USER MOD reduce.3.24.130724 H: found=0, std=0, add=838, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 837 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 SER OG : rot 31:sc= 0.482 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.37 X(o=-0.37,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0425) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -110:sc= -1.24 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -0.73 K(o=-0.73,f=-2!) USER MOD Single : A 63 GLN : amide:sc= -0.0108 X(o=-0.011,f=0) USER MOD Single : A 68 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.113) USER MOD Single : A 69 TYR OH : rot -75:sc= 1.02 USER MOD Single : A 76 THR OG1 : rot -77:sc= 0.252 USER MOD Single : A 81 LYS NZ :NH3+ -163:sc= 0.113 (180deg=0.0191) USER MOD Single : A 82 ASN : amide:sc= 0.126 X(o=0.13,f=-0.063) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -150:sc= 0.0406 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= -0.367 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -1.18 K(o=-1.2,f=-4.9!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.317 K(o=-0.32,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.806 -4.569 -0.837 1.00 0.00 N ATOM 2 CA MET A 1 2.779 -3.828 -2.126 1.00 0.00 C ATOM 3 C MET A 1 1.362 -3.392 -2.478 1.00 0.00 C ATOM 4 O MET A 1 1.110 -2.217 -2.752 1.00 0.00 O ATOM 5 CB MET A 1 3.337 -4.743 -3.218 1.00 0.00 C ATOM 6 CG MET A 1 4.111 -4.009 -4.301 1.00 0.00 C ATOM 7 SD MET A 1 4.724 -5.123 -5.581 1.00 0.00 S ATOM 8 CE MET A 1 6.203 -4.262 -6.107 1.00 0.00 C ATOM 0 H1 MET A 1 3.782 -4.854 -0.621 1.00 0.00 H new ATOM 0 H2 MET A 1 2.448 -3.956 -0.077 1.00 0.00 H new ATOM 0 H3 MET A 1 2.206 -5.415 -0.911 1.00 0.00 H new ATOM 0 HA MET A 1 3.387 -2.928 -2.039 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.990 -5.485 -2.758 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.512 -5.286 -3.679 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.468 -3.255 -4.756 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.951 -3.481 -3.849 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.693 -4.830 -6.898 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.935 -3.274 -6.483 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.883 -4.156 -5.261 1.00 0.00 H new ATOM 20 N VAL A 2 0.436 -4.347 -2.473 1.00 0.00 N ATOM 21 CA VAL A 2 -0.956 -4.064 -2.796 1.00 0.00 C ATOM 22 C VAL A 2 -1.086 -3.583 -4.234 1.00 0.00 C ATOM 23 O VAL A 2 -0.197 -2.908 -4.753 1.00 0.00 O ATOM 24 CB VAL A 2 -1.549 -2.996 -1.846 1.00 0.00 C ATOM 25 CG1 VAL A 2 -3.026 -2.750 -2.141 1.00 0.00 C ATOM 26 CG2 VAL A 2 -1.347 -3.406 -0.392 1.00 0.00 C ATOM 0 H VAL A 2 0.626 -5.324 -2.248 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.513 -4.993 -2.671 1.00 0.00 H new ATOM 0 HB VAL A 2 -1.018 -2.060 -2.018 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.413 -1.995 -1.457 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -3.139 -2.401 -3.168 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.583 -3.678 -2.010 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -1.770 -2.644 0.263 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.845 -4.358 -0.210 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.281 -3.509 -0.188 1.00 0.00 H new ATOM 36 N LYS A 3 -2.193 -3.936 -4.877 1.00 0.00 N ATOM 37 CA LYS A 3 -2.419 -3.535 -6.253 1.00 0.00 C ATOM 38 C LYS A 3 -3.897 -3.290 -6.493 1.00 0.00 C ATOM 39 O LYS A 3 -4.729 -4.168 -6.282 1.00 0.00 O ATOM 40 CB LYS A 3 -1.902 -4.605 -7.220 1.00 0.00 C ATOM 41 CG LYS A 3 -2.260 -6.028 -6.818 1.00 0.00 C ATOM 42 CD LYS A 3 -1.705 -7.038 -7.810 1.00 0.00 C ATOM 43 CE LYS A 3 -0.211 -7.241 -7.621 1.00 0.00 C ATOM 44 NZ LYS A 3 0.086 -8.197 -6.520 1.00 0.00 N ATOM 0 H LYS A 3 -2.941 -4.495 -4.468 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.872 -2.610 -6.434 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.304 -4.407 -8.213 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.818 -4.521 -7.293 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -1.866 -6.237 -5.824 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.344 -6.130 -6.759 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.221 -7.990 -7.688 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.901 -6.697 -8.826 1.00 0.00 H new ATOM 0 HE2 LYS A 3 0.225 -7.610 -8.549 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.261 -6.282 -7.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.116 -8.307 -6.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.308 -7.833 -5.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -0.342 -9.120 -6.736 1.00 0.00 H new ATOM 58 N GLN A 4 -4.216 -2.080 -6.924 1.00 0.00 N ATOM 59 CA GLN A 4 -5.596 -1.713 -7.183 1.00 0.00 C ATOM 60 C GLN A 4 -6.077 -2.364 -8.480 1.00 0.00 C ATOM 61 O GLN A 4 -5.415 -2.270 -9.514 1.00 0.00 O ATOM 62 CB GLN A 4 -5.731 -0.190 -7.260 1.00 0.00 C ATOM 63 CG GLN A 4 -7.143 0.283 -7.570 1.00 0.00 C ATOM 64 CD GLN A 4 -7.646 1.316 -6.580 1.00 0.00 C ATOM 65 OE1 GLN A 4 -7.053 2.384 -6.423 1.00 0.00 O ATOM 66 NE2 GLN A 4 -8.745 1.000 -5.905 1.00 0.00 N ATOM 0 H GLN A 4 -3.539 -1.338 -7.101 1.00 0.00 H new ATOM 0 HA GLN A 4 -6.219 -2.072 -6.364 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -5.412 0.243 -6.312 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -5.054 0.188 -8.026 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.167 0.706 -8.574 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.817 -0.574 -7.569 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -9.203 0.103 -6.068 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -9.131 1.654 -5.224 1.00 0.00 H new ATOM 75 N ILE A 5 -7.228 -3.025 -8.416 1.00 0.00 N ATOM 76 CA ILE A 5 -7.793 -3.697 -9.583 1.00 0.00 C ATOM 77 C ILE A 5 -8.923 -2.858 -10.184 1.00 0.00 C ATOM 78 O ILE A 5 -10.004 -2.745 -9.606 1.00 0.00 O ATOM 79 CB ILE A 5 -8.281 -5.126 -9.211 1.00 0.00 C ATOM 80 CG1 ILE A 5 -7.169 -6.154 -9.465 1.00 0.00 C ATOM 81 CG2 ILE A 5 -9.534 -5.523 -9.983 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.795 -5.710 -9.007 1.00 0.00 C ATOM 0 H ILE A 5 -7.789 -3.110 -7.568 1.00 0.00 H new ATOM 0 HA ILE A 5 -7.014 -3.802 -10.339 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.532 -5.113 -8.150 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.426 -7.083 -8.957 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.130 -6.374 -10.532 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -9.838 -6.528 -9.691 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -10.337 -4.821 -9.759 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.324 -5.504 -11.052 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -5.069 -6.493 -9.223 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.513 -4.798 -9.534 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.813 -5.518 -7.934 1.00 0.00 H new ATOM 94 N GLU A 6 -8.657 -2.263 -11.347 1.00 0.00 N ATOM 95 CA GLU A 6 -9.642 -1.426 -12.024 1.00 0.00 C ATOM 96 C GLU A 6 -10.371 -2.177 -13.138 1.00 0.00 C ATOM 97 O GLU A 6 -10.960 -1.558 -14.025 1.00 0.00 O ATOM 98 CB GLU A 6 -8.975 -0.165 -12.587 1.00 0.00 C ATOM 99 CG GLU A 6 -9.027 1.024 -11.639 1.00 0.00 C ATOM 100 CD GLU A 6 -8.767 2.344 -12.341 1.00 0.00 C ATOM 101 OE1 GLU A 6 -9.547 2.699 -13.249 1.00 0.00 O ATOM 102 OE2 GLU A 6 -7.782 3.024 -11.981 1.00 0.00 O ATOM 0 H GLU A 6 -7.767 -2.346 -11.838 1.00 0.00 H new ATOM 0 HA GLU A 6 -10.387 -1.141 -11.281 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.934 -0.388 -12.821 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -9.461 0.106 -13.524 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -10.005 1.059 -11.159 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -8.289 0.886 -10.849 1.00 0.00 H new ATOM 109 N SER A 7 -10.333 -3.503 -13.093 1.00 0.00 N ATOM 110 CA SER A 7 -10.995 -4.314 -14.111 1.00 0.00 C ATOM 111 C SER A 7 -11.357 -5.697 -13.565 1.00 0.00 C ATOM 112 O SER A 7 -10.786 -6.155 -12.573 1.00 0.00 O ATOM 113 CB SER A 7 -10.098 -4.447 -15.343 1.00 0.00 C ATOM 114 OG SER A 7 -10.289 -3.356 -16.230 1.00 0.00 O ATOM 0 H SER A 7 -9.855 -4.038 -12.368 1.00 0.00 H new ATOM 0 HA SER A 7 -11.920 -3.813 -14.397 1.00 0.00 H new ATOM 0 HB2 SER A 7 -9.054 -4.491 -15.034 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.318 -5.382 -15.858 1.00 0.00 H new ATOM 0 HG SER A 7 -10.527 -2.555 -15.717 1.00 0.00 H new ATOM 120 N LYS A 8 -12.307 -6.360 -14.225 1.00 0.00 N ATOM 121 CA LYS A 8 -12.747 -7.690 -13.809 1.00 0.00 C ATOM 122 C LYS A 8 -11.687 -8.741 -14.121 1.00 0.00 C ATOM 123 O LYS A 8 -11.606 -9.772 -13.450 1.00 0.00 O ATOM 124 CB LYS A 8 -14.064 -8.047 -14.507 1.00 0.00 C ATOM 125 CG LYS A 8 -14.619 -9.412 -14.123 1.00 0.00 C ATOM 126 CD LYS A 8 -15.257 -10.110 -15.316 1.00 0.00 C ATOM 127 CE LYS A 8 -14.776 -11.546 -15.451 1.00 0.00 C ATOM 128 NZ LYS A 8 -13.784 -11.697 -16.549 1.00 0.00 N ATOM 0 H LYS A 8 -12.786 -5.997 -15.049 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.903 -7.676 -12.730 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.807 -7.285 -14.271 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -13.911 -8.019 -15.586 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.817 -10.033 -13.723 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -15.358 -9.296 -13.330 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -16.341 -10.098 -15.207 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -15.022 -9.560 -16.228 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -14.329 -11.869 -14.511 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -15.629 -12.198 -15.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -13.481 -12.690 -16.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -14.218 -11.413 -17.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.959 -11.094 -16.357 1.00 0.00 H new ATOM 142 N THR A 9 -10.873 -8.476 -15.136 1.00 0.00 N ATOM 143 CA THR A 9 -9.817 -9.400 -15.529 1.00 0.00 C ATOM 144 C THR A 9 -8.606 -9.257 -14.614 1.00 0.00 C ATOM 145 O THR A 9 -7.886 -10.223 -14.361 1.00 0.00 O ATOM 146 CB THR A 9 -9.412 -9.159 -16.983 1.00 0.00 C ATOM 147 OG1 THR A 9 -10.529 -8.750 -17.754 1.00 0.00 O ATOM 148 CG2 THR A 9 -8.823 -10.384 -17.646 1.00 0.00 C ATOM 0 H THR A 9 -10.924 -7.629 -15.702 1.00 0.00 H new ATOM 0 HA THR A 9 -10.201 -10.416 -15.436 1.00 0.00 H new ATOM 0 HB THR A 9 -8.651 -8.380 -16.947 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.249 -8.599 -18.681 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.556 -10.147 -18.676 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.932 -10.698 -17.103 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.556 -11.190 -17.637 1.00 0.00 H new ATOM 156 N ALA A 10 -8.385 -8.040 -14.127 1.00 0.00 N ATOM 157 CA ALA A 10 -7.260 -7.764 -13.246 1.00 0.00 C ATOM 158 C ALA A 10 -7.413 -8.504 -11.919 1.00 0.00 C ATOM 159 O ALA A 10 -6.438 -9.027 -11.379 1.00 0.00 O ATOM 160 CB ALA A 10 -7.134 -6.264 -13.012 1.00 0.00 C ATOM 0 H ALA A 10 -8.971 -7.230 -14.329 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.349 -8.122 -13.727 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.289 -6.068 -12.352 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.974 -5.759 -13.965 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.048 -5.889 -12.552 1.00 0.00 H new ATOM 166 N PHE A 11 -8.640 -8.575 -11.406 1.00 0.00 N ATOM 167 CA PHE A 11 -8.891 -9.274 -10.144 1.00 0.00 C ATOM 168 C PHE A 11 -8.399 -10.713 -10.246 1.00 0.00 C ATOM 169 O PHE A 11 -7.791 -11.243 -9.316 1.00 0.00 O ATOM 170 CB PHE A 11 -10.387 -9.240 -9.796 1.00 0.00 C ATOM 171 CG PHE A 11 -10.676 -9.470 -8.337 1.00 0.00 C ATOM 172 CD1 PHE A 11 -9.932 -8.821 -7.362 1.00 0.00 C ATOM 173 CD2 PHE A 11 -11.685 -10.332 -7.937 1.00 0.00 C ATOM 174 CE1 PHE A 11 -10.186 -9.030 -6.022 1.00 0.00 C ATOM 175 CE2 PHE A 11 -11.945 -10.543 -6.595 1.00 0.00 C ATOM 176 CZ PHE A 11 -11.193 -9.891 -5.637 1.00 0.00 C ATOM 0 H PHE A 11 -9.468 -8.163 -11.837 1.00 0.00 H new ATOM 0 HA PHE A 11 -8.346 -8.769 -9.346 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -10.797 -8.274 -10.090 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -10.905 -9.998 -10.383 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -9.144 -8.144 -7.656 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -12.275 -10.845 -8.682 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -9.597 -8.520 -5.275 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.735 -11.216 -6.297 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.393 -10.055 -4.588 1.00 0.00 H new ATOM 186 N GLN A 12 -8.634 -11.322 -11.402 1.00 0.00 N ATOM 187 CA GLN A 12 -8.188 -12.685 -11.654 1.00 0.00 C ATOM 188 C GLN A 12 -6.667 -12.728 -11.749 1.00 0.00 C ATOM 189 O GLN A 12 -6.017 -13.608 -11.182 1.00 0.00 O ATOM 190 CB GLN A 12 -8.809 -13.219 -12.946 1.00 0.00 C ATOM 191 CG GLN A 12 -10.312 -13.012 -13.025 1.00 0.00 C ATOM 192 CD GLN A 12 -11.088 -14.282 -12.738 1.00 0.00 C ATOM 193 OE1 GLN A 12 -12.027 -14.626 -13.458 1.00 0.00 O ATOM 194 NE2 GLN A 12 -10.700 -14.986 -11.680 1.00 0.00 N ATOM 0 H GLN A 12 -9.132 -10.891 -12.181 1.00 0.00 H new ATOM 0 HA GLN A 12 -8.510 -13.316 -10.826 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.337 -12.728 -13.797 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -8.592 -14.284 -13.032 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -10.607 -12.241 -12.314 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.574 -12.647 -14.018 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.917 -14.663 -11.112 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.185 -15.849 -11.436 1.00 0.00 H new ATOM 203 N GLU A 13 -6.113 -11.770 -12.486 1.00 0.00 N ATOM 204 CA GLU A 13 -4.674 -11.676 -12.691 1.00 0.00 C ATOM 205 C GLU A 13 -3.924 -11.559 -11.360 1.00 0.00 C ATOM 206 O GLU A 13 -2.955 -12.280 -11.122 1.00 0.00 O ATOM 207 CB GLU A 13 -4.372 -10.490 -13.629 1.00 0.00 C ATOM 208 CG GLU A 13 -3.730 -9.279 -12.968 1.00 0.00 C ATOM 209 CD GLU A 13 -3.274 -8.247 -13.982 1.00 0.00 C ATOM 210 OE1 GLU A 13 -2.822 -8.649 -15.076 1.00 0.00 O ATOM 211 OE2 GLU A 13 -3.370 -7.037 -13.686 1.00 0.00 O ATOM 0 H GLU A 13 -6.648 -11.040 -12.956 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.319 -12.593 -13.162 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.715 -10.838 -14.426 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -5.304 -10.174 -14.099 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -4.443 -8.821 -12.282 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.876 -9.602 -12.372 1.00 0.00 H new ATOM 218 N ALA A 14 -4.380 -10.661 -10.496 1.00 0.00 N ATOM 219 CA ALA A 14 -3.750 -10.469 -9.192 1.00 0.00 C ATOM 220 C ALA A 14 -3.886 -11.722 -8.331 1.00 0.00 C ATOM 221 O ALA A 14 -3.009 -12.034 -7.525 1.00 0.00 O ATOM 222 CB ALA A 14 -4.361 -9.273 -8.480 1.00 0.00 C ATOM 0 H ALA A 14 -5.181 -10.055 -10.672 1.00 0.00 H new ATOM 0 HA ALA A 14 -2.689 -10.279 -9.353 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -3.881 -9.143 -7.510 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.212 -8.376 -9.082 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.428 -9.441 -8.337 1.00 0.00 H new ATOM 228 N LEU A 15 -4.992 -12.439 -8.512 1.00 0.00 N ATOM 229 CA LEU A 15 -5.250 -13.661 -7.753 1.00 0.00 C ATOM 230 C LEU A 15 -4.269 -14.765 -8.151 1.00 0.00 C ATOM 231 O LEU A 15 -3.845 -15.572 -7.318 1.00 0.00 O ATOM 232 CB LEU A 15 -6.692 -14.121 -7.980 1.00 0.00 C ATOM 233 CG LEU A 15 -7.738 -13.433 -7.101 1.00 0.00 C ATOM 234 CD1 LEU A 15 -9.139 -13.888 -7.482 1.00 0.00 C ATOM 235 CD2 LEU A 15 -7.469 -13.712 -5.630 1.00 0.00 C ATOM 0 H LEU A 15 -5.725 -12.195 -9.178 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.108 -13.448 -6.693 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.951 -13.952 -9.025 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.746 -15.196 -7.808 1.00 0.00 H new ATOM 0 HG LEU A 15 -7.669 -12.358 -7.265 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -9.869 -13.388 -6.846 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.333 -13.636 -8.525 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.220 -14.967 -7.349 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.224 -13.214 -5.021 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -7.509 -14.786 -5.450 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -6.481 -13.336 -5.363 1.00 0.00 H new ATOM 247 N ASP A 16 -3.900 -14.783 -9.428 1.00 0.00 N ATOM 248 CA ASP A 16 -2.959 -15.774 -9.933 1.00 0.00 C ATOM 249 C ASP A 16 -1.609 -15.603 -9.250 1.00 0.00 C ATOM 250 O ASP A 16 -0.902 -16.577 -8.986 1.00 0.00 O ATOM 251 CB ASP A 16 -2.810 -15.641 -11.451 1.00 0.00 C ATOM 252 CG ASP A 16 -2.310 -16.916 -12.100 1.00 0.00 C ATOM 253 OD1 ASP A 16 -3.052 -17.920 -12.084 1.00 0.00 O ATOM 254 OD2 ASP A 16 -1.178 -16.911 -12.627 1.00 0.00 O ATOM 0 H ASP A 16 -4.238 -14.124 -10.130 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.342 -16.770 -9.711 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.773 -15.370 -11.885 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.119 -14.828 -11.675 1.00 0.00 H new ATOM 259 N ALA A 17 -1.271 -14.354 -8.948 1.00 0.00 N ATOM 260 CA ALA A 17 -0.022 -14.035 -8.271 1.00 0.00 C ATOM 261 C ALA A 17 -0.112 -14.373 -6.785 1.00 0.00 C ATOM 262 O ALA A 17 0.903 -14.580 -6.122 1.00 0.00 O ATOM 263 CB ALA A 17 0.319 -12.565 -8.465 1.00 0.00 C ATOM 0 H ALA A 17 -1.850 -13.542 -9.164 1.00 0.00 H new ATOM 0 HA ALA A 17 0.773 -14.639 -8.708 1.00 0.00 H new ATOM 0 HB1 ALA A 17 1.255 -12.338 -7.954 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.426 -12.354 -9.529 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.479 -11.949 -8.051 1.00 0.00 H new ATOM 269 N ALA A 18 -1.340 -14.430 -6.271 1.00 0.00 N ATOM 270 CA ALA A 18 -1.571 -14.745 -4.867 1.00 0.00 C ATOM 271 C ALA A 18 -1.170 -16.177 -4.549 1.00 0.00 C ATOM 272 O ALA A 18 -0.622 -16.444 -3.480 1.00 0.00 O ATOM 273 CB ALA A 18 -3.027 -14.499 -4.501 1.00 0.00 C ATOM 0 H ALA A 18 -2.190 -14.261 -6.809 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.945 -14.085 -4.266 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -3.183 -14.739 -3.449 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.274 -13.452 -4.675 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -3.668 -15.130 -5.116 1.00 0.00 H new ATOM 279 N GLY A 19 -1.421 -17.105 -5.475 1.00 0.00 N ATOM 280 CA GLY A 19 -1.048 -18.489 -5.241 1.00 0.00 C ATOM 281 C GLY A 19 -1.723 -19.086 -4.024 1.00 0.00 C ATOM 282 O GLY A 19 -2.949 -19.081 -3.919 1.00 0.00 O ATOM 0 H GLY A 19 -1.871 -16.924 -6.372 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -1.304 -19.082 -6.119 1.00 0.00 H new ATOM 0 HA3 GLY A 19 0.033 -18.552 -5.118 1.00 0.00 H new ATOM 286 N ASP A 20 -0.918 -19.604 -3.102 1.00 0.00 N ATOM 287 CA ASP A 20 -1.442 -20.209 -1.884 1.00 0.00 C ATOM 288 C ASP A 20 -1.479 -19.199 -0.744 1.00 0.00 C ATOM 289 O ASP A 20 -1.824 -19.544 0.387 1.00 0.00 O ATOM 290 CB ASP A 20 -0.593 -21.413 -1.478 1.00 0.00 C ATOM 291 CG ASP A 20 -1.160 -22.137 -0.271 1.00 0.00 C ATOM 292 OD1 ASP A 20 -2.392 -22.335 -0.222 1.00 0.00 O ATOM 293 OD2 ASP A 20 -0.372 -22.505 0.626 1.00 0.00 O ATOM 0 H ASP A 20 0.099 -19.617 -3.176 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.460 -20.541 -2.088 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.526 -22.106 -2.316 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.421 -21.081 -1.256 1.00 0.00 H new ATOM 298 N LYS A 21 -1.142 -17.946 -1.043 1.00 0.00 N ATOM 299 CA LYS A 21 -1.156 -16.898 -0.042 1.00 0.00 C ATOM 300 C LYS A 21 -2.586 -16.454 0.208 1.00 0.00 C ATOM 301 O LYS A 21 -3.419 -16.487 -0.697 1.00 0.00 O ATOM 302 CB LYS A 21 -0.315 -15.709 -0.508 1.00 0.00 C ATOM 303 CG LYS A 21 1.172 -16.008 -0.582 1.00 0.00 C ATOM 304 CD LYS A 21 1.903 -14.986 -1.436 1.00 0.00 C ATOM 305 CE LYS A 21 3.322 -15.435 -1.742 1.00 0.00 C ATOM 306 NZ LYS A 21 3.425 -16.075 -3.082 1.00 0.00 N ATOM 0 H LYS A 21 -0.857 -17.638 -1.973 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.730 -17.285 0.884 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.663 -15.392 -1.491 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.475 -14.872 0.172 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.594 -16.012 0.423 1.00 0.00 H new ATOM 0 HG3 LYS A 21 1.324 -17.005 -0.996 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.359 -14.832 -2.368 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.926 -14.027 -0.919 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.992 -14.576 -1.697 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.653 -16.138 -0.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 4.408 -16.367 -3.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 2.805 -16.909 -3.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.134 -15.396 -3.814 1.00 0.00 H new ATOM 320 N LEU A 22 -2.868 -16.021 1.424 1.00 0.00 N ATOM 321 CA LEU A 22 -4.204 -15.557 1.757 1.00 0.00 C ATOM 322 C LEU A 22 -4.409 -14.160 1.185 1.00 0.00 C ATOM 323 O LEU A 22 -3.514 -13.318 1.248 1.00 0.00 O ATOM 324 CB LEU A 22 -4.411 -15.568 3.276 1.00 0.00 C ATOM 325 CG LEU A 22 -5.652 -14.826 3.788 1.00 0.00 C ATOM 326 CD1 LEU A 22 -6.868 -15.118 2.916 1.00 0.00 C ATOM 327 CD2 LEU A 22 -5.931 -15.208 5.233 1.00 0.00 C ATOM 0 H LEU A 22 -2.197 -15.981 2.191 1.00 0.00 H new ATOM 0 HA LEU A 22 -4.942 -16.228 1.318 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.469 -16.605 3.608 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.530 -15.131 3.747 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.453 -13.756 3.736 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.732 -14.578 3.304 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.668 -14.797 1.894 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.074 -16.188 2.926 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.814 -14.675 5.586 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.105 -16.282 5.298 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.074 -14.941 5.852 1.00 0.00 H new ATOM 339 N VAL A 23 -5.574 -13.928 0.595 1.00 0.00 N ATOM 340 CA VAL A 23 -5.863 -12.641 -0.015 1.00 0.00 C ATOM 341 C VAL A 23 -7.025 -11.933 0.660 1.00 0.00 C ATOM 342 O VAL A 23 -8.181 -12.335 0.529 1.00 0.00 O ATOM 343 CB VAL A 23 -6.179 -12.786 -1.516 1.00 0.00 C ATOM 344 CG1 VAL A 23 -6.177 -11.426 -2.197 1.00 0.00 C ATOM 345 CG2 VAL A 23 -5.191 -13.727 -2.190 1.00 0.00 C ATOM 0 H VAL A 23 -6.329 -14.611 0.527 1.00 0.00 H new ATOM 0 HA VAL A 23 -4.962 -12.041 0.114 1.00 0.00 H new ATOM 0 HB VAL A 23 -7.175 -13.217 -1.613 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.402 -11.549 -3.256 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -6.932 -10.788 -1.737 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.196 -10.965 -2.086 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.435 -13.813 -3.249 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.181 -13.333 -2.081 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.249 -14.710 -1.723 1.00 0.00 H new ATOM 355 N VAL A 24 -6.712 -10.847 1.350 1.00 0.00 N ATOM 356 CA VAL A 24 -7.730 -10.048 2.003 1.00 0.00 C ATOM 357 C VAL A 24 -7.898 -8.766 1.207 1.00 0.00 C ATOM 358 O VAL A 24 -6.966 -7.973 1.078 1.00 0.00 O ATOM 359 CB VAL A 24 -7.385 -9.734 3.474 1.00 0.00 C ATOM 360 CG1 VAL A 24 -6.074 -8.974 3.582 1.00 0.00 C ATOM 361 CG2 VAL A 24 -8.513 -8.957 4.134 1.00 0.00 C ATOM 0 H VAL A 24 -5.760 -10.501 1.471 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.661 -10.615 2.028 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.265 -10.681 3.999 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -5.858 -8.768 4.630 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -5.269 -9.574 3.157 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -6.152 -8.034 3.036 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -8.251 -8.745 5.171 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -8.670 -8.020 3.600 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.428 -9.549 4.105 1.00 0.00 H new ATOM 371 N VAL A 25 -9.081 -8.590 0.639 1.00 0.00 N ATOM 372 CA VAL A 25 -9.358 -7.429 -0.192 1.00 0.00 C ATOM 373 C VAL A 25 -10.554 -6.634 0.320 1.00 0.00 C ATOM 374 O VAL A 25 -11.298 -7.093 1.188 1.00 0.00 O ATOM 375 CB VAL A 25 -9.584 -7.852 -1.658 1.00 0.00 C ATOM 376 CG1 VAL A 25 -8.256 -8.147 -2.332 1.00 0.00 C ATOM 377 CG2 VAL A 25 -10.478 -9.072 -1.744 1.00 0.00 C ATOM 0 H VAL A 25 -9.864 -9.236 0.738 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.485 -6.779 -0.141 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.075 -7.025 -2.171 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.431 -8.444 -3.366 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.631 -7.254 -2.312 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.751 -8.955 -1.803 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.619 -9.347 -2.789 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.014 -9.901 -1.210 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.445 -8.847 -1.294 1.00 0.00 H new ATOM 387 N ASP A 26 -10.722 -5.430 -0.214 1.00 0.00 N ATOM 388 CA ASP A 26 -11.818 -4.565 0.202 1.00 0.00 C ATOM 389 C ASP A 26 -12.533 -3.928 -0.983 1.00 0.00 C ATOM 390 O ASP A 26 -11.900 -3.421 -1.909 1.00 0.00 O ATOM 391 CB ASP A 26 -11.299 -3.467 1.130 1.00 0.00 C ATOM 392 CG ASP A 26 -12.426 -2.696 1.788 1.00 0.00 C ATOM 393 OD1 ASP A 26 -13.566 -3.206 1.800 1.00 0.00 O ATOM 394 OD2 ASP A 26 -12.170 -1.582 2.291 1.00 0.00 O ATOM 0 H ASP A 26 -10.117 -5.033 -0.932 1.00 0.00 H new ATOM 0 HA ASP A 26 -12.537 -5.192 0.729 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -10.667 -3.912 1.899 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -10.673 -2.779 0.562 1.00 0.00 H new ATOM 399 N PHE A 27 -13.863 -3.930 -0.922 1.00 0.00 N ATOM 400 CA PHE A 27 -14.691 -3.327 -1.966 1.00 0.00 C ATOM 401 C PHE A 27 -15.138 -1.932 -1.523 1.00 0.00 C ATOM 402 O PHE A 27 -15.942 -1.799 -0.598 1.00 0.00 O ATOM 403 CB PHE A 27 -15.910 -4.205 -2.249 1.00 0.00 C ATOM 404 CG PHE A 27 -15.680 -5.182 -3.367 1.00 0.00 C ATOM 405 CD1 PHE A 27 -14.988 -6.362 -3.143 1.00 0.00 C ATOM 406 CD2 PHE A 27 -16.134 -4.909 -4.650 1.00 0.00 C ATOM 407 CE1 PHE A 27 -14.756 -7.253 -4.175 1.00 0.00 C ATOM 408 CE2 PHE A 27 -15.906 -5.798 -5.685 1.00 0.00 C ATOM 409 CZ PHE A 27 -15.216 -6.972 -5.447 1.00 0.00 C ATOM 0 H PHE A 27 -14.394 -4.345 -0.156 1.00 0.00 H new ATOM 0 HA PHE A 27 -14.105 -3.243 -2.881 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -16.175 -4.752 -1.344 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -16.760 -3.569 -2.498 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.626 -6.588 -2.151 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -16.671 -3.992 -4.842 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -14.215 -8.169 -3.986 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -16.267 -5.575 -6.678 1.00 0.00 H new ATOM 0 HZ PHE A 27 -15.037 -7.668 -6.253 1.00 0.00 H new ATOM 419 N SER A 28 -14.602 -0.897 -2.165 1.00 0.00 N ATOM 420 CA SER A 28 -14.938 0.477 -1.805 1.00 0.00 C ATOM 421 C SER A 28 -15.675 1.198 -2.932 1.00 0.00 C ATOM 422 O SER A 28 -16.105 0.583 -3.906 1.00 0.00 O ATOM 423 CB SER A 28 -13.667 1.247 -1.434 1.00 0.00 C ATOM 424 OG SER A 28 -12.793 0.441 -0.661 1.00 0.00 O ATOM 0 H SER A 28 -13.937 -0.983 -2.933 1.00 0.00 H new ATOM 0 HA SER A 28 -15.607 0.438 -0.945 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.159 1.575 -2.341 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.931 2.144 -0.874 1.00 0.00 H new ATOM 0 HG SER A 28 -11.988 0.953 -0.437 1.00 0.00 H new ATOM 430 N ALA A 29 -15.808 2.511 -2.779 1.00 0.00 N ATOM 431 CA ALA A 29 -16.480 3.343 -3.770 1.00 0.00 C ATOM 432 C ALA A 29 -15.932 4.765 -3.742 1.00 0.00 C ATOM 433 O ALA A 29 -15.446 5.227 -2.710 1.00 0.00 O ATOM 434 CB ALA A 29 -17.985 3.344 -3.529 1.00 0.00 C ATOM 0 H ALA A 29 -15.456 3.025 -1.971 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.287 2.924 -4.758 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -18.473 3.969 -4.277 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -18.366 2.325 -3.603 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -18.194 3.738 -2.534 1.00 0.00 H new ATOM 440 N THR A 30 -16.051 5.473 -4.859 1.00 0.00 N ATOM 441 CA THR A 30 -15.599 6.857 -4.927 1.00 0.00 C ATOM 442 C THR A 30 -16.549 7.739 -4.125 1.00 0.00 C ATOM 443 O THR A 30 -16.138 8.694 -3.466 1.00 0.00 O ATOM 444 CB THR A 30 -15.530 7.325 -6.383 1.00 0.00 C ATOM 445 OG1 THR A 30 -14.765 6.422 -7.162 1.00 0.00 O ATOM 446 CG2 THR A 30 -14.917 8.700 -6.544 1.00 0.00 C ATOM 0 H THR A 30 -16.454 5.114 -5.725 1.00 0.00 H new ATOM 0 HA THR A 30 -14.598 6.930 -4.501 1.00 0.00 H new ATOM 0 HB THR A 30 -16.565 7.365 -6.722 1.00 0.00 H new ATOM 0 HG1 THR A 30 -14.733 6.736 -8.090 1.00 0.00 H new ATOM 0 HG21 THR A 30 -14.899 8.969 -7.600 1.00 0.00 H new ATOM 0 HG22 THR A 30 -15.511 9.430 -5.994 1.00 0.00 H new ATOM 0 HG23 THR A 30 -13.899 8.692 -6.154 1.00 0.00 H new ATOM 454 N TRP A 31 -17.832 7.397 -4.207 1.00 0.00 N ATOM 455 CA TRP A 31 -18.889 8.134 -3.521 1.00 0.00 C ATOM 456 C TRP A 31 -19.100 7.635 -2.084 1.00 0.00 C ATOM 457 O TRP A 31 -20.093 7.980 -1.444 1.00 0.00 O ATOM 458 CB TRP A 31 -20.192 7.990 -4.315 1.00 0.00 C ATOM 459 CG TRP A 31 -20.704 6.581 -4.334 1.00 0.00 C ATOM 460 CD1 TRP A 31 -20.371 5.587 -5.215 1.00 0.00 C ATOM 461 CD2 TRP A 31 -21.635 6.007 -3.414 1.00 0.00 C ATOM 462 NE1 TRP A 31 -21.036 4.429 -4.885 1.00 0.00 N ATOM 463 CE2 TRP A 31 -21.818 4.664 -3.788 1.00 0.00 C ATOM 464 CE3 TRP A 31 -22.330 6.497 -2.307 1.00 0.00 C ATOM 465 CZ2 TRP A 31 -22.665 3.807 -3.094 1.00 0.00 C ATOM 466 CZ3 TRP A 31 -23.172 5.646 -1.619 1.00 0.00 C ATOM 467 CH2 TRP A 31 -23.332 4.314 -2.015 1.00 0.00 C ATOM 0 H TRP A 31 -18.168 6.602 -4.750 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.590 9.181 -3.462 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -20.951 8.642 -3.882 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -20.028 8.327 -5.339 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -19.688 5.696 -6.045 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -20.958 3.540 -5.378 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -22.211 7.524 -1.994 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -22.791 2.778 -3.397 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -23.716 6.015 -0.762 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -23.997 3.673 -1.456 1.00 0.00 H new ATOM 478 N CYS A 32 -18.170 6.821 -1.578 1.00 0.00 N ATOM 479 CA CYS A 32 -18.277 6.293 -0.219 1.00 0.00 C ATOM 480 C CYS A 32 -17.518 7.156 0.784 1.00 0.00 C ATOM 481 O CYS A 32 -16.617 7.911 0.417 1.00 0.00 O ATOM 482 CB CYS A 32 -17.757 4.853 -0.152 1.00 0.00 C ATOM 483 SG CYS A 32 -18.309 3.932 1.324 1.00 0.00 S ATOM 0 H CYS A 32 -17.340 6.516 -2.087 1.00 0.00 H new ATOM 0 HA CYS A 32 -19.334 6.308 0.046 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -18.083 4.318 -1.044 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -16.667 4.870 -0.171 1.00 0.00 H new ATOM 488 N GLY A 33 -17.881 7.020 2.057 1.00 0.00 N ATOM 489 CA GLY A 33 -17.223 7.774 3.110 1.00 0.00 C ATOM 490 C GLY A 33 -16.446 6.875 4.054 1.00 0.00 C ATOM 491 O GLY A 33 -15.219 6.957 4.122 1.00 0.00 O ATOM 0 H GLY A 33 -18.623 6.398 2.379 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.546 8.503 2.665 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.968 8.334 3.675 1.00 0.00 H new ATOM 495 N PRO A 34 -17.137 5.994 4.800 1.00 0.00 N ATOM 496 CA PRO A 34 -16.489 5.070 5.741 1.00 0.00 C ATOM 497 C PRO A 34 -15.528 4.118 5.038 1.00 0.00 C ATOM 498 O PRO A 34 -14.598 3.593 5.651 1.00 0.00 O ATOM 499 CB PRO A 34 -17.660 4.286 6.349 1.00 0.00 C ATOM 500 CG PRO A 34 -18.868 5.116 6.081 1.00 0.00 C ATOM 501 CD PRO A 34 -18.599 5.826 4.786 1.00 0.00 C ATOM 0 HA PRO A 34 -15.888 5.600 6.480 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -17.751 3.300 5.894 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -17.518 4.132 7.419 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -19.761 4.495 6.008 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -19.040 5.828 6.888 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -18.930 5.241 3.928 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -19.115 6.785 4.736 1.00 0.00 H new ATOM 509 N CYS A 35 -15.762 3.896 3.748 1.00 0.00 N ATOM 510 CA CYS A 35 -14.923 3.005 2.956 1.00 0.00 C ATOM 511 C CYS A 35 -13.469 3.471 2.954 1.00 0.00 C ATOM 512 O CYS A 35 -12.549 2.666 3.094 1.00 0.00 O ATOM 513 CB CYS A 35 -15.440 2.932 1.516 1.00 0.00 C ATOM 514 SG CYS A 35 -17.133 2.275 1.356 1.00 0.00 S ATOM 0 H CYS A 35 -16.529 4.323 3.228 1.00 0.00 H new ATOM 0 HA CYS A 35 -14.968 2.015 3.410 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -15.408 3.931 1.080 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -14.764 2.308 0.931 1.00 0.00 H new ATOM 519 N LYS A 36 -13.270 4.773 2.786 1.00 0.00 N ATOM 520 CA LYS A 36 -11.927 5.340 2.754 1.00 0.00 C ATOM 521 C LYS A 36 -11.230 5.213 4.109 1.00 0.00 C ATOM 522 O LYS A 36 -10.002 5.163 4.179 1.00 0.00 O ATOM 523 CB LYS A 36 -11.981 6.810 2.326 1.00 0.00 C ATOM 524 CG LYS A 36 -11.851 7.006 0.821 1.00 0.00 C ATOM 525 CD LYS A 36 -13.129 7.562 0.210 1.00 0.00 C ATOM 526 CE LYS A 36 -13.406 8.979 0.688 1.00 0.00 C ATOM 527 NZ LYS A 36 -12.463 9.963 0.088 1.00 0.00 N ATOM 0 H LYS A 36 -14.020 5.455 2.670 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.347 4.775 2.025 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.923 7.244 2.662 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.182 7.356 2.827 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.024 7.685 0.613 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.608 6.053 0.350 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -13.047 7.553 -0.877 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.969 6.918 0.472 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.429 9.255 0.432 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -13.328 9.017 1.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -12.748 10.926 0.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -11.500 9.777 0.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -12.482 9.874 -0.948 1.00 0.00 H new ATOM 541 N MET A 37 -12.013 5.176 5.184 1.00 0.00 N ATOM 542 CA MET A 37 -11.456 5.076 6.532 1.00 0.00 C ATOM 543 C MET A 37 -10.787 3.722 6.783 1.00 0.00 C ATOM 544 O MET A 37 -10.000 3.585 7.718 1.00 0.00 O ATOM 545 CB MET A 37 -12.549 5.314 7.577 1.00 0.00 C ATOM 546 CG MET A 37 -12.956 6.773 7.710 1.00 0.00 C ATOM 547 SD MET A 37 -14.488 6.983 8.636 1.00 0.00 S ATOM 548 CE MET A 37 -14.833 8.715 8.334 1.00 0.00 C ATOM 0 H MET A 37 -13.032 5.214 5.149 1.00 0.00 H new ATOM 0 HA MET A 37 -10.689 5.846 6.620 1.00 0.00 H new ATOM 0 HB2 MET A 37 -13.426 4.723 7.314 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.200 4.953 8.544 1.00 0.00 H new ATOM 0 HG2 MET A 37 -12.158 7.325 8.205 1.00 0.00 H new ATOM 0 HG3 MET A 37 -13.074 7.206 6.716 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.754 8.997 8.844 1.00 0.00 H new ATOM 0 HE2 MET A 37 -14.009 9.321 8.711 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.945 8.882 7.263 1.00 0.00 H new ATOM 558 N ILE A 38 -11.085 2.727 5.948 1.00 0.00 N ATOM 559 CA ILE A 38 -10.487 1.401 6.108 1.00 0.00 C ATOM 560 C ILE A 38 -9.137 1.320 5.398 1.00 0.00 C ATOM 561 O ILE A 38 -8.301 0.478 5.724 1.00 0.00 O ATOM 562 CB ILE A 38 -11.400 0.294 5.542 1.00 0.00 C ATOM 563 CG1 ILE A 38 -12.830 0.444 6.073 1.00 0.00 C ATOM 564 CG2 ILE A 38 -10.837 -1.081 5.879 1.00 0.00 C ATOM 565 CD1 ILE A 38 -12.992 0.042 7.524 1.00 0.00 C ATOM 0 H ILE A 38 -11.730 2.811 5.162 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.354 1.247 7.179 1.00 0.00 H new ATOM 0 HB ILE A 38 -11.433 0.395 4.457 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -13.143 1.482 5.957 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -13.499 -0.161 5.462 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.492 -1.852 5.473 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.843 -1.184 5.444 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.773 -1.193 6.961 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -14.031 0.177 7.825 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -12.712 -1.004 7.645 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.350 0.664 8.148 1.00 0.00 H new ATOM 577 N LYS A 39 -8.940 2.200 4.422 1.00 0.00 N ATOM 578 CA LYS A 39 -7.705 2.240 3.649 1.00 0.00 C ATOM 579 C LYS A 39 -6.465 2.288 4.544 1.00 0.00 C ATOM 580 O LYS A 39 -5.600 1.415 4.459 1.00 0.00 O ATOM 581 CB LYS A 39 -7.718 3.441 2.703 1.00 0.00 C ATOM 582 CG LYS A 39 -7.539 3.065 1.243 1.00 0.00 C ATOM 583 CD LYS A 39 -8.294 4.015 0.329 1.00 0.00 C ATOM 584 CE LYS A 39 -8.805 3.306 -0.914 1.00 0.00 C ATOM 585 NZ LYS A 39 -9.024 4.254 -2.041 1.00 0.00 N ATOM 0 H LYS A 39 -9.627 2.901 4.146 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.652 1.318 3.069 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.661 3.975 2.819 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.924 4.130 2.992 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.479 3.079 0.989 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.891 2.046 1.082 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -9.133 4.452 0.870 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.640 4.837 0.037 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.089 2.541 -1.216 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.739 2.795 -0.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.372 3.732 -2.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.726 4.969 -1.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.127 4.724 -2.279 1.00 0.00 H new ATOM 599 N PRO A 40 -6.349 3.312 5.410 1.00 0.00 N ATOM 600 CA PRO A 40 -5.198 3.461 6.305 1.00 0.00 C ATOM 601 C PRO A 40 -4.857 2.170 7.044 1.00 0.00 C ATOM 602 O PRO A 40 -3.690 1.785 7.129 1.00 0.00 O ATOM 603 CB PRO A 40 -5.634 4.554 7.297 1.00 0.00 C ATOM 604 CG PRO A 40 -7.083 4.798 7.022 1.00 0.00 C ATOM 605 CD PRO A 40 -7.309 4.407 5.591 1.00 0.00 C ATOM 0 HA PRO A 40 -4.294 3.715 5.751 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -5.480 4.232 8.327 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.051 5.464 7.157 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.711 4.209 7.690 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.339 5.845 7.185 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -8.334 4.082 5.416 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -7.116 5.234 4.908 1.00 0.00 H new ATOM 613 N PHE A 41 -5.874 1.517 7.601 1.00 0.00 N ATOM 614 CA PHE A 41 -5.668 0.288 8.366 1.00 0.00 C ATOM 615 C PHE A 41 -5.475 -0.927 7.464 1.00 0.00 C ATOM 616 O PHE A 41 -4.721 -1.839 7.805 1.00 0.00 O ATOM 617 CB PHE A 41 -6.861 0.043 9.290 1.00 0.00 C ATOM 618 CG PHE A 41 -7.325 1.272 10.015 1.00 0.00 C ATOM 619 CD1 PHE A 41 -6.456 1.980 10.827 1.00 0.00 C ATOM 620 CD2 PHE A 41 -8.628 1.722 9.880 1.00 0.00 C ATOM 621 CE1 PHE A 41 -6.877 3.115 11.491 1.00 0.00 C ATOM 622 CE2 PHE A 41 -9.056 2.856 10.544 1.00 0.00 C ATOM 623 CZ PHE A 41 -8.179 3.553 11.349 1.00 0.00 C ATOM 0 H PHE A 41 -6.847 1.817 7.538 1.00 0.00 H new ATOM 0 HA PHE A 41 -4.758 0.421 8.950 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -7.688 -0.356 8.703 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -6.592 -0.720 10.021 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -5.437 1.641 10.943 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -9.317 1.181 9.249 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.189 3.660 12.121 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -10.075 3.196 10.433 1.00 0.00 H new ATOM 0 HZ PHE A 41 -8.510 4.440 11.868 1.00 0.00 H new ATOM 633 N PHE A 42 -6.144 -0.946 6.318 1.00 0.00 N ATOM 634 CA PHE A 42 -6.013 -2.066 5.394 1.00 0.00 C ATOM 635 C PHE A 42 -4.600 -2.125 4.828 1.00 0.00 C ATOM 636 O PHE A 42 -3.987 -3.191 4.767 1.00 0.00 O ATOM 637 CB PHE A 42 -7.032 -1.942 4.259 1.00 0.00 C ATOM 638 CG PHE A 42 -7.485 -3.263 3.699 1.00 0.00 C ATOM 639 CD1 PHE A 42 -8.367 -4.066 4.407 1.00 0.00 C ATOM 640 CD2 PHE A 42 -7.039 -3.697 2.459 1.00 0.00 C ATOM 641 CE1 PHE A 42 -8.796 -5.274 3.890 1.00 0.00 C ATOM 642 CE2 PHE A 42 -7.463 -4.906 1.939 1.00 0.00 C ATOM 643 CZ PHE A 42 -8.344 -5.695 2.654 1.00 0.00 C ATOM 0 H PHE A 42 -6.776 -0.208 6.008 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.209 -2.989 5.940 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.902 -1.395 4.623 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.596 -1.348 3.456 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.723 -3.743 5.374 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -6.353 -3.084 1.894 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.484 -5.888 4.452 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -7.106 -5.234 0.974 1.00 0.00 H new ATOM 0 HZ PHE A 42 -8.678 -6.638 2.248 1.00 0.00 H new ATOM 653 N HIS A 43 -4.090 -0.970 4.411 1.00 0.00 N ATOM 654 CA HIS A 43 -2.750 -0.885 3.842 1.00 0.00 C ATOM 655 C HIS A 43 -1.675 -1.187 4.884 1.00 0.00 C ATOM 656 O HIS A 43 -0.689 -1.862 4.585 1.00 0.00 O ATOM 657 CB HIS A 43 -2.516 0.499 3.233 1.00 0.00 C ATOM 658 CG HIS A 43 -1.994 0.447 1.830 1.00 0.00 C ATOM 659 ND1 HIS A 43 -2.774 0.641 0.712 1.00 0.00 N ATOM 660 CD2 HIS A 43 -0.737 0.213 1.373 1.00 0.00 C ATOM 661 CE1 HIS A 43 -1.986 0.522 -0.365 1.00 0.00 C ATOM 662 NE2 HIS A 43 -0.740 0.263 -0.017 1.00 0.00 N ATOM 0 H HIS A 43 -4.585 -0.080 4.457 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.678 -1.639 3.058 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.452 1.057 3.245 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -1.810 1.048 3.856 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.128 0.019 1.991 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -2.326 0.625 -1.385 1.00 0.00 H new ATOM 0 HE2 HIS A 43 0.057 0.127 -0.639 1.00 0.00 H new ATOM 670 N SER A 44 -1.855 -0.684 6.104 1.00 0.00 N ATOM 671 CA SER A 44 -0.880 -0.909 7.168 1.00 0.00 C ATOM 672 C SER A 44 -0.716 -2.398 7.449 1.00 0.00 C ATOM 673 O SER A 44 0.402 -2.893 7.605 1.00 0.00 O ATOM 674 CB SER A 44 -1.301 -0.173 8.443 1.00 0.00 C ATOM 675 OG SER A 44 -0.339 0.800 8.812 1.00 0.00 O ATOM 0 H SER A 44 -2.661 -0.122 6.378 1.00 0.00 H new ATOM 0 HA SER A 44 0.081 -0.515 6.836 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.267 0.307 8.287 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.428 -0.889 9.255 1.00 0.00 H new ATOM 0 HG SER A 44 -0.632 1.257 9.628 1.00 0.00 H new ATOM 681 N LEU A 45 -1.832 -3.114 7.510 1.00 0.00 N ATOM 682 CA LEU A 45 -1.796 -4.547 7.769 1.00 0.00 C ATOM 683 C LEU A 45 -0.987 -5.249 6.683 1.00 0.00 C ATOM 684 O LEU A 45 -0.220 -6.169 6.961 1.00 0.00 O ATOM 685 CB LEU A 45 -3.219 -5.113 7.819 1.00 0.00 C ATOM 686 CG LEU A 45 -4.053 -4.662 9.021 1.00 0.00 C ATOM 687 CD1 LEU A 45 -5.539 -4.775 8.713 1.00 0.00 C ATOM 688 CD2 LEU A 45 -3.701 -5.481 10.254 1.00 0.00 C ATOM 0 H LEU A 45 -2.768 -2.728 7.384 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.320 -4.721 8.734 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.740 -4.826 6.906 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.161 -6.201 7.824 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.822 -3.616 9.225 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.116 -4.450 9.579 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.782 -4.145 7.858 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.785 -5.811 8.481 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.304 -5.146 11.098 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.902 -6.535 10.060 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.645 -5.350 10.488 1.00 0.00 H new ATOM 700 N SER A 46 -1.158 -4.794 5.446 1.00 0.00 N ATOM 701 CA SER A 46 -0.441 -5.356 4.310 1.00 0.00 C ATOM 702 C SER A 46 1.070 -5.299 4.515 1.00 0.00 C ATOM 703 O SER A 46 1.803 -6.140 3.995 1.00 0.00 O ATOM 704 CB SER A 46 -0.808 -4.606 3.029 1.00 0.00 C ATOM 705 OG SER A 46 -0.238 -5.232 1.891 1.00 0.00 O ATOM 0 H SER A 46 -1.792 -4.032 5.205 1.00 0.00 H new ATOM 0 HA SER A 46 -0.736 -6.402 4.222 1.00 0.00 H new ATOM 0 HB2 SER A 46 -1.892 -4.569 2.923 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.459 -3.575 3.094 1.00 0.00 H new ATOM 0 HG SER A 46 0.472 -4.664 1.526 1.00 0.00 H new ATOM 711 N GLU A 47 1.539 -4.304 5.265 1.00 0.00 N ATOM 712 CA GLU A 47 2.969 -4.154 5.511 1.00 0.00 C ATOM 713 C GLU A 47 3.420 -4.980 6.713 1.00 0.00 C ATOM 714 O GLU A 47 4.607 -5.265 6.866 1.00 0.00 O ATOM 715 CB GLU A 47 3.325 -2.681 5.717 1.00 0.00 C ATOM 716 CG GLU A 47 3.044 -1.816 4.499 1.00 0.00 C ATOM 717 CD GLU A 47 4.200 -1.796 3.519 1.00 0.00 C ATOM 718 OE1 GLU A 47 4.498 -2.858 2.930 1.00 0.00 O ATOM 719 OE2 GLU A 47 4.809 -0.721 3.339 1.00 0.00 O ATOM 0 H GLU A 47 0.954 -3.596 5.709 1.00 0.00 H new ATOM 0 HA GLU A 47 3.496 -4.526 4.633 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.762 -2.294 6.566 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.382 -2.603 5.973 1.00 0.00 H new ATOM 0 HG2 GLU A 47 2.151 -2.185 3.994 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.829 -0.798 4.823 1.00 0.00 H new ATOM 726 N LYS A 48 2.470 -5.381 7.553 1.00 0.00 N ATOM 727 CA LYS A 48 2.793 -6.193 8.722 1.00 0.00 C ATOM 728 C LYS A 48 2.602 -7.673 8.399 1.00 0.00 C ATOM 729 O LYS A 48 3.160 -8.542 9.065 1.00 0.00 O ATOM 730 CB LYS A 48 1.914 -5.798 9.913 1.00 0.00 C ATOM 731 CG LYS A 48 2.226 -6.573 11.185 1.00 0.00 C ATOM 732 CD LYS A 48 1.149 -6.370 12.241 1.00 0.00 C ATOM 733 CE LYS A 48 0.830 -7.665 12.971 1.00 0.00 C ATOM 734 NZ LYS A 48 1.792 -7.934 14.074 1.00 0.00 N ATOM 0 H LYS A 48 1.480 -5.160 7.448 1.00 0.00 H new ATOM 0 HA LYS A 48 3.835 -6.017 8.988 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.038 -4.733 10.107 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.868 -5.955 9.649 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.314 -7.634 10.953 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.190 -6.252 11.580 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.479 -5.619 12.959 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.245 -5.985 11.770 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -0.181 -7.614 13.376 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.848 -8.494 12.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.539 -8.826 14.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 2.754 -8.009 13.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.757 -7.156 14.763 1.00 0.00 H new ATOM 748 N TYR A 49 1.817 -7.943 7.358 1.00 0.00 N ATOM 749 CA TYR A 49 1.553 -9.311 6.923 1.00 0.00 C ATOM 750 C TYR A 49 2.425 -9.667 5.724 1.00 0.00 C ATOM 751 O TYR A 49 2.029 -9.457 4.579 1.00 0.00 O ATOM 752 CB TYR A 49 0.082 -9.470 6.535 1.00 0.00 C ATOM 753 CG TYR A 49 -0.830 -9.798 7.695 1.00 0.00 C ATOM 754 CD1 TYR A 49 -1.340 -8.794 8.506 1.00 0.00 C ATOM 755 CD2 TYR A 49 -1.182 -11.113 7.978 1.00 0.00 C ATOM 756 CE1 TYR A 49 -2.175 -9.089 9.566 1.00 0.00 C ATOM 757 CE2 TYR A 49 -2.017 -11.416 9.036 1.00 0.00 C ATOM 758 CZ TYR A 49 -2.511 -10.400 9.827 1.00 0.00 C ATOM 759 OH TYR A 49 -3.345 -10.696 10.880 1.00 0.00 O ATOM 0 H TYR A 49 1.351 -7.228 6.799 1.00 0.00 H new ATOM 0 HA TYR A 49 1.786 -9.980 7.751 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.261 -8.547 6.067 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -0.002 -10.258 5.786 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -1.080 -7.765 8.305 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.796 -11.911 7.361 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -2.563 -8.296 10.188 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.281 -12.443 9.242 1.00 0.00 H new ATOM 0 HH TYR A 49 -3.483 -11.665 10.926 1.00 0.00 H new ATOM 769 N SER A 50 3.607 -10.215 5.983 1.00 0.00 N ATOM 770 CA SER A 50 4.514 -10.600 4.906 1.00 0.00 C ATOM 771 C SER A 50 4.201 -12.015 4.425 1.00 0.00 C ATOM 772 O SER A 50 5.086 -12.865 4.333 1.00 0.00 O ATOM 773 CB SER A 50 5.969 -10.506 5.372 1.00 0.00 C ATOM 774 OG SER A 50 6.383 -9.154 5.474 1.00 0.00 O ATOM 0 H SER A 50 3.959 -10.402 6.922 1.00 0.00 H new ATOM 0 HA SER A 50 4.372 -9.911 4.073 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.077 -10.997 6.339 1.00 0.00 H new ATOM 0 HB3 SER A 50 6.614 -11.036 4.671 1.00 0.00 H new ATOM 0 HG SER A 50 7.315 -9.119 5.775 1.00 0.00 H new ATOM 780 N ASN A 51 2.928 -12.254 4.116 1.00 0.00 N ATOM 781 CA ASN A 51 2.482 -13.556 3.637 1.00 0.00 C ATOM 782 C ASN A 51 1.215 -13.429 2.793 1.00 0.00 C ATOM 783 O ASN A 51 1.068 -14.093 1.767 1.00 0.00 O ATOM 784 CB ASN A 51 2.226 -14.494 4.817 1.00 0.00 C ATOM 785 CG ASN A 51 2.041 -15.933 4.380 1.00 0.00 C ATOM 786 OD1 ASN A 51 1.508 -16.203 3.303 1.00 0.00 O ATOM 787 ND2 ASN A 51 2.482 -16.867 5.215 1.00 0.00 N ATOM 0 H ASN A 51 2.186 -11.558 4.190 1.00 0.00 H new ATOM 0 HA ASN A 51 3.272 -13.971 3.011 1.00 0.00 H new ATOM 0 HB2 ASN A 51 3.062 -14.433 5.514 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.338 -14.163 5.355 1.00 0.00 H new ATOM 0 HD21 ASN A 51 2.385 -17.853 4.974 1.00 0.00 H new ATOM 0 HD22 ASN A 51 2.917 -16.598 6.097 1.00 0.00 H new ATOM 794 N VAL A 52 0.293 -12.581 3.248 1.00 0.00 N ATOM 795 CA VAL A 52 -0.977 -12.373 2.560 1.00 0.00 C ATOM 796 C VAL A 52 -0.916 -11.200 1.592 1.00 0.00 C ATOM 797 O VAL A 52 -0.113 -10.282 1.760 1.00 0.00 O ATOM 798 CB VAL A 52 -2.114 -12.119 3.572 1.00 0.00 C ATOM 799 CG1 VAL A 52 -2.139 -13.210 4.626 1.00 0.00 C ATOM 800 CG2 VAL A 52 -1.965 -10.752 4.226 1.00 0.00 C ATOM 0 H VAL A 52 0.405 -12.025 4.096 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.176 -13.284 1.996 1.00 0.00 H new ATOM 0 HB VAL A 52 -3.060 -12.135 3.030 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -2.947 -13.016 5.332 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -2.301 -14.175 4.147 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.188 -13.224 5.158 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.778 -10.597 4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.011 -10.702 4.751 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -1.998 -9.977 3.460 1.00 0.00 H new ATOM 810 N ILE A 53 -1.770 -11.238 0.574 1.00 0.00 N ATOM 811 CA ILE A 53 -1.811 -10.180 -0.422 1.00 0.00 C ATOM 812 C ILE A 53 -3.006 -9.258 -0.209 1.00 0.00 C ATOM 813 O ILE A 53 -4.159 -9.665 -0.347 1.00 0.00 O ATOM 814 CB ILE A 53 -1.822 -10.758 -1.862 1.00 0.00 C ATOM 815 CG1 ILE A 53 -1.259 -9.733 -2.843 1.00 0.00 C ATOM 816 CG2 ILE A 53 -3.217 -11.198 -2.295 1.00 0.00 C ATOM 817 CD1 ILE A 53 0.253 -9.696 -2.864 1.00 0.00 C ATOM 0 H ILE A 53 -2.441 -11.990 0.420 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.903 -9.590 -0.299 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.189 -11.646 -1.864 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.624 -9.960 -3.845 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.637 -8.744 -2.582 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.175 -11.595 -3.309 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.582 -11.970 -1.618 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.893 -10.343 -2.268 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.589 -8.947 -3.581 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.625 -9.440 -1.872 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.637 -10.674 -3.154 1.00 0.00 H new ATOM 829 N PHE A 54 -2.712 -8.007 0.127 1.00 0.00 N ATOM 830 CA PHE A 54 -3.742 -7.005 0.356 1.00 0.00 C ATOM 831 C PHE A 54 -3.918 -6.171 -0.906 1.00 0.00 C ATOM 832 O PHE A 54 -3.004 -5.445 -1.295 1.00 0.00 O ATOM 833 CB PHE A 54 -3.315 -6.055 1.483 1.00 0.00 C ATOM 834 CG PHE A 54 -3.688 -6.464 2.887 1.00 0.00 C ATOM 835 CD1 PHE A 54 -3.191 -7.622 3.476 1.00 0.00 C ATOM 836 CD2 PHE A 54 -4.525 -5.648 3.631 1.00 0.00 C ATOM 837 CE1 PHE A 54 -3.533 -7.948 4.780 1.00 0.00 C ATOM 838 CE2 PHE A 54 -4.870 -5.974 4.927 1.00 0.00 C ATOM 839 CZ PHE A 54 -4.373 -7.123 5.503 1.00 0.00 C ATOM 0 H PHE A 54 -1.760 -7.662 0.247 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.668 -7.514 0.624 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -2.232 -5.938 1.438 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.750 -5.075 1.286 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.535 -8.271 2.915 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.914 -4.742 3.190 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.142 -8.848 5.231 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.529 -5.329 5.489 1.00 0.00 H new ATOM 0 HZ PHE A 54 -4.640 -7.378 6.518 1.00 0.00 H new ATOM 849 N LEU A 55 -5.086 -6.236 -1.535 1.00 0.00 N ATOM 850 CA LEU A 55 -5.314 -5.441 -2.728 1.00 0.00 C ATOM 851 C LEU A 55 -6.597 -4.645 -2.616 1.00 0.00 C ATOM 852 O LEU A 55 -7.385 -4.833 -1.688 1.00 0.00 O ATOM 853 CB LEU A 55 -5.272 -6.294 -4.001 1.00 0.00 C ATOM 854 CG LEU A 55 -6.609 -6.675 -4.646 1.00 0.00 C ATOM 855 CD1 LEU A 55 -6.858 -5.819 -5.877 1.00 0.00 C ATOM 856 CD2 LEU A 55 -6.603 -8.148 -5.027 1.00 0.00 C ATOM 0 H LEU A 55 -5.872 -6.818 -1.245 1.00 0.00 H new ATOM 0 HA LEU A 55 -4.495 -4.726 -2.809 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.681 -5.759 -4.744 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.736 -7.215 -3.771 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.410 -6.499 -3.927 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.811 -6.098 -6.328 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.886 -4.768 -5.590 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.056 -5.976 -6.598 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.557 -8.409 -5.485 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.797 -8.337 -5.736 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.451 -8.754 -4.134 1.00 0.00 H new ATOM 868 N GLU A 56 -6.770 -3.708 -3.530 1.00 0.00 N ATOM 869 CA GLU A 56 -7.918 -2.827 -3.497 1.00 0.00 C ATOM 870 C GLU A 56 -8.783 -2.932 -4.741 1.00 0.00 C ATOM 871 O GLU A 56 -8.331 -2.656 -5.851 1.00 0.00 O ATOM 872 CB GLU A 56 -7.405 -1.404 -3.377 1.00 0.00 C ATOM 873 CG GLU A 56 -8.210 -0.524 -2.436 1.00 0.00 C ATOM 874 CD GLU A 56 -7.986 -0.872 -0.977 1.00 0.00 C ATOM 875 OE1 GLU A 56 -8.518 -1.908 -0.526 1.00 0.00 O ATOM 876 OE2 GLU A 56 -7.278 -0.109 -0.286 1.00 0.00 O ATOM 0 H GLU A 56 -6.128 -3.539 -4.304 1.00 0.00 H new ATOM 0 HA GLU A 56 -8.541 -3.116 -2.651 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.371 -1.431 -3.034 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.400 -0.948 -4.367 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.942 0.519 -2.602 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.270 -0.622 -2.670 1.00 0.00 H new ATOM 883 N VAL A 57 -10.042 -3.295 -4.547 1.00 0.00 N ATOM 884 CA VAL A 57 -10.971 -3.389 -5.659 1.00 0.00 C ATOM 885 C VAL A 57 -12.077 -2.360 -5.513 1.00 0.00 C ATOM 886 O VAL A 57 -12.842 -2.382 -4.555 1.00 0.00 O ATOM 887 CB VAL A 57 -11.606 -4.785 -5.791 1.00 0.00 C ATOM 888 CG1 VAL A 57 -12.083 -4.990 -7.216 1.00 0.00 C ATOM 889 CG2 VAL A 57 -10.629 -5.882 -5.390 1.00 0.00 C ATOM 0 H VAL A 57 -10.440 -3.527 -3.637 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.389 -3.198 -6.560 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.457 -4.844 -5.112 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.533 -5.978 -7.310 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.823 -4.229 -7.465 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.237 -4.910 -7.898 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -11.110 -6.854 -5.495 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.751 -5.840 -6.034 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.326 -5.738 -4.353 1.00 0.00 H new ATOM 899 N ASP A 58 -12.154 -1.456 -6.473 1.00 0.00 N ATOM 900 CA ASP A 58 -13.168 -0.420 -6.461 1.00 0.00 C ATOM 901 C ASP A 58 -14.320 -0.845 -7.359 1.00 0.00 C ATOM 902 O ASP A 58 -14.130 -1.093 -8.549 1.00 0.00 O ATOM 903 CB ASP A 58 -12.569 0.905 -6.931 1.00 0.00 C ATOM 904 CG ASP A 58 -13.575 2.039 -6.908 1.00 0.00 C ATOM 905 OD1 ASP A 58 -14.316 2.155 -5.909 1.00 0.00 O ATOM 906 OD2 ASP A 58 -13.620 2.813 -7.887 1.00 0.00 O ATOM 0 H ASP A 58 -11.523 -1.420 -7.274 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.542 -0.278 -5.447 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.722 1.163 -6.295 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -12.183 0.787 -7.944 1.00 0.00 H new ATOM 911 N VAL A 59 -15.506 -0.969 -6.776 1.00 0.00 N ATOM 912 CA VAL A 59 -16.675 -1.407 -7.526 1.00 0.00 C ATOM 913 C VAL A 59 -16.999 -0.466 -8.681 1.00 0.00 C ATOM 914 O VAL A 59 -17.707 -0.845 -9.614 1.00 0.00 O ATOM 915 CB VAL A 59 -17.911 -1.543 -6.616 1.00 0.00 C ATOM 916 CG1 VAL A 59 -18.319 -0.188 -6.058 1.00 0.00 C ATOM 917 CG2 VAL A 59 -19.064 -2.185 -7.374 1.00 0.00 C ATOM 0 H VAL A 59 -15.683 -0.773 -5.791 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.425 -2.385 -7.936 1.00 0.00 H new ATOM 0 HB VAL A 59 -17.651 -2.190 -5.778 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -19.194 -0.306 -5.418 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.497 0.228 -5.476 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.559 0.487 -6.880 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -19.928 -2.273 -6.716 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -19.324 -1.566 -8.233 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.767 -3.176 -7.717 1.00 0.00 H new ATOM 927 N ASP A 60 -16.476 0.754 -8.629 1.00 0.00 N ATOM 928 CA ASP A 60 -16.716 1.713 -9.696 1.00 0.00 C ATOM 929 C ASP A 60 -16.066 1.224 -10.986 1.00 0.00 C ATOM 930 O ASP A 60 -16.624 1.372 -12.074 1.00 0.00 O ATOM 931 CB ASP A 60 -16.179 3.095 -9.315 1.00 0.00 C ATOM 932 CG ASP A 60 -17.000 4.218 -9.918 1.00 0.00 C ATOM 933 OD1 ASP A 60 -18.244 4.167 -9.816 1.00 0.00 O ATOM 934 OD2 ASP A 60 -16.399 5.150 -10.495 1.00 0.00 O ATOM 0 H ASP A 60 -15.890 1.098 -7.868 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.791 1.801 -9.852 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -16.174 3.194 -8.230 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -15.145 3.185 -9.648 1.00 0.00 H new ATOM 939 N ASP A 61 -14.887 0.624 -10.847 1.00 0.00 N ATOM 940 CA ASP A 61 -14.154 0.085 -11.987 1.00 0.00 C ATOM 941 C ASP A 61 -14.370 -1.423 -12.090 1.00 0.00 C ATOM 942 O ASP A 61 -14.429 -1.984 -13.183 1.00 0.00 O ATOM 943 CB ASP A 61 -12.660 0.386 -11.856 1.00 0.00 C ATOM 944 CG ASP A 61 -12.330 1.833 -12.168 1.00 0.00 C ATOM 945 OD1 ASP A 61 -12.268 2.183 -13.365 1.00 0.00 O ATOM 946 OD2 ASP A 61 -12.133 2.616 -11.215 1.00 0.00 O ATOM 0 H ASP A 61 -14.417 0.499 -9.950 1.00 0.00 H new ATOM 0 HA ASP A 61 -14.530 0.562 -12.892 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.333 0.152 -10.843 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.101 -0.264 -12.529 1.00 0.00 H new ATOM 951 N ALA A 62 -14.478 -2.065 -10.931 1.00 0.00 N ATOM 952 CA ALA A 62 -14.684 -3.505 -10.861 1.00 0.00 C ATOM 953 C ALA A 62 -16.169 -3.838 -10.745 1.00 0.00 C ATOM 954 O ALA A 62 -16.575 -4.659 -9.917 1.00 0.00 O ATOM 955 CB ALA A 62 -13.908 -4.079 -9.684 1.00 0.00 C ATOM 0 H ALA A 62 -14.426 -1.605 -10.022 1.00 0.00 H new ATOM 0 HA ALA A 62 -14.314 -3.957 -11.781 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -14.065 -5.157 -9.635 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -12.846 -3.873 -9.813 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -14.257 -3.619 -8.759 1.00 0.00 H new ATOM 961 N GLN A 63 -16.977 -3.189 -11.578 1.00 0.00 N ATOM 962 CA GLN A 63 -18.421 -3.401 -11.573 1.00 0.00 C ATOM 963 C GLN A 63 -18.790 -4.761 -12.162 1.00 0.00 C ATOM 964 O GLN A 63 -19.936 -5.198 -12.055 1.00 0.00 O ATOM 965 CB GLN A 63 -19.120 -2.291 -12.362 1.00 0.00 C ATOM 966 CG GLN A 63 -18.640 -2.171 -13.799 1.00 0.00 C ATOM 967 CD GLN A 63 -19.451 -1.177 -14.609 1.00 0.00 C ATOM 968 OE1 GLN A 63 -18.926 -0.170 -15.085 1.00 0.00 O ATOM 969 NE2 GLN A 63 -20.740 -1.456 -14.771 1.00 0.00 N ATOM 0 H GLN A 63 -16.655 -2.510 -12.267 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.755 -3.378 -10.536 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -20.194 -2.477 -12.361 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -18.961 -1.340 -11.854 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -17.593 -1.868 -13.803 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -18.691 -3.149 -14.277 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -21.134 -2.302 -14.359 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -21.335 -0.824 -15.307 1.00 0.00 H new ATOM 978 N ASP A 64 -17.822 -5.429 -12.785 1.00 0.00 N ATOM 979 CA ASP A 64 -18.068 -6.734 -13.387 1.00 0.00 C ATOM 980 C ASP A 64 -17.744 -7.860 -12.412 1.00 0.00 C ATOM 981 O ASP A 64 -18.264 -8.968 -12.542 1.00 0.00 O ATOM 982 CB ASP A 64 -17.244 -6.897 -14.666 1.00 0.00 C ATOM 983 CG ASP A 64 -18.062 -6.636 -15.917 1.00 0.00 C ATOM 984 OD1 ASP A 64 -18.972 -5.783 -15.863 1.00 0.00 O ATOM 985 OD2 ASP A 64 -17.792 -7.285 -16.950 1.00 0.00 O ATOM 0 H ASP A 64 -16.865 -5.089 -12.885 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.127 -6.791 -13.637 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.397 -6.212 -14.639 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -16.836 -7.907 -14.706 1.00 0.00 H new ATOM 990 N VAL A 65 -16.895 -7.578 -11.426 1.00 0.00 N ATOM 991 CA VAL A 65 -16.535 -8.590 -10.443 1.00 0.00 C ATOM 992 C VAL A 65 -17.628 -8.741 -9.389 1.00 0.00 C ATOM 993 O VAL A 65 -18.015 -9.860 -9.054 1.00 0.00 O ATOM 994 CB VAL A 65 -15.175 -8.309 -9.760 1.00 0.00 C ATOM 995 CG1 VAL A 65 -14.033 -8.751 -10.664 1.00 0.00 C ATOM 996 CG2 VAL A 65 -15.024 -6.841 -9.393 1.00 0.00 C ATOM 0 H VAL A 65 -16.451 -6.670 -11.289 1.00 0.00 H new ATOM 0 HA VAL A 65 -16.433 -9.526 -10.993 1.00 0.00 H new ATOM 0 HB VAL A 65 -15.141 -8.884 -8.835 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.081 -8.548 -10.173 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -14.119 -9.819 -10.863 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -14.080 -8.202 -11.605 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -14.057 -6.683 -8.916 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -15.087 -6.232 -10.295 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -15.819 -6.554 -8.705 1.00 0.00 H new ATOM 1006 N ALA A 66 -18.117 -7.622 -8.845 1.00 0.00 N ATOM 1007 CA ALA A 66 -19.149 -7.669 -7.807 1.00 0.00 C ATOM 1008 C ALA A 66 -20.334 -8.549 -8.200 1.00 0.00 C ATOM 1009 O ALA A 66 -20.633 -9.533 -7.521 1.00 0.00 O ATOM 1010 CB ALA A 66 -19.643 -6.260 -7.533 1.00 0.00 C ATOM 0 H ALA A 66 -17.818 -6.682 -9.104 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.699 -8.105 -6.915 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -20.412 -6.288 -6.761 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.811 -5.642 -7.195 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -20.061 -5.837 -8.446 1.00 0.00 H new ATOM 1016 N PRO A 67 -21.027 -8.219 -9.302 1.00 0.00 N ATOM 1017 CA PRO A 67 -22.178 -8.994 -9.776 1.00 0.00 C ATOM 1018 C PRO A 67 -21.859 -10.484 -9.882 1.00 0.00 C ATOM 1019 O PRO A 67 -22.737 -11.332 -9.722 1.00 0.00 O ATOM 1020 CB PRO A 67 -22.471 -8.401 -11.165 1.00 0.00 C ATOM 1021 CG PRO A 67 -21.292 -7.540 -11.485 1.00 0.00 C ATOM 1022 CD PRO A 67 -20.767 -7.065 -10.171 1.00 0.00 C ATOM 0 HA PRO A 67 -23.024 -8.929 -9.092 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -22.597 -9.187 -11.909 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -23.392 -7.819 -11.157 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -20.533 -8.102 -12.029 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -21.581 -6.700 -12.117 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -19.706 -6.822 -10.220 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -21.283 -6.170 -9.825 1.00 0.00 H new ATOM 1030 N LYS A 68 -20.589 -10.789 -10.127 1.00 0.00 N ATOM 1031 CA LYS A 68 -20.136 -12.172 -10.231 1.00 0.00 C ATOM 1032 C LYS A 68 -19.980 -12.800 -8.847 1.00 0.00 C ATOM 1033 O LYS A 68 -20.026 -14.022 -8.703 1.00 0.00 O ATOM 1034 CB LYS A 68 -18.808 -12.243 -10.986 1.00 0.00 C ATOM 1035 CG LYS A 68 -18.950 -12.043 -12.486 1.00 0.00 C ATOM 1036 CD LYS A 68 -17.606 -12.136 -13.192 1.00 0.00 C ATOM 1037 CE LYS A 68 -17.377 -13.520 -13.782 1.00 0.00 C ATOM 1038 NZ LYS A 68 -17.965 -13.651 -15.144 1.00 0.00 N ATOM 0 H LYS A 68 -19.853 -10.095 -10.258 1.00 0.00 H new ATOM 0 HA LYS A 68 -20.890 -12.732 -10.783 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -18.133 -11.485 -10.589 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -18.345 -13.212 -10.799 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -19.628 -12.794 -12.891 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.399 -11.069 -12.683 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.559 -11.390 -13.985 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.807 -11.904 -12.487 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -16.307 -13.722 -13.828 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -17.815 -14.271 -13.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -18.518 -14.530 -15.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -18.586 -12.839 -15.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -17.202 -13.676 -15.851 1.00 0.00 H new ATOM 1052 N TYR A 69 -19.790 -11.954 -7.833 1.00 0.00 N ATOM 1053 CA TYR A 69 -19.614 -12.414 -6.452 1.00 0.00 C ATOM 1054 C TYR A 69 -20.858 -12.141 -5.603 1.00 0.00 C ATOM 1055 O TYR A 69 -20.921 -12.521 -4.434 1.00 0.00 O ATOM 1056 CB TYR A 69 -18.417 -11.700 -5.827 1.00 0.00 C ATOM 1057 CG TYR A 69 -17.076 -12.233 -6.284 1.00 0.00 C ATOM 1058 CD1 TYR A 69 -16.738 -13.571 -6.108 1.00 0.00 C ATOM 1059 CD2 TYR A 69 -16.152 -11.399 -6.901 1.00 0.00 C ATOM 1060 CE1 TYR A 69 -15.518 -14.059 -6.535 1.00 0.00 C ATOM 1061 CE2 TYR A 69 -14.929 -11.880 -7.329 1.00 0.00 C ATOM 1062 CZ TYR A 69 -14.617 -13.211 -7.145 1.00 0.00 C ATOM 1063 OH TYR A 69 -13.400 -13.693 -7.571 1.00 0.00 O ATOM 0 H TYR A 69 -19.754 -10.941 -7.942 1.00 0.00 H new ATOM 0 HA TYR A 69 -19.447 -13.491 -6.477 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -18.475 -10.638 -6.066 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -18.481 -11.787 -4.742 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.440 -14.238 -5.630 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -16.394 -10.357 -7.049 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -15.271 -15.100 -6.392 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.221 -11.217 -7.805 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.816 -13.836 -6.797 1.00 0.00 H new ATOM 1073 N GLY A 70 -21.847 -11.496 -6.208 1.00 0.00 N ATOM 1074 CA GLY A 70 -23.085 -11.192 -5.513 1.00 0.00 C ATOM 1075 C GLY A 70 -22.914 -10.211 -4.365 1.00 0.00 C ATOM 1076 O GLY A 70 -23.623 -10.298 -3.364 1.00 0.00 O ATOM 0 H GLY A 70 -21.814 -11.175 -7.176 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -23.801 -10.783 -6.226 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -23.512 -12.118 -5.128 1.00 0.00 H new ATOM 1080 N ILE A 71 -21.988 -9.263 -4.507 1.00 0.00 N ATOM 1081 CA ILE A 71 -21.760 -8.262 -3.467 1.00 0.00 C ATOM 1082 C ILE A 71 -22.844 -7.181 -3.512 1.00 0.00 C ATOM 1083 O ILE A 71 -23.187 -6.681 -4.584 1.00 0.00 O ATOM 1084 CB ILE A 71 -20.369 -7.598 -3.607 1.00 0.00 C ATOM 1085 CG1 ILE A 71 -19.254 -8.647 -3.527 1.00 0.00 C ATOM 1086 CG2 ILE A 71 -20.170 -6.543 -2.527 1.00 0.00 C ATOM 1087 CD1 ILE A 71 -17.887 -8.102 -3.876 1.00 0.00 C ATOM 0 H ILE A 71 -21.388 -9.168 -5.326 1.00 0.00 H new ATOM 0 HA ILE A 71 -21.800 -8.780 -2.509 1.00 0.00 H new ATOM 0 HB ILE A 71 -20.322 -7.116 -4.583 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -19.225 -9.059 -2.518 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -19.491 -9.470 -4.201 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -19.187 -6.087 -2.641 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -20.939 -5.776 -2.621 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -20.242 -7.010 -1.545 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -17.147 -8.899 -3.798 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -17.899 -7.716 -4.895 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -17.629 -7.298 -3.186 1.00 0.00 H new ATOM 1099 N ARG A 72 -23.391 -6.837 -2.347 1.00 0.00 N ATOM 1100 CA ARG A 72 -24.446 -5.827 -2.265 1.00 0.00 C ATOM 1101 C ARG A 72 -24.324 -4.999 -0.989 1.00 0.00 C ATOM 1102 O ARG A 72 -25.202 -5.034 -0.124 1.00 0.00 O ATOM 1103 CB ARG A 72 -25.821 -6.494 -2.321 1.00 0.00 C ATOM 1104 CG ARG A 72 -26.975 -5.507 -2.403 1.00 0.00 C ATOM 1105 CD ARG A 72 -28.081 -6.017 -3.313 1.00 0.00 C ATOM 1106 NE ARG A 72 -28.734 -7.207 -2.771 1.00 0.00 N ATOM 1107 CZ ARG A 72 -29.648 -7.178 -1.804 1.00 0.00 C ATOM 1108 NH1 ARG A 72 -30.011 -6.025 -1.256 1.00 0.00 N ATOM 1109 NH2 ARG A 72 -30.199 -8.308 -1.381 1.00 0.00 N ATOM 0 H ARG A 72 -23.123 -7.241 -1.450 1.00 0.00 H new ATOM 0 HA ARG A 72 -24.334 -5.157 -3.118 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -25.859 -7.157 -3.186 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -25.949 -7.117 -1.436 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -27.376 -5.331 -1.405 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -26.610 -4.549 -2.774 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -28.822 -5.231 -3.457 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -27.665 -6.247 -4.294 1.00 0.00 H new ATOM 0 HE ARG A 72 -28.474 -8.114 -3.157 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -29.589 -5.153 -1.576 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -30.712 -6.011 -0.515 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -29.922 -9.197 -1.797 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -30.900 -8.288 -0.640 1.00 0.00 H new ATOM 1123 N GLY A 73 -23.230 -4.256 -0.882 1.00 0.00 N ATOM 1124 CA GLY A 73 -23.003 -3.426 0.285 1.00 0.00 C ATOM 1125 C GLY A 73 -21.606 -2.838 0.308 1.00 0.00 C ATOM 1126 O GLY A 73 -20.717 -3.315 -0.393 1.00 0.00 O ATOM 0 H GLY A 73 -22.493 -4.213 -1.586 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -23.735 -2.619 0.302 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -23.161 -4.019 1.186 1.00 0.00 H new ATOM 1130 N ILE A 74 -21.409 -1.800 1.112 1.00 0.00 N ATOM 1131 CA ILE A 74 -20.107 -1.154 1.218 1.00 0.00 C ATOM 1132 C ILE A 74 -19.878 -0.611 2.630 1.00 0.00 C ATOM 1133 O ILE A 74 -20.797 -0.070 3.242 1.00 0.00 O ATOM 1134 CB ILE A 74 -19.967 -0.003 0.200 1.00 0.00 C ATOM 1135 CG1 ILE A 74 -21.175 0.934 0.272 1.00 0.00 C ATOM 1136 CG2 ILE A 74 -19.813 -0.561 -1.208 1.00 0.00 C ATOM 1137 CD1 ILE A 74 -20.994 2.213 -0.517 1.00 0.00 C ATOM 0 H ILE A 74 -22.134 -1.388 1.700 1.00 0.00 H new ATOM 0 HA ILE A 74 -19.355 -1.912 0.999 1.00 0.00 H new ATOM 0 HB ILE A 74 -19.074 0.570 0.450 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -22.055 0.409 -0.099 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -21.369 1.184 1.315 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -19.715 0.261 -1.917 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -18.923 -1.189 -1.255 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.690 -1.156 -1.462 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -21.888 2.829 -0.421 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -20.134 2.760 -0.131 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -20.830 1.972 -1.567 1.00 0.00 H new ATOM 1149 N PRO A 75 -18.651 -0.745 3.177 1.00 0.00 N ATOM 1150 CA PRO A 75 -17.515 -1.379 2.505 1.00 0.00 C ATOM 1151 C PRO A 75 -17.465 -2.886 2.734 1.00 0.00 C ATOM 1152 O PRO A 75 -17.426 -3.344 3.877 1.00 0.00 O ATOM 1153 CB PRO A 75 -16.322 -0.713 3.187 1.00 0.00 C ATOM 1154 CG PRO A 75 -16.783 -0.461 4.584 1.00 0.00 C ATOM 1155 CD PRO A 75 -18.282 -0.271 4.523 1.00 0.00 C ATOM 0 HA PRO A 75 -17.554 -1.257 1.423 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -15.444 -1.358 3.169 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -16.046 0.215 2.687 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.526 -1.298 5.233 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -16.298 0.423 4.997 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -18.788 -0.844 5.300 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -18.557 0.774 4.667 1.00 0.00 H new ATOM 1163 N THR A 76 -17.457 -3.659 1.652 1.00 0.00 N ATOM 1164 CA THR A 76 -17.393 -5.112 1.761 1.00 0.00 C ATOM 1165 C THR A 76 -15.947 -5.593 1.844 1.00 0.00 C ATOM 1166 O THR A 76 -15.098 -5.177 1.056 1.00 0.00 O ATOM 1167 CB THR A 76 -18.091 -5.780 0.570 1.00 0.00 C ATOM 1168 OG1 THR A 76 -18.859 -4.840 -0.156 1.00 0.00 O ATOM 1169 CG2 THR A 76 -19.010 -6.914 0.973 1.00 0.00 C ATOM 0 H THR A 76 -17.494 -3.306 0.696 1.00 0.00 H new ATOM 0 HA THR A 76 -17.909 -5.395 2.678 1.00 0.00 H new ATOM 0 HB THR A 76 -17.287 -6.187 -0.043 1.00 0.00 H new ATOM 0 HG1 THR A 76 -19.695 -4.660 0.323 1.00 0.00 H new ATOM 0 HG21 THR A 76 -19.471 -7.342 0.083 1.00 0.00 H new ATOM 0 HG22 THR A 76 -18.435 -7.683 1.489 1.00 0.00 H new ATOM 0 HG23 THR A 76 -19.786 -6.535 1.637 1.00 0.00 H new ATOM 1177 N LEU A 77 -15.683 -6.499 2.771 1.00 0.00 N ATOM 1178 CA LEU A 77 -14.355 -7.067 2.918 1.00 0.00 C ATOM 1179 C LEU A 77 -14.391 -8.489 2.381 1.00 0.00 C ATOM 1180 O LEU A 77 -15.212 -9.302 2.807 1.00 0.00 O ATOM 1181 CB LEU A 77 -13.904 -7.045 4.386 1.00 0.00 C ATOM 1182 CG LEU A 77 -12.609 -6.277 4.665 1.00 0.00 C ATOM 1183 CD1 LEU A 77 -12.880 -4.783 4.770 1.00 0.00 C ATOM 1184 CD2 LEU A 77 -11.956 -6.791 5.940 1.00 0.00 C ATOM 0 H LEU A 77 -16.372 -6.856 3.433 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.633 -6.474 2.357 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.702 -6.608 4.987 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -13.777 -8.073 4.724 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.925 -6.441 3.832 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -11.946 -4.257 4.968 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -13.307 -4.424 3.834 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -13.581 -4.597 5.583 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.036 -6.237 6.127 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.639 -6.655 6.779 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.725 -7.850 5.829 1.00 0.00 H new ATOM 1196 N LEU A 78 -13.528 -8.778 1.417 1.00 0.00 N ATOM 1197 CA LEU A 78 -13.508 -10.097 0.801 1.00 0.00 C ATOM 1198 C LEU A 78 -12.197 -10.830 1.071 1.00 0.00 C ATOM 1199 O LEU A 78 -11.112 -10.258 0.963 1.00 0.00 O ATOM 1200 CB LEU A 78 -13.721 -9.971 -0.716 1.00 0.00 C ATOM 1201 CG LEU A 78 -15.182 -9.905 -1.203 1.00 0.00 C ATOM 1202 CD1 LEU A 78 -15.257 -10.193 -2.696 1.00 0.00 C ATOM 1203 CD2 LEU A 78 -16.068 -10.876 -0.435 1.00 0.00 C ATOM 0 H LEU A 78 -12.838 -8.124 1.047 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.317 -10.678 1.244 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.206 -9.074 -1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.238 -10.820 -1.200 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.549 -8.896 -1.017 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.295 -10.143 -3.025 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.668 -9.454 -3.239 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.861 -11.189 -2.895 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.091 -10.804 -0.803 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.702 -11.893 -0.577 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -16.046 -10.627 0.626 1.00 0.00 H new ATOM 1215 N LEU A 79 -12.315 -12.110 1.408 1.00 0.00 N ATOM 1216 CA LEU A 79 -11.156 -12.948 1.677 1.00 0.00 C ATOM 1217 C LEU A 79 -11.085 -14.066 0.648 1.00 0.00 C ATOM 1218 O LEU A 79 -12.017 -14.860 0.522 1.00 0.00 O ATOM 1219 CB LEU A 79 -11.237 -13.552 3.084 1.00 0.00 C ATOM 1220 CG LEU A 79 -10.615 -12.721 4.210 1.00 0.00 C ATOM 1221 CD1 LEU A 79 -9.097 -12.800 4.166 1.00 0.00 C ATOM 1222 CD2 LEU A 79 -11.080 -11.275 4.134 1.00 0.00 C ATOM 0 H LEU A 79 -13.210 -12.591 1.501 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.260 -12.331 1.614 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -12.286 -13.724 3.324 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -10.750 -14.527 3.068 1.00 0.00 H new ATOM 0 HG LEU A 79 -10.949 -13.137 5.160 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.678 -12.202 4.975 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.783 -13.837 4.281 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.740 -12.417 3.210 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.626 -10.704 4.943 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.783 -10.847 3.177 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -12.165 -11.236 4.228 1.00 0.00 H new ATOM 1234 N PHE A 80 -9.985 -14.119 -0.089 1.00 0.00 N ATOM 1235 CA PHE A 80 -9.812 -15.132 -1.119 1.00 0.00 C ATOM 1236 C PHE A 80 -8.711 -16.117 -0.744 1.00 0.00 C ATOM 1237 O PHE A 80 -7.724 -15.753 -0.105 1.00 0.00 O ATOM 1238 CB PHE A 80 -9.499 -14.454 -2.452 1.00 0.00 C ATOM 1239 CG PHE A 80 -10.720 -13.907 -3.129 1.00 0.00 C ATOM 1240 CD1 PHE A 80 -11.466 -14.689 -3.999 1.00 0.00 C ATOM 1241 CD2 PHE A 80 -11.130 -12.607 -2.884 1.00 0.00 C ATOM 1242 CE1 PHE A 80 -12.598 -14.180 -4.612 1.00 0.00 C ATOM 1243 CE2 PHE A 80 -12.259 -12.094 -3.492 1.00 0.00 C ATOM 1244 CZ PHE A 80 -12.994 -12.881 -4.358 1.00 0.00 C ATOM 0 H PHE A 80 -9.201 -13.474 0.007 1.00 0.00 H new ATOM 0 HA PHE A 80 -10.739 -15.698 -1.212 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.789 -13.644 -2.284 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -9.013 -15.171 -3.114 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -11.160 -15.705 -4.200 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -10.560 -11.986 -2.209 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -13.171 -14.798 -5.288 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -12.567 -11.079 -3.291 1.00 0.00 H new ATOM 0 HZ PHE A 80 -13.876 -12.481 -4.835 1.00 0.00 H new ATOM 1254 N LYS A 81 -8.901 -17.370 -1.137 1.00 0.00 N ATOM 1255 CA LYS A 81 -7.946 -18.429 -0.844 1.00 0.00 C ATOM 1256 C LYS A 81 -7.911 -19.431 -1.991 1.00 0.00 C ATOM 1257 O LYS A 81 -8.879 -20.156 -2.220 1.00 0.00 O ATOM 1258 CB LYS A 81 -8.340 -19.128 0.459 1.00 0.00 C ATOM 1259 CG LYS A 81 -7.159 -19.574 1.307 1.00 0.00 C ATOM 1260 CD LYS A 81 -7.395 -19.275 2.781 1.00 0.00 C ATOM 1261 CE LYS A 81 -6.107 -19.363 3.586 1.00 0.00 C ATOM 1262 NZ LYS A 81 -5.492 -20.716 3.508 1.00 0.00 N ATOM 0 H LYS A 81 -9.717 -17.679 -1.665 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.952 -17.997 -0.729 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.961 -18.453 1.047 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.952 -19.998 0.221 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.994 -20.643 1.172 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.255 -19.067 0.971 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.823 -18.278 2.886 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.124 -19.978 3.183 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.398 -18.621 3.218 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.313 -19.118 4.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.799 -20.827 4.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.233 -21.440 3.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.014 -20.828 2.591 1.00 0.00 H new ATOM 1276 N ASN A 82 -6.801 -19.460 -2.721 1.00 0.00 N ATOM 1277 CA ASN A 82 -6.667 -20.368 -3.855 1.00 0.00 C ATOM 1278 C ASN A 82 -7.718 -20.044 -4.914 1.00 0.00 C ATOM 1279 O ASN A 82 -8.365 -20.936 -5.462 1.00 0.00 O ATOM 1280 CB ASN A 82 -6.802 -21.823 -3.398 1.00 0.00 C ATOM 1281 CG ASN A 82 -6.049 -22.100 -2.110 1.00 0.00 C ATOM 1282 OD1 ASN A 82 -6.630 -22.550 -1.123 1.00 0.00 O ATOM 1283 ND2 ASN A 82 -4.748 -21.828 -2.114 1.00 0.00 N ATOM 0 H ASN A 82 -5.987 -18.870 -2.550 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.677 -20.236 -4.291 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.857 -22.060 -3.257 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.430 -22.483 -4.182 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -4.190 -21.991 -1.276 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -4.307 -21.456 -2.955 1.00 0.00 H new ATOM 1290 N GLY A 83 -7.855 -18.754 -5.214 1.00 0.00 N ATOM 1291 CA GLY A 83 -8.802 -18.314 -6.223 1.00 0.00 C ATOM 1292 C GLY A 83 -10.254 -18.405 -5.781 1.00 0.00 C ATOM 1293 O GLY A 83 -11.156 -18.125 -6.569 1.00 0.00 O ATOM 0 H GLY A 83 -7.324 -18.003 -4.773 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.578 -17.282 -6.493 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -8.667 -18.915 -7.122 1.00 0.00 H new ATOM 1297 N GLU A 84 -10.490 -18.807 -4.537 1.00 0.00 N ATOM 1298 CA GLU A 84 -11.854 -18.936 -4.036 1.00 0.00 C ATOM 1299 C GLU A 84 -12.072 -18.104 -2.779 1.00 0.00 C ATOM 1300 O GLU A 84 -11.249 -18.103 -1.866 1.00 0.00 O ATOM 1301 CB GLU A 84 -12.177 -20.402 -3.743 1.00 0.00 C ATOM 1302 CG GLU A 84 -13.623 -20.774 -4.025 1.00 0.00 C ATOM 1303 CD GLU A 84 -14.014 -22.105 -3.413 1.00 0.00 C ATOM 1304 OE1 GLU A 84 -13.355 -23.118 -3.726 1.00 0.00 O ATOM 1305 OE2 GLU A 84 -14.979 -22.133 -2.620 1.00 0.00 O ATOM 0 H GLU A 84 -9.763 -19.047 -3.863 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.523 -18.563 -4.812 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.524 -21.036 -4.342 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.954 -20.613 -2.697 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -14.277 -19.994 -3.636 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.780 -20.814 -5.103 1.00 0.00 H new ATOM 1312 N VAL A 85 -13.208 -17.417 -2.733 1.00 0.00 N ATOM 1313 CA VAL A 85 -13.553 -16.595 -1.581 1.00 0.00 C ATOM 1314 C VAL A 85 -13.792 -17.480 -0.355 1.00 0.00 C ATOM 1315 O VAL A 85 -14.694 -18.319 -0.360 1.00 0.00 O ATOM 1316 CB VAL A 85 -14.807 -15.740 -1.851 1.00 0.00 C ATOM 1317 CG1 VAL A 85 -16.003 -16.618 -2.188 1.00 0.00 C ATOM 1318 CG2 VAL A 85 -15.105 -14.845 -0.658 1.00 0.00 C ATOM 0 H VAL A 85 -13.904 -17.413 -3.479 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.716 -15.923 -1.392 1.00 0.00 H new ATOM 0 HB VAL A 85 -14.610 -15.105 -2.714 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.874 -15.990 -2.374 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.783 -17.206 -3.079 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -16.210 -17.287 -1.353 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.993 -14.248 -0.864 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -15.279 -15.461 0.224 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.257 -14.184 -0.478 1.00 0.00 H new ATOM 1328 N ALA A 86 -12.976 -17.311 0.686 1.00 0.00 N ATOM 1329 CA ALA A 86 -13.117 -18.125 1.892 1.00 0.00 C ATOM 1330 C ALA A 86 -13.688 -17.335 3.067 1.00 0.00 C ATOM 1331 O ALA A 86 -13.693 -17.812 4.203 1.00 0.00 O ATOM 1332 CB ALA A 86 -11.782 -18.760 2.264 1.00 0.00 C ATOM 0 H ALA A 86 -12.220 -16.627 0.719 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.834 -18.914 1.666 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.904 -19.363 3.164 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.440 -19.394 1.446 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.046 -17.978 2.448 1.00 0.00 H new ATOM 1338 N ALA A 87 -14.185 -16.141 2.785 1.00 0.00 N ATOM 1339 CA ALA A 87 -14.782 -15.295 3.817 1.00 0.00 C ATOM 1340 C ALA A 87 -15.419 -14.048 3.213 1.00 0.00 C ATOM 1341 O ALA A 87 -14.907 -13.482 2.247 1.00 0.00 O ATOM 1342 CB ALA A 87 -13.749 -14.913 4.868 1.00 0.00 C ATOM 0 H ALA A 87 -14.189 -15.732 1.851 1.00 0.00 H new ATOM 0 HA ALA A 87 -15.570 -15.872 4.302 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -14.216 -14.284 5.625 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -13.357 -15.815 5.337 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.933 -14.366 4.395 1.00 0.00 H new ATOM 1348 N THR A 88 -16.528 -13.614 3.799 1.00 0.00 N ATOM 1349 CA THR A 88 -17.224 -12.424 3.327 1.00 0.00 C ATOM 1350 C THR A 88 -17.643 -11.545 4.499 1.00 0.00 C ATOM 1351 O THR A 88 -18.405 -11.975 5.364 1.00 0.00 O ATOM 1352 CB THR A 88 -18.453 -12.808 2.497 1.00 0.00 C ATOM 1353 OG1 THR A 88 -19.327 -11.702 2.353 1.00 0.00 O ATOM 1354 CG2 THR A 88 -19.256 -13.947 3.093 1.00 0.00 C ATOM 0 H THR A 88 -16.964 -14.068 4.601 1.00 0.00 H new ATOM 0 HA THR A 88 -16.537 -11.862 2.695 1.00 0.00 H new ATOM 0 HB THR A 88 -18.055 -13.131 1.535 1.00 0.00 H new ATOM 0 HG1 THR A 88 -20.105 -11.967 1.819 1.00 0.00 H new ATOM 0 HG21 THR A 88 -20.110 -14.164 2.452 1.00 0.00 H new ATOM 0 HG22 THR A 88 -18.627 -14.834 3.172 1.00 0.00 H new ATOM 0 HG23 THR A 88 -19.609 -13.663 4.085 1.00 0.00 H new ATOM 1362 N LYS A 89 -17.150 -10.307 4.523 1.00 0.00 N ATOM 1363 CA LYS A 89 -17.486 -9.372 5.589 1.00 0.00 C ATOM 1364 C LYS A 89 -18.119 -8.114 5.007 1.00 0.00 C ATOM 1365 O LYS A 89 -17.687 -7.612 3.970 1.00 0.00 O ATOM 1366 CB LYS A 89 -16.233 -9.004 6.386 1.00 0.00 C ATOM 1367 CG LYS A 89 -16.422 -9.104 7.890 1.00 0.00 C ATOM 1368 CD LYS A 89 -16.819 -10.509 8.308 1.00 0.00 C ATOM 1369 CE LYS A 89 -16.353 -10.816 9.722 1.00 0.00 C ATOM 1370 NZ LYS A 89 -16.925 -12.092 10.233 1.00 0.00 N ATOM 0 H LYS A 89 -16.518 -9.931 3.816 1.00 0.00 H new ATOM 0 HA LYS A 89 -18.201 -9.851 6.257 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -15.415 -9.659 6.086 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -15.936 -7.987 6.132 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -15.498 -8.821 8.394 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -17.188 -8.398 8.209 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -17.902 -10.616 8.248 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -16.388 -11.232 7.616 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -15.265 -10.873 9.741 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -16.640 -9.999 10.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -17.031 -12.036 11.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -17.856 -12.254 9.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -16.289 -12.879 9.992 1.00 0.00 H new ATOM 1384 N VAL A 90 -19.147 -7.613 5.675 1.00 0.00 N ATOM 1385 CA VAL A 90 -19.844 -6.419 5.216 1.00 0.00 C ATOM 1386 C VAL A 90 -19.819 -5.318 6.271 1.00 0.00 C ATOM 1387 O VAL A 90 -19.860 -5.594 7.470 1.00 0.00 O ATOM 1388 CB VAL A 90 -21.302 -6.737 4.840 1.00 0.00 C ATOM 1389 CG1 VAL A 90 -21.950 -5.538 4.167 1.00 0.00 C ATOM 1390 CG2 VAL A 90 -21.361 -7.961 3.938 1.00 0.00 C ATOM 0 H VAL A 90 -19.518 -8.014 6.537 1.00 0.00 H new ATOM 0 HA VAL A 90 -19.318 -6.065 4.329 1.00 0.00 H new ATOM 0 HB VAL A 90 -21.858 -6.957 5.752 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -22.981 -5.779 3.907 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -21.937 -4.687 4.848 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -21.397 -5.286 3.262 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -22.399 -8.174 3.681 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -20.793 -7.770 3.028 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -20.934 -8.818 4.459 1.00 0.00 H new ATOM 1400 N GLY A 91 -19.753 -4.067 5.818 1.00 0.00 N ATOM 1401 CA GLY A 91 -19.718 -2.948 6.738 1.00 0.00 C ATOM 1402 C GLY A 91 -18.333 -2.693 7.291 1.00 0.00 C ATOM 1403 O GLY A 91 -17.468 -3.568 7.260 1.00 0.00 O ATOM 0 H GLY A 91 -19.723 -3.812 4.831 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -20.072 -2.052 6.228 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -20.405 -3.139 7.562 1.00 0.00 H new ATOM 1407 N ALA A 92 -18.119 -1.479 7.791 1.00 0.00 N ATOM 1408 CA ALA A 92 -16.827 -1.092 8.341 1.00 0.00 C ATOM 1409 C ALA A 92 -16.529 -1.837 9.638 1.00 0.00 C ATOM 1410 O ALA A 92 -17.427 -2.098 10.440 1.00 0.00 O ATOM 1411 CB ALA A 92 -16.781 0.412 8.572 1.00 0.00 C ATOM 0 H ALA A 92 -18.827 -0.746 7.826 1.00 0.00 H new ATOM 0 HA ALA A 92 -16.059 -1.363 7.616 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -15.810 0.687 8.983 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -16.934 0.930 7.626 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -17.566 0.697 9.273 1.00 0.00 H new ATOM 1417 N LEU A 93 -15.259 -2.176 9.836 1.00 0.00 N ATOM 1418 CA LEU A 93 -14.829 -2.890 11.032 1.00 0.00 C ATOM 1419 C LEU A 93 -13.703 -2.132 11.732 1.00 0.00 C ATOM 1420 O LEU A 93 -13.388 -1.000 11.366 1.00 0.00 O ATOM 1421 CB LEU A 93 -14.369 -4.314 10.677 1.00 0.00 C ATOM 1422 CG LEU A 93 -14.053 -4.558 9.198 1.00 0.00 C ATOM 1423 CD1 LEU A 93 -13.034 -5.677 9.049 1.00 0.00 C ATOM 1424 CD2 LEU A 93 -15.322 -4.888 8.426 1.00 0.00 C ATOM 0 H LEU A 93 -14.507 -1.966 9.180 1.00 0.00 H new ATOM 0 HA LEU A 93 -15.679 -2.959 11.711 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -13.480 -4.546 11.263 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -15.145 -5.015 10.985 1.00 0.00 H new ATOM 0 HG LEU A 93 -13.627 -3.644 8.783 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.821 -5.837 7.992 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -12.115 -5.403 9.567 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -13.435 -6.594 9.481 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -15.076 -5.058 7.378 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -15.778 -5.786 8.842 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -16.022 -4.056 8.504 1.00 0.00 H new ATOM 1436 N SER A 94 -13.097 -2.759 12.737 1.00 0.00 N ATOM 1437 CA SER A 94 -12.005 -2.133 13.477 1.00 0.00 C ATOM 1438 C SER A 94 -10.677 -2.809 13.158 1.00 0.00 C ATOM 1439 O SER A 94 -10.645 -3.897 12.585 1.00 0.00 O ATOM 1440 CB SER A 94 -12.267 -2.194 14.983 1.00 0.00 C ATOM 1441 OG SER A 94 -11.123 -1.786 15.716 1.00 0.00 O ATOM 0 H SER A 94 -13.342 -3.696 13.057 1.00 0.00 H new ATOM 0 HA SER A 94 -11.950 -1.089 13.170 1.00 0.00 H new ATOM 0 HB2 SER A 94 -13.112 -1.553 15.235 1.00 0.00 H new ATOM 0 HB3 SER A 94 -12.542 -3.210 15.267 1.00 0.00 H new ATOM 0 HG SER A 94 -11.316 -1.832 16.676 1.00 0.00 H new ATOM 1447 N LYS A 95 -9.581 -2.158 13.537 1.00 0.00 N ATOM 1448 CA LYS A 95 -8.249 -2.699 13.291 1.00 0.00 C ATOM 1449 C LYS A 95 -8.093 -4.079 13.922 1.00 0.00 C ATOM 1450 O LYS A 95 -7.441 -4.957 13.357 1.00 0.00 O ATOM 1451 CB LYS A 95 -7.179 -1.754 13.840 1.00 0.00 C ATOM 1452 CG LYS A 95 -5.758 -2.229 13.575 1.00 0.00 C ATOM 1453 CD LYS A 95 -4.975 -1.224 12.744 1.00 0.00 C ATOM 1454 CE LYS A 95 -3.629 -1.786 12.315 1.00 0.00 C ATOM 1455 NZ LYS A 95 -2.514 -1.260 13.151 1.00 0.00 N ATOM 0 H LYS A 95 -9.589 -1.257 14.015 1.00 0.00 H new ATOM 0 HA LYS A 95 -8.121 -2.795 12.213 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.313 -0.768 13.395 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -7.322 -1.641 14.915 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.247 -2.394 14.523 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.785 -3.187 13.056 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.554 -0.950 11.862 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.823 -0.312 13.322 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -3.652 -2.874 12.383 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -3.448 -1.536 11.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -1.614 -1.668 12.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.475 -0.224 13.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -2.673 -1.520 14.145 1.00 0.00 H new ATOM 1469 N GLY A 96 -8.678 -4.260 15.102 1.00 0.00 N ATOM 1470 CA GLY A 96 -8.580 -5.533 15.781 1.00 0.00 C ATOM 1471 C GLY A 96 -9.509 -6.581 15.203 1.00 0.00 C ATOM 1472 O GLY A 96 -9.201 -7.772 15.234 1.00 0.00 O ATOM 0 H GLY A 96 -9.216 -3.548 15.596 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -7.553 -5.893 15.722 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.809 -5.394 16.838 1.00 0.00 H new ATOM 1476 N GLN A 97 -10.643 -6.144 14.666 1.00 0.00 N ATOM 1477 CA GLN A 97 -11.604 -7.070 14.077 1.00 0.00 C ATOM 1478 C GLN A 97 -11.125 -7.536 12.706 1.00 0.00 C ATOM 1479 O GLN A 97 -11.370 -8.673 12.305 1.00 0.00 O ATOM 1480 CB GLN A 97 -12.984 -6.422 13.968 1.00 0.00 C ATOM 1481 CG GLN A 97 -13.434 -5.745 15.252 1.00 0.00 C ATOM 1482 CD GLN A 97 -14.510 -4.702 15.022 1.00 0.00 C ATOM 1483 OE1 GLN A 97 -14.997 -4.530 13.904 1.00 0.00 O ATOM 1484 NE2 GLN A 97 -14.888 -4.003 16.085 1.00 0.00 N ATOM 0 H GLN A 97 -10.918 -5.163 14.626 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.685 -7.939 14.730 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -12.970 -5.687 13.164 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -13.714 -7.183 13.692 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -13.809 -6.500 15.943 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.575 -5.274 15.729 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -14.456 -4.180 16.992 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -15.610 -3.289 15.995 1.00 0.00 H new ATOM 1493 N LEU A 98 -10.423 -6.658 11.998 1.00 0.00 N ATOM 1494 CA LEU A 98 -9.892 -7.006 10.688 1.00 0.00 C ATOM 1495 C LEU A 98 -8.742 -7.992 10.858 1.00 0.00 C ATOM 1496 O LEU A 98 -8.697 -9.035 10.207 1.00 0.00 O ATOM 1497 CB LEU A 98 -9.421 -5.761 9.929 1.00 0.00 C ATOM 1498 CG LEU A 98 -9.777 -5.752 8.440 1.00 0.00 C ATOM 1499 CD1 LEU A 98 -9.947 -4.329 7.933 1.00 0.00 C ATOM 1500 CD2 LEU A 98 -8.716 -6.486 7.633 1.00 0.00 C ATOM 0 H LEU A 98 -10.211 -5.709 12.306 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.686 -7.467 10.100 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.856 -4.879 10.399 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.339 -5.676 10.031 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.727 -6.272 8.314 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.200 -4.348 6.873 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.747 -3.838 8.488 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -9.017 -3.779 8.074 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.986 -6.469 6.577 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.752 -5.996 7.769 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.649 -7.519 7.974 1.00 0.00 H new ATOM 1512 N LYS A 99 -7.816 -7.643 11.747 1.00 0.00 N ATOM 1513 CA LYS A 99 -6.656 -8.482 12.027 1.00 0.00 C ATOM 1514 C LYS A 99 -7.087 -9.844 12.566 1.00 0.00 C ATOM 1515 O LYS A 99 -6.563 -10.878 12.151 1.00 0.00 O ATOM 1516 CB LYS A 99 -5.735 -7.791 13.038 1.00 0.00 C ATOM 1517 CG LYS A 99 -4.266 -7.805 12.640 1.00 0.00 C ATOM 1518 CD LYS A 99 -3.445 -6.847 13.492 1.00 0.00 C ATOM 1519 CE LYS A 99 -3.049 -7.473 14.822 1.00 0.00 C ATOM 1520 NZ LYS A 99 -3.728 -6.813 15.971 1.00 0.00 N ATOM 0 H LYS A 99 -7.848 -6.779 12.289 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.114 -8.634 11.094 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.058 -6.758 13.163 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.844 -8.278 14.007 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.870 -8.815 12.743 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.171 -7.531 11.589 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.548 -6.553 12.947 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.019 -5.939 13.674 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -3.300 -8.534 14.813 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -1.969 -7.402 14.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -3.432 -7.269 16.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -3.469 -5.806 15.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -4.759 -6.903 15.863 1.00 0.00 H new ATOM 1534 N GLU A 100 -8.052 -9.842 13.484 1.00 0.00 N ATOM 1535 CA GLU A 100 -8.547 -11.088 14.056 1.00 0.00 C ATOM 1536 C GLU A 100 -9.169 -11.956 12.967 1.00 0.00 C ATOM 1537 O GLU A 100 -8.994 -13.174 12.953 1.00 0.00 O ATOM 1538 CB GLU A 100 -9.537 -10.819 15.203 1.00 0.00 C ATOM 1539 CG GLU A 100 -10.979 -10.601 14.768 1.00 0.00 C ATOM 1540 CD GLU A 100 -11.822 -11.855 14.902 1.00 0.00 C ATOM 1541 OE1 GLU A 100 -11.240 -12.959 14.956 1.00 0.00 O ATOM 1542 OE2 GLU A 100 -13.064 -11.732 14.956 1.00 0.00 O ATOM 0 H GLU A 100 -8.501 -9.000 13.843 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.705 -11.633 14.483 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.505 -11.660 15.896 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.202 -9.940 15.754 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.420 -9.805 15.368 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -10.996 -10.265 13.731 1.00 0.00 H new ATOM 1549 N PHE A 101 -9.865 -11.316 12.028 1.00 0.00 N ATOM 1550 CA PHE A 101 -10.479 -12.027 10.913 1.00 0.00 C ATOM 1551 C PHE A 101 -9.402 -12.714 10.078 1.00 0.00 C ATOM 1552 O PHE A 101 -9.569 -13.851 9.630 1.00 0.00 O ATOM 1553 CB PHE A 101 -11.295 -11.061 10.046 1.00 0.00 C ATOM 1554 CG PHE A 101 -12.282 -11.748 9.143 1.00 0.00 C ATOM 1555 CD1 PHE A 101 -13.085 -12.770 9.625 1.00 0.00 C ATOM 1556 CD2 PHE A 101 -12.403 -11.378 7.814 1.00 0.00 C ATOM 1557 CE1 PHE A 101 -13.987 -13.410 8.798 1.00 0.00 C ATOM 1558 CE2 PHE A 101 -13.306 -12.013 6.982 1.00 0.00 C ATOM 1559 CZ PHE A 101 -14.099 -13.032 7.475 1.00 0.00 C ATOM 0 H PHE A 101 -10.016 -10.307 12.019 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.155 -12.786 11.308 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -11.830 -10.368 10.695 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.613 -10.466 9.439 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.004 -13.069 10.660 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.784 -10.584 7.423 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -14.605 -14.206 9.186 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -13.392 -11.713 5.948 1.00 0.00 H new ATOM 0 HZ PHE A 101 -14.804 -13.531 6.827 1.00 0.00 H new ATOM 1569 N LEU A 102 -8.285 -12.014 9.891 1.00 0.00 N ATOM 1570 CA LEU A 102 -7.169 -12.548 9.122 1.00 0.00 C ATOM 1571 C LEU A 102 -6.563 -13.743 9.848 1.00 0.00 C ATOM 1572 O LEU A 102 -6.537 -14.850 9.318 1.00 0.00 O ATOM 1573 CB LEU A 102 -6.106 -11.464 8.900 1.00 0.00 C ATOM 1574 CG LEU A 102 -6.149 -10.783 7.528 1.00 0.00 C ATOM 1575 CD1 LEU A 102 -4.982 -9.818 7.370 1.00 0.00 C ATOM 1576 CD2 LEU A 102 -6.134 -11.821 6.415 1.00 0.00 C ATOM 0 H LEU A 102 -8.131 -11.076 10.262 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.536 -12.875 8.149 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.220 -10.702 9.671 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.121 -11.910 9.036 1.00 0.00 H new ATOM 0 HG LEU A 102 -7.077 -10.215 7.458 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -5.031 -9.345 6.389 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.035 -9.053 8.145 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.043 -10.364 7.463 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -6.165 -11.318 5.448 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.224 -12.417 6.485 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.002 -12.472 6.513 1.00 0.00 H new ATOM 1588 N ASP A 103 -6.094 -13.516 11.072 1.00 0.00 N ATOM 1589 CA ASP A 103 -5.503 -14.587 11.871 1.00 0.00 C ATOM 1590 C ASP A 103 -6.404 -15.820 11.872 1.00 0.00 C ATOM 1591 O ASP A 103 -5.927 -16.956 11.900 1.00 0.00 O ATOM 1592 CB ASP A 103 -5.272 -14.112 13.309 1.00 0.00 C ATOM 1593 CG ASP A 103 -3.932 -14.563 13.857 1.00 0.00 C ATOM 1594 OD1 ASP A 103 -3.824 -15.739 14.265 1.00 0.00 O ATOM 1595 OD2 ASP A 103 -2.991 -13.741 13.875 1.00 0.00 O ATOM 0 H ASP A 103 -6.111 -12.605 11.531 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.545 -14.855 11.425 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -5.328 -13.024 13.343 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -6.069 -14.492 13.947 1.00 0.00 H new ATOM 1600 N ALA A 104 -7.711 -15.582 11.846 1.00 0.00 N ATOM 1601 CA ALA A 104 -8.694 -16.657 11.846 1.00 0.00 C ATOM 1602 C ALA A 104 -8.718 -17.417 10.520 1.00 0.00 C ATOM 1603 O ALA A 104 -9.132 -18.577 10.473 1.00 0.00 O ATOM 1604 CB ALA A 104 -10.073 -16.098 12.158 1.00 0.00 C ATOM 0 H ALA A 104 -8.116 -14.646 11.825 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.404 -17.368 12.620 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -10.803 -16.908 12.156 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -10.060 -15.624 13.139 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -10.346 -15.361 11.403 1.00 0.00 H new ATOM 1610 N ASN A 105 -8.286 -16.764 9.443 1.00 0.00 N ATOM 1611 CA ASN A 105 -8.278 -17.392 8.122 1.00 0.00 C ATOM 1612 C ASN A 105 -6.854 -17.754 7.695 1.00 0.00 C ATOM 1613 O ASN A 105 -6.598 -18.871 7.245 1.00 0.00 O ATOM 1614 CB ASN A 105 -8.913 -16.453 7.090 1.00 0.00 C ATOM 1615 CG ASN A 105 -9.941 -17.151 6.219 1.00 0.00 C ATOM 1616 OD1 ASN A 105 -10.374 -18.263 6.519 1.00 0.00 O ATOM 1617 ND2 ASN A 105 -10.339 -16.497 5.131 1.00 0.00 N ATOM 0 H ASN A 105 -7.938 -15.805 9.458 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.861 -18.311 8.178 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -9.387 -15.619 7.607 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.131 -16.033 6.457 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -11.029 -16.916 4.508 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.954 -15.576 4.920 1.00 0.00 H new ATOM 1624 N LEU A 106 -5.935 -16.805 7.845 1.00 0.00 N ATOM 1625 CA LEU A 106 -4.534 -17.019 7.485 1.00 0.00 C ATOM 1626 C LEU A 106 -3.986 -18.271 8.164 1.00 0.00 C ATOM 1627 O LEU A 106 -3.739 -18.279 9.370 1.00 0.00 O ATOM 1628 CB LEU A 106 -3.700 -15.798 7.885 1.00 0.00 C ATOM 1629 CG LEU A 106 -2.294 -15.728 7.278 1.00 0.00 C ATOM 1630 CD1 LEU A 106 -1.696 -14.345 7.490 1.00 0.00 C ATOM 1631 CD2 LEU A 106 -1.394 -16.793 7.884 1.00 0.00 C ATOM 0 H LEU A 106 -6.135 -15.876 8.215 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.472 -17.158 6.406 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.245 -14.899 7.599 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.608 -15.783 8.971 1.00 0.00 H new ATOM 0 HG LEU A 106 -2.372 -15.915 6.207 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -0.698 -14.310 7.054 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.328 -13.598 7.010 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.633 -14.136 8.558 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.401 -16.726 7.440 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.321 -16.638 8.960 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -1.814 -17.779 7.687 1.00 0.00 H new ATOM 1643 N VAL A 107 -3.803 -19.327 7.380 1.00 0.00 N ATOM 1644 CA VAL A 107 -3.288 -20.588 7.901 1.00 0.00 C ATOM 1645 C VAL A 107 -2.646 -21.417 6.794 1.00 0.00 C ATOM 1646 O VAL A 107 -3.242 -21.501 5.699 1.00 0.00 O ATOM 1647 CB VAL A 107 -4.405 -21.419 8.563 1.00 0.00 C ATOM 1648 CG1 VAL A 107 -4.887 -20.749 9.840 1.00 0.00 C ATOM 1649 CG2 VAL A 107 -5.559 -21.629 7.595 1.00 0.00 C ATOM 0 H VAL A 107 -4.004 -19.335 6.380 1.00 0.00 H new ATOM 0 HA VAL A 107 -2.536 -20.338 8.650 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.998 -22.395 8.825 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -5.675 -21.351 10.292 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -4.055 -20.657 10.539 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -5.276 -19.758 9.606 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -6.338 -22.218 8.080 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -5.966 -20.662 7.299 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -5.201 -22.158 6.712 1.00 0.00 H new TER 1659 VAL A 107