H new ATOM 0 HA PHE A 10 1.198 13.402 -9.062 1.00 0.00 H new ATOM 0 HB2 PHE A 10 3.184 13.549 -11.356 1.00 0.00 H new ATOM 0 HB3 PHE A 10 2.242 12.156 -10.860 1.00 0.00 H new ATOM 0 HD1 PHE A 10 2.117 15.450 -12.550 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -0.132 11.936 -11.480 1.00 0.00 H new ATOM 0 HE1 PHE A 10 0.279 16.174 -14.052 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -1.972 12.664 -12.983 1.00 0.00 H new ATOM 0 HZ PHE A 10 -1.762 14.773 -14.280 1.00 0.00 H new ATOM 129 N THR A 11 3.066 12.638 -7.608 1.00 0.00 N ATOM 130 CA THR A 11 4.039 12.401 -6.523 1.00 0.00 C ATOM 131 C THR A 11 4.319 10.911 -6.305 1.00 0.00 C ATOM 132 O THR A 11 3.392 10.098 -6.267 1.00 0.00 O ATOM 133 CB THR A 11 3.536 13.055 -5.221 1.00 0.00 C ATOM 134 OG1 THR A 11 3.254 14.424 -5.439 1.00 0.00 O ATOM 135 CG2 THR A 11 4.552 13.000 -4.081 1.00 0.00 C ATOM 0 H THR A 11 2.222 12.071 -7.527 1.00 0.00 H new ATOM 0 HA THR A 11 4.983 12.858 -6.820 1.00 0.00 H new ATOM 0 HB THR A 11 2.650 12.487 -4.938 1.00 0.00 H new ATOM 0 HG1 THR A 11 2.934 14.829 -4.606 1.00 0.00 H new ATOM 0 HG21 THR A 11 4.132 13.478 -3.196 1.00 0.00 H new ATOM 0 HG22 THR A 11 4.788 11.960 -3.854 1.00 0.00 H new ATOM 0 HG23 THR A 11 5.461 13.522 -4.379 1.00 0.00 H new ATOM 143 N CYS A 12 5.596 10.555 -6.127 1.00 0.00 N ATOM 144 CA CYS A 12 6.060 9.204 -5.815 1.00 0.00 C ATOM 145 C CYS A 12 5.691 8.796 -4.377 1.00 0.00 C ATOM 146 O CYS A 12 5.955 9.524 -3.416 1.00 0.00 O ATOM 147 CB CYS A 12 7.571 9.153 -6.078 1.00 0.00 C ATOM 148 SG CYS A 12 8.221 7.495 -5.725 1.00 0.00 S ATOM 0 H CYS A 12 6.360 11.226 -6.200 1.00 0.00 H new ATOM 0 HA CYS A 12 5.562 8.475 -6.455 1.00 0.00 H new ATOM 0 HB2 CYS A 12 7.775 9.417 -7.116 1.00 0.00 H new ATOM 0 HB3 CYS A 12 8.080 9.890 -5.456 1.00 0.00 H new ATOM 153 N GLU A 13 5.101 7.611 -4.219 1.00 0.00 N ATOM 154 CA GLU A 13 4.732 7.049 -2.911 1.00 0.00 C ATOM 155 C GLU A 13 5.899 6.345 -2.188 1.00 0.00 C ATOM 156 O GLU A 13 5.762 5.972 -1.021 1.00 0.00 O ATOM 157 CB GLU A 13 3.497 6.143 -3.056 1.00 0.00 C ATOM 158 CG GLU A 13 3.753 4.851 -3.843 1.00 0.00 C ATOM 159 CD GLU A 13 2.457 4.029 -3.976 1.00 0.00 C ATOM 160 OE1 GLU A 13 2.101 3.286 -3.028 1.00 0.00 O ATOM 161 OE2 GLU A 13 1.774 4.125 -5.026 1.00 0.00 O ATOM 0 H GLU A 13 4.861 7.004 -5.003 1.00 0.00 H new ATOM 0 HA GLU A 13 4.474 7.885 -2.261 1.00 0.00 H new ATOM 0 HB2 GLU A 13 3.132 5.883 -2.062 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.704 6.705 -3.550 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.139 5.093 -4.833 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.516 4.258 -3.339 1.00 0.00 H new ATOM 168 N TYR A 14 7.048 6.176 -2.859 1.00 0.00 N ATOM 169 CA TYR A 14 8.211 5.439 -2.345 1.00 0.00 C ATOM 170 C TYR A 14 9.387 6.342 -1.928 1.00 0.00 C ATOM 171 O TYR A 14 10.107 5.990 -0.989 1.00 0.00 O ATOM 172 CB TYR A 14 8.671 4.428 -3.401 1.00 0.00 C ATOM 173 CG TYR A 14 7.650 3.378 -3.802 1.00 0.00 C ATOM 174 CD1 TYR A 14 7.511 2.205 -3.034 1.00 0.00 C ATOM 175 CD2 TYR A 14 6.874 3.553 -4.967 1.00 0.00 C ATOM 176 CE1 TYR A 14 6.599 1.207 -3.430 1.00 0.00 C ATOM 177 CE2 TYR A 14 5.961 2.556 -5.366 1.00 0.00 C ATOM 178 CZ TYR A 14 5.822 1.380 -4.595 1.00 0.00 C ATOM 179 OH TYR A 14 4.943 0.409 -4.971 1.00 0.00 O ATOM 0 H TYR A 14 7.197 6.556 -3.794 1.00 0.00 H new ATOM 0 HA TYR A 14 7.889 4.932 -1.436 1.00 0.00 H new ATOM 0 HB2 TYR A 14 8.970 4.976 -4.295 1.00 0.00 H new ATOM 0 HB3 TYR A 14 9.559 3.919 -3.026 1.00 0.00 H new ATOM 0 HD1 TYR A 14 8.104 2.071 -2.141 1.00 0.00 H new ATOM 0 HD2 TYR A 14 6.980 4.453 -5.555 1.00 0.00 H new ATOM 0 HE1 TYR A 14 6.494 0.308 -2.841 1.00 0.00 H new ATOM 0 HE2 TYR A 14 5.369 2.691 -6.259 1.00 0.00 H new ATOM 0 HH TYR A 14 4.486 0.682 -5.793 1.00 0.00 H new ATOM 189 N CYS A 15 9.581 7.494 -2.591 1.00 0.00 N ATOM 190 CA CYS A 15 10.650 8.463 -2.287 1.00 0.00 C ATOM 191 C CYS A 15 10.194 9.943 -2.205 1.00 0.00 C ATOM 192 O CYS A 15 11.023 10.842 -2.038 1.00 0.00 O ATOM 193 CB CYS A 15 11.850 8.232 -3.220 1.00 0.00 C ATOM 194 SG CYS A 15 11.492 8.657 -4.938 1.00 0.00 S ATOM 0 H CYS A 15 8.988 7.785 -3.369 1.00 0.00 H new ATOM 0 HA CYS A 15 10.971 8.265 -1.264 1.00 0.00 H new ATOM 0 HB2 CYS A 15 12.695 8.826 -2.872 1.00 0.00 H new ATOM 0 HB3 CYS A 15 12.152 7.186 -3.164 1.00 0.00 H new ATOM 199 N ASN A 16 8.881 10.201 -2.278 1.00 0.00 N ATOM 200 CA ASN A 16 8.240 11.519 -2.129 1.00 0.00 C ATOM 201 C ASN A 16 8.680 12.603 -3.148 1.00 0.00 C ATOM 202 O ASN A 16 8.390 13.788 -2.967 1.00 0.00 O ATOM 203 CB ASN A 16 8.295 11.938 -0.643 1.00 0.00 C ATOM 204 CG ASN A 16 7.328 13.057 -0.282 1.00 0.00 C ATOM 205 OD1 ASN A 16 7.714 14.158 0.090 1.00 0.00 O ATOM 206 ND2 ASN A 16 6.038 12.805 -0.339 1.00 0.00 N ATOM 0 H ASN A 16 8.201 9.460 -2.451 1.00 0.00 H new ATOM 0 HA ASN A 16 7.193 11.415 -2.412 1.00 0.00 H new ATOM 0 HB2 ASN A 16 8.078 11.069 -0.022 1.00 0.00 H new ATOM 0 HB3 ASN A 16 9.309 12.256 -0.402 1.00 0.00 H new ATOM 0 HD21 ASN A 16 5.366 13.525 -0.074 1.00 0.00 H new ATOM 0 HD22 ASN A 16 5.710 11.890 -0.648 1.00 0.00 H new ATOM 213 N LYS A 17 9.335 12.210 -4.249 1.00 0.00 N ATOM 214 CA LYS A 17 9.635 13.084 -5.397 1.00 0.00 C ATOM 215 C LYS A 17 8.361 13.564 -6.092 1.00 0.00 C ATOM 216 O LYS A 17 7.367 12.842 -6.157 1.00 0.00 O ATOM 217 CB LYS A 17 10.520 12.349 -6.409 1.00 0.00 C ATOM 218 CG LYS A 17 11.965 12.215 -5.927 1.00 0.00 C ATOM 219 CD LYS A 17 12.741 11.377 -6.952 1.00 0.00 C ATOM 220 CE LYS A 17 14.148 10.981 -6.499 1.00 0.00 C ATOM 221 NZ LYS A 17 14.138 10.240 -5.209 1.00 0.00 N ATOM 0 H LYS A 17 9.679 11.258 -4.371 1.00 0.00 H new ATOM 0 HA LYS A 17 10.163 13.956 -5.011 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.108 11.357 -6.595 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.504 12.884 -7.358 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.421 13.199 -5.818 1.00 0.00 H new ATOM 0 HG3 LYS A 17 11.995 11.739 -4.947 1.00 0.00 H new ATOM 0 HD2 LYS A 17 12.173 10.472 -7.170 1.00 0.00 H new ATOM 0 HD3 LYS A 17 12.815 11.939 -7.883 1.00 0.00 H new ATOM 0 HE2 LYS A 17 14.614 10.363 -7.267 1.00 0.00 H new ATOM 0 HE3 LYS A 17 14.760 11.877 -6.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 15.064 9.790 -5.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 13.945 10.902 -4.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 13.398 9.509 -5.234 1.00 0.00 H new ATOM 235 N VAL A 18 8.428 14.771 -6.646 1.00 0.00 N ATOM 236 CA VAL A 18 7.305 15.479 -7.285 1.00 0.00 C ATOM 237 C VAL A 18 7.600 15.738 -8.767 1.00 0.00 C ATOM 238 O VAL A 18 8.703 16.159 -9.127 1.00 0.00 O ATOM 239 CB VAL A 18 6.982 16.787 -6.532 1.00 0.00 C ATOM 240 CG1 VAL A 18 5.753 17.481 -7.121 1.00 0.00 C ATOM 241 CG2 VAL A 18 6.684 16.530 -5.047 1.00 0.00 C ATOM 0 H VAL A 18 9.294 15.309 -6.667 1.00 0.00 H new ATOM 0 HA VAL A 18 6.421 14.844 -7.232 1.00 0.00 H new ATOM 0 HB VAL A 18 7.866 17.416 -6.637 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.553 18.399 -6.568 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.938 17.722 -8.168 1.00 0.00 H new ATOM 0 HG13 VAL A 18 4.891 16.818 -7.048 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.461 17.475 -4.552 1.00 0.00 H new ATOM 0 HG22 VAL A 18 5.827 15.863 -4.958 1.00 0.00 H new ATOM 0 HG23 VAL A 18 7.552 16.069 -4.576 1.00 0.00 H new ATOM 251 N PHE A 19 6.603 15.499 -9.621 1.00 0.00 N ATOM 252 CA PHE A 19 6.676 15.552 -11.083 1.00 0.00 C ATOM 253 C PHE A 19 5.496 16.353 -11.666 1.00 0.00 C ATOM 254 O PHE A 19 4.371 16.300 -11.154 1.00 0.00 O ATOM 255 CB PHE A 19 6.713 14.116 -11.642 1.00 0.00 C ATOM 256 CG PHE A 19 7.842 13.250 -11.102 1.00 0.00 C ATOM 257 CD1 PHE A 19 7.648 12.482 -9.936 1.00 0.00 C ATOM 258 CD2 PHE A 19 9.099 13.233 -11.738 1.00 0.00 C ATOM 259 CE1 PHE A 19 8.705 11.725 -9.398 1.00 0.00 C ATOM 260 CE2 PHE A 19 10.159 12.478 -11.196 1.00 0.00 C ATOM 261 CZ PHE A 19 9.968 11.734 -10.019 1.00 0.00 C ATOM 0 H PHE A 19 5.670 15.249 -9.293 1.00 0.00 H new ATOM 0 HA PHE A 19 7.589 16.069 -11.379 1.00 0.00 H new ATOM 0 HB2 PHE A 19 5.763 13.630 -11.420 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.799 14.166 -12.727 1.00 0.00 H new ATOM 0 HD1 PHE A 19 6.682 12.475 -9.453 1.00 0.00 H new ATOM 0 HD2 PHE A 19 9.251 13.801 -12.644 1.00 0.00 H new ATOM 0 HE1 PHE A 19 8.547 11.136 -8.507 1.00 0.00 H new ATOM 0 HE2 PHE A 19 11.121 12.471 -11.687 1.00 0.00 H new ATOM 0 HZ PHE A 19 10.786 11.172 -9.593 1.00 0.00 H new ATOM 271 N LYS A 20 5.740 17.084 -12.764 1.00 0.00 N ATOM 272 CA LYS A 20 4.740 17.951 -13.424 1.00 0.00 C ATOM 273 C LYS A 20 3.751 17.194 -14.320 1.00 0.00 C ATOM 274 O LYS A 20 2.688 17.728 -14.640 1.00 0.00 O ATOM 275 CB LYS A 20 5.453 19.058 -14.222 1.00 0.00 C ATOM 276 CG LYS A 20 6.242 20.019 -13.314 1.00 0.00 C ATOM 277 CD LYS A 20 6.805 21.234 -14.069 1.00 0.00 C ATOM 278 CE LYS A 20 7.847 20.838 -15.124 1.00 0.00 C ATOM 279 NZ LYS A 20 8.424 22.033 -15.795 1.00 0.00 N ATOM 0 H LYS A 20 6.648 17.093 -13.228 1.00 0.00 H new ATOM 0 HA LYS A 20 4.139 18.389 -12.627 1.00 0.00 H new ATOM 0 HB2 LYS A 20 6.133 18.603 -14.943 1.00 0.00 H new ATOM 0 HB3 LYS A 20 4.716 19.624 -14.792 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.592 20.367 -12.511 1.00 0.00 H new ATOM 0 HG3 LYS A 20 7.064 19.476 -12.847 1.00 0.00 H new ATOM 0 HD2 LYS A 20 5.987 21.768 -14.553 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.258 21.923 -13.356 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.644 20.264 -14.652 1.00 0.00 H new ATOM 0 HE3 LYS A 20 7.385 20.189 -15.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 9.124 21.730 -16.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 7.666 22.567 -16.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 8.886 22.639 -15.087 1.00 0.00 H new ATOM 293 N PHE A 21 4.083 15.960 -14.710 1.00 0.00 N ATOM 294 CA PHE A 21 3.291 15.115 -15.611 1.00 0.00 C ATOM 295 C PHE A 21 3.262 13.655 -15.141 1.00 0.00 C ATOM 296 O PHE A 21 4.245 13.151 -14.589 1.00 0.00 O ATOM 297 CB PHE A 21 3.863 15.194 -17.036 1.00 0.00 C ATOM 298 CG PHE A 21 3.961 16.598 -17.606 1.00 0.00 C ATOM 299 CD1 PHE A 21 2.804 17.260 -18.059 1.00 0.00 C ATOM 300 CD2 PHE A 21 5.207 17.252 -17.668 1.00 0.00 C ATOM 301 CE1 PHE A 21 2.892 18.570 -18.565 1.00 0.00 C ATOM 302 CE2 PHE A 21 5.295 18.562 -18.173 1.00 0.00 C ATOM 303 CZ PHE A 21 4.137 19.222 -18.620 1.00 0.00 C ATOM 0 H PHE A 21 4.940 15.505 -14.397 1.00 0.00 H new ATOM 0 HA PHE A 21 2.267 15.487 -15.604 1.00 0.00 H new ATOM 0 HB2 PHE A 21 4.857 14.746 -17.039 1.00 0.00 H new ATOM 0 HB3 PHE A 21 3.239 14.592 -17.697 1.00 0.00 H new ATOM 0 HD1 PHE A 21 1.847 16.761 -18.018 1.00 0.00 H new ATOM 0 HD2 PHE A 21 6.098 16.746 -17.327 1.00 0.00 H new ATOM 0 HE1 PHE A 21 2.003 19.075 -18.911 1.00 0.00 H new ATOM 0 HE2 PHE A 21 6.252 19.061 -18.217 1.00 0.00 H new ATOM 0 HZ PHE A 21 4.203 20.229 -19.005 1.00 0.00 H new ATOM 313 N LYS A 22 2.156 12.948 -15.411 1.00 0.00 N ATOM 314 CA LYS A 22 1.979 11.548 -14.996 1.00 0.00 C ATOM 315 C LYS A 22 2.964 10.602 -15.685 1.00 0.00 C ATOM 316 O LYS A 22 3.485 9.705 -15.032 1.00 0.00 O ATOM 317 CB LYS A 22 0.524 11.108 -15.226 1.00 0.00 C ATOM 318 CG LYS A 22 0.193 9.844 -14.412 1.00 0.00 C ATOM 319 CD LYS A 22 -1.296 9.472 -14.425 1.00 0.00 C ATOM 320 CE LYS A 22 -1.826 9.281 -15.851 1.00 0.00 C ATOM 321 NZ LYS A 22 -3.216 8.755 -15.858 1.00 0.00 N ATOM 0 H LYS A 22 1.360 13.329 -15.922 1.00 0.00 H new ATOM 0 HA LYS A 22 2.199 11.491 -13.930 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -0.152 11.914 -14.943 1.00 0.00 H new ATOM 0 HB3 LYS A 22 0.362 10.914 -16.286 1.00 0.00 H new ATOM 0 HG2 LYS A 22 0.770 9.008 -14.806 1.00 0.00 H new ATOM 0 HG3 LYS A 22 0.512 9.993 -13.380 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.446 8.554 -13.856 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -1.870 10.253 -13.926 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -1.795 10.233 -16.381 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.175 8.594 -16.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -3.539 8.640 -16.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -3.241 7.834 -15.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -3.842 9.422 -15.364 1.00 0.00 H new ATOM 335 N HIS A 23 3.291 10.834 -16.959 1.00 0.00 N ATOM 336 CA HIS A 23 4.255 10.003 -17.696 1.00 0.00 C ATOM 337 C HIS A 23 5.674 10.060 -17.098 1.00 0.00 C ATOM 338 O HIS A 23 6.371 9.042 -17.074 1.00 0.00 O ATOM 339 CB HIS A 23 4.230 10.364 -19.191 1.00 0.00 C ATOM 340 CG HIS A 23 4.510 11.811 -19.530 1.00 0.00 C ATOM 341 ND1 HIS A 23 3.587 12.734 -19.975 1.00 0.00 N ATOM 342 CD2 HIS A 23 5.733 12.431 -19.550 1.00 0.00 C ATOM 343 CE1 HIS A 23 4.234 13.878 -20.255 1.00 0.00 C ATOM 344 NE2 HIS A 23 5.549 13.744 -20.006 1.00 0.00 N ATOM 0 H HIS A 23 2.899 11.598 -17.509 1.00 0.00 H new ATOM 0 HA HIS A 23 3.945 8.963 -17.593 1.00 0.00 H new ATOM 0 HB2 HIS A 23 4.963 9.743 -19.706 1.00 0.00 H new ATOM 0 HB3 HIS A 23 3.251 10.101 -19.591 1.00 0.00 H new ATOM 0 HD2 HIS A 23 6.674 11.985 -19.264 1.00 0.00 H new ATOM 0 HE1 HIS A 23 3.765 14.777 -20.627 1.00 0.00 H new ATOM 0 HE2 HIS A 23 6.269 14.456 -20.125 1.00 0.00 H new ATOM 352 N SER A 24 6.078 11.206 -16.537 1.00 0.00 N ATOM 353 CA SER A 24 7.352 11.354 -15.815 1.00 0.00 C ATOM 354 C SER A 24 7.361 10.540 -14.516 1.00 0.00 C ATOM 355 O SER A 24 8.343 9.854 -14.230 1.00 0.00 O ATOM 356 CB SER A 24 7.634 12.827 -15.504 1.00 0.00 C ATOM 357 OG SER A 24 7.664 13.586 -16.703 1.00 0.00 O ATOM 0 H SER A 24 5.528 12.064 -16.570 1.00 0.00 H new ATOM 0 HA SER A 24 8.138 10.970 -16.466 1.00 0.00 H new ATOM 0 HB2 SER A 24 6.866 13.218 -14.837 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.587 12.920 -14.983 1.00 0.00 H new ATOM 0 HG SER A 24 7.843 14.526 -16.491 1.00 0.00 H new ATOM 363 N LEU A 25 6.248 10.535 -13.770 1.00 0.00 N ATOM 364 CA LEU A 25 6.092 9.684 -12.587 1.00 0.00 C ATOM 365 C LEU A 25 6.042 8.191 -12.959 1.00 0.00 C ATOM 366 O LEU A 25 6.726 7.390 -12.332 1.00 0.00 O ATOM 367 CB LEU A 25 4.857 10.125 -11.778 1.00 0.00 C ATOM 368 CG LEU A 25 4.580 9.234 -10.549 1.00 0.00 C ATOM 369 CD1 LEU A 25 5.722 9.245 -9.533 1.00 0.00 C ATOM 370 CD2 LEU A 25 3.317 9.694 -9.830 1.00 0.00 C ATOM 0 H LEU A 25 5.435 11.118 -13.970 1.00 0.00 H new ATOM 0 HA LEU A 25 6.971 9.808 -11.954 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.997 11.154 -11.447 1.00 0.00 H new ATOM 0 HB3 LEU A 25 3.983 10.115 -12.429 1.00 0.00 H new ATOM 0 HG LEU A 25 4.468 8.222 -10.937 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.467 8.600 -8.692 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.634 8.881 -10.006 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.881 10.262 -9.175 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.137 9.054 -8.966 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.442 10.725 -9.499 1.00 0.00 H new ATOM 0 HD23 LEU A 25 2.468 9.632 -10.511 1.00 0.00 H new ATOM 382 N GLN A 26 5.295 7.802 -13.995 1.00 0.00 N ATOM 383 CA GLN A 26 5.189 6.405 -14.449 1.00 0.00 C ATOM 384 C GLN A 26 6.553 5.815 -14.838 1.00 0.00 C ATOM 385 O GLN A 26 6.866 4.684 -14.463 1.00 0.00 O ATOM 386 CB GLN A 26 4.222 6.316 -15.642 1.00 0.00 C ATOM 387 CG GLN A 26 2.749 6.458 -15.231 1.00 0.00 C ATOM 388 CD GLN A 26 1.831 6.506 -16.453 1.00 0.00 C ATOM 389 OE1 GLN A 26 1.459 7.561 -16.950 1.00 0.00 O ATOM 390 NE2 GLN A 26 1.448 5.373 -17.003 1.00 0.00 N ATOM 0 H GLN A 26 4.739 8.452 -14.551 1.00 0.00 H new ATOM 0 HA GLN A 26 4.805 5.818 -13.614 1.00 0.00 H new ATOM 0 HB2 GLN A 26 4.469 7.096 -16.362 1.00 0.00 H new ATOM 0 HB3 GLN A 26 4.362 5.360 -16.146 1.00 0.00 H new ATOM 0 HG2 GLN A 26 2.465 5.621 -14.594 1.00 0.00 H new ATOM 0 HG3 GLN A 26 2.620 7.366 -14.641 1.00 0.00 H new ATOM 0 HE21 GLN A 26 1.748 4.484 -16.602 1.00 0.00 H new ATOM 0 HE22 GLN A 26 0.851 5.384 -17.830 1.00 0.00 H new ATOM 399 N ALA A 27 7.392 6.586 -15.536 1.00 0.00 N ATOM 400 CA ALA A 27 8.747 6.169 -15.889 1.00 0.00 C ATOM 401 C ALA A 27 9.715 6.175 -14.688 1.00 0.00 C ATOM 402 O ALA A 27 10.620 5.339 -14.636 1.00 0.00 O ATOM 403 CB ALA A 27 9.249 7.073 -17.010 1.00 0.00 C ATOM 0 H ALA A 27 7.148 7.518 -15.871 1.00 0.00 H new ATOM 0 HA ALA A 27 8.713 5.132 -16.224 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.261 6.779 -17.289 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.592 6.979 -17.875 1.00 0.00 H new ATOM 0 HB3 ALA A 27 9.254 8.108 -16.668 1.00 0.00 H new ATOM 409 N HIS A 28 9.512 7.062 -13.709 1.00 0.00 N ATOM 410 CA HIS A 28 10.261 7.057 -12.451 1.00 0.00 C ATOM 411 C HIS A 28 9.921 5.830 -11.585 1.00 0.00 C ATOM 412 O HIS A 28 10.823 5.171 -11.067 1.00 0.00 O ATOM 413 CB HIS A 28 9.997 8.366 -11.691 1.00 0.00 C ATOM 414 CG HIS A 28 10.529 8.322 -10.286 1.00 0.00 C ATOM 415 ND1 HIS A 28 11.855 8.325 -9.926 1.00 0.00 N ATOM 416 CD2 HIS A 28 9.799 8.090 -9.151 1.00 0.00 C ATOM 417 CE1 HIS A 28 11.934 8.091 -8.611 1.00 0.00 C ATOM 418 NE2 HIS A 28 10.697 7.938 -8.076 1.00 0.00 N ATOM 0 H HIS A 28 8.819 7.808 -13.769 1.00 0.00 H new ATOM 0 HA HIS A 28 11.324 6.988 -12.683 1.00 0.00 H new ATOM 0 HB2 HIS A 28 10.459 9.195 -12.227 1.00 0.00 H new ATOM 0 HB3 HIS A 28 8.925 8.560 -11.666 1.00 0.00 H new ATOM 0 HD1 HIS A 28 12.644 8.479 -10.554 1.00 0.00 H new ATOM 0 HD2 HIS A 28 8.722 8.033 -9.090 1.00 0.00 H new ATOM 0 HE1 HIS A 28 12.856 8.032 -8.052 1.00 0.00 H new ATOM 426 N LEU A 29 8.633 5.485 -11.456 1.00 0.00 N ATOM 427 CA LEU A 29 8.142 4.399 -10.596 1.00 0.00 C ATOM 428 C LEU A 29 8.751 3.026 -10.924 1.00 0.00 C ATOM 429 O LEU A 29 8.842 2.192 -10.023 1.00 0.00 O ATOM 430 CB LEU A 29 6.602 4.340 -10.665 1.00 0.00 C ATOM 431 CG LEU A 29 5.875 5.413 -9.833 1.00 0.00 C ATOM 432 CD1 LEU A 29 4.383 5.399 -10.172 1.00 0.00 C ATOM 433 CD2 LEU A 29 6.013 5.182 -8.327 1.00 0.00 C ATOM 0 H LEU A 29 7.886 5.964 -11.958 1.00 0.00 H new ATOM 0 HA LEU A 29 8.465 4.631 -9.581 1.00 0.00 H new ATOM 0 HB2 LEU A 29 6.295 4.439 -11.706 1.00 0.00 H new ATOM 0 HB3 LEU A 29 6.275 3.356 -10.328 1.00 0.00 H new ATOM 0 HG LEU A 29 6.336 6.369 -10.081 1.00 0.00 H new ATOM 0 HD11 LEU A 29 3.869 6.158 -9.583 1.00 0.00 H new ATOM 0 HD12 LEU A 29 4.249 5.610 -11.233 1.00 0.00 H new ATOM 0 HD13 LEU A 29 3.967 4.418 -9.942 1.00 0.00 H new ATOM 0 HD21 LEU A 29 5.482 5.967 -7.788 1.00 0.00 H new ATOM 0 HD22 LEU A 29 5.588 4.212 -8.067 1.00 0.00 H new ATOM 0 HD23 LEU A 29 7.067 5.202 -8.051 1.00 0.00 H new ATOM 445 N ARG A 30 9.244 2.814 -12.157 1.00 0.00 N ATOM 446 CA ARG A 30 9.915 1.566 -12.580 1.00 0.00 C ATOM 447 C ARG A 30 11.032 1.115 -11.627 1.00 0.00 C ATOM 448 O ARG A 30 11.195 -0.088 -11.421 1.00 0.00 O ATOM 449 CB ARG A 30 10.501 1.739 -13.992 1.00 0.00 C ATOM 450 CG ARG A 30 9.432 1.975 -15.074 1.00 0.00 C ATOM 451 CD ARG A 30 10.053 2.102 -16.472 1.00 0.00 C ATOM 452 NE ARG A 30 10.939 3.278 -16.567 1.00 0.00 N ATOM 453 CZ ARG A 30 11.718 3.622 -17.574 1.00 0.00 C ATOM 454 NH1 ARG A 30 11.775 2.933 -18.679 1.00 0.00 N ATOM 455 NH2 ARG A 30 12.462 4.685 -17.478 1.00 0.00 N ATOM 0 H ARG A 30 9.188 3.512 -12.899 1.00 0.00 H new ATOM 0 HA ARG A 30 9.149 0.790 -12.567 1.00 0.00 H new ATOM 0 HB2 ARG A 30 11.195 2.579 -13.989 1.00 0.00 H new ATOM 0 HB3 ARG A 30 11.077 0.850 -14.249 1.00 0.00 H new ATOM 0 HG2 ARG A 30 8.719 1.150 -15.067 1.00 0.00 H new ATOM 0 HG3 ARG A 30 8.873 2.881 -14.841 1.00 0.00 H new ATOM 0 HD2 ARG A 30 10.619 1.200 -16.703 1.00 0.00 H new ATOM 0 HD3 ARG A 30 9.261 2.181 -17.217 1.00 0.00 H new ATOM 0 HE ARG A 30 10.950 3.899 -15.758 1.00 0.00 H new ATOM 0 HH11 ARG A 30 11.204 2.095 -18.787 1.00 0.00 H new ATOM 0 HH12 ARG A 30 12.391 3.232 -19.435 1.00 0.00 H new ATOM 0 HH21 ARG A 30 12.441 5.247 -16.627 1.00 0.00 H new ATOM 0 HH22 ARG A 30 13.067 4.956 -18.254 1.00 0.00 H new ATOM 469 N ILE A 31 11.768 2.050 -11.013 1.00 0.00 N ATOM 470 CA ILE A 31 12.870 1.733 -10.087 1.00 0.00 C ATOM 471 C ILE A 31 12.387 1.121 -8.760 1.00 0.00 C ATOM 472 O ILE A 31 13.128 0.384 -8.107 1.00 0.00 O ATOM 473 CB ILE A 31 13.783 2.953 -9.838 1.00 0.00 C ATOM 474 CG1 ILE A 31 13.194 3.976 -8.841 1.00 0.00 C ATOM 475 CG2 ILE A 31 14.213 3.592 -11.174 1.00 0.00 C ATOM 476 CD1 ILE A 31 14.114 5.174 -8.592 1.00 0.00 C ATOM 0 H ILE A 31 11.618 3.051 -11.143 1.00 0.00 H new ATOM 0 HA ILE A 31 13.463 0.966 -10.586 1.00 0.00 H new ATOM 0 HB ILE A 31 14.681 2.582 -9.343 1.00 0.00 H new ATOM 0 HG12 ILE A 31 12.237 4.334 -9.221 1.00 0.00 H new ATOM 0 HG13 ILE A 31 12.994 3.476 -7.893 1.00 0.00 H new ATOM 0 HG21 ILE A 31 14.856 4.450 -10.977 1.00 0.00 H new ATOM 0 HG22 ILE A 31 14.758 2.859 -11.769 1.00 0.00 H new ATOM 0 HG23 ILE A 31 13.329 3.919 -11.722 1.00 0.00 H new ATOM 0 HD11 ILE A 31 13.642 5.854 -7.883 1.00 0.00 H new ATOM 0 HD12 ILE A 31 15.063 4.826 -8.184 1.00 0.00 H new ATOM 0 HD13 ILE A 31 14.293 5.696 -9.532 1.00 0.00 H new ATOM 488 N HIS A 32 11.146 1.424 -8.368 1.00 0.00 N ATOM 489 CA HIS A 32 10.516 0.957 -7.133 1.00 0.00 C ATOM 490 C HIS A 32 9.641 -0.288 -7.353 1.00 0.00 C ATOM 491 O HIS A 32 9.645 -1.196 -6.520 1.00 0.00 O ATOM 492 CB HIS A 32 9.677 2.091 -6.527 1.00 0.00 C ATOM 493 CG HIS A 32 10.411 3.387 -6.277 1.00 0.00 C ATOM 494 ND1 HIS A 32 11.414 3.608 -5.361 1.00 0.00 N ATOM 495 CD2 HIS A 32 10.098 4.601 -6.824 1.00 0.00 C ATOM 496 CE1 HIS A 32 11.693 4.922 -5.343 1.00 0.00 C ATOM 497 NE2 HIS A 32 10.895 5.591 -6.212 1.00 0.00 N ATOM 0 H HIS A 32 10.533 2.022 -8.922 1.00 0.00 H new ATOM 0 HA HIS A 32 11.311 0.669 -6.445 1.00 0.00 H new ATOM 0 HB2 HIS A 32 8.838 2.293 -7.192 1.00 0.00 H new ATOM 0 HB3 HIS A 32 9.259 1.744 -5.582 1.00 0.00 H new ATOM 0 HD1 HIS A 32 11.869 2.894 -4.792 1.00 0.00 H new ATOM 0 HD2 HIS A 32 9.363 4.773 -7.596 1.00 0.00 H new ATOM 0 HE1 HIS A 32 12.448 5.382 -4.723 1.00 0.00 H new ATOM 505 N THR A 33 8.900 -0.360 -8.464 1.00 0.00 N ATOM 506 CA THR A 33 7.905 -1.423 -8.716 1.00 0.00 C ATOM 507 C THR A 33 8.502 -2.716 -9.281 1.00 0.00 C ATOM 508 O THR A 33 8.011 -3.802 -8.968 1.00 0.00 O ATOM 509 CB THR A 33 6.795 -0.931 -9.661 1.00 0.00 C ATOM 510 OG1 THR A 33 7.348 -0.490 -10.884 1.00 0.00 O ATOM 511 CG2 THR A 33 5.993 0.225 -9.059 1.00 0.00 C ATOM 0 H THR A 33 8.970 0.319 -9.222 1.00 0.00 H new ATOM 0 HA THR A 33 7.493 -1.659 -7.735 1.00 0.00 H new ATOM 0 HB THR A 33 6.128 -1.778 -9.822 1.00 0.00 H new ATOM 0 HG1 THR A 33 7.729 0.405 -10.767 1.00 0.00 H new ATOM 0 HG21 THR A 33 5.222 0.538 -9.763 1.00 0.00 H new ATOM 0 HG22 THR A 33 5.526 -0.101 -8.130 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.660 1.063 -8.855 1.00 0.00 H new ATOM 519 N ASN A 34 9.563 -2.625 -10.088 1.00 0.00 N ATOM 520 CA ASN A 34 10.150 -3.763 -10.804 1.00 0.00 C ATOM 521 C ASN A 34 11.178 -4.551 -9.952 1.00 0.00 C ATOM 522 O ASN A 34 11.423 -4.238 -8.785 1.00 0.00 O ATOM 523 CB ASN A 34 10.714 -3.236 -12.144 1.00 0.00 C ATOM 524 CG ASN A 34 10.877 -4.297 -13.223 1.00 0.00 C ATOM 525 OD1 ASN A 34 10.451 -5.439 -13.093 1.00 0.00 O ATOM 526 ND2 ASN A 34 11.499 -3.961 -14.326 1.00 0.00 N ATOM 0 H ASN A 34 10.047 -1.745 -10.265 1.00 0.00 H new ATOM 0 HA ASN A 34 9.382 -4.507 -11.013 1.00 0.00 H new ATOM 0 HB2 ASN A 34 10.054 -2.454 -12.519 1.00 0.00 H new ATOM 0 HB3 ASN A 34 11.683 -2.773 -11.958 1.00 0.00 H new ATOM 0 HD21 ASN A 34 11.626 -4.648 -15.069 1.00 0.00 H new ATOM 0 HD22 ASN A 34 11.856 -3.013 -14.441 1.00 0.00 H new ATOM 533 N GLU A 35 11.775 -5.592 -10.536 1.00 0.00 N ATOM 534 CA GLU A 35 12.792 -6.490 -9.951 1.00 0.00 C ATOM 535 C GLU A 35 12.311 -7.396 -8.794 1.00 0.00 C ATOM 536 O GLU A 35 13.113 -8.127 -8.206 1.00 0.00 O ATOM 537 CB GLU A 35 14.108 -5.743 -9.643 1.00 0.00 C ATOM 538 CG GLU A 35 14.680 -5.008 -10.864 1.00 0.00 C ATOM 539 CD GLU A 35 16.077 -4.432 -10.556 1.00 0.00 C ATOM 540 OE1 GLU A 35 16.172 -3.278 -10.073 1.00 0.00 O ATOM 541 OE2 GLU A 35 17.092 -5.127 -10.805 1.00 0.00 O ATOM 0 H GLU A 35 11.550 -5.854 -11.496 1.00 0.00 H new ATOM 0 HA GLU A 35 13.002 -7.213 -10.740 1.00 0.00 H new ATOM 0 HB2 GLU A 35 13.933 -5.024 -8.842 1.00 0.00 H new ATOM 0 HB3 GLU A 35 14.847 -6.456 -9.276 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.743 -5.693 -11.709 1.00 0.00 H new ATOM 0 HG3 GLU A 35 14.007 -4.202 -11.157 1.00 0.00 H new ATOM 548 N LYS A 36 11.002 -7.413 -8.497 1.00 0.00 N ATOM 549 CA LYS A 36 10.370 -8.402 -7.602 1.00 0.00 C ATOM 550 C LYS A 36 9.945 -9.634 -8.427 1.00 0.00 C ATOM 551 O LYS A 36 9.259 -9.453 -9.437 1.00 0.00 O ATOM 552 CB LYS A 36 9.183 -7.786 -6.834 1.00 0.00 C ATOM 553 CG LYS A 36 9.562 -7.280 -5.430 1.00 0.00 C ATOM 554 CD LYS A 36 10.530 -6.087 -5.416 1.00 0.00 C ATOM 555 CE LYS A 36 9.849 -4.803 -5.902 1.00 0.00 C ATOM 556 NZ LYS A 36 10.833 -3.708 -6.075 1.00 0.00 N ATOM 0 H LYS A 36 10.342 -6.733 -8.875 1.00 0.00 H new ATOM 0 HA LYS A 36 11.092 -8.719 -6.849 1.00 0.00 H new ATOM 0 HB2 LYS A 36 8.775 -6.958 -7.413 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.392 -8.531 -6.743 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.651 -6.997 -4.903 1.00 0.00 H new ATOM 0 HG3 LYS A 36 10.011 -8.101 -4.872 1.00 0.00 H new ATOM 0 HD2 LYS A 36 10.910 -5.938 -4.405 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.389 -6.307 -6.050 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.342 -4.993 -6.848 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.085 -4.500 -5.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 10.339 -2.793 -6.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 11.522 -3.734 -5.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.330 -3.827 -6.981 1.00 0.00 H new ATOM 570 N PRO A 37 10.335 -10.866 -8.046 1.00 0.00 N ATOM 571 CA PRO A 37 10.138 -12.062 -8.873 1.00 0.00 C ATOM 572 C PRO A 37 8.678 -12.511 -9.010 1.00 0.00 C ATOM 573 O PRO A 37 8.266 -12.941 -10.089 1.00 0.00 O ATOM 574 CB PRO A 37 10.978 -13.160 -8.208 1.00 0.00 C ATOM 575 CG PRO A 37 11.131 -12.701 -6.760 1.00 0.00 C ATOM 576 CD PRO A 37 11.160 -11.183 -6.889 1.00 0.00 C ATOM 0 HA PRO A 37 10.443 -11.844 -9.897 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.482 -14.129 -8.267 1.00 0.00 H new ATOM 0 HB3 PRO A 37 11.947 -13.268 -8.695 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.301 -13.038 -6.139 1.00 0.00 H new ATOM 0 HG3 PRO A 37 12.045 -13.086 -6.308 1.00 0.00 H new ATOM 0 HD2 PRO A 37 10.771 -10.707 -5.989 1.00 0.00 H new ATOM 0 HD3 PRO A 37 12.179 -10.822 -7.025 1.00 0.00 H new ATOM 584 N TYR A 38 7.892 -12.425 -7.934 1.00 0.00 N ATOM 585 CA TYR A 38 6.535 -12.975 -7.883 1.00 0.00 C ATOM 586 C TYR A 38 5.501 -11.907 -8.255 1.00 0.00 C ATOM 587 O TYR A 38 5.021 -11.163 -7.399 1.00 0.00 O ATOM 588 CB TYR A 38 6.288 -13.625 -6.512 1.00 0.00 C ATOM 589 CG TYR A 38 7.261 -14.749 -6.209 1.00 0.00 C ATOM 590 CD1 TYR A 38 7.180 -15.965 -6.917 1.00 0.00 C ATOM 591 CD2 TYR A 38 8.287 -14.554 -5.267 1.00 0.00 C ATOM 592 CE1 TYR A 38 8.137 -16.974 -6.695 1.00 0.00 C ATOM 593 CE2 TYR A 38 9.242 -15.563 -5.035 1.00 0.00 C ATOM 594 CZ TYR A 38 9.174 -16.774 -5.758 1.00 0.00 C ATOM 595 OH TYR A 38 10.094 -17.756 -5.549 1.00 0.00 O ATOM 0 H TYR A 38 8.181 -11.969 -7.068 1.00 0.00 H new ATOM 0 HA TYR A 38 6.425 -13.763 -8.628 1.00 0.00 H new ATOM 0 HB2 TYR A 38 6.366 -12.864 -5.735 1.00 0.00 H new ATOM 0 HB3 TYR A 38 5.270 -14.013 -6.477 1.00 0.00 H new ATOM 0 HD1 TYR A 38 6.384 -16.123 -7.630 1.00 0.00 H new ATOM 0 HD2 TYR A 38 8.343 -13.625 -4.718 1.00 0.00 H new ATOM 0 HE1 TYR A 38 8.078 -17.903 -7.243 1.00 0.00 H new ATOM 0 HE2 TYR A 38 10.024 -15.411 -4.306 1.00 0.00 H new ATOM 0 HH TYR A 38 10.741 -17.460 -4.875 1.00 0.00 H new ATOM 605 N LYS A 39 5.174 -11.821 -9.550 1.00 0.00 N ATOM 606 CA LYS A 39 4.246 -10.834 -10.128 1.00 0.00 C ATOM 607 C LYS A 39 2.827 -11.390 -10.302 1.00 0.00 C ATOM 608 O LYS A 39 2.641 -12.514 -10.774 1.00 0.00 O ATOM 609 CB LYS A 39 4.813 -10.294 -11.451 1.00 0.00 C ATOM 610 CG LYS A 39 6.031 -9.389 -11.214 1.00 0.00 C ATOM 611 CD LYS A 39 6.689 -8.951 -12.527 1.00 0.00 C ATOM 612 CE LYS A 39 7.864 -8.006 -12.236 1.00 0.00 C ATOM 613 NZ LYS A 39 8.527 -7.552 -13.486 1.00 0.00 N ATOM 0 H LYS A 39 5.559 -12.456 -10.249 1.00 0.00 H new ATOM 0 HA LYS A 39 4.157 -10.008 -9.423 1.00 0.00 H new ATOM 0 HB2 LYS A 39 5.097 -11.128 -12.093 1.00 0.00 H new ATOM 0 HB3 LYS A 39 4.040 -9.735 -11.978 1.00 0.00 H new ATOM 0 HG2 LYS A 39 5.723 -8.507 -10.652 1.00 0.00 H new ATOM 0 HG3 LYS A 39 6.761 -9.918 -10.602 1.00 0.00 H new ATOM 0 HD2 LYS A 39 7.041 -9.824 -13.076 1.00 0.00 H new ATOM 0 HD3 LYS A 39 5.957 -8.450 -13.161 1.00 0.00 H new ATOM 0 HE2 LYS A 39 7.505 -7.140 -11.679 1.00 0.00 H new ATOM 0 HE3 LYS A 39 8.591 -8.514 -11.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 9.200 -6.790 -13.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 9.036 -8.349 -13.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 7.810 -7.198 -14.151 1.00 0.00 H new ATOM 627 N CYS A 40 1.835 -10.570 -9.960 1.00 0.00 N ATOM 628 CA CYS A 40 0.410 -10.813 -10.157 1.00 0.00 C ATOM 629 C CYS A 40 0.027 -10.627 -11.643 1.00 0.00 C ATOM 630 O CYS A 40 0.294 -9.559 -12.210 1.00 0.00 O ATOM 631 CB CYS A 40 -0.357 -9.846 -9.248 1.00 0.00 C ATOM 632 SG CYS A 40 -2.149 -10.062 -9.448 1.00 0.00 S ATOM 0 H CYS A 40 2.015 -9.670 -9.514 1.00 0.00 H new ATOM 0 HA CYS A 40 0.154 -11.840 -9.896 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -0.079 -10.018 -8.208 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.081 -8.819 -9.486 1.00 0.00 H new ATOM 637 N PRO A 41 -0.625 -11.617 -12.281 1.00 0.00 N ATOM 638 CA PRO A 41 -1.108 -11.497 -13.656 1.00 0.00 C ATOM 639 C PRO A 41 -2.390 -10.649 -13.775 1.00 0.00 C ATOM 640 O PRO A 41 -2.829 -10.381 -14.896 1.00 0.00 O ATOM 641 CB PRO A 41 -1.321 -12.945 -14.114 1.00 0.00 C ATOM 642 CG PRO A 41 -1.713 -13.673 -12.830 1.00 0.00 C ATOM 643 CD PRO A 41 -0.915 -12.944 -11.752 1.00 0.00 C ATOM 0 HA PRO A 41 -0.394 -10.966 -14.286 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.103 -13.016 -14.870 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -0.415 -13.364 -14.552 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -2.786 -13.613 -12.646 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -1.456 -14.731 -12.874 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -1.485 -12.877 -10.826 1.00 0.00 H new ATOM 0 HD3 PRO A 41 0.006 -13.480 -11.521 1.00 0.00 H new ATOM 651 N GLN A 42 -3.005 -10.237 -12.656 1.00 0.00 N ATOM 652 CA GLN A 42 -4.332 -9.602 -12.628 1.00 0.00 C ATOM 653 C GLN A 42 -4.333 -8.115 -12.223 1.00 0.00 C ATOM 654 O GLN A 42 -5.279 -7.415 -12.599 1.00 0.00 O ATOM 655 CB GLN A 42 -5.279 -10.443 -11.753 1.00 0.00 C ATOM 656 CG GLN A 42 -5.623 -11.778 -12.435 1.00 0.00 C ATOM 657 CD GLN A 42 -6.542 -12.651 -11.585 1.00 0.00 C ATOM 658 OE1 GLN A 42 -7.755 -12.663 -11.744 1.00 0.00 O ATOM 659 NE2 GLN A 42 -6.006 -13.415 -10.656 1.00 0.00 N ATOM 0 H GLN A 42 -2.588 -10.337 -11.731 1.00 0.00 H new ATOM 0 HA GLN A 42 -4.694 -9.585 -13.656 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -4.812 -10.634 -10.787 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -6.194 -9.883 -11.560 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -6.101 -11.579 -13.394 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -4.702 -12.323 -12.645 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -4.996 -13.413 -10.514 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -6.601 -14.009 -10.078 1.00 0.00 H new ATOM 668 N CYS A 43 -3.312 -7.599 -11.515 1.00 0.00 N ATOM 669 CA CYS A 43 -3.209 -6.166 -11.184 1.00 0.00 C ATOM 670 C CYS A 43 -1.783 -5.565 -11.277 1.00 0.00 C ATOM 671 O CYS A 43 -1.553 -4.425 -10.860 1.00 0.00 O ATOM 672 CB CYS A 43 -3.890 -5.924 -9.829 1.00 0.00 C ATOM 673 SG CYS A 43 -2.990 -6.737 -8.496 1.00 0.00 S ATOM 0 H CYS A 43 -2.539 -8.160 -11.158 1.00 0.00 H new ATOM 0 HA CYS A 43 -3.737 -5.612 -11.960 1.00 0.00 H new ATOM 0 HB2 CYS A 43 -3.947 -4.853 -9.633 1.00 0.00 H new ATOM 0 HB3 CYS A 43 -4.914 -6.297 -9.861 1.00 0.00 H new ATOM 678 N SER A 44 -0.824 -6.311 -11.842 1.00 0.00 N ATOM 679 CA SER A 44 0.600 -5.936 -11.971 1.00 0.00 C ATOM 680 C SER A 44 1.339 -5.682 -10.640 1.00 0.00 C ATOM 681 O SER A 44 2.446 -5.137 -10.628 1.00 0.00 O ATOM 682 CB SER A 44 0.802 -4.797 -12.985 1.00 0.00 C ATOM 683 OG SER A 44 0.221 -5.126 -14.241 1.00 0.00 O ATOM 0 H SER A 44 -1.022 -7.230 -12.239 1.00 0.00 H new ATOM 0 HA SER A 44 1.084 -6.828 -12.369 1.00 0.00 H new ATOM 0 HB2 SER A 44 0.354 -3.880 -12.602 1.00 0.00 H new ATOM 0 HB3 SER A 44 1.867 -4.603 -13.112 1.00 0.00 H new ATOM 0 HG SER A 44 0.360 -4.387 -14.869 1.00 0.00 H new ATOM 689 N TYR A 45 0.750 -6.100 -9.514 1.00 0.00 N ATOM 690 CA TYR A 45 1.374 -6.180 -8.195 1.00 0.00 C ATOM 691 C TYR A 45 2.591 -7.121 -8.233 1.00 0.00 C ATOM 692 O TYR A 45 2.642 -8.047 -9.044 1.00 0.00 O ATOM 693 CB TYR A 45 0.305 -6.685 -7.212 1.00 0.00 C ATOM 694 CG TYR A 45 0.811 -7.062 -5.830 1.00 0.00 C ATOM 695 CD1 TYR A 45 0.923 -6.068 -4.839 1.00 0.00 C ATOM 696 CD2 TYR A 45 1.179 -8.392 -5.535 1.00 0.00 C ATOM 697 CE1 TYR A 45 1.393 -6.401 -3.556 1.00 0.00 C ATOM 698 CE2 TYR A 45 1.651 -8.730 -4.248 1.00 0.00 C ATOM 699 CZ TYR A 45 1.757 -7.731 -3.254 1.00 0.00 C ATOM 700 OH TYR A 45 2.201 -8.024 -2.001 1.00 0.00 O ATOM 0 H TYR A 45 -0.223 -6.406 -9.501 1.00 0.00 H new ATOM 0 HA TYR A 45 1.740 -5.204 -7.877 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -0.456 -5.913 -7.103 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -0.184 -7.555 -7.650 1.00 0.00 H new ATOM 0 HD1 TYR A 45 0.648 -5.048 -5.064 1.00 0.00 H new ATOM 0 HD2 TYR A 45 1.099 -9.154 -6.296 1.00 0.00 H new ATOM 0 HE1 TYR A 45 1.476 -5.636 -2.798 1.00 0.00 H new ATOM 0 HE2 TYR A 45 1.930 -9.749 -4.024 1.00 0.00 H new ATOM 0 HH TYR A 45 2.427 -8.976 -1.948 1.00 0.00 H new ATOM 710 N ALA A 46 3.570 -6.903 -7.356 1.00 0.00 N ATOM 711 CA ALA A 46 4.739 -7.777 -7.226 1.00 0.00 C ATOM 712 C ALA A 46 5.215 -7.974 -5.775 1.00 0.00 C ATOM 713 O ALA A 46 5.094 -7.075 -4.939 1.00 0.00 O ATOM 714 CB ALA A 46 5.862 -7.252 -8.125 1.00 0.00 C ATOM 0 H ALA A 46 3.576 -6.112 -6.712 1.00 0.00 H new ATOM 0 HA ALA A 46 4.439 -8.772 -7.553 1.00 0.00 H new ATOM 0 HB1 ALA A 46 6.735 -7.899 -8.032 1.00 0.00 H new ATOM 0 HB2 ALA A 46 5.525 -7.244 -9.161 1.00 0.00 H new ATOM 0 HB3 ALA A 46 6.127 -6.239 -7.822 1.00 0.00 H new ATOM 720 N SER A 47 5.807 -9.142 -5.502 1.00 0.00 N ATOM 721 CA SER A 47 6.375 -9.528 -4.204 1.00 0.00 C ATOM 722 C SER A 47 7.708 -10.279 -4.331 1.00 0.00 C ATOM 723 O SER A 47 8.032 -10.857 -5.371 1.00 0.00 O ATOM 724 CB SER A 47 5.359 -10.383 -3.440 1.00 0.00 C ATOM 725 OG SER A 47 5.800 -10.595 -2.110 1.00 0.00 O ATOM 0 H SER A 47 5.908 -9.873 -6.206 1.00 0.00 H new ATOM 0 HA SER A 47 6.588 -8.610 -3.656 1.00 0.00 H new ATOM 0 HB2 SER A 47 4.388 -9.888 -3.434 1.00 0.00 H new ATOM 0 HB3 SER A 47 5.226 -11.340 -3.944 1.00 0.00 H new ATOM 0 HG SER A 47 5.034 -10.553 -1.501 1.00 0.00 H new ATOM 731 N ALA A 48 8.477 -10.290 -3.240 1.00 0.00 N ATOM 732 CA ALA A 48 9.686 -11.094 -3.066 1.00 0.00 C ATOM 733 C ALA A 48 9.412 -12.498 -2.474 1.00 0.00 C ATOM 734 O ALA A 48 10.342 -13.299 -2.355 1.00 0.00 O ATOM 735 CB ALA A 48 10.671 -10.284 -2.214 1.00 0.00 C ATOM 0 H ALA A 48 8.266 -9.717 -2.423 1.00 0.00 H new ATOM 0 HA ALA A 48 10.118 -11.299 -4.045 1.00 0.00 H new ATOM 0 HB1 ALA A 48 11.585 -10.860 -2.067 1.00 0.00 H new ATOM 0 HB2 ALA A 48 10.909 -9.350 -2.722 1.00 0.00 H new ATOM 0 HB3 ALA A 48 10.220 -10.066 -1.246 1.00 0.00 H new ATOM 741 N ILE A 49 8.157 -12.813 -2.111 1.00 0.00 N ATOM 742 CA ILE A 49 7.757 -14.075 -1.459 1.00 0.00 C ATOM 743 C ILE A 49 6.610 -14.747 -2.235 1.00 0.00 C ATOM 744 O ILE A 49 5.573 -14.130 -2.495 1.00 0.00 O ATOM 745 CB ILE A 49 7.388 -13.832 0.028 1.00 0.00 C ATOM 746 CG1 ILE A 49 8.499 -13.055 0.777 1.00 0.00 C ATOM 747 CG2 ILE A 49 7.098 -15.172 0.735 1.00 0.00 C ATOM 748 CD1 ILE A 49 8.208 -12.776 2.257 1.00 0.00 C ATOM 0 H ILE A 49 7.371 -12.182 -2.266 1.00 0.00 H new ATOM 0 HA ILE A 49 8.605 -14.760 -1.474 1.00 0.00 H new ATOM 0 HB ILE A 49 6.488 -13.218 0.048 1.00 0.00 H new ATOM 0 HG12 ILE A 49 9.429 -13.620 0.705 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.663 -12.105 0.269 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.841 -14.985 1.778 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.266 -15.672 0.240 1.00 0.00 H new ATOM 0 HG23 ILE A 49 7.983 -15.807 0.688 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.042 -12.228 2.695 1.00 0.00 H new ATOM 0 HD12 ILE A 49 7.299 -12.181 2.343 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.076 -13.720 2.786 1.00 0.00 H new ATOM 760 N LYS A 50 6.764 -16.039 -2.558 1.00 0.00 N ATOM 761 CA LYS A 50 5.777 -16.825 -3.328 1.00 0.00 C ATOM 762 C LYS A 50 4.457 -17.012 -2.577 1.00 0.00 C ATOM 763 O LYS A 50 3.384 -16.828 -3.148 1.00 0.00 O ATOM 764 CB LYS A 50 6.404 -18.177 -3.713 1.00 0.00 C ATOM 765 CG LYS A 50 5.579 -18.914 -4.782 1.00 0.00 C ATOM 766 CD LYS A 50 6.282 -20.205 -5.220 1.00 0.00 C ATOM 767 CE LYS A 50 5.457 -20.918 -6.299 1.00 0.00 C ATOM 768 NZ LYS A 50 6.111 -22.175 -6.748 1.00 0.00 N ATOM 0 H LYS A 50 7.587 -16.579 -2.290 1.00 0.00 H new ATOM 0 HA LYS A 50 5.525 -16.269 -4.231 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.416 -18.014 -4.085 1.00 0.00 H new ATOM 0 HB3 LYS A 50 6.488 -18.803 -2.825 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.591 -19.149 -4.387 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.431 -18.265 -5.645 1.00 0.00 H new ATOM 0 HD2 LYS A 50 7.275 -19.974 -5.605 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.418 -20.863 -4.362 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.464 -21.143 -5.909 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.321 -20.253 -7.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.525 -22.630 -7.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 7.048 -21.957 -7.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 6.218 -22.819 -5.938 1.00 0.00 H new ATOM 782 N ALA A 51 4.528 -17.313 -1.279 1.00 0.00 N ATOM 783 CA ALA A 51 3.358 -17.475 -0.413 1.00 0.00 C ATOM 784 C ALA A 51 2.565 -16.165 -0.227 1.00 0.00 C ATOM 785 O ALA A 51 1.339 -16.196 -0.125 1.00 0.00 O ATOM 786 CB ALA A 51 3.834 -18.040 0.932 1.00 0.00 C ATOM 0 H ALA A 51 5.413 -17.453 -0.792 1.00 0.00 H new ATOM 0 HA ALA A 51 2.662 -18.167 -0.888 1.00 0.00 H new ATOM 0 HB1 ALA A 51 2.979 -18.170 1.595 1.00 0.00 H new ATOM 0 HB2 ALA A 51 4.318 -19.003 0.771 1.00 0.00 H new ATOM 0 HB3 ALA A 51 4.544 -17.349 1.386 1.00 0.00 H new ATOM 792 N ASN A 52 3.230 -15.003 -0.259 1.00 0.00 N ATOM 793 CA ASN A 52 2.552 -13.704 -0.227 1.00 0.00 C ATOM 794 C ASN A 52 1.732 -13.466 -1.508 1.00 0.00 C ATOM 795 O ASN A 52 0.574 -13.055 -1.415 1.00 0.00 O ATOM 796 CB ASN A 52 3.596 -12.604 0.018 1.00 0.00 C ATOM 797 CG ASN A 52 2.975 -11.220 -0.019 1.00 0.00 C ATOM 798 OD1 ASN A 52 3.022 -10.535 -1.030 1.00 0.00 O ATOM 799 ND2 ASN A 52 2.366 -10.772 1.055 1.00 0.00 N ATOM 0 H ASN A 52 4.247 -14.938 -0.307 1.00 0.00 H new ATOM 0 HA ASN A 52 1.833 -13.686 0.592 1.00 0.00 H new ATOM 0 HB2 ASN A 52 4.072 -12.763 0.986 1.00 0.00 H new ATOM 0 HB3 ASN A 52 4.379 -12.671 -0.737 1.00 0.00 H new ATOM 0 HD21 ASN A 52 1.930 -9.850 1.047 1.00 0.00 H new ATOM 0 HD22 ASN A 52 2.329 -11.346 1.897 1.00 0.00 H new ATOM 806 N LEU A 53 2.266 -13.812 -2.690 1.00 0.00 N ATOM 807 CA LEU A 53 1.484 -13.809 -3.931 1.00 0.00 C ATOM 808 C LEU A 53 0.339 -14.840 -3.884 1.00 0.00 C ATOM 809 O LEU A 53 -0.770 -14.545 -4.323 1.00 0.00 O ATOM 810 CB LEU A 53 2.413 -14.020 -5.140 1.00 0.00 C ATOM 811 CG LEU A 53 1.667 -14.013 -6.491 1.00 0.00 C ATOM 812 CD1 LEU A 53 0.953 -12.688 -6.764 1.00 0.00 C ATOM 813 CD2 LEU A 53 2.648 -14.251 -7.633 1.00 0.00 C ATOM 0 H LEU A 53 3.238 -14.097 -2.810 1.00 0.00 H new ATOM 0 HA LEU A 53 1.009 -12.834 -4.041 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.172 -13.237 -5.148 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.936 -14.970 -5.026 1.00 0.00 H new ATOM 0 HG LEU A 53 0.923 -14.808 -6.432 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.445 -12.740 -7.727 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.222 -12.500 -5.978 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.683 -11.878 -6.782 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.111 -14.244 -8.581 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.401 -13.463 -7.636 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.135 -15.217 -7.499 1.00 0.00 H new ATOM 825 N ASN A 54 0.567 -16.017 -3.295 1.00 0.00 N ATOM 826 CA ASN A 54 -0.456 -17.058 -3.129 1.00 0.00 C ATOM 827 C ASN A 54 -1.664 -16.568 -2.298 1.00 0.00 C ATOM 828 O ASN A 54 -2.812 -16.877 -2.622 1.00 0.00 O ATOM 829 CB ASN A 54 0.225 -18.298 -2.515 1.00 0.00 C ATOM 830 CG ASN A 54 -0.554 -19.576 -2.754 1.00 0.00 C ATOM 831 OD1 ASN A 54 -1.333 -20.028 -1.928 1.00 0.00 O ATOM 832 ND2 ASN A 54 -0.368 -20.201 -3.892 1.00 0.00 N ATOM 0 H ASN A 54 1.477 -16.279 -2.915 1.00 0.00 H new ATOM 0 HA ASN A 54 -0.877 -17.320 -4.100 1.00 0.00 H new ATOM 0 HB2 ASN A 54 1.225 -18.403 -2.936 1.00 0.00 H new ATOM 0 HB3 ASN A 54 0.345 -18.147 -1.442 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -0.874 -21.065 -4.088 1.00 0.00 H new ATOM 0 HD22 ASN A 54 0.282 -19.823 -4.581 1.00 0.00 H new ATOM 839 N VAL A 55 -1.431 -15.748 -1.265 1.00 0.00 N ATOM 840 CA VAL A 55 -2.490 -15.082 -0.478 1.00 0.00 C ATOM 841 C VAL A 55 -3.088 -13.878 -1.222 1.00 0.00 C ATOM 842 O VAL A 55 -4.296 -13.660 -1.163 1.00 0.00 O ATOM 843 CB VAL A 55 -1.964 -14.685 0.917 1.00 0.00 C ATOM 844 CG1 VAL A 55 -2.990 -13.904 1.752 1.00 0.00 C ATOM 845 CG2 VAL A 55 -1.585 -15.932 1.725 1.00 0.00 C ATOM 0 H VAL A 55 -0.490 -15.522 -0.944 1.00 0.00 H new ATOM 0 HA VAL A 55 -3.300 -15.798 -0.342 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.100 -14.048 0.728 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.557 -13.656 2.721 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -3.261 -12.986 1.230 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -3.881 -14.515 1.898 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -1.216 -15.632 2.706 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -2.462 -16.568 1.846 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -0.807 -16.484 1.198 1.00 0.00 H new ATOM 855 N HIS A 56 -2.291 -13.126 -1.981 1.00 0.00 N ATOM 856 CA HIS A 56 -2.772 -12.008 -2.805 1.00 0.00 C ATOM 857 C HIS A 56 -3.740 -12.450 -3.918 1.00 0.00 C ATOM 858 O HIS A 56 -4.749 -11.787 -4.157 1.00 0.00 O ATOM 859 CB HIS A 56 -1.554 -11.268 -3.374 1.00 0.00 C ATOM 860 CG HIS A 56 -1.923 -10.182 -4.343 1.00 0.00 C ATOM 861 ND1 HIS A 56 -2.300 -8.902 -4.022 1.00 0.00 N ATOM 862 CD2 HIS A 56 -2.049 -10.320 -5.699 1.00 0.00 C ATOM 863 CE1 HIS A 56 -2.659 -8.276 -5.151 1.00 0.00 C ATOM 864 NE2 HIS A 56 -2.536 -9.105 -6.216 1.00 0.00 N ATOM 0 H HIS A 56 -1.284 -13.274 -2.044 1.00 0.00 H new ATOM 0 HA HIS A 56 -3.355 -11.338 -2.173 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -0.983 -10.835 -2.552 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -0.901 -11.985 -3.872 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -2.306 -8.497 -3.086 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -1.816 -11.206 -6.271 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -2.999 -7.252 -5.205 1.00 0.00 H new ATOM 872 N LEU A 57 -3.495 -13.588 -4.573 1.00 0.00 N ATOM 873 CA LEU A 57 -4.381 -14.127 -5.618 1.00 0.00 C ATOM 874 C LEU A 57 -5.781 -14.486 -5.087 1.00 0.00 C ATOM 875 O LEU A 57 -6.761 -14.348 -5.818 1.00 0.00 O ATOM 876 CB LEU A 57 -3.717 -15.353 -6.248 1.00 0.00 C ATOM 877 CG LEU A 57 -2.487 -15.037 -7.116 1.00 0.00 C ATOM 878 CD1 LEU A 57 -1.686 -16.322 -7.297 1.00 0.00 C ATOM 879 CD2 LEU A 57 -2.875 -14.492 -8.491 1.00 0.00 C ATOM 0 H LEU A 57 -2.674 -14.167 -4.395 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.528 -13.349 -6.367 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.419 -16.038 -5.454 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.453 -15.875 -6.859 1.00 0.00 H new ATOM 0 HG LEU A 57 -1.900 -14.269 -6.612 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.808 -16.120 -7.911 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.370 -16.694 -6.322 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.307 -17.072 -7.788 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.974 -14.284 -9.067 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.480 -15.230 -9.018 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -3.448 -13.573 -8.370 1.00 0.00 H new ATOM 891 N ARG A 58 -5.902 -14.853 -3.804 1.00 0.00 N ATOM 892 CA ARG A 58 -7.200 -15.052 -3.117 1.00 0.00 C ATOM 893 C ARG A 58 -8.068 -13.782 -3.043 1.00 0.00 C ATOM 894 O ARG A 58 -9.277 -13.898 -2.840 1.00 0.00 O ATOM 895 CB ARG A 58 -6.995 -15.617 -1.700 1.00 0.00 C ATOM 896 CG ARG A 58 -6.405 -17.034 -1.665 1.00 0.00 C ATOM 897 CD ARG A 58 -6.060 -17.411 -0.216 1.00 0.00 C ATOM 898 NE ARG A 58 -5.833 -18.859 -0.042 1.00 0.00 N ATOM 899 CZ ARG A 58 -4.753 -19.550 -0.362 1.00 0.00 C ATOM 900 NH1 ARG A 58 -3.758 -19.024 -1.008 1.00 0.00 N ATOM 901 NH2 ARG A 58 -4.648 -20.805 -0.037 1.00 0.00 N ATOM 0 H ARG A 58 -5.097 -15.024 -3.201 1.00 0.00 H new ATOM 0 HA ARG A 58 -7.742 -15.772 -3.731 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -6.336 -14.948 -1.146 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -7.954 -15.622 -1.181 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -7.119 -17.747 -2.077 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -5.511 -17.083 -2.287 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -5.167 -16.868 0.093 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -6.870 -17.093 0.440 1.00 0.00 H new ATOM 0 HE ARG A 58 -6.599 -19.388 0.374 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -3.792 -18.044 -1.287 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -2.941 -19.591 -1.236 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -5.404 -21.265 0.470 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -3.810 -21.329 -0.289 1.00 0.00 H new ATOM 915 N LYS A 59 -7.497 -12.582 -3.238 1.00 0.00 N ATOM 916 CA LYS A 59 -8.255 -11.316 -3.369 1.00 0.00 C ATOM 917 C LYS A 59 -8.927 -11.169 -4.742 1.00 0.00 C ATOM 918 O LYS A 59 -9.930 -10.465 -4.865 1.00 0.00 O ATOM 919 CB LYS A 59 -7.351 -10.100 -3.083 1.00 0.00 C ATOM 920 CG LYS A 59 -6.650 -10.173 -1.715 1.00 0.00 C ATOM 921 CD LYS A 59 -5.964 -8.846 -1.363 1.00 0.00 C ATOM 922 CE LYS A 59 -5.319 -8.947 0.026 1.00 0.00 C ATOM 923 NZ LYS A 59 -4.733 -7.651 0.457 1.00 0.00 N ATOM 0 H LYS A 59 -6.487 -12.457 -3.311 1.00 0.00 H new ATOM 0 HA LYS A 59 -9.049 -11.352 -2.623 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -6.597 -10.024 -3.867 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -7.951 -9.191 -3.128 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -7.379 -10.422 -0.944 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -5.911 -10.974 -1.726 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -5.206 -8.609 -2.110 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -6.692 -8.035 -1.378 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -6.067 -9.267 0.752 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.541 -9.711 0.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.307 -7.759 1.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.002 -7.358 -0.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -5.480 -6.928 0.496 1.00 0.00 H new ATOM 937 N HIS A 60 -8.396 -11.840 -5.768 1.00 0.00 N ATOM 938 CA HIS A 60 -8.915 -11.838 -7.140 1.00 0.00 C ATOM 939 C HIS A 60 -9.944 -12.962 -7.373 1.00 0.00 C ATOM 940 O HIS A 60 -9.655 -13.977 -8.015 1.00 0.00 O ATOM 941 CB HIS A 60 -7.744 -11.895 -8.134 1.00 0.00 C ATOM 942 CG HIS A 60 -6.827 -10.700 -8.078 1.00 0.00 C ATOM 943 ND1 HIS A 60 -7.182 -9.400 -8.351 1.00 0.00 N ATOM 944 CD2 HIS A 60 -5.489 -10.707 -7.795 1.00 0.00 C ATOM 945 CE1 HIS A 60 -6.093 -8.630 -8.233 1.00 0.00 C ATOM 946 NE2 HIS A 60 -5.012 -9.383 -7.913 1.00 0.00 N ATOM 0 H HIS A 60 -7.564 -12.420 -5.663 1.00 0.00 H new ATOM 0 HA HIS A 60 -9.458 -10.908 -7.307 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -7.161 -12.795 -7.940 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -8.144 -11.985 -9.144 1.00 0.00 H new ATOM 0 HD1 HIS A 60 -8.117 -9.077 -8.601 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -4.901 -11.573 -7.528 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -6.078 -7.559 -8.373 1.00 0.00 H new ATOM 954 N THR A 61 -11.160 -12.782 -6.849 1.00 0.00 N ATOM 955 CA THR A 61 -12.296 -13.718 -6.986 1.00 0.00 C ATOM 956 C THR A 61 -13.552 -13.034 -7.543 1.00 0.00 C ATOM 957 O THR A 61 -13.759 -11.830 -7.363 1.00 0.00 O ATOM 958 CB THR A 61 -12.619 -14.421 -5.654 1.00 0.00 C ATOM 959 OG1 THR A 61 -12.822 -13.481 -4.617 1.00 0.00 O ATOM 960 CG2 THR A 61 -11.499 -15.370 -5.223 1.00 0.00 C ATOM 0 H THR A 61 -11.395 -11.956 -6.299 1.00 0.00 H new ATOM 0 HA THR A 61 -11.981 -14.473 -7.707 1.00 0.00 H new ATOM 0 HB THR A 61 -13.531 -14.993 -5.826 1.00 0.00 H new ATOM 0 HG1 THR A 61 -13.027 -13.953 -3.783 1.00 0.00 H new ATOM 0 HG21 THR A 61 -11.767 -15.845 -4.279 1.00 0.00 H new ATOM 0 HG22 THR A 61 -11.356 -16.135 -5.986 1.00 0.00 H new ATOM 0 HG23 THR A 61 -10.574 -14.807 -5.096 1.00 0.00 H new ATOM 968 N GLY A 62 -14.393 -13.806 -8.241 1.00 0.00 N ATOM 969 CA GLY A 62 -15.638 -13.340 -8.864 1.00 0.00 C ATOM 970 C GLY A 62 -16.091 -14.211 -10.042 1.00 0.00 C ATOM 971 O GLY A 62 -15.350 -15.079 -10.517 1.00 0.00 O ATOM 0 H GLY A 62 -14.222 -14.800 -8.392 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -16.427 -13.320 -8.112 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -15.501 -12.316 -9.210 1.00 0.00 H new ATOM 975 N GLU A 63 -17.314 -13.973 -10.525 1.00 0.00 N ATOM 976 CA GLU A 63 -17.883 -14.630 -11.702 1.00 0.00 C ATOM 977 C GLU A 63 -17.191 -14.188 -12.998 1.00 0.00 C ATOM 978 O GLU A 63 -16.546 -13.138 -13.079 1.00 0.00 O ATOM 979 CB GLU A 63 -19.399 -14.368 -11.785 1.00 0.00 C ATOM 980 CG GLU A 63 -20.200 -15.075 -10.684 1.00 0.00 C ATOM 981 CD GLU A 63 -20.145 -16.610 -10.809 1.00 0.00 C ATOM 982 OE1 GLU A 63 -20.803 -17.172 -11.719 1.00 0.00 O ATOM 983 OE2 GLU A 63 -19.445 -17.267 -10.003 1.00 0.00 O ATOM 0 H GLU A 63 -17.950 -13.301 -10.096 1.00 0.00 H new ATOM 0 HA GLU A 63 -17.713 -15.701 -11.591 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -19.579 -13.295 -11.723 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -19.764 -14.697 -12.758 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -19.812 -14.779 -9.709 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -21.239 -14.747 -10.727 1.00 0.00 H new ATOM 990 N LYS A 64 -17.335 -15.034 -14.015 1.00 0.00 N ATOM 991 CA LYS A 64 -16.595 -14.961 -15.287 1.00 0.00 C ATOM 992 C LYS A 64 -17.447 -14.592 -16.501 1.00 0.00 C ATOM 993 O LYS A 64 -18.631 -14.928 -16.592 1.00 0.00 O ATOM 994 CB LYS A 64 -15.852 -16.283 -15.564 1.00 0.00 C ATOM 995 CG LYS A 64 -14.885 -16.738 -14.463 1.00 0.00 C ATOM 996 CD LYS A 64 -13.797 -15.701 -14.141 1.00 0.00 C ATOM 997 CE LYS A 64 -12.745 -16.251 -13.169 1.00 0.00 C ATOM 998 NZ LYS A 64 -13.328 -16.631 -11.852 1.00 0.00 N ATOM 0 H LYS A 64 -17.989 -15.816 -13.983 1.00 0.00 H new ATOM 0 HA LYS A 64 -15.886 -14.144 -15.151 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -16.591 -17.069 -15.723 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -15.293 -16.178 -16.494 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -15.452 -16.952 -13.557 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -14.410 -17.670 -14.769 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -13.309 -15.390 -15.065 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -14.259 -14.813 -13.710 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -12.264 -17.122 -13.614 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -11.969 -15.501 -13.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -12.577 -16.653 -11.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -14.050 -15.934 -11.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -13.765 -17.572 -11.924 1.00 0.00 H new ATOM 1012 N PHE A 65 -16.772 -13.980 -17.467 1.00 0.00 N ATOM 1013 CA PHE A 65 -17.219 -13.711 -18.832 1.00 0.00 C ATOM 1014 C PHE A 65 -16.197 -14.338 -19.796 1.00 0.00 C ATOM 1015 O PHE A 65 -15.000 -14.314 -19.503 1.00 0.00 O ATOM 1016 CB PHE A 65 -17.341 -12.194 -19.038 1.00 0.00 C ATOM 1017 CG PHE A 65 -18.219 -11.481 -18.026 1.00 0.00 C ATOM 1018 CD1 PHE A 65 -19.616 -11.451 -18.194 1.00 0.00 C ATOM 1019 CD2 PHE A 65 -17.638 -10.862 -16.902 1.00 0.00 C ATOM 1020 CE1 PHE A 65 -20.426 -10.799 -17.247 1.00 0.00 C ATOM 1021 CE2 PHE A 65 -18.448 -10.202 -15.961 1.00 0.00 C ATOM 1022 CZ PHE A 65 -19.842 -10.170 -16.134 1.00 0.00 C ATOM 0 H PHE A 65 -15.827 -13.632 -17.306 1.00 0.00 H new ATOM 0 HA PHE A 65 -18.200 -14.147 -19.023 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -16.343 -11.756 -19.004 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -17.737 -12.008 -20.036 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.067 -11.929 -19.051 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -16.568 -10.894 -16.763 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -21.498 -10.782 -17.375 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -17.999 -9.720 -15.105 1.00 0.00 H new ATOM 0 HZ PHE A 65 -20.464 -9.662 -15.412 1.00 0.00 H new ATOM 1032 N ALA A 66 -16.634 -14.905 -20.925 1.00 0.00 N ATOM 1033 CA ALA A 66 -15.773 -15.679 -21.832 1.00 0.00 C ATOM 1034 C ALA A 66 -15.756 -15.124 -23.268 1.00 0.00 C ATOM 1035 O ALA A 66 -16.791 -14.699 -23.795 1.00 0.00 O ATOM 1036 CB ALA A 66 -16.211 -17.147 -21.791 1.00 0.00 C ATOM 0 H ALA A 66 -17.602 -14.841 -21.240 1.00 0.00 H new ATOM 0 HA ALA A 66 -14.743 -15.594 -21.486 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -15.581 -17.734 -22.459 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -16.114 -17.527 -20.774 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -17.250 -17.226 -22.110 1.00 0.00 H new ATOM 1042 N CYS A 67 -14.582 -15.161 -23.904 1.00 0.00 N ATOM 1043 CA CYS A 67 -14.349 -14.698 -25.271 1.00 0.00 C ATOM 1044 C CYS A 67 -15.131 -15.526 -26.312 1.00 0.00 C ATOM 1045 O CYS A 67 -15.330 -16.737 -26.168 1.00 0.00 O ATOM 1046 CB CYS A 67 -12.833 -14.699 -25.498 1.00 0.00 C ATOM 1047 SG CYS A 67 -12.389 -13.961 -27.103 1.00 0.00 S ATOM 0 H CYS A 67 -13.738 -15.528 -23.463 1.00 0.00 H new ATOM 0 HA CYS A 67 -14.732 -13.686 -25.404 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -12.345 -14.145 -24.696 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -12.459 -15.722 -25.452 1.00 0.00 H new ATOM 1052 N ASP A 68 -15.577 -14.854 -27.375 1.00 0.00 N ATOM 1053 CA ASP A 68 -16.293 -15.461 -28.506 1.00 0.00 C ATOM 1054 C ASP A 68 -15.337 -16.004 -29.593 1.00 0.00 C ATOM 1055 O ASP A 68 -15.770 -16.708 -30.509 1.00 0.00 O ATOM 1056 CB ASP A 68 -17.282 -14.427 -29.067 1.00 0.00 C ATOM 1057 CG ASP A 68 -18.291 -15.046 -30.055 1.00 0.00 C ATOM 1058 OD1 ASP A 68 -19.048 -15.963 -29.651 1.00 0.00 O ATOM 1059 OD2 ASP A 68 -18.377 -14.581 -31.217 1.00 0.00 O ATOM 0 H ASP A 68 -15.449 -13.847 -27.479 1.00 0.00 H new ATOM 0 HA ASP A 68 -16.842 -16.333 -28.151 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -17.824 -13.964 -28.243 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -16.727 -13.634 -29.569 1.00 0.00 H new ATOM 1064 N TYR A 69 -14.038 -15.693 -29.487 1.00 0.00 N ATOM 1065 CA TYR A 69 -13.022 -15.960 -30.515 1.00 0.00 C ATOM 1066 C TYR A 69 -11.848 -16.839 -30.030 1.00 0.00 C ATOM 1067 O TYR A 69 -11.180 -17.460 -30.861 1.00 0.00 O ATOM 1068 CB TYR A 69 -12.488 -14.617 -31.027 1.00 0.00 C ATOM 1069 CG TYR A 69 -13.513 -13.706 -31.676 1.00 0.00 C ATOM 1070 CD1 TYR A 69 -13.762 -13.802 -33.059 1.00 0.00 C ATOM 1071 CD2 TYR A 69 -14.197 -12.747 -30.903 1.00 0.00 C ATOM 1072 CE1 TYR A 69 -14.692 -12.939 -33.670 1.00 0.00 C ATOM 1073 CE2 TYR A 69 -15.137 -11.890 -31.510 1.00 0.00 C ATOM 1074 CZ TYR A 69 -15.383 -11.980 -32.898 1.00 0.00 C ATOM 1075 OH TYR A 69 -16.278 -11.146 -33.497 1.00 0.00 O ATOM 0 H TYR A 69 -13.654 -15.236 -28.660 1.00 0.00 H new ATOM 0 HA TYR A 69 -13.508 -16.529 -31.307 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -12.034 -14.085 -30.191 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -11.695 -14.813 -31.749 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -13.239 -14.538 -33.651 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -14.001 -12.668 -29.844 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -14.877 -13.011 -34.732 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -15.670 -11.164 -30.913 1.00 0.00 H new ATOM 0 HH TYR A 69 -16.667 -10.547 -32.826 1.00 0.00 H new ATOM 1085 N CYS A 70 -11.593 -16.906 -28.716 1.00 0.00 N ATOM 1086 CA CYS A 70 -10.569 -17.758 -28.092 1.00 0.00 C ATOM 1087 C CYS A 70 -11.029 -18.335 -26.729 1.00 0.00 C ATOM 1088 O CYS A 70 -12.197 -18.223 -26.346 1.00 0.00 O ATOM 1089 CB CYS A 70 -9.235 -16.991 -28.015 1.00 0.00 C ATOM 1090 SG CYS A 70 -9.280 -15.666 -26.780 1.00 0.00 S ATOM 0 H CYS A 70 -12.111 -16.350 -28.035 1.00 0.00 H new ATOM 0 HA CYS A 70 -10.411 -18.635 -28.720 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -8.431 -17.686 -27.771 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -9.004 -16.567 -28.992 1.00 0.00 H new ATOM 1095 N SER A 71 -10.112 -18.980 -26.004 1.00 0.00 N ATOM 1096 CA SER A 71 -10.343 -19.617 -24.695 1.00 0.00 C ATOM 1097 C SER A 71 -10.278 -18.657 -23.490 1.00 0.00 C ATOM 1098 O SER A 71 -10.438 -19.095 -22.347 1.00 0.00 O ATOM 1099 CB SER A 71 -9.359 -20.781 -24.520 1.00 0.00 C ATOM 1100 OG SER A 71 -8.015 -20.329 -24.627 1.00 0.00 O ATOM 0 H SER A 71 -9.148 -19.080 -26.321 1.00 0.00 H new ATOM 0 HA SER A 71 -11.371 -19.979 -24.704 1.00 0.00 H new ATOM 0 HB2 SER A 71 -9.513 -21.250 -23.548 1.00 0.00 H new ATOM 0 HB3 SER A 71 -9.552 -21.543 -25.275 1.00 0.00 H new ATOM 0 HG SER A 71 -7.405 -21.087 -24.511 1.00 0.00 H new ATOM 1106 N PHE A 72 -10.051 -17.357 -23.713 1.00 0.00 N ATOM 1107 CA PHE A 72 -9.893 -16.346 -22.657 1.00 0.00 C ATOM 1108 C PHE A 72 -11.148 -16.167 -21.780 1.00 0.00 C ATOM 1109 O PHE A 72 -12.277 -16.114 -22.277 1.00 0.00 O ATOM 1110 CB PHE A 72 -9.493 -15.016 -23.314 1.00 0.00 C ATOM 1111 CG PHE A 72 -9.380 -13.823 -22.381 1.00 0.00 C ATOM 1112 CD1 PHE A 72 -8.310 -13.725 -21.470 1.00 0.00 C ATOM 1113 CD2 PHE A 72 -10.341 -12.796 -22.438 1.00 0.00 C ATOM 1114 CE1 PHE A 72 -8.212 -12.611 -20.615 1.00 0.00 C ATOM 1115 CE2 PHE A 72 -10.234 -11.675 -21.596 1.00 0.00 C ATOM 1116 CZ PHE A 72 -9.176 -11.588 -20.676 1.00 0.00 C ATOM 0 H PHE A 72 -9.970 -16.969 -24.653 1.00 0.00 H new ATOM 0 HA PHE A 72 -9.114 -16.693 -21.978 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -8.534 -15.154 -23.814 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.225 -14.780 -24.087 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.564 -14.505 -21.427 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -11.165 -12.869 -23.132 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.396 -12.542 -19.911 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -10.964 -10.882 -21.657 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.103 -10.736 -20.016 1.00 0.00 H new ATOM 1126 N THR A 73 -10.930 -16.002 -20.470 1.00 0.00 N ATOM 1127 CA THR A 73 -11.938 -15.614 -19.468 1.00 0.00 C ATOM 1128 C THR A 73 -11.525 -14.349 -18.714 1.00 0.00 C ATOM 1129 O THR A 73 -10.341 -14.098 -18.480 1.00 0.00 O ATOM 1130 CB THR A 73 -12.234 -16.726 -18.446 1.00 0.00 C ATOM 1131 OG1 THR A 73 -11.039 -17.258 -17.905 1.00 0.00 O ATOM 1132 CG2 THR A 73 -13.029 -17.880 -19.052 1.00 0.00 C ATOM 0 H THR A 73 -10.007 -16.141 -20.058 1.00 0.00 H new ATOM 0 HA THR A 73 -12.848 -15.424 -20.038 1.00 0.00 H new ATOM 0 HB THR A 73 -12.829 -16.254 -17.664 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.257 -17.961 -17.258 1.00 0.00 H new ATOM 0 HG21 THR A 73 -13.211 -18.637 -18.289 1.00 0.00 H new ATOM 0 HG22 THR A 73 -13.982 -17.508 -19.428 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.463 -18.321 -19.872 1.00 0.00 H new ATOM 1140 N CYS A 74 -12.517 -13.552 -18.312 1.00 0.00 N ATOM 1141 CA CYS A 74 -12.347 -12.248 -17.672 1.00 0.00 C ATOM 1142 C CYS A 74 -13.298 -12.062 -16.478 1.00 0.00 C ATOM 1143 O CYS A 74 -14.389 -12.635 -16.447 1.00 0.00 O ATOM 1144 CB CYS A 74 -12.590 -11.181 -18.747 1.00 0.00 C ATOM 1145 SG CYS A 74 -12.023 -9.564 -18.163 1.00 0.00 S ATOM 0 H CYS A 74 -13.498 -13.808 -18.428 1.00 0.00 H new ATOM 0 HA CYS A 74 -11.340 -12.163 -17.264 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -12.063 -11.450 -19.662 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -13.651 -11.136 -18.991 1.00 0.00 H new ATOM 0 HG CYS A 74 -13.001 -8.710 -18.232 1.00 0.00 H new ATOM 1151 N LEU A 75 -12.907 -11.213 -15.520 1.00 0.00 N ATOM 1152 CA LEU A 75 -13.718 -10.809 -14.359 1.00 0.00 C ATOM 1153 C LEU A 75 -14.678 -9.637 -14.673 1.00 0.00 C ATOM 1154 O LEU A 75 -15.514 -9.286 -13.839 1.00 0.00 O ATOM 1155 CB LEU A 75 -12.772 -10.455 -13.184 1.00 0.00 C ATOM 1156 CG LEU A 75 -12.158 -11.618 -12.371 1.00 0.00 C ATOM 1157 CD1 LEU A 75 -13.217 -12.393 -11.586 1.00 0.00 C ATOM 1158 CD2 LEU A 75 -11.351 -12.612 -13.208 1.00 0.00 C ATOM 0 H LEU A 75 -11.987 -10.772 -15.530 1.00 0.00 H new ATOM 0 HA LEU A 75 -14.356 -11.649 -14.084 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -11.952 -9.858 -13.583 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -13.323 -9.818 -12.492 1.00 0.00 H new ATOM 0 HG LEU A 75 -11.470 -11.123 -11.686 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.740 -13.200 -11.030 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -13.719 -11.721 -10.890 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -13.948 -12.812 -12.277 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -10.956 -13.395 -12.561 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -11.996 -13.058 -13.965 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -10.526 -12.092 -13.694 1.00 0.00 H new ATOM 1170 N SER A 76 -14.574 -9.026 -15.863 1.00 0.00 N ATOM 1171 CA SER A 76 -15.410 -7.901 -16.316 1.00 0.00 C ATOM 1172 C SER A 76 -15.755 -8.002 -17.804 1.00 0.00 C ATOM 1173 O SER A 76 -14.874 -8.198 -18.648 1.00 0.00 O ATOM 1174 CB SER A 76 -14.691 -6.574 -16.044 1.00 0.00 C ATOM 1175 OG SER A 76 -15.400 -5.490 -16.630 1.00 0.00 O ATOM 0 H SER A 76 -13.884 -9.309 -16.559 1.00 0.00 H new ATOM 0 HA SER A 76 -16.344 -7.942 -15.755 1.00 0.00 H new ATOM 0 HB2 SER A 76 -14.600 -6.417 -14.969 1.00 0.00 H new ATOM 0 HB3 SER A 76 -13.679 -6.614 -16.447 1.00 0.00 H new ATOM 0 HG SER A 76 -14.927 -4.652 -16.445 1.00 0.00 H new ATOM 1181 N LYS A 77 -17.034 -7.789 -18.142 1.00 0.00 N ATOM 1182 CA LYS A 77 -17.515 -7.701 -19.531 1.00 0.00 C ATOM 1183 C LYS A 77 -16.951 -6.486 -20.286 1.00 0.00 C ATOM 1184 O LYS A 77 -16.775 -6.550 -21.502 1.00 0.00 O ATOM 1185 CB LYS A 77 -19.055 -7.749 -19.567 1.00 0.00 C ATOM 1186 CG LYS A 77 -19.746 -6.572 -18.853 1.00 0.00 C ATOM 1187 CD LYS A 77 -21.276 -6.592 -18.999 1.00 0.00 C ATOM 1188 CE LYS A 77 -21.917 -7.812 -18.321 1.00 0.00 C ATOM 1189 NZ LYS A 77 -23.400 -7.772 -18.416 1.00 0.00 N ATOM 0 H LYS A 77 -17.775 -7.671 -17.451 1.00 0.00 H new ATOM 0 HA LYS A 77 -17.134 -8.572 -20.065 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -19.381 -7.769 -20.607 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -19.388 -8.681 -19.110 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -19.488 -6.595 -17.794 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -19.361 -5.635 -19.255 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -21.691 -5.681 -18.567 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -21.537 -6.590 -20.057 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -21.546 -8.725 -18.787 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -21.619 -7.845 -17.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -23.801 -8.610 -17.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -23.755 -6.913 -17.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -23.684 -7.765 -19.417 1.00 0.00 H new ATOM 1203 N GLY A 78 -16.608 -5.408 -19.575 1.00 0.00 N ATOM 1204 CA GLY A 78 -15.977 -4.213 -20.148 1.00 0.00 C ATOM 1205 C GLY A 78 -14.533 -4.478 -20.583 1.00 0.00 C ATOM 1206 O GLY A 78 -14.159 -4.186 -21.718 1.00 0.00 O ATOM 0 H GLY A 78 -16.763 -5.339 -18.569 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -16.557 -3.873 -21.006 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -15.992 -3.408 -19.414 1.00 0.00 H new ATOM 1210 N HIS A 79 -13.738 -5.124 -19.723 1.00 0.00 N ATOM 1211 CA HIS A 79 -12.373 -5.534 -20.074 1.00 0.00 C ATOM 1212 C HIS A 79 -12.358 -6.675 -21.112 1.00 0.00 C ATOM 1213 O HIS A 79 -11.477 -6.710 -21.973 1.00 0.00 O ATOM 1214 CB HIS A 79 -11.607 -5.884 -18.793 1.00 0.00 C ATOM 1215 CG HIS A 79 -10.161 -6.238 -19.046 1.00 0.00 C ATOM 1216 ND1 HIS A 79 -9.594 -7.486 -18.931 1.00 0.00 N ATOM 1217 CD2 HIS A 79 -9.172 -5.385 -19.459 1.00 0.00 C ATOM 1218 CE1 HIS A 79 -8.296 -7.392 -19.264 1.00 0.00 C ATOM 1219 NE2 HIS A 79 -7.989 -6.124 -19.594 1.00 0.00 N ATOM 0 H HIS A 79 -14.018 -5.375 -18.775 1.00 0.00 H new ATOM 0 HA HIS A 79 -11.864 -4.701 -20.560 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -11.653 -5.039 -18.107 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -12.099 -6.722 -18.300 1.00 0.00 H new ATOM 0 HD1 HIS A 79 -10.077 -8.337 -18.642 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -9.284 -4.328 -19.648 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -7.598 -8.216 -19.267 1.00 0.00 H new ATOM 1227 N LEU A 80 -13.376 -7.548 -21.122 1.00 0.00 N ATOM 1228 CA LEU A 80 -13.564 -8.533 -22.194 1.00 0.00 C ATOM 1229 C LEU A 80 -13.853 -7.870 -23.551 1.00 0.00 C ATOM 1230 O LEU A 80 -13.303 -8.298 -24.565 1.00 0.00 O ATOM 1231 CB LEU A 80 -14.681 -9.514 -21.797 1.00 0.00 C ATOM 1232 CG LEU A 80 -14.930 -10.621 -22.838 1.00 0.00 C ATOM 1233 CD1 LEU A 80 -13.706 -11.512 -23.047 1.00 0.00 C ATOM 1234 CD2 LEU A 80 -16.082 -11.504 -22.372 1.00 0.00 C ATOM 0 H LEU A 80 -14.087 -7.590 -20.392 1.00 0.00 H new ATOM 0 HA LEU A 80 -12.632 -9.084 -22.320 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -14.426 -9.975 -20.843 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -15.605 -8.956 -21.644 1.00 0.00 H new ATOM 0 HG LEU A 80 -15.161 -10.126 -23.781 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -13.935 -12.276 -23.790 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -12.870 -10.906 -23.395 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -13.439 -11.991 -22.105 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -16.260 -12.288 -23.108 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -15.829 -11.956 -21.413 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -16.982 -10.899 -22.261 1.00 0.00 H new ATOM 1246 N LYS A 81 -14.651 -6.792 -23.592 1.00 0.00 N ATOM 1247 CA LYS A 81 -14.868 -6.006 -24.819 1.00 0.00 C ATOM 1248 C LYS A 81 -13.559 -5.389 -25.327 1.00 0.00 C ATOM 1249 O LYS A 81 -13.283 -5.458 -26.522 1.00 0.00 O ATOM 1250 CB LYS A 81 -15.967 -4.955 -24.577 1.00 0.00 C ATOM 1251 CG LYS A 81 -16.385 -4.246 -25.876 1.00 0.00 C ATOM 1252 CD LYS A 81 -17.482 -3.192 -25.663 1.00 0.00 C ATOM 1253 CE LYS A 81 -18.813 -3.813 -25.215 1.00 0.00 C ATOM 1254 NZ LYS A 81 -19.881 -2.787 -25.094 1.00 0.00 N ATOM 0 H LYS A 81 -15.162 -6.441 -22.782 1.00 0.00 H new ATOM 0 HA LYS A 81 -15.213 -6.669 -25.612 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -16.837 -5.437 -24.131 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -15.610 -4.216 -23.860 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -15.511 -3.768 -26.319 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -16.738 -4.989 -26.591 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -17.150 -2.472 -24.915 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -17.636 -2.640 -26.590 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -19.119 -4.575 -25.932 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -18.678 -4.313 -24.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -20.766 -3.241 -24.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -19.599 -2.073 -24.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -20.027 -2.327 -26.015 1.00 0.00 H new ATOM 1268 N VAL A 82 -12.708 -4.878 -24.430 1.00 0.00 N ATOM 1269 CA VAL A 82 -11.358 -4.384 -24.772 1.00 0.00 C ATOM 1270 C VAL A 82 -10.465 -5.507 -25.323 1.00 0.00 C ATOM 1271 O VAL A 82 -9.816 -5.307 -26.350 1.00 0.00 O ATOM 1272 CB VAL A 82 -10.707 -3.663 -23.574 1.00 0.00 C ATOM 1273 CG1 VAL A 82 -9.260 -3.236 -23.854 1.00 0.00 C ATOM 1274 CG2 VAL A 82 -11.485 -2.389 -23.219 1.00 0.00 C ATOM 0 H VAL A 82 -12.933 -4.793 -23.439 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.468 -3.650 -25.570 1.00 0.00 H new ATOM 0 HB VAL A 82 -10.723 -4.383 -22.756 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.853 -2.734 -22.977 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.658 -4.116 -24.080 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.240 -2.554 -24.704 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.009 -1.896 -22.371 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -11.489 -1.715 -24.075 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -12.511 -2.650 -22.958 1.00 0.00 H new ATOM 1284 N HIS A 83 -10.477 -6.703 -24.721 1.00 0.00 N ATOM 1285 CA HIS A 83 -9.794 -7.887 -25.265 1.00 0.00 C ATOM 1286 C HIS A 83 -10.281 -8.219 -26.685 1.00 0.00 C ATOM 1287 O HIS A 83 -9.463 -8.399 -27.586 1.00 0.00 O ATOM 1288 CB HIS A 83 -9.974 -9.090 -24.314 1.00 0.00 C ATOM 1289 CG HIS A 83 -9.579 -10.421 -24.916 1.00 0.00 C ATOM 1290 ND1 HIS A 83 -8.332 -10.997 -24.878 1.00 0.00 N ATOM 1291 CD2 HIS A 83 -10.394 -11.282 -25.602 1.00 0.00 C ATOM 1292 CE1 HIS A 83 -8.386 -12.172 -25.526 1.00 0.00 C ATOM 1293 NE2 HIS A 83 -9.631 -12.398 -26.012 1.00 0.00 N ATOM 0 H HIS A 83 -10.961 -6.879 -23.841 1.00 0.00 H new ATOM 0 HA HIS A 83 -8.730 -7.661 -25.339 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -9.381 -8.920 -23.415 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -11.017 -9.140 -24.003 1.00 0.00 H new ATOM 0 HD1 HIS A 83 -7.505 -10.599 -24.433 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -11.446 -11.132 -25.797 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -7.550 -12.846 -25.644 1.00 0.00 H new ATOM 1301 N ILE A 84 -11.598 -8.256 -26.916 1.00 0.00 N ATOM 1302 CA ILE A 84 -12.168 -8.561 -28.236 1.00 0.00 C ATOM 1303 C ILE A 84 -11.748 -7.509 -29.270 1.00 0.00 C ATOM 1304 O ILE A 84 -11.193 -7.876 -30.306 1.00 0.00 O ATOM 1305 CB ILE A 84 -13.698 -8.780 -28.144 1.00 0.00 C ATOM 1306 CG1 ILE A 84 -13.971 -10.104 -27.387 1.00 0.00 C ATOM 1307 CG2 ILE A 84 -14.340 -8.821 -29.544 1.00 0.00 C ATOM 1308 CD1 ILE A 84 -15.444 -10.362 -27.046 1.00 0.00 C ATOM 0 H ILE A 84 -12.298 -8.076 -26.196 1.00 0.00 H new ATOM 0 HA ILE A 84 -11.758 -9.506 -28.592 1.00 0.00 H new ATOM 0 HB ILE A 84 -14.144 -7.945 -27.603 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -13.603 -10.933 -27.991 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -13.394 -10.102 -26.462 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -15.415 -8.976 -29.447 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -14.154 -7.877 -30.057 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -13.906 -9.639 -30.120 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -15.534 -11.311 -26.518 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -15.817 -9.557 -26.413 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -16.029 -10.401 -27.965 1.00 0.00 H new ATOM 1320 N GLU A 85 -11.925 -6.220 -28.980 1.00 0.00 N ATOM 1321 CA GLU A 85 -11.576 -5.118 -29.888 1.00 0.00 C ATOM 1322 C GLU A 85 -10.082 -5.096 -30.263 1.00 0.00 C ATOM 1323 O GLU A 85 -9.750 -4.849 -31.426 1.00 0.00 O ATOM 1324 CB GLU A 85 -11.963 -3.776 -29.241 1.00 0.00 C ATOM 1325 CG GLU A 85 -13.477 -3.514 -29.209 1.00 0.00 C ATOM 1326 CD GLU A 85 -14.031 -3.161 -30.602 1.00 0.00 C ATOM 1327 OE1 GLU A 85 -13.884 -1.994 -31.039 1.00 0.00 O ATOM 1328 OE2 GLU A 85 -14.628 -4.044 -31.264 1.00 0.00 O ATOM 0 H GLU A 85 -12.321 -5.903 -28.095 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.134 -5.276 -30.811 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -11.578 -3.751 -28.221 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -11.476 -2.967 -29.786 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -13.990 -4.397 -28.828 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -13.689 -2.699 -28.517 1.00 0.00 H new ATOM 1335 N ARG A 86 -9.180 -5.376 -29.308 1.00 0.00 N ATOM 1336 CA ARG A 86 -7.719 -5.311 -29.514 1.00 0.00 C ATOM 1337 C ARG A 86 -7.111 -6.586 -30.105 1.00 0.00 C ATOM 1338 O ARG A 86 -6.182 -6.485 -30.906 1.00 0.00 O ATOM 1339 CB ARG A 86 -7.019 -4.937 -28.197 1.00 0.00 C ATOM 1340 CG ARG A 86 -7.329 -3.493 -27.773 1.00 0.00 C ATOM 1341 CD ARG A 86 -6.567 -3.140 -26.493 1.00 0.00 C ATOM 1342 NE ARG A 86 -6.830 -1.748 -26.074 1.00 0.00 N ATOM 1343 CZ ARG A 86 -6.414 -1.167 -24.963 1.00 0.00 C ATOM 1344 NH1 ARG A 86 -5.686 -1.793 -24.081 1.00 0.00 N ATOM 1345 NH2 ARG A 86 -6.729 0.072 -24.711 1.00 0.00 N ATOM 0 H ARG A 86 -9.444 -5.656 -28.363 1.00 0.00 H new ATOM 0 HA ARG A 86 -7.551 -4.535 -30.261 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -7.335 -5.622 -27.410 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -5.942 -5.058 -28.311 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -7.051 -2.805 -28.571 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -8.400 -3.377 -27.610 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -6.858 -3.823 -25.695 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.498 -3.277 -26.655 1.00 0.00 H new ATOM 0 HE ARG A 86 -7.390 -1.177 -26.707 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -5.419 -2.765 -24.237 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -5.384 -1.311 -23.235 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -7.299 0.598 -25.373 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -6.405 0.516 -23.852 1.00 0.00 H new ATOM 1359 N VAL A 87 -7.606 -7.769 -29.730 1.00 0.00 N ATOM 1360 CA VAL A 87 -7.002 -9.065 -30.108 1.00 0.00 C ATOM 1361 C VAL A 87 -7.659 -9.677 -31.352 1.00 0.00 C ATOM 1362 O VAL A 87 -6.960 -10.278 -32.170 1.00 0.00 O ATOM 1363 CB VAL A 87 -7.012 -10.052 -28.917 1.00 0.00 C ATOM 1364 CG1 VAL A 87 -6.304 -11.374 -29.240 1.00 0.00 C ATOM 1365 CG2 VAL A 87 -6.295 -9.457 -27.693 1.00 0.00 C ATOM 0 H VAL A 87 -8.441 -7.863 -29.152 1.00 0.00 H new ATOM 0 HA VAL A 87 -5.963 -8.867 -30.372 1.00 0.00 H new ATOM 0 HB VAL A 87 -8.066 -10.236 -28.708 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -6.341 -12.029 -28.369 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -6.803 -11.858 -30.080 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -5.264 -11.176 -29.501 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -6.319 -10.175 -26.873 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.259 -9.235 -27.950 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -6.798 -8.540 -27.387 1.00 0.00 H new ATOM 1375 N HIS A 88 -8.975 -9.510 -31.528 1.00 0.00 N ATOM 1376 CA HIS A 88 -9.750 -10.215 -32.564 1.00 0.00 C ATOM 1377 C HIS A 88 -10.432 -9.278 -33.577 1.00 0.00 C ATOM 1378 O HIS A 88 -10.417 -9.554 -34.779 1.00 0.00 O ATOM 1379 CB HIS A 88 -10.778 -11.124 -31.875 1.00 0.00 C ATOM 1380 CG HIS A 88 -10.179 -12.075 -30.867 1.00 0.00 C ATOM 1381 ND1 HIS A 88 -9.351 -13.143 -31.131 1.00 0.00 N ATOM 1382 CD2 HIS A 88 -10.417 -12.078 -29.521 1.00 0.00 C ATOM 1383 CE1 HIS A 88 -9.108 -13.788 -29.979 1.00 0.00 C ATOM 1384 NE2 HIS A 88 -9.745 -13.179 -28.951 1.00 0.00 N ATOM 0 H HIS A 88 -9.537 -8.880 -30.955 1.00 0.00 H new ATOM 0 HA HIS A 88 -9.050 -10.806 -33.154 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -11.521 -10.502 -31.376 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -11.305 -11.701 -32.635 1.00 0.00 H new ATOM 0 HD1 HIS A 88 -8.984 -13.401 -32.047 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -11.018 -11.359 -28.985 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -8.491 -14.669 -29.885 1.00 0.00 H new ATOM 1392 N LYS A 89 -10.986 -8.148 -33.119 1.00 0.00 N ATOM 1393 CA LYS A 89 -11.748 -7.179 -33.934 1.00 0.00 C ATOM 1394 C LYS A 89 -10.905 -6.065 -34.572 1.00 0.00 C ATOM 1395 O LYS A 89 -11.458 -5.187 -35.235 1.00 0.00 O ATOM 1396 CB LYS A 89 -12.960 -6.654 -33.129 1.00 0.00 C ATOM 1397 CG LYS A 89 -14.276 -7.321 -33.553 1.00 0.00 C ATOM 1398 CD LYS A 89 -14.767 -6.812 -34.917 1.00 0.00 C ATOM 1399 CE LYS A 89 -15.973 -7.629 -35.396 1.00 0.00 C ATOM 1400 NZ LYS A 89 -16.487 -7.119 -36.693 1.00 0.00 N ATOM 0 H LYS A 89 -10.917 -7.869 -32.140 1.00 0.00 H new ATOM 0 HA LYS A 89 -12.120 -7.721 -34.804 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -12.792 -6.831 -32.067 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -13.042 -5.575 -33.263 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -14.137 -8.401 -33.598 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -15.039 -7.129 -32.799 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -15.041 -5.760 -34.841 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -13.961 -6.880 -35.648 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -15.688 -8.676 -35.501 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -16.764 -7.588 -34.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -17.110 -7.832 -37.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -17.023 -6.242 -36.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -15.689 -6.925 -37.331 1.00 0.00 H new ATOM 1414 N LYS A 90 -9.571 -6.144 -34.482 1.00 0.00 N ATOM 1415 CA LYS A 90 -8.615 -5.245 -35.166 1.00 0.00 C ATOM 1416 C LYS A 90 -8.802 -5.217 -36.696 1.00 0.00 C ATOM 1417 O LYS A 90 -8.556 -4.194 -37.334 1.00 0.00 O ATOM 1418 CB LYS A 90 -7.189 -5.672 -34.763 1.00 0.00 C ATOM 1419 CG LYS A 90 -6.107 -4.674 -35.214 1.00 0.00 C ATOM 1420 CD LYS A 90 -4.684 -5.105 -34.826 1.00 0.00 C ATOM 1421 CE LYS A 90 -4.482 -5.153 -33.305 1.00 0.00 C ATOM 1422 NZ LYS A 90 -3.085 -5.514 -32.946 1.00 0.00 N ATOM 0 H LYS A 90 -9.107 -6.854 -33.916 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.801 -4.219 -34.848 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -7.143 -5.783 -33.680 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -6.974 -6.650 -35.194 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -6.161 -4.555 -36.296 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -6.316 -3.699 -34.775 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.477 -6.088 -35.249 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.965 -4.412 -35.264 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.729 -4.183 -32.874 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.169 -5.879 -32.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.987 -5.536 -31.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.858 -6.451 -33.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.432 -4.807 -33.340 1.00 0.00 H new ATOM 1436 N ILE A 91 -9.299 -6.319 -37.271 1.00 0.00 N ATOM 1437 CA ILE A 91 -9.625 -6.471 -38.703 1.00 0.00 C ATOM 1438 C ILE A 91 -10.946 -5.788 -39.134 1.00 0.00 C ATOM 1439 O ILE A 91 -11.216 -5.662 -40.330 1.00 0.00 O ATOM 1440 CB ILE A 91 -9.568 -7.979 -39.064 1.00 0.00 C ATOM 1441 CG1 ILE A 91 -9.510 -8.302 -40.575 1.00 0.00 C ATOM 1442 CG2 ILE A 91 -10.742 -8.754 -38.437 1.00 0.00 C ATOM 1443 CD1 ILE A 91 -8.337 -7.646 -41.311 1.00 0.00 C ATOM 0 H ILE A 91 -9.494 -7.164 -36.735 1.00 0.00 H new ATOM 0 HA ILE A 91 -8.874 -5.932 -39.281 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.617 -8.304 -38.642 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -9.446 -9.383 -40.702 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -10.442 -7.981 -41.040 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -10.670 -9.807 -38.710 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -10.704 -8.658 -37.352 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -11.684 -8.347 -38.804 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -8.368 -7.922 -42.365 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -8.409 -6.562 -41.218 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -7.398 -7.986 -40.875 1.00 0.00 H new ATOM 1455 N LYS A 92 -11.737 -5.313 -38.161 1.00 0.00 N ATOM 1456 CA LYS A 92 -13.058 -4.662 -38.297 1.00 0.00 C ATOM 1457 C LYS A 92 -14.067 -5.475 -39.128 1.00 0.00 C ATOM 1458 O LYS A 92 -14.554 -6.494 -38.586 1.00 0.00 O ATOM 1459 CB LYS A 92 -12.895 -3.193 -38.740 1.00 0.00 C ATOM 1460 CG LYS A 92 -12.092 -2.356 -37.725 1.00 0.00 C ATOM 1461 CD LYS A 92 -12.015 -0.869 -38.100 1.00 0.00 C ATOM 1462 CE LYS A 92 -11.224 -0.641 -39.398 1.00 0.00 C ATOM 1463 NZ LYS A 92 -11.110 0.804 -39.722 1.00 0.00 N ATOM 1464 OXT LYS A 92 -14.420 -5.083 -40.264 1.00 0.00 O ATOM 0 H LYS A 92 -11.453 -5.376 -37.183 1.00 0.00 H new ATOM 0 HA LYS A 92 -13.519 -4.640 -37.310 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -12.395 -3.162 -39.708 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -13.880 -2.746 -38.876 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -12.549 -2.453 -36.740 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -11.082 -2.759 -37.649 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -13.023 -0.472 -38.216 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -11.546 -0.314 -37.288 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -10.228 -1.072 -39.298 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -11.715 -1.161 -40.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -10.571 0.921 -40.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -12.060 1.209 -39.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -10.619 1.296 -38.948 1.00 0.00 H new TER 1478 LYS A 92 HETATM 1479 ZN ZN A 101 10.319 7.415 -6.272 1.00 0.00 ZN HETATM 1480 ZN ZN A 102 -3.186 -8.834 -7.990 1.00 0.00 ZN HETATM 1481 ZN ZN A 103 -10.231 -13.766 -27.204 1.00 0.00 ZN