USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1029 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 98 ASN : amide:sc= 0.88 K(o=2.5,f=0.72) USER MOD Set 1.2: A 119 TYR OH : rot -126:sc= 1.64 USER MOD Set 2.1: A 70 TYR OH : rot -3:sc= 1.68 USER MOD Set 2.2: A 115 GLN : amide:sc= 0.615 K(o=3.9,f=-0.71!) USER MOD Set 2.3: A 117 TYR OH : rot 170:sc= 1.57 USER MOD Set 3.1: A 5 THR OG1 : rot 180:sc= 1.01 USER MOD Set 3.2: A 37 LYS NZ :NH3+ -158:sc= 0.0413 (180deg=0) USER MOD Set 3.3: A 39 THR OG1 : rot -77:sc= 1.22 USER MOD Single : A 4 SER OG : rot 11:sc= 1.12 USER MOD Single : A 7 LYS NZ :NH3+ -171:sc= -0.0111 (180deg=-0.0843) USER MOD Single : A 11 SER OG : rot 100:sc= 0.916 USER MOD Single : A 13 ASN : amide:sc= 0.954 K(o=0.95,f=-0.057) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 165:sc= 1.21 (180deg=1.13) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -167:sc= 0.616 (180deg=0.514) USER MOD Single : A 21 MET CE :methyl 167:sc= -0.481 (180deg=-0.638) USER MOD Single : A 24 ASN : amide:sc= 0.272 K(o=0.27,f=-2.9!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 THR OG1 : rot 31:sc= 0.348 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ -152:sc= 0.0673 (180deg=-0.0321) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -163:sc= 1.41 USER MOD Single : A 54 THR OG1 : rot 87:sc= 1.26 USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -0.0159 X(o=-0.016,f=-0.33) USER MOD Single : A 71 ASN : amide:sc= 0.177 K(o=0.18,f=-2.2!) USER MOD Single : A 76 THR OG1 : rot -154:sc= 1.12 USER MOD Single : A 81 THR OG1 : rot 16:sc= 0.829 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ -175:sc= 0.984 (180deg=0.948) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -130:sc= 0.311 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 53:sc= 1.1 USER MOD Single : A 100 ASN : amide:sc= 1.07 K(o=1.1,f=-0.17) USER MOD Single : A 103 ASN : amide:sc= 0.269 K(o=0.27,f=-0.38) USER MOD Single : A 104 THR OG1 : rot 133:sc= 0.321 USER MOD Single : A 116 THR OG1 : rot 85:sc= 1.24 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 165:sc= 1.04 (180deg=0.848) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 11 N PHE A 2 5.284 2.578 1.053 1.00 0.00 N ATOM 12 CA PHE A 2 6.305 2.025 0.104 1.00 0.00 C ATOM 13 C PHE A 2 6.868 3.114 -0.865 1.00 0.00 C ATOM 14 O PHE A 2 8.090 3.215 -1.009 1.00 0.00 O ATOM 15 CB PHE A 2 5.794 0.770 -0.669 1.00 0.00 C ATOM 16 CG PHE A 2 5.555 -0.508 0.162 1.00 0.00 C ATOM 17 CD1 PHE A 2 6.610 -1.113 0.858 1.00 0.00 C ATOM 18 CD2 PHE A 2 4.281 -1.084 0.221 1.00 0.00 C ATOM 19 CE1 PHE A 2 6.390 -2.265 1.611 1.00 0.00 C ATOM 20 CE2 PHE A 2 4.064 -2.238 0.971 1.00 0.00 C ATOM 21 CZ PHE A 2 5.119 -2.826 1.664 1.00 0.00 C ATOM 0 HA PHE A 2 7.137 1.690 0.724 1.00 0.00 H new ATOM 0 HB2 PHE A 2 4.859 1.033 -1.164 1.00 0.00 H new ATOM 0 HB3 PHE A 2 6.515 0.536 -1.452 1.00 0.00 H new ATOM 0 HD1 PHE A 2 7.600 -0.684 0.811 1.00 0.00 H new ATOM 0 HD2 PHE A 2 3.462 -0.632 -0.318 1.00 0.00 H new ATOM 0 HE1 PHE A 2 7.206 -2.721 2.152 1.00 0.00 H new ATOM 0 HE2 PHE A 2 3.078 -2.676 1.015 1.00 0.00 H new ATOM 0 HZ PHE A 2 4.949 -3.721 2.245 1.00 0.00 H new ATOM 31 N ASP A 3 6.014 3.919 -1.522 1.00 0.00 N ATOM 32 CA ASP A 3 6.421 5.071 -2.367 1.00 0.00 C ATOM 33 C ASP A 3 7.025 6.278 -1.568 1.00 0.00 C ATOM 34 O ASP A 3 6.322 7.135 -1.023 1.00 0.00 O ATOM 35 CB ASP A 3 5.217 5.441 -3.277 1.00 0.00 C ATOM 36 CG ASP A 3 3.874 5.791 -2.617 1.00 0.00 C ATOM 37 OD1 ASP A 3 3.312 4.926 -1.905 1.00 0.00 O ATOM 38 OD2 ASP A 3 3.371 6.914 -2.826 1.00 0.00 O ATOM 0 H ASP A 3 5.003 3.790 -1.484 1.00 0.00 H new ATOM 0 HA ASP A 3 7.264 4.776 -2.992 1.00 0.00 H new ATOM 0 HB2 ASP A 3 5.515 6.291 -3.891 1.00 0.00 H new ATOM 0 HB3 ASP A 3 5.045 4.604 -3.954 1.00 0.00 H new ATOM 43 N SER A 4 8.363 6.310 -1.460 1.00 0.00 N ATOM 44 CA SER A 4 9.133 7.391 -0.777 1.00 0.00 C ATOM 45 C SER A 4 10.666 7.276 -1.094 1.00 0.00 C ATOM 46 O SER A 4 11.148 6.315 -1.706 1.00 0.00 O ATOM 47 CB SER A 4 8.849 7.382 0.756 1.00 0.00 C ATOM 48 OG SER A 4 7.530 7.848 1.039 1.00 0.00 O ATOM 0 H SER A 4 8.960 5.579 -1.847 1.00 0.00 H new ATOM 0 HA SER A 4 8.799 8.353 -1.165 1.00 0.00 H new ATOM 0 HB2 SER A 4 8.972 6.371 1.145 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.577 8.011 1.267 1.00 0.00 H new ATOM 0 HG SER A 4 7.019 7.910 0.205 1.00 0.00 H new ATOM 54 N THR A 5 11.445 8.278 -0.650 1.00 0.00 N ATOM 55 CA THR A 5 12.936 8.202 -0.607 1.00 0.00 C ATOM 56 C THR A 5 13.389 7.598 0.764 1.00 0.00 C ATOM 57 O THR A 5 13.125 8.183 1.819 1.00 0.00 O ATOM 58 CB THR A 5 13.520 9.613 -0.925 1.00 0.00 C ATOM 59 OG1 THR A 5 13.265 9.946 -2.289 1.00 0.00 O ATOM 60 CG2 THR A 5 15.039 9.744 -0.769 1.00 0.00 C ATOM 0 H THR A 5 11.072 9.164 -0.310 1.00 0.00 H new ATOM 0 HA THR A 5 13.331 7.529 -1.368 1.00 0.00 H new ATOM 0 HB THR A 5 13.032 10.265 -0.201 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.632 10.834 -2.483 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.343 10.762 -1.013 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.320 9.518 0.260 1.00 0.00 H new ATOM 0 HG23 THR A 5 15.536 9.045 -1.442 1.00 0.00 H new ATOM 68 N TRP A 6 14.064 6.434 0.741 1.00 0.00 N ATOM 69 CA TRP A 6 14.466 5.703 1.979 1.00 0.00 C ATOM 70 C TRP A 6 16.022 5.547 2.023 1.00 0.00 C ATOM 71 O TRP A 6 16.601 4.816 1.211 1.00 0.00 O ATOM 72 CB TRP A 6 13.784 4.307 2.072 1.00 0.00 C ATOM 73 CG TRP A 6 12.262 4.195 1.915 1.00 0.00 C ATOM 74 CD1 TRP A 6 11.579 4.097 0.684 1.00 0.00 C ATOM 75 CD2 TRP A 6 11.302 3.982 2.889 1.00 0.00 C ATOM 76 NE1 TRP A 6 10.210 3.832 0.866 1.00 0.00 N ATOM 77 CE2 TRP A 6 10.065 3.750 2.237 1.00 0.00 C ATOM 78 CE3 TRP A 6 11.393 3.893 4.302 1.00 0.00 C ATOM 79 CZ2 TRP A 6 8.919 3.414 2.988 1.00 0.00 C ATOM 80 CZ3 TRP A 6 10.246 3.563 5.025 1.00 0.00 C ATOM 81 CH2 TRP A 6 9.027 3.322 4.376 1.00 0.00 C ATOM 0 H TRP A 6 14.348 5.969 -0.121 1.00 0.00 H new ATOM 0 HA TRP A 6 14.134 6.289 2.836 1.00 0.00 H new ATOM 0 HB2 TRP A 6 14.238 3.671 1.312 1.00 0.00 H new ATOM 0 HB3 TRP A 6 14.044 3.881 3.041 1.00 0.00 H new ATOM 0 HD1 TRP A 6 12.051 4.212 -0.281 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.491 3.725 0.151 1.00 0.00 H new ATOM 0 HE3 TRP A 6 12.330 4.077 4.807 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.975 3.231 2.497 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 10.298 3.492 6.101 1.00 0.00 H new ATOM 0 HH2 TRP A 6 8.157 3.061 4.960 1.00 0.00 H new ATOM 92 N LYS A 7 16.702 6.206 2.977 1.00 0.00 N ATOM 93 CA LYS A 7 18.181 6.076 3.164 1.00 0.00 C ATOM 94 C LYS A 7 18.568 4.893 4.099 1.00 0.00 C ATOM 95 O LYS A 7 17.909 4.642 5.112 1.00 0.00 O ATOM 96 CB LYS A 7 18.748 7.426 3.701 1.00 0.00 C ATOM 97 CG LYS A 7 19.224 8.401 2.597 1.00 0.00 C ATOM 98 CD LYS A 7 20.753 8.544 2.395 1.00 0.00 C ATOM 99 CE LYS A 7 21.527 7.280 1.966 1.00 0.00 C ATOM 100 NZ LYS A 7 22.075 6.538 3.120 1.00 0.00 N ATOM 0 H LYS A 7 16.259 6.841 3.641 1.00 0.00 H new ATOM 0 HA LYS A 7 18.626 5.848 2.195 1.00 0.00 H new ATOM 0 HB2 LYS A 7 17.979 7.918 4.297 1.00 0.00 H new ATOM 0 HB3 LYS A 7 19.584 7.216 4.369 1.00 0.00 H new ATOM 0 HG2 LYS A 7 18.786 8.081 1.651 1.00 0.00 H new ATOM 0 HG3 LYS A 7 18.818 9.388 2.819 1.00 0.00 H new ATOM 0 HD2 LYS A 7 20.924 9.316 1.645 1.00 0.00 H new ATOM 0 HD3 LYS A 7 21.185 8.905 3.328 1.00 0.00 H new ATOM 0 HE2 LYS A 7 20.865 6.626 1.398 1.00 0.00 H new ATOM 0 HE3 LYS A 7 22.342 7.564 1.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 22.711 5.788 2.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 22.605 7.190 3.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 21.295 6.112 3.661 1.00 0.00 H new ATOM 113 N VAL A 8 19.675 4.189 3.784 1.00 0.00 N ATOM 114 CA VAL A 8 20.153 3.037 4.608 1.00 0.00 C ATOM 115 C VAL A 8 20.684 3.499 6.006 1.00 0.00 C ATOM 116 O VAL A 8 21.676 4.227 6.112 1.00 0.00 O ATOM 117 CB VAL A 8 21.121 2.090 3.813 1.00 0.00 C ATOM 118 CG1 VAL A 8 22.588 2.556 3.707 1.00 0.00 C ATOM 119 CG2 VAL A 8 21.103 0.644 4.363 1.00 0.00 C ATOM 0 H VAL A 8 20.258 4.389 2.972 1.00 0.00 H new ATOM 0 HA VAL A 8 19.290 2.409 4.831 1.00 0.00 H new ATOM 0 HB VAL A 8 20.710 2.128 2.804 1.00 0.00 H new ATOM 0 HG11 VAL A 8 23.162 1.825 3.138 1.00 0.00 H new ATOM 0 HG12 VAL A 8 22.628 3.521 3.202 1.00 0.00 H new ATOM 0 HG13 VAL A 8 23.012 2.652 4.706 1.00 0.00 H new ATOM 0 HG21 VAL A 8 21.787 0.025 3.782 1.00 0.00 H new ATOM 0 HG22 VAL A 8 21.415 0.648 5.407 1.00 0.00 H new ATOM 0 HG23 VAL A 8 20.094 0.238 4.287 1.00 0.00 H new ATOM 129 N ASP A 9 20.002 3.059 7.070 1.00 0.00 N ATOM 130 CA ASP A 9 20.461 3.250 8.470 1.00 0.00 C ATOM 131 C ASP A 9 21.549 2.201 8.881 1.00 0.00 C ATOM 132 O ASP A 9 22.637 2.572 9.328 1.00 0.00 O ATOM 133 CB ASP A 9 19.173 3.212 9.333 1.00 0.00 C ATOM 134 CG ASP A 9 19.337 3.764 10.742 1.00 0.00 C ATOM 135 OD1 ASP A 9 19.403 4.999 10.913 1.00 0.00 O ATOM 136 OD2 ASP A 9 19.362 2.957 11.695 1.00 0.00 O ATOM 0 H ASP A 9 19.116 2.560 6.995 1.00 0.00 H new ATOM 0 HA ASP A 9 20.975 4.201 8.613 1.00 0.00 H new ATOM 0 HB2 ASP A 9 18.393 3.778 8.824 1.00 0.00 H new ATOM 0 HB3 ASP A 9 18.826 2.181 9.399 1.00 0.00 H new ATOM 141 N ARG A 10 21.259 0.896 8.703 1.00 0.00 N ATOM 142 CA ARG A 10 22.224 -0.200 9.011 1.00 0.00 C ATOM 143 C ARG A 10 22.042 -1.447 8.085 1.00 0.00 C ATOM 144 O ARG A 10 20.924 -1.825 7.718 1.00 0.00 O ATOM 145 CB ARG A 10 22.258 -0.557 10.531 1.00 0.00 C ATOM 146 CG ARG A 10 20.981 -1.116 11.212 1.00 0.00 C ATOM 147 CD ARG A 10 19.971 -0.048 11.655 1.00 0.00 C ATOM 148 NE ARG A 10 18.769 -0.685 12.254 1.00 0.00 N ATOM 149 CZ ARG A 10 17.598 -0.062 12.424 1.00 0.00 C ATOM 150 NH1 ARG A 10 17.416 1.222 12.229 1.00 0.00 N ATOM 151 NH2 ARG A 10 16.566 -0.760 12.793 1.00 0.00 N ATOM 0 H ARG A 10 20.362 0.566 8.346 1.00 0.00 H new ATOM 0 HA ARG A 10 23.215 0.190 8.777 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.053 -1.288 10.677 1.00 0.00 H new ATOM 0 HB3 ARG A 10 22.549 0.343 11.072 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.487 -1.800 10.522 1.00 0.00 H new ATOM 0 HG3 ARG A 10 21.276 -1.701 12.083 1.00 0.00 H new ATOM 0 HD2 ARG A 10 20.435 0.621 12.380 1.00 0.00 H new ATOM 0 HD3 ARG A 10 19.679 0.562 10.800 1.00 0.00 H new ATOM 0 HE ARG A 10 18.842 -1.657 12.554 1.00 0.00 H new ATOM 0 HH11 ARG A 10 18.195 1.808 11.929 1.00 0.00 H new ATOM 0 HH12 ARG A 10 16.495 1.635 12.377 1.00 0.00 H new ATOM 0 HH21 ARG A 10 16.658 -1.764 12.947 1.00 0.00 H new ATOM 0 HH22 ARG A 10 15.664 -0.304 12.928 1.00 0.00 H new ATOM 165 N SER A 11 23.166 -2.094 7.713 1.00 0.00 N ATOM 166 CA SER A 11 23.153 -3.371 6.937 1.00 0.00 C ATOM 167 C SER A 11 23.609 -4.560 7.837 1.00 0.00 C ATOM 168 O SER A 11 24.794 -4.899 7.923 1.00 0.00 O ATOM 169 CB SER A 11 24.000 -3.189 5.657 1.00 0.00 C ATOM 170 OG SER A 11 23.487 -2.120 4.859 1.00 0.00 O ATOM 0 H SER A 11 24.103 -1.758 7.935 1.00 0.00 H new ATOM 0 HA SER A 11 22.141 -3.621 6.617 1.00 0.00 H new ATOM 0 HB2 SER A 11 25.036 -2.983 5.927 1.00 0.00 H new ATOM 0 HB3 SER A 11 23.999 -4.113 5.080 1.00 0.00 H new ATOM 0 HG SER A 11 24.023 -1.313 5.009 1.00 0.00 H new ATOM 176 N GLU A 12 22.642 -5.177 8.533 1.00 0.00 N ATOM 177 CA GLU A 12 22.907 -6.157 9.622 1.00 0.00 C ATOM 178 C GLU A 12 23.115 -7.594 9.043 1.00 0.00 C ATOM 179 O GLU A 12 22.238 -8.147 8.373 1.00 0.00 O ATOM 180 CB GLU A 12 21.744 -6.084 10.655 1.00 0.00 C ATOM 181 CG GLU A 12 21.683 -4.770 11.485 1.00 0.00 C ATOM 182 CD GLU A 12 20.551 -4.664 12.502 1.00 0.00 C ATOM 183 OE1 GLU A 12 20.473 -5.522 13.405 1.00 0.00 O ATOM 184 OE2 GLU A 12 19.762 -3.694 12.432 1.00 0.00 O ATOM 0 H GLU A 12 21.649 -5.017 8.364 1.00 0.00 H new ATOM 0 HA GLU A 12 23.835 -5.906 10.136 1.00 0.00 H new ATOM 0 HB2 GLU A 12 20.799 -6.205 10.125 1.00 0.00 H new ATOM 0 HB3 GLU A 12 21.835 -6.926 11.342 1.00 0.00 H new ATOM 0 HG2 GLU A 12 22.629 -4.655 12.013 1.00 0.00 H new ATOM 0 HG3 GLU A 12 21.601 -3.932 10.793 1.00 0.00 H new ATOM 191 N ASN A 13 24.314 -8.172 9.272 1.00 0.00 N ATOM 192 CA ASN A 13 24.756 -9.481 8.683 1.00 0.00 C ATOM 193 C ASN A 13 24.996 -9.552 7.123 1.00 0.00 C ATOM 194 O ASN A 13 25.211 -10.644 6.585 1.00 0.00 O ATOM 195 CB ASN A 13 23.906 -10.651 9.271 1.00 0.00 C ATOM 196 CG ASN A 13 24.560 -12.039 9.234 1.00 0.00 C ATOM 197 OD1 ASN A 13 25.655 -12.253 9.743 1.00 0.00 O ATOM 198 ND2 ASN A 13 23.922 -13.027 8.660 1.00 0.00 N ATOM 0 H ASN A 13 25.019 -7.748 9.876 1.00 0.00 H new ATOM 0 HA ASN A 13 25.789 -9.597 9.012 1.00 0.00 H new ATOM 0 HB2 ASN A 13 23.663 -10.413 10.306 1.00 0.00 H new ATOM 0 HB3 ASN A 13 22.964 -10.700 8.725 1.00 0.00 H new ATOM 0 HD21 ASN A 13 24.336 -13.959 8.641 1.00 0.00 H new ATOM 0 HD22 ASN A 13 23.010 -12.865 8.232 1.00 0.00 H new ATOM 205 N TYR A 14 25.037 -8.418 6.389 1.00 0.00 N ATOM 206 CA TYR A 14 25.179 -8.415 4.898 1.00 0.00 C ATOM 207 C TYR A 14 26.523 -8.979 4.326 1.00 0.00 C ATOM 208 O TYR A 14 26.500 -9.694 3.322 1.00 0.00 O ATOM 209 CB TYR A 14 24.789 -7.006 4.362 1.00 0.00 C ATOM 210 CG TYR A 14 24.274 -6.998 2.909 1.00 0.00 C ATOM 211 CD1 TYR A 14 22.956 -7.376 2.630 1.00 0.00 C ATOM 212 CD2 TYR A 14 25.117 -6.631 1.852 1.00 0.00 C ATOM 213 CE1 TYR A 14 22.491 -7.407 1.318 1.00 0.00 C ATOM 214 CE2 TYR A 14 24.646 -6.653 0.540 1.00 0.00 C ATOM 215 CZ TYR A 14 23.339 -7.046 0.273 1.00 0.00 C ATOM 216 OH TYR A 14 22.883 -7.081 -1.018 1.00 0.00 O ATOM 0 H TYR A 14 24.974 -7.485 6.797 1.00 0.00 H new ATOM 0 HA TYR A 14 24.480 -9.155 4.508 1.00 0.00 H new ATOM 0 HB2 TYR A 14 24.020 -6.584 5.009 1.00 0.00 H new ATOM 0 HB3 TYR A 14 25.658 -6.351 4.430 1.00 0.00 H new ATOM 0 HD1 TYR A 14 22.294 -7.646 3.439 1.00 0.00 H new ATOM 0 HD2 TYR A 14 26.134 -6.330 2.054 1.00 0.00 H new ATOM 0 HE1 TYR A 14 21.475 -7.710 1.111 1.00 0.00 H new ATOM 0 HE2 TYR A 14 25.298 -6.364 -0.271 1.00 0.00 H new ATOM 0 HH TYR A 14 23.598 -6.799 -1.625 1.00 0.00 H new ATOM 226 N ASP A 15 27.672 -8.728 4.979 1.00 0.00 N ATOM 227 CA ASP A 15 28.973 -9.361 4.609 1.00 0.00 C ATOM 228 C ASP A 15 29.050 -10.922 4.750 1.00 0.00 C ATOM 229 O ASP A 15 29.585 -11.566 3.845 1.00 0.00 O ATOM 230 CB ASP A 15 30.132 -8.668 5.379 1.00 0.00 C ATOM 231 CG ASP A 15 30.307 -7.168 5.135 1.00 0.00 C ATOM 232 OD1 ASP A 15 30.633 -6.887 3.841 1.00 0.00 O ATOM 233 OD2 ASP A 15 30.158 -6.322 6.011 1.00 0.00 O ATOM 0 H ASP A 15 27.737 -8.089 5.771 1.00 0.00 H new ATOM 0 HA ASP A 15 29.072 -9.200 3.536 1.00 0.00 H new ATOM 0 HB2 ASP A 15 29.975 -8.825 6.446 1.00 0.00 H new ATOM 0 HB3 ASP A 15 31.064 -9.168 5.117 1.00 0.00 H new ATOM 238 N LYS A 16 28.524 -11.528 5.834 1.00 0.00 N ATOM 239 CA LYS A 16 28.409 -13.018 5.961 1.00 0.00 C ATOM 240 C LYS A 16 27.330 -13.692 5.047 1.00 0.00 C ATOM 241 O LYS A 16 27.618 -14.734 4.454 1.00 0.00 O ATOM 242 CB LYS A 16 28.245 -13.402 7.458 1.00 0.00 C ATOM 243 CG LYS A 16 29.551 -13.337 8.289 1.00 0.00 C ATOM 244 CD LYS A 16 30.469 -14.566 8.085 1.00 0.00 C ATOM 245 CE LYS A 16 31.887 -14.404 8.662 1.00 0.00 C ATOM 246 NZ LYS A 16 32.752 -13.635 7.741 1.00 0.00 N ATOM 0 H LYS A 16 28.168 -11.018 6.642 1.00 0.00 H new ATOM 0 HA LYS A 16 29.343 -13.429 5.577 1.00 0.00 H new ATOM 0 HB2 LYS A 16 27.509 -12.738 7.911 1.00 0.00 H new ATOM 0 HB3 LYS A 16 27.842 -14.413 7.518 1.00 0.00 H new ATOM 0 HG2 LYS A 16 30.100 -12.434 8.021 1.00 0.00 H new ATOM 0 HG3 LYS A 16 29.297 -13.253 9.346 1.00 0.00 H new ATOM 0 HD2 LYS A 16 30.000 -15.435 8.546 1.00 0.00 H new ATOM 0 HD3 LYS A 16 30.546 -14.774 7.018 1.00 0.00 H new ATOM 0 HE2 LYS A 16 31.835 -13.897 9.626 1.00 0.00 H new ATOM 0 HE3 LYS A 16 32.324 -15.386 8.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 33.605 -13.322 8.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 33.026 -14.237 6.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 32.234 -12.805 7.390 1.00 0.00 H new ATOM 259 N PHE A 17 26.137 -13.090 4.863 1.00 0.00 N ATOM 260 CA PHE A 17 25.240 -13.372 3.697 1.00 0.00 C ATOM 261 C PHE A 17 25.948 -13.394 2.290 1.00 0.00 C ATOM 262 O PHE A 17 25.870 -14.406 1.590 1.00 0.00 O ATOM 263 CB PHE A 17 24.044 -12.379 3.842 1.00 0.00 C ATOM 264 CG PHE A 17 23.174 -12.118 2.602 1.00 0.00 C ATOM 265 CD1 PHE A 17 22.127 -12.973 2.248 1.00 0.00 C ATOM 266 CD2 PHE A 17 23.499 -11.045 1.765 1.00 0.00 C ATOM 267 CE1 PHE A 17 21.442 -12.774 1.051 1.00 0.00 C ATOM 268 CE2 PHE A 17 22.837 -10.867 0.558 1.00 0.00 C ATOM 269 CZ PHE A 17 21.815 -11.735 0.197 1.00 0.00 C ATOM 0 H PHE A 17 25.760 -12.396 5.509 1.00 0.00 H new ATOM 0 HA PHE A 17 24.882 -14.401 3.725 1.00 0.00 H new ATOM 0 HB2 PHE A 17 23.394 -12.751 4.634 1.00 0.00 H new ATOM 0 HB3 PHE A 17 24.442 -11.422 4.179 1.00 0.00 H new ATOM 0 HD1 PHE A 17 21.849 -13.787 2.901 1.00 0.00 H new ATOM 0 HD2 PHE A 17 24.271 -10.350 2.060 1.00 0.00 H new ATOM 0 HE1 PHE A 17 20.622 -13.424 0.784 1.00 0.00 H new ATOM 0 HE2 PHE A 17 23.116 -10.056 -0.098 1.00 0.00 H new ATOM 0 HZ PHE A 17 21.307 -11.606 -0.747 1.00 0.00 H new ATOM 279 N MET A 18 26.652 -12.317 1.891 1.00 0.00 N ATOM 280 CA MET A 18 27.443 -12.291 0.627 1.00 0.00 C ATOM 281 C MET A 18 28.636 -13.314 0.558 1.00 0.00 C ATOM 282 O MET A 18 28.838 -13.933 -0.489 1.00 0.00 O ATOM 283 CB MET A 18 27.906 -10.839 0.348 1.00 0.00 C ATOM 284 CG MET A 18 26.823 -9.810 -0.027 1.00 0.00 C ATOM 285 SD MET A 18 27.604 -8.206 -0.301 1.00 0.00 S ATOM 286 CE MET A 18 27.496 -8.075 -2.093 1.00 0.00 C ATOM 0 H MET A 18 26.694 -11.447 2.422 1.00 0.00 H new ATOM 0 HA MET A 18 26.775 -12.633 -0.164 1.00 0.00 H new ATOM 0 HB2 MET A 18 28.425 -10.474 1.235 1.00 0.00 H new ATOM 0 HB3 MET A 18 28.637 -10.868 -0.460 1.00 0.00 H new ATOM 0 HG2 MET A 18 26.295 -10.130 -0.925 1.00 0.00 H new ATOM 0 HG3 MET A 18 26.082 -9.737 0.769 1.00 0.00 H new ATOM 0 HE1 MET A 18 27.939 -7.133 -2.416 1.00 0.00 H new ATOM 0 HE2 MET A 18 28.034 -8.905 -2.552 1.00 0.00 H new ATOM 0 HE3 MET A 18 26.450 -8.108 -2.398 1.00 0.00 H new ATOM 296 N GLU A 19 29.396 -13.546 1.647 1.00 0.00 N ATOM 297 CA GLU A 19 30.352 -14.690 1.739 1.00 0.00 C ATOM 298 C GLU A 19 29.708 -16.120 1.601 1.00 0.00 C ATOM 299 O GLU A 19 30.226 -16.935 0.834 1.00 0.00 O ATOM 300 CB GLU A 19 31.176 -14.510 3.040 1.00 0.00 C ATOM 301 CG GLU A 19 32.441 -15.404 3.156 1.00 0.00 C ATOM 302 CD GLU A 19 33.446 -14.916 4.187 1.00 0.00 C ATOM 303 OE1 GLU A 19 33.212 -15.085 5.398 1.00 0.00 O ATOM 304 OE2 GLU A 19 34.456 -14.297 3.782 1.00 0.00 O ATOM 0 H GLU A 19 29.373 -12.960 2.482 1.00 0.00 H new ATOM 0 HA GLU A 19 31.006 -14.657 0.868 1.00 0.00 H new ATOM 0 HB2 GLU A 19 31.481 -13.466 3.115 1.00 0.00 H new ATOM 0 HB3 GLU A 19 30.528 -14.715 3.892 1.00 0.00 H new ATOM 0 HG2 GLU A 19 32.135 -16.418 3.412 1.00 0.00 H new ATOM 0 HG3 GLU A 19 32.929 -15.455 2.183 1.00 0.00 H new ATOM 311 N LYS A 20 28.558 -16.403 2.256 1.00 0.00 N ATOM 312 CA LYS A 20 27.687 -17.576 1.925 1.00 0.00 C ATOM 313 C LYS A 20 27.214 -17.694 0.430 1.00 0.00 C ATOM 314 O LYS A 20 27.179 -18.807 -0.105 1.00 0.00 O ATOM 315 CB LYS A 20 26.502 -17.574 2.936 1.00 0.00 C ATOM 316 CG LYS A 20 25.484 -18.743 2.864 1.00 0.00 C ATOM 317 CD LYS A 20 25.892 -20.077 3.539 1.00 0.00 C ATOM 318 CE LYS A 20 26.993 -20.941 2.895 1.00 0.00 C ATOM 319 NZ LYS A 20 26.699 -21.297 1.491 1.00 0.00 N ATOM 0 H LYS A 20 28.202 -15.835 3.025 1.00 0.00 H new ATOM 0 HA LYS A 20 28.295 -18.475 2.027 1.00 0.00 H new ATOM 0 HB2 LYS A 20 26.921 -17.557 3.942 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.951 -16.643 2.804 1.00 0.00 H new ATOM 0 HG2 LYS A 20 24.551 -18.407 3.316 1.00 0.00 H new ATOM 0 HG3 LYS A 20 25.275 -18.945 1.814 1.00 0.00 H new ATOM 0 HD2 LYS A 20 26.209 -19.846 4.556 1.00 0.00 H new ATOM 0 HD3 LYS A 20 24.996 -20.693 3.617 1.00 0.00 H new ATOM 0 HE2 LYS A 20 27.940 -20.404 2.937 1.00 0.00 H new ATOM 0 HE3 LYS A 20 27.118 -21.854 3.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 27.348 -22.048 1.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 25.718 -21.635 1.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 26.823 -20.459 0.887 1.00 0.00 H new ATOM 332 N MET A 21 26.889 -16.582 -0.256 1.00 0.00 N ATOM 333 CA MET A 21 26.727 -16.561 -1.738 1.00 0.00 C ATOM 334 C MET A 21 27.967 -16.975 -2.603 1.00 0.00 C ATOM 335 O MET A 21 27.775 -17.586 -3.660 1.00 0.00 O ATOM 336 CB MET A 21 26.219 -15.164 -2.189 1.00 0.00 C ATOM 337 CG MET A 21 24.811 -14.810 -1.704 1.00 0.00 C ATOM 338 SD MET A 21 24.325 -13.209 -2.346 1.00 0.00 S ATOM 339 CE MET A 21 22.604 -13.604 -2.663 1.00 0.00 C ATOM 0 H MET A 21 26.731 -15.677 0.188 1.00 0.00 H new ATOM 0 HA MET A 21 26.000 -17.350 -1.931 1.00 0.00 H new ATOM 0 HB2 MET A 21 26.914 -14.406 -1.829 1.00 0.00 H new ATOM 0 HB3 MET A 21 26.235 -15.120 -3.278 1.00 0.00 H new ATOM 0 HG2 MET A 21 24.103 -15.572 -2.030 1.00 0.00 H new ATOM 0 HG3 MET A 21 24.786 -14.797 -0.614 1.00 0.00 H new ATOM 0 HE1 MET A 21 22.049 -12.685 -2.853 1.00 0.00 H new ATOM 0 HE2 MET A 21 22.535 -14.256 -3.534 1.00 0.00 H new ATOM 0 HE3 MET A 21 22.181 -14.111 -1.796 1.00 0.00 H new ATOM 349 N GLY A 22 29.194 -16.615 -2.189 1.00 0.00 N ATOM 350 CA GLY A 22 30.436 -16.898 -2.954 1.00 0.00 C ATOM 351 C GLY A 22 30.931 -15.717 -3.812 1.00 0.00 C ATOM 352 O GLY A 22 30.975 -15.830 -5.038 1.00 0.00 O ATOM 0 H GLY A 22 29.360 -16.118 -1.314 1.00 0.00 H new ATOM 0 HA2 GLY A 22 31.224 -17.180 -2.255 1.00 0.00 H new ATOM 0 HA3 GLY A 22 30.262 -17.757 -3.603 1.00 0.00 H new ATOM 356 N VAL A 23 31.295 -14.599 -3.162 1.00 0.00 N ATOM 357 CA VAL A 23 31.659 -13.325 -3.865 1.00 0.00 C ATOM 358 C VAL A 23 33.128 -12.847 -3.528 1.00 0.00 C ATOM 359 O VAL A 23 33.903 -13.554 -2.872 1.00 0.00 O ATOM 360 CB VAL A 23 30.529 -12.250 -3.647 1.00 0.00 C ATOM 361 CG1 VAL A 23 29.091 -12.671 -4.035 1.00 0.00 C ATOM 362 CG2 VAL A 23 30.528 -11.557 -2.276 1.00 0.00 C ATOM 0 H VAL A 23 31.350 -14.537 -2.145 1.00 0.00 H new ATOM 0 HA VAL A 23 31.700 -13.503 -4.940 1.00 0.00 H new ATOM 0 HB VAL A 23 30.840 -11.511 -4.386 1.00 0.00 H new ATOM 0 HG11 VAL A 23 28.405 -11.847 -3.839 1.00 0.00 H new ATOM 0 HG12 VAL A 23 29.060 -12.925 -5.095 1.00 0.00 H new ATOM 0 HG13 VAL A 23 28.794 -13.538 -3.445 1.00 0.00 H new ATOM 0 HG21 VAL A 23 29.711 -10.837 -2.233 1.00 0.00 H new ATOM 0 HG22 VAL A 23 30.397 -12.302 -1.492 1.00 0.00 H new ATOM 0 HG23 VAL A 23 31.476 -11.039 -2.129 1.00 0.00 H new ATOM 372 N ASN A 24 33.523 -11.622 -3.947 1.00 0.00 N ATOM 373 CA ASN A 24 34.807 -10.984 -3.516 1.00 0.00 C ATOM 374 C ASN A 24 34.870 -10.645 -1.971 1.00 0.00 C ATOM 375 O ASN A 24 33.900 -10.808 -1.223 1.00 0.00 O ATOM 376 CB ASN A 24 34.979 -9.749 -4.459 1.00 0.00 C ATOM 377 CG ASN A 24 36.355 -9.067 -4.524 1.00 0.00 C ATOM 378 OD1 ASN A 24 37.341 -9.464 -3.910 1.00 0.00 O ATOM 379 ND2 ASN A 24 36.464 -7.996 -5.269 1.00 0.00 N ATOM 0 H ASN A 24 32.974 -11.047 -4.586 1.00 0.00 H new ATOM 0 HA ASN A 24 35.648 -11.670 -3.617 1.00 0.00 H new ATOM 0 HB2 ASN A 24 34.716 -10.063 -5.469 1.00 0.00 H new ATOM 0 HB3 ASN A 24 34.249 -8.997 -4.158 1.00 0.00 H new ATOM 0 HD21 ASN A 24 37.357 -7.507 -5.332 1.00 0.00 H new ATOM 0 HD22 ASN A 24 35.656 -7.651 -5.787 1.00 0.00 H new ATOM 386 N ILE A 25 36.038 -10.196 -1.480 1.00 0.00 N ATOM 387 CA ILE A 25 36.192 -9.596 -0.112 1.00 0.00 C ATOM 388 C ILE A 25 36.104 -8.028 -0.078 1.00 0.00 C ATOM 389 O ILE A 25 35.412 -7.487 0.790 1.00 0.00 O ATOM 390 CB ILE A 25 37.406 -10.234 0.654 1.00 0.00 C ATOM 391 CG1 ILE A 25 37.372 -9.919 2.180 1.00 0.00 C ATOM 392 CG2 ILE A 25 38.791 -9.890 0.048 1.00 0.00 C ATOM 393 CD1 ILE A 25 38.157 -10.899 3.069 1.00 0.00 C ATOM 0 H ILE A 25 36.910 -10.232 -2.007 1.00 0.00 H new ATOM 0 HA ILE A 25 35.310 -9.873 0.465 1.00 0.00 H new ATOM 0 HB ILE A 25 37.278 -11.309 0.524 1.00 0.00 H new ATOM 0 HG12 ILE A 25 37.767 -8.915 2.336 1.00 0.00 H new ATOM 0 HG13 ILE A 25 36.333 -9.907 2.509 1.00 0.00 H new ATOM 0 HG21 ILE A 25 39.574 -10.369 0.635 1.00 0.00 H new ATOM 0 HG22 ILE A 25 38.838 -10.249 -0.980 1.00 0.00 H new ATOM 0 HG23 ILE A 25 38.936 -8.810 0.062 1.00 0.00 H new ATOM 0 HD11 ILE A 25 38.071 -10.593 4.112 1.00 0.00 H new ATOM 0 HD12 ILE A 25 37.750 -11.903 2.951 1.00 0.00 H new ATOM 0 HD13 ILE A 25 39.207 -10.896 2.775 1.00 0.00 H new ATOM 405 N VAL A 26 36.778 -7.301 -0.993 1.00 0.00 N ATOM 406 CA VAL A 26 36.790 -5.801 -1.007 1.00 0.00 C ATOM 407 C VAL A 26 35.419 -5.201 -1.474 1.00 0.00 C ATOM 408 O VAL A 26 34.792 -4.470 -0.702 1.00 0.00 O ATOM 409 CB VAL A 26 38.035 -5.244 -1.792 1.00 0.00 C ATOM 410 CG1 VAL A 26 38.109 -3.697 -1.803 1.00 0.00 C ATOM 411 CG2 VAL A 26 39.399 -5.740 -1.249 1.00 0.00 C ATOM 0 H VAL A 26 37.329 -7.721 -1.742 1.00 0.00 H new ATOM 0 HA VAL A 26 36.909 -5.457 0.021 1.00 0.00 H new ATOM 0 HB VAL A 26 37.872 -5.632 -2.797 1.00 0.00 H new ATOM 0 HG11 VAL A 26 38.990 -3.379 -2.360 1.00 0.00 H new ATOM 0 HG12 VAL A 26 37.214 -3.293 -2.277 1.00 0.00 H new ATOM 0 HG13 VAL A 26 38.175 -3.329 -0.779 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.205 -5.311 -1.844 1.00 0.00 H new ATOM 0 HG22 VAL A 26 39.511 -5.431 -0.210 1.00 0.00 H new ATOM 0 HG23 VAL A 26 39.442 -6.827 -1.311 1.00 0.00 H new ATOM 421 N LYS A 27 34.948 -5.502 -2.704 1.00 0.00 N ATOM 422 CA LYS A 27 33.623 -5.029 -3.212 1.00 0.00 C ATOM 423 C LYS A 27 32.385 -5.379 -2.325 1.00 0.00 C ATOM 424 O LYS A 27 31.642 -4.471 -1.960 1.00 0.00 O ATOM 425 CB LYS A 27 33.439 -5.494 -4.677 1.00 0.00 C ATOM 426 CG LYS A 27 34.253 -4.691 -5.719 1.00 0.00 C ATOM 427 CD LYS A 27 33.769 -4.915 -7.164 1.00 0.00 C ATOM 428 CE LYS A 27 34.144 -6.291 -7.743 1.00 0.00 C ATOM 429 NZ LYS A 27 33.518 -6.491 -9.063 1.00 0.00 N ATOM 0 H LYS A 27 35.463 -6.074 -3.374 1.00 0.00 H new ATOM 0 HA LYS A 27 33.656 -3.941 -3.161 1.00 0.00 H new ATOM 0 HB2 LYS A 27 33.720 -6.545 -4.748 1.00 0.00 H new ATOM 0 HB3 LYS A 27 32.382 -5.429 -4.934 1.00 0.00 H new ATOM 0 HG2 LYS A 27 34.190 -3.629 -5.481 1.00 0.00 H new ATOM 0 HG3 LYS A 27 35.304 -4.972 -5.646 1.00 0.00 H new ATOM 0 HD2 LYS A 27 32.685 -4.802 -7.195 1.00 0.00 H new ATOM 0 HD3 LYS A 27 34.189 -4.137 -7.802 1.00 0.00 H new ATOM 0 HE2 LYS A 27 35.227 -6.370 -7.833 1.00 0.00 H new ATOM 0 HE3 LYS A 27 33.823 -7.078 -7.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 33.784 -7.425 -9.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 32.484 -6.438 -8.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 33.844 -5.752 -9.718 1.00 0.00 H new ATOM 442 N ARG A 28 32.224 -6.643 -1.905 1.00 0.00 N ATOM 443 CA ARG A 28 31.377 -7.060 -0.748 1.00 0.00 C ATOM 444 C ARG A 28 31.277 -6.105 0.496 1.00 0.00 C ATOM 445 O ARG A 28 30.165 -5.787 0.924 1.00 0.00 O ATOM 446 CB ARG A 28 31.941 -8.459 -0.377 1.00 0.00 C ATOM 447 CG ARG A 28 31.182 -9.282 0.699 1.00 0.00 C ATOM 448 CD ARG A 28 32.045 -9.771 1.881 1.00 0.00 C ATOM 449 NE ARG A 28 33.000 -10.808 1.410 1.00 0.00 N ATOM 450 CZ ARG A 28 33.604 -11.709 2.171 1.00 0.00 C ATOM 451 NH1 ARG A 28 33.553 -11.723 3.476 1.00 0.00 N ATOM 452 NH2 ARG A 28 34.278 -12.656 1.594 1.00 0.00 N ATOM 0 H ARG A 28 32.684 -7.430 -2.362 1.00 0.00 H new ATOM 0 HA ARG A 28 30.332 -7.044 -1.056 1.00 0.00 H new ATOM 0 HB2 ARG A 28 31.983 -9.056 -1.288 1.00 0.00 H new ATOM 0 HB3 ARG A 28 32.968 -8.327 -0.035 1.00 0.00 H new ATOM 0 HG2 ARG A 28 30.368 -8.673 1.092 1.00 0.00 H new ATOM 0 HG3 ARG A 28 30.729 -10.149 0.218 1.00 0.00 H new ATOM 0 HD2 ARG A 28 32.589 -8.933 2.317 1.00 0.00 H new ATOM 0 HD3 ARG A 28 31.407 -10.180 2.665 1.00 0.00 H new ATOM 0 HE ARG A 28 33.209 -10.828 0.412 1.00 0.00 H new ATOM 0 HH11 ARG A 28 33.022 -11.008 3.973 1.00 0.00 H new ATOM 0 HH12 ARG A 28 34.044 -12.449 3.998 1.00 0.00 H new ATOM 0 HH21 ARG A 28 34.334 -12.695 0.576 1.00 0.00 H new ATOM 0 HH22 ARG A 28 34.752 -13.361 2.158 1.00 0.00 H new ATOM 466 N LYS A 29 32.413 -5.652 1.058 1.00 0.00 N ATOM 467 CA LYS A 29 32.434 -4.602 2.123 1.00 0.00 C ATOM 468 C LYS A 29 32.123 -3.145 1.645 1.00 0.00 C ATOM 469 O LYS A 29 31.385 -2.438 2.339 1.00 0.00 O ATOM 470 CB LYS A 29 33.768 -4.699 2.910 1.00 0.00 C ATOM 471 CG LYS A 29 33.845 -5.921 3.858 1.00 0.00 C ATOM 472 CD LYS A 29 35.069 -5.942 4.787 1.00 0.00 C ATOM 473 CE LYS A 29 36.384 -6.328 4.088 1.00 0.00 C ATOM 474 NZ LYS A 29 37.486 -6.331 5.071 1.00 0.00 N ATOM 0 H LYS A 29 33.339 -5.992 0.798 1.00 0.00 H new ATOM 0 HA LYS A 29 31.595 -4.818 2.785 1.00 0.00 H new ATOM 0 HB2 LYS A 29 34.595 -4.748 2.201 1.00 0.00 H new ATOM 0 HB3 LYS A 29 33.902 -3.788 3.494 1.00 0.00 H new ATOM 0 HG2 LYS A 29 32.943 -5.946 4.469 1.00 0.00 H new ATOM 0 HG3 LYS A 29 33.848 -6.830 3.256 1.00 0.00 H new ATOM 0 HD2 LYS A 29 35.186 -4.957 5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 29 34.883 -6.644 5.599 1.00 0.00 H new ATOM 0 HE2 LYS A 29 36.289 -7.313 3.631 1.00 0.00 H new ATOM 0 HE3 LYS A 29 36.601 -5.623 3.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.374 -6.592 4.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 37.582 -5.383 5.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 37.279 -7.020 5.822 1.00 0.00 H new ATOM 487 N LEU A 30 32.616 -2.702 0.469 1.00 0.00 N ATOM 488 CA LEU A 30 32.148 -1.436 -0.178 1.00 0.00 C ATOM 489 C LEU A 30 30.607 -1.379 -0.488 1.00 0.00 C ATOM 490 O LEU A 30 29.976 -0.360 -0.215 1.00 0.00 O ATOM 491 CB LEU A 30 32.986 -1.151 -1.460 1.00 0.00 C ATOM 492 CG LEU A 30 34.529 -1.016 -1.359 1.00 0.00 C ATOM 493 CD1 LEU A 30 35.131 -0.726 -2.745 1.00 0.00 C ATOM 494 CD2 LEU A 30 34.977 0.078 -0.373 1.00 0.00 C ATOM 0 H LEU A 30 33.337 -3.194 -0.059 1.00 0.00 H new ATOM 0 HA LEU A 30 32.310 -0.650 0.559 1.00 0.00 H new ATOM 0 HB2 LEU A 30 32.775 -1.950 -2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 30 32.607 -0.228 -1.898 1.00 0.00 H new ATOM 0 HG LEU A 30 34.895 -1.969 -0.977 1.00 0.00 H new ATOM 0 HD11 LEU A 30 36.214 -0.634 -2.659 1.00 0.00 H new ATOM 0 HD12 LEU A 30 34.889 -1.543 -3.425 1.00 0.00 H new ATOM 0 HD13 LEU A 30 34.717 0.204 -3.134 1.00 0.00 H new ATOM 0 HD21 LEU A 30 36.066 0.122 -0.348 1.00 0.00 H new ATOM 0 HD22 LEU A 30 34.582 1.042 -0.695 1.00 0.00 H new ATOM 0 HD23 LEU A 30 34.601 -0.154 0.623 1.00 0.00 H new ATOM 506 N ALA A 31 30.014 -2.468 -1.010 1.00 0.00 N ATOM 507 CA ALA A 31 28.547 -2.660 -1.127 1.00 0.00 C ATOM 508 C ALA A 31 27.732 -2.747 0.209 1.00 0.00 C ATOM 509 O ALA A 31 26.658 -2.147 0.300 1.00 0.00 O ATOM 510 CB ALA A 31 28.387 -3.946 -1.945 1.00 0.00 C ATOM 0 H ALA A 31 30.548 -3.259 -1.371 1.00 0.00 H new ATOM 0 HA ALA A 31 28.123 -1.769 -1.590 1.00 0.00 H new ATOM 0 HB1 ALA A 31 27.327 -4.162 -2.079 1.00 0.00 H new ATOM 0 HB2 ALA A 31 28.857 -3.818 -2.920 1.00 0.00 H new ATOM 0 HB3 ALA A 31 28.863 -4.774 -1.419 1.00 0.00 H new ATOM 516 N ALA A 32 28.223 -3.472 1.239 1.00 0.00 N ATOM 517 CA ALA A 32 27.645 -3.446 2.613 1.00 0.00 C ATOM 518 C ALA A 32 27.495 -2.039 3.281 1.00 0.00 C ATOM 519 O ALA A 32 26.432 -1.746 3.839 1.00 0.00 O ATOM 520 CB ALA A 32 28.506 -4.394 3.474 1.00 0.00 C ATOM 0 H ALA A 32 29.028 -4.091 1.148 1.00 0.00 H new ATOM 0 HA ALA A 32 26.608 -3.772 2.536 1.00 0.00 H new ATOM 0 HB1 ALA A 32 28.121 -4.410 4.494 1.00 0.00 H new ATOM 0 HB2 ALA A 32 28.468 -5.400 3.056 1.00 0.00 H new ATOM 0 HB3 ALA A 32 29.538 -4.043 3.481 1.00 0.00 H new ATOM 526 N HIS A 33 28.521 -1.171 3.189 1.00 0.00 N ATOM 527 CA HIS A 33 28.447 0.232 3.695 1.00 0.00 C ATOM 528 C HIS A 33 28.527 1.285 2.531 1.00 0.00 C ATOM 529 O HIS A 33 29.325 2.227 2.578 1.00 0.00 O ATOM 530 CB HIS A 33 29.525 0.408 4.809 1.00 0.00 C ATOM 531 CG HIS A 33 29.380 -0.498 6.041 1.00 0.00 C ATOM 532 ND1 HIS A 33 30.219 -1.570 6.297 1.00 0.00 N ATOM 533 CD2 HIS A 33 28.335 -0.454 6.980 1.00 0.00 C ATOM 534 CE1 HIS A 33 29.576 -2.082 7.396 1.00 0.00 C ATOM 535 NE2 HIS A 33 28.439 -1.492 7.891 1.00 0.00 N ATOM 0 H HIS A 33 29.419 -1.409 2.768 1.00 0.00 H new ATOM 0 HA HIS A 33 27.473 0.425 4.145 1.00 0.00 H new ATOM 0 HB2 HIS A 33 30.506 0.232 4.368 1.00 0.00 H new ATOM 0 HB3 HIS A 33 29.507 1.446 5.142 1.00 0.00 H new ATOM 0 HD2 HIS A 33 27.554 0.291 6.990 1.00 0.00 H new ATOM 0 HE1 HIS A 33 29.971 -2.963 7.880 1.00 0.00 H new ATOM 0 HE2 HIS A 33 27.851 -1.742 8.686 1.00 0.00 H new ATOM 542 N ASP A 34 27.645 1.172 1.514 1.00 0.00 N ATOM 543 CA ASP A 34 27.628 2.091 0.334 1.00 0.00 C ATOM 544 C ASP A 34 26.865 3.459 0.477 1.00 0.00 C ATOM 545 O ASP A 34 27.028 4.337 -0.378 1.00 0.00 O ATOM 546 CB ASP A 34 27.189 1.291 -0.927 1.00 0.00 C ATOM 547 CG ASP A 34 25.755 0.784 -1.077 1.00 0.00 C ATOM 548 OD1 ASP A 34 25.072 0.511 -0.067 1.00 0.00 O ATOM 549 OD2 ASP A 34 25.304 0.648 -2.237 1.00 0.00 O ATOM 0 H ASP A 34 26.926 0.449 1.479 1.00 0.00 H new ATOM 0 HA ASP A 34 28.655 2.443 0.239 1.00 0.00 H new ATOM 0 HB2 ASP A 34 27.398 1.920 -1.793 1.00 0.00 H new ATOM 0 HB3 ASP A 34 27.844 0.423 -0.998 1.00 0.00 H new ATOM 554 N ASN A 35 26.029 3.653 1.517 1.00 0.00 N ATOM 555 CA ASN A 35 25.048 4.783 1.618 1.00 0.00 C ATOM 556 C ASN A 35 23.924 4.724 0.523 1.00 0.00 C ATOM 557 O ASN A 35 23.782 5.629 -0.304 1.00 0.00 O ATOM 558 CB ASN A 35 25.722 6.180 1.778 1.00 0.00 C ATOM 559 CG ASN A 35 26.489 6.395 3.085 1.00 0.00 C ATOM 560 OD1 ASN A 35 25.922 6.749 4.111 1.00 0.00 O ATOM 561 ND2 ASN A 35 27.784 6.192 3.103 1.00 0.00 N ATOM 0 H ASN A 35 26.006 3.031 2.325 1.00 0.00 H new ATOM 0 HA ASN A 35 24.521 4.634 2.560 1.00 0.00 H new ATOM 0 HB2 ASN A 35 26.409 6.330 0.945 1.00 0.00 H new ATOM 0 HB3 ASN A 35 24.952 6.947 1.699 1.00 0.00 H new ATOM 0 HD21 ASN A 35 28.310 6.329 3.966 1.00 0.00 H new ATOM 0 HD22 ASN A 35 28.266 5.897 2.254 1.00 0.00 H new ATOM 568 N LEU A 36 23.124 3.638 0.529 1.00 0.00 N ATOM 569 CA LEU A 36 22.062 3.403 -0.484 1.00 0.00 C ATOM 570 C LEU A 36 20.726 4.141 -0.162 1.00 0.00 C ATOM 571 O LEU A 36 20.073 3.918 0.861 1.00 0.00 O ATOM 572 CB LEU A 36 21.922 1.867 -0.690 1.00 0.00 C ATOM 573 CG LEU A 36 20.850 1.368 -1.698 1.00 0.00 C ATOM 574 CD1 LEU A 36 21.083 1.839 -3.136 1.00 0.00 C ATOM 575 CD2 LEU A 36 20.788 -0.168 -1.720 1.00 0.00 C ATOM 0 H LEU A 36 23.191 2.900 1.230 1.00 0.00 H new ATOM 0 HA LEU A 36 22.354 3.851 -1.434 1.00 0.00 H new ATOM 0 HB2 LEU A 36 22.890 1.482 -1.012 1.00 0.00 H new ATOM 0 HB3 LEU A 36 21.706 1.417 0.279 1.00 0.00 H new ATOM 0 HG LEU A 36 19.915 1.800 -1.342 1.00 0.00 H new ATOM 0 HD11 LEU A 36 20.293 1.450 -3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 36 21.073 2.928 -3.168 1.00 0.00 H new ATOM 0 HD13 LEU A 36 22.049 1.475 -3.486 1.00 0.00 H new ATOM 0 HD21 LEU A 36 20.030 -0.491 -2.433 1.00 0.00 H new ATOM 0 HD22 LEU A 36 21.758 -0.567 -2.016 1.00 0.00 H new ATOM 0 HD23 LEU A 36 20.532 -0.536 -0.727 1.00 0.00 H new ATOM 587 N LYS A 37 20.331 4.999 -1.109 1.00 0.00 N ATOM 588 CA LYS A 37 19.045 5.725 -1.106 1.00 0.00 C ATOM 589 C LYS A 37 18.071 5.034 -2.110 1.00 0.00 C ATOM 590 O LYS A 37 18.335 4.979 -3.318 1.00 0.00 O ATOM 591 CB LYS A 37 19.398 7.187 -1.491 1.00 0.00 C ATOM 592 CG LYS A 37 18.218 8.180 -1.442 1.00 0.00 C ATOM 593 CD LYS A 37 18.633 9.643 -1.726 1.00 0.00 C ATOM 594 CE LYS A 37 18.929 9.978 -3.201 1.00 0.00 C ATOM 595 NZ LYS A 37 17.687 10.091 -3.996 1.00 0.00 N ATOM 0 H LYS A 37 20.908 5.217 -1.922 1.00 0.00 H new ATOM 0 HA LYS A 37 18.534 5.717 -0.143 1.00 0.00 H new ATOM 0 HB2 LYS A 37 20.181 7.544 -0.822 1.00 0.00 H new ATOM 0 HB3 LYS A 37 19.814 7.191 -2.498 1.00 0.00 H new ATOM 0 HG2 LYS A 37 17.466 7.876 -2.170 1.00 0.00 H new ATOM 0 HG3 LYS A 37 17.749 8.127 -0.459 1.00 0.00 H new ATOM 0 HD2 LYS A 37 17.838 10.302 -1.375 1.00 0.00 H new ATOM 0 HD3 LYS A 37 19.520 9.871 -1.135 1.00 0.00 H new ATOM 0 HE2 LYS A 37 19.484 10.915 -3.257 1.00 0.00 H new ATOM 0 HE3 LYS A 37 19.566 9.204 -3.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 17.904 9.944 -5.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.006 9.371 -3.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 17.276 11.037 -3.865 1.00 0.00 H new ATOM 608 N LEU A 38 16.940 4.522 -1.602 1.00 0.00 N ATOM 609 CA LEU A 38 15.874 3.922 -2.446 1.00 0.00 C ATOM 610 C LEU A 38 14.771 4.985 -2.729 1.00 0.00 C ATOM 611 O LEU A 38 13.906 5.211 -1.877 1.00 0.00 O ATOM 612 CB LEU A 38 15.251 2.682 -1.739 1.00 0.00 C ATOM 613 CG LEU A 38 16.153 1.479 -1.375 1.00 0.00 C ATOM 614 CD1 LEU A 38 15.303 0.422 -0.656 1.00 0.00 C ATOM 615 CD2 LEU A 38 16.837 0.842 -2.593 1.00 0.00 C ATOM 0 H LEU A 38 16.731 4.508 -0.604 1.00 0.00 H new ATOM 0 HA LEU A 38 16.313 3.597 -3.389 1.00 0.00 H new ATOM 0 HB2 LEU A 38 14.785 3.031 -0.818 1.00 0.00 H new ATOM 0 HB3 LEU A 38 14.451 2.309 -2.379 1.00 0.00 H new ATOM 0 HG LEU A 38 16.948 1.854 -0.731 1.00 0.00 H new ATOM 0 HD11 LEU A 38 15.929 -0.431 -0.394 1.00 0.00 H new ATOM 0 HD12 LEU A 38 14.878 0.852 0.251 1.00 0.00 H new ATOM 0 HD13 LEU A 38 14.498 0.094 -1.313 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.454 0.005 -2.267 1.00 0.00 H new ATOM 0 HD22 LEU A 38 16.079 0.484 -3.290 1.00 0.00 H new ATOM 0 HD23 LEU A 38 17.464 1.584 -3.088 1.00 0.00 H new ATOM 627 N THR A 39 14.769 5.620 -3.915 1.00 0.00 N ATOM 628 CA THR A 39 13.643 6.512 -4.335 1.00 0.00 C ATOM 629 C THR A 39 12.597 5.666 -5.128 1.00 0.00 C ATOM 630 O THR A 39 12.799 5.304 -6.292 1.00 0.00 O ATOM 631 CB THR A 39 14.170 7.805 -5.025 1.00 0.00 C ATOM 632 OG1 THR A 39 14.891 8.590 -4.077 1.00 0.00 O ATOM 633 CG2 THR A 39 13.075 8.738 -5.568 1.00 0.00 C ATOM 0 H THR A 39 15.520 5.542 -4.601 1.00 0.00 H new ATOM 0 HA THR A 39 13.103 6.907 -3.475 1.00 0.00 H new ATOM 0 HB THR A 39 14.772 7.444 -5.859 1.00 0.00 H new ATOM 0 HG1 THR A 39 14.259 9.054 -3.489 1.00 0.00 H new ATOM 0 HG21 THR A 39 13.537 9.610 -6.030 1.00 0.00 H new ATOM 0 HG22 THR A 39 12.479 8.207 -6.310 1.00 0.00 H new ATOM 0 HG23 THR A 39 12.432 9.059 -4.749 1.00 0.00 H new ATOM 641 N ILE A 40 11.491 5.335 -4.441 1.00 0.00 N ATOM 642 CA ILE A 40 10.432 4.420 -4.951 1.00 0.00 C ATOM 643 C ILE A 40 9.218 5.298 -5.405 1.00 0.00 C ATOM 644 O ILE A 40 8.650 6.038 -4.597 1.00 0.00 O ATOM 645 CB ILE A 40 10.047 3.361 -3.843 1.00 0.00 C ATOM 646 CG1 ILE A 40 11.254 2.516 -3.321 1.00 0.00 C ATOM 647 CG2 ILE A 40 8.899 2.428 -4.317 1.00 0.00 C ATOM 648 CD1 ILE A 40 10.984 1.552 -2.149 1.00 0.00 C ATOM 0 H ILE A 40 11.296 5.694 -3.506 1.00 0.00 H new ATOM 0 HA ILE A 40 10.783 3.845 -5.808 1.00 0.00 H new ATOM 0 HB ILE A 40 9.699 3.954 -2.997 1.00 0.00 H new ATOM 0 HG12 ILE A 40 11.644 1.933 -4.155 1.00 0.00 H new ATOM 0 HG13 ILE A 40 12.042 3.205 -3.017 1.00 0.00 H new ATOM 0 HG21 ILE A 40 8.662 1.713 -3.529 1.00 0.00 H new ATOM 0 HG22 ILE A 40 8.015 3.025 -4.544 1.00 0.00 H new ATOM 0 HG23 ILE A 40 9.213 1.890 -5.212 1.00 0.00 H new ATOM 0 HD11 ILE A 40 11.905 1.030 -1.888 1.00 0.00 H new ATOM 0 HD12 ILE A 40 10.630 2.117 -1.287 1.00 0.00 H new ATOM 0 HD13 ILE A 40 10.226 0.826 -2.442 1.00 0.00 H new ATOM 660 N THR A 41 8.779 5.166 -6.669 1.00 0.00 N ATOM 661 CA THR A 41 7.481 5.753 -7.134 1.00 0.00 C ATOM 662 C THR A 41 6.550 4.586 -7.594 1.00 0.00 C ATOM 663 O THR A 41 6.794 3.972 -8.643 1.00 0.00 O ATOM 664 CB THR A 41 7.645 6.838 -8.244 1.00 0.00 C ATOM 665 OG1 THR A 41 8.137 6.263 -9.446 1.00 0.00 O ATOM 666 CG2 THR A 41 8.555 8.025 -7.886 1.00 0.00 C ATOM 0 H THR A 41 9.291 4.663 -7.394 1.00 0.00 H new ATOM 0 HA THR A 41 7.030 6.287 -6.298 1.00 0.00 H new ATOM 0 HB THR A 41 6.637 7.235 -8.362 1.00 0.00 H new ATOM 0 HG1 THR A 41 7.815 5.341 -9.523 1.00 0.00 H new ATOM 0 HG21 THR A 41 8.598 8.717 -8.727 1.00 0.00 H new ATOM 0 HG22 THR A 41 8.155 8.540 -7.012 1.00 0.00 H new ATOM 0 HG23 THR A 41 9.558 7.661 -7.665 1.00 0.00 H new ATOM 674 N GLN A 42 5.503 4.278 -6.805 1.00 0.00 N ATOM 675 CA GLN A 42 4.540 3.184 -7.118 1.00 0.00 C ATOM 676 C GLN A 42 3.377 3.694 -8.032 1.00 0.00 C ATOM 677 O GLN A 42 2.328 4.141 -7.554 1.00 0.00 O ATOM 678 CB GLN A 42 4.072 2.583 -5.763 1.00 0.00 C ATOM 679 CG GLN A 42 3.157 1.338 -5.878 1.00 0.00 C ATOM 680 CD GLN A 42 2.758 0.696 -4.539 1.00 0.00 C ATOM 681 OE1 GLN A 42 3.428 0.784 -3.514 1.00 0.00 O ATOM 682 NE2 GLN A 42 1.666 -0.031 -4.512 1.00 0.00 N ATOM 0 H GLN A 42 5.294 4.771 -5.937 1.00 0.00 H new ATOM 0 HA GLN A 42 5.008 2.392 -7.703 1.00 0.00 H new ATOM 0 HB2 GLN A 42 4.952 2.315 -5.179 1.00 0.00 H new ATOM 0 HB3 GLN A 42 3.541 3.354 -5.205 1.00 0.00 H new ATOM 0 HG2 GLN A 42 2.250 1.621 -6.412 1.00 0.00 H new ATOM 0 HG3 GLN A 42 3.664 0.589 -6.486 1.00 0.00 H new ATOM 0 HE21 GLN A 42 1.092 -0.120 -5.350 1.00 0.00 H new ATOM 0 HE22 GLN A 42 1.391 -0.507 -3.653 1.00 0.00 H new ATOM 691 N GLU A 43 3.557 3.584 -9.358 1.00 0.00 N ATOM 692 CA GLU A 43 2.584 4.109 -10.357 1.00 0.00 C ATOM 693 C GLU A 43 1.490 3.047 -10.733 1.00 0.00 C ATOM 694 O GLU A 43 1.444 2.539 -11.859 1.00 0.00 O ATOM 695 CB GLU A 43 3.376 4.646 -11.591 1.00 0.00 C ATOM 696 CG GLU A 43 4.457 5.742 -11.362 1.00 0.00 C ATOM 697 CD GLU A 43 3.983 7.044 -10.732 1.00 0.00 C ATOM 698 OE1 GLU A 43 3.369 7.866 -11.444 1.00 0.00 O ATOM 699 OE2 GLU A 43 4.247 7.255 -9.531 1.00 0.00 O ATOM 0 H GLU A 43 4.371 3.134 -9.776 1.00 0.00 H new ATOM 0 HA GLU A 43 2.024 4.937 -9.923 1.00 0.00 H new ATOM 0 HB2 GLU A 43 3.863 3.795 -12.068 1.00 0.00 H new ATOM 0 HB3 GLU A 43 2.651 5.039 -12.304 1.00 0.00 H new ATOM 0 HG2 GLU A 43 5.239 5.322 -10.730 1.00 0.00 H new ATOM 0 HG3 GLU A 43 4.915 5.975 -12.323 1.00 0.00 H new ATOM 706 N GLY A 44 0.599 2.709 -9.774 1.00 0.00 N ATOM 707 CA GLY A 44 -0.533 1.759 -9.998 1.00 0.00 C ATOM 708 C GLY A 44 -0.162 0.312 -10.399 1.00 0.00 C ATOM 709 O GLY A 44 -0.200 -0.011 -11.587 1.00 0.00 O ATOM 0 H GLY A 44 0.637 3.081 -8.825 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -1.126 1.717 -9.085 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -1.175 2.173 -10.776 1.00 0.00 H new ATOM 713 N ASN A 45 0.250 -0.535 -9.435 1.00 0.00 N ATOM 714 CA ASN A 45 0.906 -1.864 -9.719 1.00 0.00 C ATOM 715 C ASN A 45 2.375 -1.823 -10.264 1.00 0.00 C ATOM 716 O ASN A 45 3.159 -2.718 -9.927 1.00 0.00 O ATOM 717 CB ASN A 45 0.025 -2.891 -10.494 1.00 0.00 C ATOM 718 CG ASN A 45 -1.230 -3.365 -9.753 1.00 0.00 C ATOM 719 OD1 ASN A 45 -2.327 -2.849 -9.926 1.00 0.00 O ATOM 720 ND2 ASN A 45 -1.118 -4.361 -8.906 1.00 0.00 N ATOM 0 H ASN A 45 0.147 -0.336 -8.440 1.00 0.00 H new ATOM 0 HA ASN A 45 1.003 -2.248 -8.703 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -0.279 -2.444 -11.440 1.00 0.00 H new ATOM 0 HB3 ASN A 45 0.636 -3.761 -10.734 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -1.939 -4.696 -8.401 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -0.210 -4.800 -8.752 1.00 0.00 H new ATOM 727 N LYS A 46 2.751 -0.821 -11.078 1.00 0.00 N ATOM 728 CA LYS A 46 4.154 -0.603 -11.509 1.00 0.00 C ATOM 729 C LYS A 46 5.035 0.073 -10.404 1.00 0.00 C ATOM 730 O LYS A 46 4.564 0.853 -9.574 1.00 0.00 O ATOM 731 CB LYS A 46 4.141 0.188 -12.850 1.00 0.00 C ATOM 732 CG LYS A 46 5.224 -0.298 -13.838 1.00 0.00 C ATOM 733 CD LYS A 46 5.285 0.544 -15.125 1.00 0.00 C ATOM 734 CE LYS A 46 6.178 -0.105 -16.193 1.00 0.00 C ATOM 735 NZ LYS A 46 6.308 0.786 -17.363 1.00 0.00 N ATOM 0 H LYS A 46 2.096 -0.137 -11.458 1.00 0.00 H new ATOM 0 HA LYS A 46 4.631 -1.569 -11.673 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.160 0.090 -13.315 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.292 1.248 -12.644 1.00 0.00 H new ATOM 0 HG2 LYS A 46 6.196 -0.270 -13.346 1.00 0.00 H new ATOM 0 HG3 LYS A 46 5.029 -1.338 -14.100 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.278 0.672 -15.523 1.00 0.00 H new ATOM 0 HD3 LYS A 46 5.664 1.539 -14.890 1.00 0.00 H new ATOM 0 HE2 LYS A 46 7.163 -0.314 -15.775 1.00 0.00 H new ATOM 0 HE3 LYS A 46 5.753 -1.060 -16.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 6.914 0.335 -18.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 5.368 0.964 -17.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 6.734 1.688 -17.067 1.00 0.00 H new ATOM 748 N PHE A 47 6.330 -0.252 -10.399 1.00 0.00 N ATOM 749 CA PHE A 47 7.310 0.226 -9.393 1.00 0.00 C ATOM 750 C PHE A 47 8.569 0.740 -10.150 1.00 0.00 C ATOM 751 O PHE A 47 9.289 -0.039 -10.786 1.00 0.00 O ATOM 752 CB PHE A 47 7.689 -0.958 -8.454 1.00 0.00 C ATOM 753 CG PHE A 47 6.881 -1.096 -7.159 1.00 0.00 C ATOM 754 CD1 PHE A 47 5.624 -1.707 -7.160 1.00 0.00 C ATOM 755 CD2 PHE A 47 7.434 -0.664 -5.949 1.00 0.00 C ATOM 756 CE1 PHE A 47 4.928 -1.875 -5.966 1.00 0.00 C ATOM 757 CE2 PHE A 47 6.736 -0.833 -4.756 1.00 0.00 C ATOM 758 CZ PHE A 47 5.488 -1.447 -4.765 1.00 0.00 C ATOM 0 H PHE A 47 6.744 -0.865 -11.101 1.00 0.00 H new ATOM 0 HA PHE A 47 6.890 1.032 -8.791 1.00 0.00 H new ATOM 0 HB2 PHE A 47 7.588 -1.885 -9.018 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.742 -0.859 -8.189 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.192 -2.049 -8.089 1.00 0.00 H new ATOM 0 HD2 PHE A 47 8.408 -0.197 -5.940 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.952 -2.338 -5.971 1.00 0.00 H new ATOM 0 HE2 PHE A 47 7.163 -0.488 -3.826 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.952 -1.592 -3.839 1.00 0.00 H new ATOM 768 N THR A 48 8.865 2.041 -10.021 1.00 0.00 N ATOM 769 CA THR A 48 10.163 2.620 -10.477 1.00 0.00 C ATOM 770 C THR A 48 11.051 2.828 -9.208 1.00 0.00 C ATOM 771 O THR A 48 10.858 3.783 -8.448 1.00 0.00 O ATOM 772 CB THR A 48 9.892 3.910 -11.308 1.00 0.00 C ATOM 773 OG1 THR A 48 9.129 3.599 -12.469 1.00 0.00 O ATOM 774 CG2 THR A 48 11.144 4.629 -11.823 1.00 0.00 C ATOM 0 H THR A 48 8.231 2.723 -9.606 1.00 0.00 H new ATOM 0 HA THR A 48 10.710 1.960 -11.150 1.00 0.00 H new ATOM 0 HB THR A 48 9.376 4.565 -10.606 1.00 0.00 H new ATOM 0 HG1 THR A 48 8.964 4.418 -12.981 1.00 0.00 H new ATOM 0 HG21 THR A 48 10.849 5.513 -12.388 1.00 0.00 H new ATOM 0 HG22 THR A 48 11.765 4.929 -10.979 1.00 0.00 H new ATOM 0 HG23 THR A 48 11.710 3.957 -12.469 1.00 0.00 H new ATOM 782 N VAL A 49 11.999 1.903 -8.970 1.00 0.00 N ATOM 783 CA VAL A 49 12.849 1.895 -7.740 1.00 0.00 C ATOM 784 C VAL A 49 14.276 2.378 -8.140 1.00 0.00 C ATOM 785 O VAL A 49 15.061 1.619 -8.716 1.00 0.00 O ATOM 786 CB VAL A 49 12.836 0.472 -7.069 1.00 0.00 C ATOM 787 CG1 VAL A 49 13.801 0.328 -5.866 1.00 0.00 C ATOM 788 CG2 VAL A 49 11.434 0.033 -6.588 1.00 0.00 C ATOM 0 H VAL A 49 12.205 1.139 -9.614 1.00 0.00 H new ATOM 0 HA VAL A 49 12.457 2.577 -6.985 1.00 0.00 H new ATOM 0 HB VAL A 49 13.174 -0.174 -7.879 1.00 0.00 H new ATOM 0 HG11 VAL A 49 13.730 -0.682 -5.462 1.00 0.00 H new ATOM 0 HG12 VAL A 49 14.823 0.517 -6.195 1.00 0.00 H new ATOM 0 HG13 VAL A 49 13.530 1.048 -5.094 1.00 0.00 H new ATOM 0 HG21 VAL A 49 11.498 -0.957 -6.136 1.00 0.00 H new ATOM 0 HG22 VAL A 49 11.062 0.745 -5.851 1.00 0.00 H new ATOM 0 HG23 VAL A 49 10.752 0.000 -7.437 1.00 0.00 H new ATOM 798 N LYS A 50 14.642 3.623 -7.804 1.00 0.00 N ATOM 799 CA LYS A 50 16.023 4.131 -8.034 1.00 0.00 C ATOM 800 C LYS A 50 16.968 3.701 -6.875 1.00 0.00 C ATOM 801 O LYS A 50 16.923 4.271 -5.781 1.00 0.00 O ATOM 802 CB LYS A 50 15.977 5.664 -8.274 1.00 0.00 C ATOM 803 CG LYS A 50 15.528 6.039 -9.706 1.00 0.00 C ATOM 804 CD LYS A 50 15.287 7.542 -9.961 1.00 0.00 C ATOM 805 CE LYS A 50 13.997 8.136 -9.364 1.00 0.00 C ATOM 806 NZ LYS A 50 12.770 7.522 -9.922 1.00 0.00 N ATOM 0 H LYS A 50 14.013 4.301 -7.374 1.00 0.00 H new ATOM 0 HA LYS A 50 16.445 3.684 -8.934 1.00 0.00 H new ATOM 0 HB2 LYS A 50 15.295 6.118 -7.555 1.00 0.00 H new ATOM 0 HB3 LYS A 50 16.965 6.085 -8.087 1.00 0.00 H new ATOM 0 HG2 LYS A 50 16.284 5.687 -10.408 1.00 0.00 H new ATOM 0 HG3 LYS A 50 14.608 5.499 -9.931 1.00 0.00 H new ATOM 0 HD2 LYS A 50 16.136 8.097 -9.562 1.00 0.00 H new ATOM 0 HD3 LYS A 50 15.274 7.709 -11.038 1.00 0.00 H new ATOM 0 HE2 LYS A 50 14.006 8.000 -8.283 1.00 0.00 H new ATOM 0 HE3 LYS A 50 13.977 9.210 -9.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 11.990 8.209 -9.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 12.939 7.244 -10.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 12.518 6.681 -9.364 1.00 0.00 H new ATOM 819 N GLU A 51 17.827 2.696 -7.141 1.00 0.00 N ATOM 820 CA GLU A 51 18.923 2.305 -6.216 1.00 0.00 C ATOM 821 C GLU A 51 20.157 3.238 -6.449 1.00 0.00 C ATOM 822 O GLU A 51 20.953 3.022 -7.372 1.00 0.00 O ATOM 823 CB GLU A 51 19.292 0.800 -6.388 1.00 0.00 C ATOM 824 CG GLU A 51 18.235 -0.246 -5.932 1.00 0.00 C ATOM 825 CD GLU A 51 18.756 -1.605 -5.460 1.00 0.00 C ATOM 826 OE1 GLU A 51 19.822 -2.067 -5.918 1.00 0.00 O ATOM 827 OE2 GLU A 51 18.077 -2.236 -4.619 1.00 0.00 O ATOM 0 H GLU A 51 17.786 2.135 -7.992 1.00 0.00 H new ATOM 0 HA GLU A 51 18.587 2.429 -5.187 1.00 0.00 H new ATOM 0 HB2 GLU A 51 19.510 0.624 -7.441 1.00 0.00 H new ATOM 0 HB3 GLU A 51 20.213 0.613 -5.836 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.653 0.193 -5.122 1.00 0.00 H new ATOM 0 HG3 GLU A 51 17.549 -0.417 -6.761 1.00 0.00 H new ATOM 834 N SER A 52 20.280 4.293 -5.624 1.00 0.00 N ATOM 835 CA SER A 52 21.341 5.327 -5.763 1.00 0.00 C ATOM 836 C SER A 52 22.305 5.305 -4.537 1.00 0.00 C ATOM 837 O SER A 52 21.894 5.597 -3.409 1.00 0.00 O ATOM 838 CB SER A 52 20.614 6.683 -5.934 1.00 0.00 C ATOM 839 OG SER A 52 21.538 7.756 -6.123 1.00 0.00 O ATOM 0 H SER A 52 19.650 4.460 -4.839 1.00 0.00 H new ATOM 0 HA SER A 52 21.976 5.139 -6.628 1.00 0.00 H new ATOM 0 HB2 SER A 52 19.939 6.629 -6.788 1.00 0.00 H new ATOM 0 HB3 SER A 52 20.001 6.881 -5.055 1.00 0.00 H new ATOM 0 HG SER A 52 21.046 8.597 -6.229 1.00 0.00 H new ATOM 845 N SER A 53 23.586 4.950 -4.748 1.00 0.00 N ATOM 846 CA SER A 53 24.605 4.887 -3.661 1.00 0.00 C ATOM 847 C SER A 53 26.021 5.388 -4.095 1.00 0.00 C ATOM 848 O SER A 53 26.262 5.772 -5.245 1.00 0.00 O ATOM 849 CB SER A 53 24.600 3.445 -3.076 1.00 0.00 C ATOM 850 OG SER A 53 25.376 2.480 -3.789 1.00 0.00 O ATOM 0 H SER A 53 23.951 4.699 -5.667 1.00 0.00 H new ATOM 0 HA SER A 53 24.332 5.590 -2.874 1.00 0.00 H new ATOM 0 HB2 SER A 53 24.964 3.489 -2.049 1.00 0.00 H new ATOM 0 HB3 SER A 53 23.569 3.094 -3.034 1.00 0.00 H new ATOM 0 HG SER A 53 25.101 1.578 -3.522 1.00 0.00 H new ATOM 856 N THR A 54 27.001 5.311 -3.172 1.00 0.00 N ATOM 857 CA THR A 54 28.464 5.316 -3.528 1.00 0.00 C ATOM 858 C THR A 54 28.906 4.203 -4.556 1.00 0.00 C ATOM 859 O THR A 54 29.812 4.421 -5.362 1.00 0.00 O ATOM 860 CB THR A 54 29.343 5.216 -2.230 1.00 0.00 C ATOM 861 OG1 THR A 54 28.814 5.977 -1.146 1.00 0.00 O ATOM 862 CG2 THR A 54 30.796 5.687 -2.408 1.00 0.00 C ATOM 0 H THR A 54 26.822 5.244 -2.170 1.00 0.00 H new ATOM 0 HA THR A 54 28.627 6.267 -4.035 1.00 0.00 H new ATOM 0 HB THR A 54 29.326 4.148 -2.015 1.00 0.00 H new ATOM 0 HG1 THR A 54 28.165 5.434 -0.651 1.00 0.00 H new ATOM 0 HG21 THR A 54 31.330 5.584 -1.464 1.00 0.00 H new ATOM 0 HG22 THR A 54 31.285 5.079 -3.170 1.00 0.00 H new ATOM 0 HG23 THR A 54 30.804 6.732 -2.717 1.00 0.00 H new ATOM 870 N PHE A 55 28.275 3.017 -4.496 1.00 0.00 N ATOM 871 CA PHE A 55 28.587 1.849 -5.355 1.00 0.00 C ATOM 872 C PHE A 55 27.770 1.775 -6.693 1.00 0.00 C ATOM 873 O PHE A 55 28.372 1.513 -7.737 1.00 0.00 O ATOM 874 CB PHE A 55 28.384 0.609 -4.436 1.00 0.00 C ATOM 875 CG PHE A 55 29.104 -0.664 -4.883 1.00 0.00 C ATOM 876 CD1 PHE A 55 28.543 -1.509 -5.847 1.00 0.00 C ATOM 877 CD2 PHE A 55 30.301 -1.032 -4.260 1.00 0.00 C ATOM 878 CE1 PHE A 55 29.154 -2.722 -6.152 1.00 0.00 C ATOM 879 CE2 PHE A 55 30.897 -2.253 -4.554 1.00 0.00 C ATOM 880 CZ PHE A 55 30.307 -3.106 -5.474 1.00 0.00 C ATOM 0 H PHE A 55 27.518 2.835 -3.837 1.00 0.00 H new ATOM 0 HA PHE A 55 29.608 1.916 -5.731 1.00 0.00 H new ATOM 0 HB2 PHE A 55 28.722 0.863 -3.431 1.00 0.00 H new ATOM 0 HB3 PHE A 55 27.317 0.398 -4.370 1.00 0.00 H new ATOM 0 HD1 PHE A 55 27.635 -1.220 -6.355 1.00 0.00 H new ATOM 0 HD2 PHE A 55 30.764 -0.365 -3.548 1.00 0.00 H new ATOM 0 HE1 PHE A 55 28.734 -3.363 -6.913 1.00 0.00 H new ATOM 0 HE2 PHE A 55 31.818 -2.537 -4.067 1.00 0.00 H new ATOM 0 HZ PHE A 55 30.745 -4.074 -5.666 1.00 0.00 H new ATOM 890 N ARG A 56 26.426 1.935 -6.675 1.00 0.00 N ATOM 891 CA ARG A 56 25.566 1.773 -7.887 1.00 0.00 C ATOM 892 C ARG A 56 24.584 2.972 -8.102 1.00 0.00 C ATOM 893 O ARG A 56 24.135 3.616 -7.150 1.00 0.00 O ATOM 894 CB ARG A 56 24.867 0.377 -7.833 1.00 0.00 C ATOM 895 CG ARG A 56 23.535 0.247 -7.035 1.00 0.00 C ATOM 896 CD ARG A 56 23.047 -1.178 -6.679 1.00 0.00 C ATOM 897 NE ARG A 56 23.146 -2.157 -7.800 1.00 0.00 N ATOM 898 CZ ARG A 56 22.568 -3.360 -7.822 1.00 0.00 C ATOM 899 NH1 ARG A 56 21.555 -3.724 -7.073 1.00 0.00 N ATOM 900 NH2 ARG A 56 23.023 -4.243 -8.657 1.00 0.00 N ATOM 0 H ARG A 56 25.905 2.178 -5.833 1.00 0.00 H new ATOM 0 HA ARG A 56 26.195 1.797 -8.777 1.00 0.00 H new ATOM 0 HB2 ARG A 56 24.672 0.063 -8.858 1.00 0.00 H new ATOM 0 HB3 ARG A 56 25.577 -0.334 -7.412 1.00 0.00 H new ATOM 0 HG2 ARG A 56 23.645 0.806 -6.106 1.00 0.00 H new ATOM 0 HG3 ARG A 56 22.750 0.737 -7.611 1.00 0.00 H new ATOM 0 HD2 ARG A 56 23.629 -1.549 -5.835 1.00 0.00 H new ATOM 0 HD3 ARG A 56 22.009 -1.123 -6.350 1.00 0.00 H new ATOM 0 HE ARG A 56 23.699 -1.886 -8.613 1.00 0.00 H new ATOM 0 HH11 ARG A 56 21.149 -3.065 -6.409 1.00 0.00 H new ATOM 0 HH12 ARG A 56 21.173 -4.666 -7.154 1.00 0.00 H new ATOM 0 HH21 ARG A 56 23.802 -4.009 -9.273 1.00 0.00 H new ATOM 0 HH22 ARG A 56 22.602 -5.171 -8.697 1.00 0.00 H new ATOM 914 N ASN A 57 24.203 3.239 -9.363 1.00 0.00 N ATOM 915 CA ASN A 57 23.124 4.217 -9.695 1.00 0.00 C ATOM 916 C ASN A 57 22.216 3.639 -10.827 1.00 0.00 C ATOM 917 O ASN A 57 22.539 3.757 -12.011 1.00 0.00 O ATOM 918 CB ASN A 57 23.697 5.646 -9.939 1.00 0.00 C ATOM 919 CG ASN A 57 24.675 5.874 -11.101 1.00 0.00 C ATOM 920 OD1 ASN A 57 24.316 6.358 -12.168 1.00 0.00 O ATOM 921 ND2 ASN A 57 25.940 5.578 -10.925 1.00 0.00 N ATOM 0 H ASN A 57 24.622 2.795 -10.180 1.00 0.00 H new ATOM 0 HA ASN A 57 22.463 4.357 -8.839 1.00 0.00 H new ATOM 0 HB2 ASN A 57 22.851 6.318 -10.086 1.00 0.00 H new ATOM 0 HB3 ASN A 57 24.198 5.959 -9.023 1.00 0.00 H new ATOM 0 HD21 ASN A 57 26.613 5.751 -11.672 1.00 0.00 H new ATOM 0 HD22 ASN A 57 26.251 5.175 -10.041 1.00 0.00 H new ATOM 928 N ILE A 58 21.105 2.966 -10.460 1.00 0.00 N ATOM 929 CA ILE A 58 20.243 2.226 -11.441 1.00 0.00 C ATOM 930 C ILE A 58 18.721 2.486 -11.169 1.00 0.00 C ATOM 931 O ILE A 58 18.238 2.321 -10.045 1.00 0.00 O ATOM 932 CB ILE A 58 20.582 0.689 -11.543 1.00 0.00 C ATOM 933 CG1 ILE A 58 20.510 -0.102 -10.203 1.00 0.00 C ATOM 934 CG2 ILE A 58 21.934 0.449 -12.262 1.00 0.00 C ATOM 935 CD1 ILE A 58 20.504 -1.636 -10.337 1.00 0.00 C ATOM 0 H ILE A 58 20.774 2.912 -9.497 1.00 0.00 H new ATOM 0 HA ILE A 58 20.477 2.633 -12.425 1.00 0.00 H new ATOM 0 HB ILE A 58 19.776 0.278 -12.151 1.00 0.00 H new ATOM 0 HG12 ILE A 58 21.359 0.188 -9.584 1.00 0.00 H new ATOM 0 HG13 ILE A 58 19.609 0.202 -9.670 1.00 0.00 H new ATOM 0 HG21 ILE A 58 22.134 -0.621 -12.313 1.00 0.00 H new ATOM 0 HG22 ILE A 58 21.887 0.858 -13.271 1.00 0.00 H new ATOM 0 HG23 ILE A 58 22.733 0.941 -11.708 1.00 0.00 H new ATOM 0 HD11 ILE A 58 20.452 -2.088 -9.346 1.00 0.00 H new ATOM 0 HD12 ILE A 58 19.639 -1.947 -10.923 1.00 0.00 H new ATOM 0 HD13 ILE A 58 21.417 -1.961 -10.836 1.00 0.00 H new ATOM 947 N GLU A 59 17.952 2.849 -12.218 1.00 0.00 N ATOM 948 CA GLU A 59 16.467 2.958 -12.139 1.00 0.00 C ATOM 949 C GLU A 59 15.802 1.581 -12.464 1.00 0.00 C ATOM 950 O GLU A 59 15.766 1.139 -13.616 1.00 0.00 O ATOM 951 CB GLU A 59 16.022 4.121 -13.069 1.00 0.00 C ATOM 952 CG GLU A 59 14.513 4.463 -12.990 1.00 0.00 C ATOM 953 CD GLU A 59 14.097 5.706 -13.780 1.00 0.00 C ATOM 954 OE1 GLU A 59 14.109 5.751 -15.006 1.00 0.00 O ATOM 955 OE2 GLU A 59 13.693 6.739 -12.976 1.00 0.00 O ATOM 0 H GLU A 59 18.332 3.074 -13.138 1.00 0.00 H new ATOM 0 HA GLU A 59 16.133 3.199 -11.130 1.00 0.00 H new ATOM 0 HB2 GLU A 59 16.597 5.012 -12.817 1.00 0.00 H new ATOM 0 HB3 GLU A 59 16.270 3.862 -14.098 1.00 0.00 H new ATOM 0 HG2 GLU A 59 13.941 3.609 -13.354 1.00 0.00 H new ATOM 0 HG3 GLU A 59 14.241 4.606 -11.944 1.00 0.00 H new ATOM 962 N VAL A 60 15.290 0.902 -11.428 1.00 0.00 N ATOM 963 CA VAL A 60 14.851 -0.520 -11.511 1.00 0.00 C ATOM 964 C VAL A 60 13.303 -0.539 -11.752 1.00 0.00 C ATOM 965 O VAL A 60 12.510 -0.318 -10.829 1.00 0.00 O ATOM 966 CB VAL A 60 15.319 -1.289 -10.222 1.00 0.00 C ATOM 967 CG1 VAL A 60 14.992 -2.792 -10.276 1.00 0.00 C ATOM 968 CG2 VAL A 60 16.833 -1.192 -9.908 1.00 0.00 C ATOM 0 H VAL A 60 15.164 1.313 -10.503 1.00 0.00 H new ATOM 0 HA VAL A 60 15.310 -1.045 -12.348 1.00 0.00 H new ATOM 0 HB VAL A 60 14.758 -0.779 -9.439 1.00 0.00 H new ATOM 0 HG11 VAL A 60 15.337 -3.273 -9.361 1.00 0.00 H new ATOM 0 HG12 VAL A 60 13.915 -2.927 -10.372 1.00 0.00 H new ATOM 0 HG13 VAL A 60 15.492 -3.243 -11.133 1.00 0.00 H new ATOM 0 HG21 VAL A 60 17.053 -1.755 -9.001 1.00 0.00 H new ATOM 0 HG22 VAL A 60 17.404 -1.605 -10.739 1.00 0.00 H new ATOM 0 HG23 VAL A 60 17.108 -0.147 -9.762 1.00 0.00 H new ATOM 978 N VAL A 61 12.890 -0.773 -13.010 1.00 0.00 N ATOM 979 CA VAL A 61 11.465 -0.640 -13.447 1.00 0.00 C ATOM 980 C VAL A 61 10.815 -2.063 -13.540 1.00 0.00 C ATOM 981 O VAL A 61 11.278 -2.928 -14.292 1.00 0.00 O ATOM 982 CB VAL A 61 11.376 0.177 -14.785 1.00 0.00 C ATOM 983 CG1 VAL A 61 9.926 0.344 -15.296 1.00 0.00 C ATOM 984 CG2 VAL A 61 11.967 1.606 -14.692 1.00 0.00 C ATOM 0 H VAL A 61 13.521 -1.059 -13.758 1.00 0.00 H new ATOM 0 HA VAL A 61 10.894 -0.074 -12.711 1.00 0.00 H new ATOM 0 HB VAL A 61 11.967 -0.427 -15.474 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.931 0.917 -16.223 1.00 0.00 H new ATOM 0 HG12 VAL A 61 9.489 -0.638 -15.478 1.00 0.00 H new ATOM 0 HG13 VAL A 61 9.335 0.871 -14.547 1.00 0.00 H new ATOM 0 HG21 VAL A 61 11.867 2.104 -15.656 1.00 0.00 H new ATOM 0 HG22 VAL A 61 11.429 2.174 -13.933 1.00 0.00 H new ATOM 0 HG23 VAL A 61 13.021 1.547 -14.421 1.00 0.00 H new ATOM 994 N PHE A 62 9.727 -2.288 -12.785 1.00 0.00 N ATOM 995 CA PHE A 62 9.029 -3.609 -12.720 1.00 0.00 C ATOM 996 C PHE A 62 7.541 -3.452 -12.278 1.00 0.00 C ATOM 997 O PHE A 62 7.229 -2.603 -11.442 1.00 0.00 O ATOM 998 CB PHE A 62 9.793 -4.595 -11.775 1.00 0.00 C ATOM 999 CG PHE A 62 9.915 -4.213 -10.281 1.00 0.00 C ATOM 1000 CD1 PHE A 62 10.979 -3.414 -9.854 1.00 0.00 C ATOM 1001 CD2 PHE A 62 8.946 -4.615 -9.355 1.00 0.00 C ATOM 1002 CE1 PHE A 62 11.073 -3.016 -8.524 1.00 0.00 C ATOM 1003 CE2 PHE A 62 9.026 -4.194 -8.029 1.00 0.00 C ATOM 1004 CZ PHE A 62 10.091 -3.399 -7.614 1.00 0.00 C ATOM 0 H PHE A 62 9.298 -1.571 -12.200 1.00 0.00 H new ATOM 0 HA PHE A 62 9.028 -4.031 -13.725 1.00 0.00 H new ATOM 0 HB2 PHE A 62 9.299 -5.565 -11.833 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.800 -4.725 -12.171 1.00 0.00 H new ATOM 0 HD1 PHE A 62 11.734 -3.103 -10.561 1.00 0.00 H new ATOM 0 HD2 PHE A 62 8.134 -5.254 -9.669 1.00 0.00 H new ATOM 0 HE1 PHE A 62 11.906 -2.411 -8.198 1.00 0.00 H new ATOM 0 HE2 PHE A 62 8.262 -4.484 -7.323 1.00 0.00 H new ATOM 0 HZ PHE A 62 10.156 -3.079 -6.585 1.00 0.00 H new ATOM 1014 N GLU A 63 6.631 -4.322 -12.738 1.00 0.00 N ATOM 1015 CA GLU A 63 5.290 -4.502 -12.115 1.00 0.00 C ATOM 1016 C GLU A 63 5.213 -5.753 -11.176 1.00 0.00 C ATOM 1017 O GLU A 63 5.973 -6.723 -11.292 1.00 0.00 O ATOM 1018 CB GLU A 63 4.184 -4.438 -13.207 1.00 0.00 C ATOM 1019 CG GLU A 63 4.082 -5.599 -14.228 1.00 0.00 C ATOM 1020 CD GLU A 63 5.098 -5.596 -15.370 1.00 0.00 C ATOM 1021 OE1 GLU A 63 6.306 -5.799 -15.118 1.00 0.00 O ATOM 1022 OE2 GLU A 63 4.682 -5.407 -16.531 1.00 0.00 O ATOM 0 H GLU A 63 6.791 -4.922 -13.547 1.00 0.00 H new ATOM 0 HA GLU A 63 5.107 -3.670 -11.435 1.00 0.00 H new ATOM 0 HB2 GLU A 63 3.222 -4.358 -12.700 1.00 0.00 H new ATOM 0 HB3 GLU A 63 4.326 -3.515 -13.769 1.00 0.00 H new ATOM 0 HG2 GLU A 63 4.181 -6.539 -13.686 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.082 -5.585 -14.661 1.00 0.00 H new ATOM 1029 N LEU A 64 4.265 -5.716 -10.219 1.00 0.00 N ATOM 1030 CA LEU A 64 4.116 -6.777 -9.181 1.00 0.00 C ATOM 1031 C LEU A 64 3.791 -8.202 -9.745 1.00 0.00 C ATOM 1032 O LEU A 64 2.816 -8.386 -10.480 1.00 0.00 O ATOM 1033 CB LEU A 64 3.032 -6.351 -8.149 1.00 0.00 C ATOM 1034 CG LEU A 64 3.351 -5.155 -7.216 1.00 0.00 C ATOM 1035 CD1 LEU A 64 2.114 -4.814 -6.365 1.00 0.00 C ATOM 1036 CD2 LEU A 64 4.548 -5.447 -6.292 1.00 0.00 C ATOM 0 H LEU A 64 3.583 -4.962 -10.136 1.00 0.00 H new ATOM 0 HA LEU A 64 5.092 -6.869 -8.704 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.122 -6.113 -8.699 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.809 -7.214 -7.522 1.00 0.00 H new ATOM 0 HG LEU A 64 3.617 -4.307 -7.847 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.343 -3.973 -5.711 1.00 0.00 H new ATOM 0 HD12 LEU A 64 1.284 -4.549 -7.020 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.838 -5.679 -5.761 1.00 0.00 H new ATOM 0 HD21 LEU A 64 4.736 -4.582 -5.656 1.00 0.00 H new ATOM 0 HD22 LEU A 64 4.324 -6.313 -5.670 1.00 0.00 H new ATOM 0 HD23 LEU A 64 5.432 -5.652 -6.896 1.00 0.00 H new ATOM 1048 N GLY A 65 4.622 -9.201 -9.396 1.00 0.00 N ATOM 1049 CA GLY A 65 4.505 -10.574 -9.971 1.00 0.00 C ATOM 1050 C GLY A 65 5.301 -10.937 -11.253 1.00 0.00 C ATOM 1051 O GLY A 65 5.392 -12.127 -11.557 1.00 0.00 O ATOM 0 H GLY A 65 5.381 -9.095 -8.723 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.799 -11.280 -9.194 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.450 -10.751 -10.181 1.00 0.00 H new ATOM 1055 N VAL A 66 5.852 -9.972 -12.010 1.00 0.00 N ATOM 1056 CA VAL A 66 6.563 -10.240 -13.301 1.00 0.00 C ATOM 1057 C VAL A 66 8.106 -10.419 -13.060 1.00 0.00 C ATOM 1058 O VAL A 66 8.724 -9.738 -12.233 1.00 0.00 O ATOM 1059 CB VAL A 66 6.172 -9.125 -14.339 1.00 0.00 C ATOM 1060 CG1 VAL A 66 7.001 -9.106 -15.645 1.00 0.00 C ATOM 1061 CG2 VAL A 66 4.687 -9.219 -14.777 1.00 0.00 C ATOM 0 H VAL A 66 5.825 -8.984 -11.757 1.00 0.00 H new ATOM 0 HA VAL A 66 6.247 -11.188 -13.736 1.00 0.00 H new ATOM 0 HB VAL A 66 6.380 -8.214 -13.778 1.00 0.00 H new ATOM 0 HG11 VAL A 66 6.648 -8.300 -16.288 1.00 0.00 H new ATOM 0 HG12 VAL A 66 8.052 -8.946 -15.406 1.00 0.00 H new ATOM 0 HG13 VAL A 66 6.887 -10.059 -16.162 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.468 -8.427 -15.494 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.505 -10.189 -15.241 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.043 -9.107 -13.905 1.00 0.00 H new ATOM 1071 N THR A 67 8.732 -11.360 -13.801 1.00 0.00 N ATOM 1072 CA THR A 67 10.192 -11.649 -13.682 1.00 0.00 C ATOM 1073 C THR A 67 11.104 -10.540 -14.304 1.00 0.00 C ATOM 1074 O THR A 67 11.004 -10.216 -15.491 1.00 0.00 O ATOM 1075 CB THR A 67 10.544 -13.082 -14.192 1.00 0.00 C ATOM 1076 OG1 THR A 67 11.916 -13.360 -13.941 1.00 0.00 O ATOM 1077 CG2 THR A 67 10.309 -13.378 -15.685 1.00 0.00 C ATOM 0 H THR A 67 8.253 -11.938 -14.492 1.00 0.00 H new ATOM 0 HA THR A 67 10.417 -11.628 -12.616 1.00 0.00 H new ATOM 0 HB THR A 67 9.847 -13.712 -13.638 1.00 0.00 H new ATOM 0 HG1 THR A 67 12.131 -14.261 -14.261 1.00 0.00 H new ATOM 0 HG21 THR A 67 10.595 -14.407 -15.901 1.00 0.00 H new ATOM 0 HG22 THR A 67 9.255 -13.237 -15.922 1.00 0.00 H new ATOM 0 HG23 THR A 67 10.911 -12.699 -16.290 1.00 0.00 H new ATOM 1085 N PHE A 68 12.025 -10.001 -13.493 1.00 0.00 N ATOM 1086 CA PHE A 68 13.040 -9.004 -13.940 1.00 0.00 C ATOM 1087 C PHE A 68 14.456 -9.325 -13.340 1.00 0.00 C ATOM 1088 O PHE A 68 14.596 -10.066 -12.360 1.00 0.00 O ATOM 1089 CB PHE A 68 12.511 -7.563 -13.637 1.00 0.00 C ATOM 1090 CG PHE A 68 12.658 -7.078 -12.184 1.00 0.00 C ATOM 1091 CD1 PHE A 68 11.737 -7.465 -11.207 1.00 0.00 C ATOM 1092 CD2 PHE A 68 13.797 -6.356 -11.811 1.00 0.00 C ATOM 1093 CE1 PHE A 68 11.960 -7.143 -9.873 1.00 0.00 C ATOM 1094 CE2 PHE A 68 14.031 -6.061 -10.474 1.00 0.00 C ATOM 1095 CZ PHE A 68 13.111 -6.445 -9.507 1.00 0.00 C ATOM 0 H PHE A 68 12.097 -10.237 -12.503 1.00 0.00 H new ATOM 0 HA PHE A 68 13.185 -9.063 -15.019 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.035 -6.862 -14.287 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.456 -7.521 -13.907 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.851 -8.015 -11.488 1.00 0.00 H new ATOM 0 HD2 PHE A 68 14.497 -6.027 -12.565 1.00 0.00 H new ATOM 0 HE1 PHE A 68 11.242 -7.433 -9.120 1.00 0.00 H new ATOM 0 HE2 PHE A 68 14.928 -5.533 -10.186 1.00 0.00 H new ATOM 0 HZ PHE A 68 13.287 -6.203 -8.469 1.00 0.00 H new ATOM 1105 N ASN A 69 15.509 -8.704 -13.898 1.00 0.00 N ATOM 1106 CA ASN A 69 16.902 -8.859 -13.388 1.00 0.00 C ATOM 1107 C ASN A 69 17.224 -7.748 -12.330 1.00 0.00 C ATOM 1108 O ASN A 69 17.332 -6.564 -12.662 1.00 0.00 O ATOM 1109 CB ASN A 69 17.901 -8.879 -14.580 1.00 0.00 C ATOM 1110 CG ASN A 69 17.777 -10.033 -15.594 1.00 0.00 C ATOM 1111 OD1 ASN A 69 16.858 -10.846 -15.600 1.00 0.00 O ATOM 1112 ND2 ASN A 69 18.708 -10.149 -16.505 1.00 0.00 N ATOM 0 H ASN A 69 15.432 -8.086 -14.706 1.00 0.00 H new ATOM 0 HA ASN A 69 17.005 -9.813 -12.871 1.00 0.00 H new ATOM 0 HB2 ASN A 69 17.794 -7.941 -15.124 1.00 0.00 H new ATOM 0 HB3 ASN A 69 18.911 -8.897 -14.172 1.00 0.00 H new ATOM 0 HD21 ASN A 69 18.657 -10.900 -17.194 1.00 0.00 H new ATOM 0 HD22 ASN A 69 19.485 -9.489 -16.527 1.00 0.00 H new ATOM 1119 N TYR A 70 17.352 -8.141 -11.050 1.00 0.00 N ATOM 1120 CA TYR A 70 17.758 -7.226 -9.940 1.00 0.00 C ATOM 1121 C TYR A 70 19.311 -7.054 -9.788 1.00 0.00 C ATOM 1122 O TYR A 70 19.783 -5.917 -9.696 1.00 0.00 O ATOM 1123 CB TYR A 70 17.035 -7.733 -8.655 1.00 0.00 C ATOM 1124 CG TYR A 70 17.270 -6.906 -7.378 1.00 0.00 C ATOM 1125 CD1 TYR A 70 16.645 -5.667 -7.203 1.00 0.00 C ATOM 1126 CD2 TYR A 70 18.168 -7.365 -6.406 1.00 0.00 C ATOM 1127 CE1 TYR A 70 16.934 -4.886 -6.085 1.00 0.00 C ATOM 1128 CE2 TYR A 70 18.450 -6.584 -5.287 1.00 0.00 C ATOM 1129 CZ TYR A 70 17.839 -5.344 -5.129 1.00 0.00 C ATOM 1130 OH TYR A 70 18.168 -4.555 -4.057 1.00 0.00 O ATOM 0 H TYR A 70 17.180 -9.099 -10.744 1.00 0.00 H new ATOM 0 HA TYR A 70 17.445 -6.205 -10.160 1.00 0.00 H new ATOM 0 HB2 TYR A 70 15.963 -7.763 -8.853 1.00 0.00 H new ATOM 0 HB3 TYR A 70 17.353 -8.758 -8.464 1.00 0.00 H new ATOM 0 HD1 TYR A 70 15.936 -5.314 -7.937 1.00 0.00 H new ATOM 0 HD2 TYR A 70 18.643 -8.327 -6.524 1.00 0.00 H new ATOM 0 HE1 TYR A 70 16.456 -3.926 -5.960 1.00 0.00 H new ATOM 0 HE2 TYR A 70 19.144 -6.942 -4.541 1.00 0.00 H new ATOM 0 HH TYR A 70 17.719 -3.688 -4.139 1.00 0.00 H new ATOM 1140 N ASN A 71 20.088 -8.161 -9.736 1.00 0.00 N ATOM 1141 CA ASN A 71 21.586 -8.136 -9.753 1.00 0.00 C ATOM 1142 C ASN A 71 22.228 -7.696 -8.395 1.00 0.00 C ATOM 1143 O ASN A 71 21.850 -6.672 -7.813 1.00 0.00 O ATOM 1144 CB ASN A 71 22.218 -7.402 -10.982 1.00 0.00 C ATOM 1145 CG ASN A 71 21.796 -7.921 -12.367 1.00 0.00 C ATOM 1146 OD1 ASN A 71 20.637 -7.848 -12.755 1.00 0.00 O ATOM 1147 ND2 ASN A 71 22.689 -8.462 -13.160 1.00 0.00 N ATOM 0 H ASN A 71 19.702 -9.103 -9.681 1.00 0.00 H new ATOM 0 HA ASN A 71 21.852 -9.185 -9.887 1.00 0.00 H new ATOM 0 HB2 ASN A 71 21.963 -6.344 -10.919 1.00 0.00 H new ATOM 0 HB3 ASN A 71 23.303 -7.473 -10.904 1.00 0.00 H new ATOM 0 HD21 ASN A 71 22.412 -8.811 -14.078 1.00 0.00 H new ATOM 0 HD22 ASN A 71 23.661 -8.534 -12.859 1.00 0.00 H new ATOM 1154 N LEU A 72 23.246 -8.433 -7.911 1.00 0.00 N ATOM 1155 CA LEU A 72 23.999 -8.060 -6.678 1.00 0.00 C ATOM 1156 C LEU A 72 25.031 -6.912 -6.900 1.00 0.00 C ATOM 1157 O LEU A 72 25.558 -6.693 -7.997 1.00 0.00 O ATOM 1158 CB LEU A 72 24.708 -9.333 -6.120 1.00 0.00 C ATOM 1159 CG LEU A 72 23.789 -10.291 -5.323 1.00 0.00 C ATOM 1160 CD1 LEU A 72 24.355 -11.716 -5.317 1.00 0.00 C ATOM 1161 CD2 LEU A 72 23.568 -9.816 -3.872 1.00 0.00 C ATOM 0 H LEU A 72 23.573 -9.294 -8.350 1.00 0.00 H new ATOM 0 HA LEU A 72 23.279 -7.672 -5.958 1.00 0.00 H new ATOM 0 HB2 LEU A 72 25.147 -9.882 -6.953 1.00 0.00 H new ATOM 0 HB3 LEU A 72 25.530 -9.021 -5.476 1.00 0.00 H new ATOM 0 HG LEU A 72 22.824 -10.288 -5.829 1.00 0.00 H new ATOM 0 HD11 LEU A 72 23.691 -12.369 -4.751 1.00 0.00 H new ATOM 0 HD12 LEU A 72 24.435 -12.080 -6.341 1.00 0.00 H new ATOM 0 HD13 LEU A 72 25.342 -11.713 -4.855 1.00 0.00 H new ATOM 0 HD21 LEU A 72 22.917 -10.520 -3.354 1.00 0.00 H new ATOM 0 HD22 LEU A 72 24.527 -9.762 -3.357 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.103 -8.830 -3.879 1.00 0.00 H new ATOM 1202 N THR A 76 27.477 -11.395 -9.321 1.00 0.00 N ATOM 1203 CA THR A 76 26.367 -12.342 -9.651 1.00 0.00 C ATOM 1204 C THR A 76 24.973 -11.676 -9.949 1.00 0.00 C ATOM 1205 O THR A 76 24.572 -10.678 -9.337 1.00 0.00 O ATOM 1206 CB THR A 76 26.330 -13.384 -8.480 1.00 0.00 C ATOM 1207 OG1 THR A 76 27.416 -14.301 -8.613 1.00 0.00 O ATOM 1208 CG2 THR A 76 25.067 -14.242 -8.345 1.00 0.00 C ATOM 0 HA THR A 76 26.573 -12.823 -10.607 1.00 0.00 H new ATOM 0 HB THR A 76 26.377 -12.751 -7.594 1.00 0.00 H new ATOM 0 HG1 THR A 76 27.183 -15.149 -8.181 1.00 0.00 H new ATOM 0 HG21 THR A 76 25.175 -14.918 -7.497 1.00 0.00 H new ATOM 0 HG22 THR A 76 24.204 -13.596 -8.186 1.00 0.00 H new ATOM 0 HG23 THR A 76 24.923 -14.823 -9.256 1.00 0.00 H new ATOM 1216 N GLU A 77 24.210 -12.307 -10.862 1.00 0.00 N ATOM 1217 CA GLU A 77 22.824 -11.894 -11.187 1.00 0.00 C ATOM 1218 C GLU A 77 21.740 -12.678 -10.363 1.00 0.00 C ATOM 1219 O GLU A 77 21.653 -13.912 -10.365 1.00 0.00 O ATOM 1220 CB GLU A 77 22.653 -11.982 -12.722 1.00 0.00 C ATOM 1221 CG GLU A 77 21.239 -11.612 -13.241 1.00 0.00 C ATOM 1222 CD GLU A 77 21.152 -11.393 -14.736 1.00 0.00 C ATOM 1223 OE1 GLU A 77 20.875 -12.360 -15.478 1.00 0.00 O ATOM 1224 OE2 GLU A 77 21.294 -10.230 -15.172 1.00 0.00 O ATOM 0 H GLU A 77 24.532 -13.115 -11.395 1.00 0.00 H new ATOM 0 HA GLU A 77 22.657 -10.862 -10.880 1.00 0.00 H new ATOM 0 HB2 GLU A 77 23.382 -11.322 -13.193 1.00 0.00 H new ATOM 0 HB3 GLU A 77 22.888 -12.997 -13.042 1.00 0.00 H new ATOM 0 HG2 GLU A 77 20.545 -12.405 -12.963 1.00 0.00 H new ATOM 0 HG3 GLU A 77 20.906 -10.706 -12.735 1.00 0.00 H new ATOM 1231 N LEU A 78 20.874 -11.893 -9.706 1.00 0.00 N ATOM 1232 CA LEU A 78 19.598 -12.362 -9.105 1.00 0.00 C ATOM 1233 C LEU A 78 18.413 -11.960 -10.037 1.00 0.00 C ATOM 1234 O LEU A 78 18.243 -10.771 -10.334 1.00 0.00 O ATOM 1235 CB LEU A 78 19.427 -11.661 -7.726 1.00 0.00 C ATOM 1236 CG LEU A 78 20.392 -12.070 -6.588 1.00 0.00 C ATOM 1237 CD1 LEU A 78 20.200 -11.110 -5.402 1.00 0.00 C ATOM 1238 CD2 LEU A 78 20.181 -13.527 -6.136 1.00 0.00 C ATOM 0 H LEU A 78 21.035 -10.895 -9.570 1.00 0.00 H new ATOM 0 HA LEU A 78 19.610 -13.445 -8.983 1.00 0.00 H new ATOM 0 HB2 LEU A 78 19.527 -10.587 -7.881 1.00 0.00 H new ATOM 0 HB3 LEU A 78 18.408 -11.840 -7.383 1.00 0.00 H new ATOM 0 HG LEU A 78 21.412 -12.004 -6.967 1.00 0.00 H new ATOM 0 HD11 LEU A 78 20.876 -11.390 -4.594 1.00 0.00 H new ATOM 0 HD12 LEU A 78 20.417 -10.090 -5.720 1.00 0.00 H new ATOM 0 HD13 LEU A 78 19.170 -11.168 -5.050 1.00 0.00 H new ATOM 0 HD21 LEU A 78 20.882 -13.765 -5.336 1.00 0.00 H new ATOM 0 HD22 LEU A 78 19.161 -13.651 -5.773 1.00 0.00 H new ATOM 0 HD23 LEU A 78 20.351 -14.197 -6.978 1.00 0.00 H new ATOM 1250 N ARG A 79 17.584 -12.923 -10.481 1.00 0.00 N ATOM 1251 CA ARG A 79 16.451 -12.638 -11.413 1.00 0.00 C ATOM 1252 C ARG A 79 15.125 -13.358 -11.017 1.00 0.00 C ATOM 1253 O ARG A 79 15.100 -14.556 -10.720 1.00 0.00 O ATOM 1254 CB ARG A 79 16.876 -12.848 -12.889 1.00 0.00 C ATOM 1255 CG ARG A 79 17.369 -14.249 -13.331 1.00 0.00 C ATOM 1256 CD ARG A 79 18.180 -14.131 -14.632 1.00 0.00 C ATOM 1257 NE ARG A 79 18.621 -15.462 -15.117 1.00 0.00 N ATOM 1258 CZ ARG A 79 19.520 -15.658 -16.083 1.00 0.00 C ATOM 1259 NH1 ARG A 79 20.292 -14.722 -16.589 1.00 0.00 N ATOM 1260 NH2 ARG A 79 19.657 -16.865 -16.552 1.00 0.00 N ATOM 0 H ARG A 79 17.668 -13.905 -10.217 1.00 0.00 H new ATOM 0 HA ARG A 79 16.206 -11.581 -11.313 1.00 0.00 H new ATOM 0 HB2 ARG A 79 16.026 -12.583 -13.518 1.00 0.00 H new ATOM 0 HB3 ARG A 79 17.670 -12.134 -13.109 1.00 0.00 H new ATOM 0 HG2 ARG A 79 17.984 -14.692 -12.548 1.00 0.00 H new ATOM 0 HG3 ARG A 79 16.518 -14.913 -13.482 1.00 0.00 H new ATOM 0 HD2 ARG A 79 17.575 -13.645 -15.397 1.00 0.00 H new ATOM 0 HD3 ARG A 79 19.050 -13.497 -14.464 1.00 0.00 H new ATOM 0 HE ARG A 79 18.207 -16.286 -14.681 1.00 0.00 H new ATOM 0 HH11 ARG A 79 20.227 -13.765 -16.243 1.00 0.00 H new ATOM 0 HH12 ARG A 79 20.956 -14.953 -17.328 1.00 0.00 H new ATOM 0 HH21 ARG A 79 19.086 -17.624 -16.180 1.00 0.00 H new ATOM 0 HH22 ARG A 79 20.335 -17.051 -17.291 1.00 0.00 H new ATOM 1274 N GLY A 80 14.022 -12.593 -10.993 1.00 0.00 N ATOM 1275 CA GLY A 80 12.705 -13.083 -10.516 1.00 0.00 C ATOM 1276 C GLY A 80 11.743 -11.950 -10.093 1.00 0.00 C ATOM 1277 O GLY A 80 11.714 -10.877 -10.703 1.00 0.00 O ATOM 0 H GLY A 80 14.010 -11.621 -11.301 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.237 -13.671 -11.306 1.00 0.00 H new ATOM 0 HA3 GLY A 80 12.860 -13.752 -9.670 1.00 0.00 H new ATOM 1281 N THR A 81 10.886 -12.227 -9.103 1.00 0.00 N ATOM 1282 CA THR A 81 9.600 -11.485 -8.922 1.00 0.00 C ATOM 1283 C THR A 81 9.519 -10.781 -7.532 1.00 0.00 C ATOM 1284 O THR A 81 9.486 -11.474 -6.507 1.00 0.00 O ATOM 1285 CB THR A 81 8.367 -12.443 -9.059 1.00 0.00 C ATOM 1286 OG1 THR A 81 8.337 -13.395 -7.997 1.00 0.00 O ATOM 1287 CG2 THR A 81 8.242 -13.229 -10.372 1.00 0.00 C ATOM 0 H THR A 81 11.046 -12.956 -8.408 1.00 0.00 H new ATOM 0 HA THR A 81 9.576 -10.730 -9.708 1.00 0.00 H new ATOM 0 HB THR A 81 7.529 -11.747 -9.030 1.00 0.00 H new ATOM 0 HG1 THR A 81 8.929 -13.098 -7.274 1.00 0.00 H new ATOM 0 HG21 THR A 81 7.349 -13.853 -10.339 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.168 -12.533 -11.207 1.00 0.00 H new ATOM 0 HG23 THR A 81 9.121 -13.860 -10.503 1.00 0.00 H new ATOM 1295 N TRP A 82 9.315 -9.449 -7.493 1.00 0.00 N ATOM 1296 CA TRP A 82 8.661 -8.794 -6.319 1.00 0.00 C ATOM 1297 C TRP A 82 7.107 -8.951 -6.424 1.00 0.00 C ATOM 1298 O TRP A 82 6.454 -8.294 -7.241 1.00 0.00 O ATOM 1299 CB TRP A 82 9.036 -7.289 -6.199 1.00 0.00 C ATOM 1300 CG TRP A 82 10.413 -6.946 -5.611 1.00 0.00 C ATOM 1301 CD1 TRP A 82 11.452 -6.297 -6.299 1.00 0.00 C ATOM 1302 CD2 TRP A 82 10.876 -7.089 -4.315 1.00 0.00 C ATOM 1303 NE1 TRP A 82 12.583 -6.081 -5.488 1.00 0.00 N ATOM 1304 CE2 TRP A 82 12.206 -6.593 -4.263 1.00 0.00 C ATOM 1305 CE3 TRP A 82 10.246 -7.566 -3.143 1.00 0.00 C ATOM 1306 CZ2 TRP A 82 12.920 -6.596 -3.043 1.00 0.00 C ATOM 1307 CZ3 TRP A 82 10.967 -7.554 -1.949 1.00 0.00 C ATOM 1308 CH2 TRP A 82 12.283 -7.079 -1.898 1.00 0.00 C ATOM 0 H TRP A 82 9.584 -8.808 -8.240 1.00 0.00 H new ATOM 0 HA TRP A 82 9.025 -9.291 -5.420 1.00 0.00 H new ATOM 0 HB2 TRP A 82 8.975 -6.847 -7.193 1.00 0.00 H new ATOM 0 HB3 TRP A 82 8.278 -6.801 -5.587 1.00 0.00 H new ATOM 0 HD1 TRP A 82 11.390 -5.997 -7.335 1.00 0.00 H new ATOM 0 HE1 TRP A 82 13.470 -5.649 -5.745 1.00 0.00 H new ATOM 0 HE3 TRP A 82 9.230 -7.931 -3.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 13.936 -6.233 -2.997 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 10.501 -7.918 -1.046 1.00 0.00 H new ATOM 0 HH2 TRP A 82 12.814 -7.086 -0.958 1.00 0.00 H new ATOM 1319 N SER A 83 6.520 -9.815 -5.584 1.00 0.00 N ATOM 1320 CA SER A 83 5.054 -9.803 -5.306 1.00 0.00 C ATOM 1321 C SER A 83 4.728 -8.980 -4.012 1.00 0.00 C ATOM 1322 O SER A 83 5.628 -8.534 -3.290 1.00 0.00 O ATOM 1323 CB SER A 83 4.596 -11.279 -5.226 1.00 0.00 C ATOM 1324 OG SER A 83 4.738 -11.929 -6.490 1.00 0.00 O ATOM 0 H SER A 83 7.030 -10.539 -5.077 1.00 0.00 H new ATOM 0 HA SER A 83 4.503 -9.300 -6.101 1.00 0.00 H new ATOM 0 HB2 SER A 83 5.184 -11.806 -4.474 1.00 0.00 H new ATOM 0 HB3 SER A 83 3.555 -11.324 -4.905 1.00 0.00 H new ATOM 0 HG SER A 83 4.444 -12.861 -6.414 1.00 0.00 H new ATOM 1330 N LEU A 84 3.436 -8.744 -3.715 1.00 0.00 N ATOM 1331 CA LEU A 84 3.020 -8.004 -2.487 1.00 0.00 C ATOM 1332 C LEU A 84 1.828 -8.738 -1.801 1.00 0.00 C ATOM 1333 O LEU A 84 0.734 -8.834 -2.367 1.00 0.00 O ATOM 1334 CB LEU A 84 2.698 -6.524 -2.865 1.00 0.00 C ATOM 1335 CG LEU A 84 2.823 -5.462 -1.740 1.00 0.00 C ATOM 1336 CD1 LEU A 84 2.770 -4.048 -2.340 1.00 0.00 C ATOM 1337 CD2 LEU A 84 1.735 -5.562 -0.660 1.00 0.00 C ATOM 0 H LEU A 84 2.658 -9.050 -4.300 1.00 0.00 H new ATOM 0 HA LEU A 84 3.829 -7.982 -1.757 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.360 -6.232 -3.681 1.00 0.00 H new ATOM 0 HB3 LEU A 84 1.680 -6.488 -3.252 1.00 0.00 H new ATOM 0 HG LEU A 84 3.781 -5.661 -1.260 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.859 -3.311 -1.542 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.592 -3.921 -3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.822 -3.908 -2.859 1.00 0.00 H new ATOM 0 HD21 LEU A 84 1.893 -4.786 0.089 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.755 -5.430 -1.118 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.784 -6.541 -0.184 1.00 0.00 H new ATOM 1349 N GLU A 85 2.042 -9.223 -0.567 1.00 0.00 N ATOM 1350 CA GLU A 85 0.968 -9.846 0.261 1.00 0.00 C ATOM 1351 C GLU A 85 0.321 -8.814 1.247 1.00 0.00 C ATOM 1352 O GLU A 85 0.756 -8.639 2.390 1.00 0.00 O ATOM 1353 CB GLU A 85 1.484 -11.162 0.908 1.00 0.00 C ATOM 1354 CG GLU A 85 2.681 -11.090 1.888 1.00 0.00 C ATOM 1355 CD GLU A 85 3.099 -12.442 2.443 1.00 0.00 C ATOM 1356 OE1 GLU A 85 3.742 -13.219 1.707 1.00 0.00 O ATOM 1357 OE2 GLU A 85 2.794 -12.726 3.619 1.00 0.00 O ATOM 0 H GLU A 85 2.953 -9.200 -0.108 1.00 0.00 H new ATOM 0 HA GLU A 85 0.137 -10.145 -0.378 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.649 -11.618 1.439 1.00 0.00 H new ATOM 0 HB3 GLU A 85 1.758 -11.842 0.101 1.00 0.00 H new ATOM 0 HG2 GLU A 85 3.531 -10.639 1.377 1.00 0.00 H new ATOM 0 HG3 GLU A 85 2.421 -10.431 2.717 1.00 0.00 H new ATOM 1364 N GLY A 86 -0.718 -8.093 0.782 1.00 0.00 N ATOM 1365 CA GLY A 86 -1.459 -7.104 1.619 1.00 0.00 C ATOM 1366 C GLY A 86 -0.714 -5.786 1.924 1.00 0.00 C ATOM 1367 O GLY A 86 -0.898 -4.786 1.227 1.00 0.00 O ATOM 0 H GLY A 86 -1.071 -8.171 -0.172 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -2.396 -6.862 1.117 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -1.718 -7.580 2.565 1.00 0.00 H new ATOM 1371 N ASN A 87 0.131 -5.808 2.965 1.00 0.00 N ATOM 1372 CA ASN A 87 1.074 -4.687 3.278 1.00 0.00 C ATOM 1373 C ASN A 87 2.578 -5.136 3.431 1.00 0.00 C ATOM 1374 O ASN A 87 3.337 -4.510 4.177 1.00 0.00 O ATOM 1375 CB ASN A 87 0.541 -3.927 4.533 1.00 0.00 C ATOM 1376 CG ASN A 87 -0.761 -3.135 4.352 1.00 0.00 C ATOM 1377 OD1 ASN A 87 -1.848 -3.579 4.704 1.00 0.00 O ATOM 1378 ND2 ASN A 87 -0.701 -1.939 3.815 1.00 0.00 N ATOM 0 H ASN A 87 0.192 -6.589 3.618 1.00 0.00 H new ATOM 0 HA ASN A 87 1.095 -4.012 2.423 1.00 0.00 H new ATOM 0 HB2 ASN A 87 0.391 -4.652 5.333 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.316 -3.238 4.869 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -1.553 -1.391 3.695 1.00 0.00 H new ATOM 0 HD22 ASN A 87 0.197 -1.558 3.518 1.00 0.00 H new ATOM 1385 N LYS A 88 3.040 -6.169 2.694 1.00 0.00 N ATOM 1386 CA LYS A 88 4.439 -6.681 2.771 1.00 0.00 C ATOM 1387 C LYS A 88 4.923 -7.059 1.339 1.00 0.00 C ATOM 1388 O LYS A 88 4.308 -7.892 0.664 1.00 0.00 O ATOM 1389 CB LYS A 88 4.560 -7.909 3.716 1.00 0.00 C ATOM 1390 CG LYS A 88 4.254 -7.647 5.208 1.00 0.00 C ATOM 1391 CD LYS A 88 4.673 -8.823 6.108 1.00 0.00 C ATOM 1392 CE LYS A 88 4.384 -8.548 7.593 1.00 0.00 C ATOM 1393 NZ LYS A 88 5.057 -9.559 8.431 1.00 0.00 N ATOM 0 H LYS A 88 2.459 -6.676 2.027 1.00 0.00 H new ATOM 0 HA LYS A 88 5.067 -5.893 3.186 1.00 0.00 H new ATOM 0 HB2 LYS A 88 3.885 -8.686 3.358 1.00 0.00 H new ATOM 0 HB3 LYS A 88 5.572 -8.305 3.637 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.773 -6.744 5.529 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.187 -7.462 5.330 1.00 0.00 H new ATOM 0 HD2 LYS A 88 4.143 -9.723 5.797 1.00 0.00 H new ATOM 0 HD3 LYS A 88 5.737 -9.018 5.977 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.732 -7.550 7.862 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.309 -8.570 7.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.790 -9.419 9.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.769 -10.511 8.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.088 -9.461 8.332 1.00 0.00 H new ATOM 1406 N LEU A 89 6.044 -6.477 0.880 1.00 0.00 N ATOM 1407 CA LEU A 89 6.668 -6.859 -0.422 1.00 0.00 C ATOM 1408 C LEU A 89 7.540 -8.145 -0.273 1.00 0.00 C ATOM 1409 O LEU A 89 8.419 -8.203 0.591 1.00 0.00 O ATOM 1410 CB LEU A 89 7.525 -5.668 -0.950 1.00 0.00 C ATOM 1411 CG LEU A 89 6.772 -4.551 -1.713 1.00 0.00 C ATOM 1412 CD1 LEU A 89 7.631 -3.282 -1.831 1.00 0.00 C ATOM 1413 CD2 LEU A 89 6.385 -5.001 -3.132 1.00 0.00 C ATOM 0 H LEU A 89 6.543 -5.742 1.381 1.00 0.00 H new ATOM 0 HA LEU A 89 5.879 -7.083 -1.140 1.00 0.00 H new ATOM 0 HB2 LEU A 89 8.036 -5.214 -0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.295 -6.069 -1.608 1.00 0.00 H new ATOM 0 HG LEU A 89 5.871 -4.337 -1.138 1.00 0.00 H new ATOM 0 HD11 LEU A 89 7.076 -2.516 -2.372 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.878 -2.916 -0.834 1.00 0.00 H new ATOM 0 HD13 LEU A 89 8.549 -3.513 -2.371 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.858 -4.193 -3.639 1.00 0.00 H new ATOM 0 HD22 LEU A 89 7.285 -5.254 -3.692 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.737 -5.875 -3.072 1.00 0.00 H new ATOM 1425 N ILE A 90 7.311 -9.163 -1.120 1.00 0.00 N ATOM 1426 CA ILE A 90 8.018 -10.479 -1.029 1.00 0.00 C ATOM 1427 C ILE A 90 8.761 -10.779 -2.371 1.00 0.00 C ATOM 1428 O ILE A 90 8.172 -10.759 -3.458 1.00 0.00 O ATOM 1429 CB ILE A 90 7.101 -11.642 -0.503 1.00 0.00 C ATOM 1430 CG1 ILE A 90 5.954 -12.142 -1.434 1.00 0.00 C ATOM 1431 CG2 ILE A 90 6.555 -11.350 0.916 1.00 0.00 C ATOM 1432 CD1 ILE A 90 6.351 -13.310 -2.357 1.00 0.00 C ATOM 0 H ILE A 90 6.639 -9.111 -1.885 1.00 0.00 H new ATOM 0 HA ILE A 90 8.784 -10.410 -0.257 1.00 0.00 H new ATOM 0 HB ILE A 90 7.797 -12.481 -0.482 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.110 -12.452 -0.817 1.00 0.00 H new ATOM 0 HG13 ILE A 90 5.611 -11.309 -2.048 1.00 0.00 H new ATOM 0 HG21 ILE A 90 5.926 -12.179 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 90 7.388 -11.232 1.609 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.966 -10.433 0.898 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.496 -13.596 -2.970 1.00 0.00 H new ATOM 0 HD12 ILE A 90 7.173 -13.001 -3.002 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.665 -14.161 -1.752 1.00 0.00 H new ATOM 1444 N GLY A 91 10.077 -11.019 -2.290 1.00 0.00 N ATOM 1445 CA GLY A 91 10.964 -11.117 -3.470 1.00 0.00 C ATOM 1446 C GLY A 91 11.529 -12.524 -3.696 1.00 0.00 C ATOM 1447 O GLY A 91 12.483 -12.924 -3.026 1.00 0.00 O ATOM 0 H GLY A 91 10.563 -11.152 -1.403 1.00 0.00 H new ATOM 0 HA2 GLY A 91 10.410 -10.810 -4.357 1.00 0.00 H new ATOM 0 HA3 GLY A 91 11.791 -10.417 -3.352 1.00 0.00 H new ATOM 1451 N LYS A 92 10.962 -13.233 -4.676 1.00 0.00 N ATOM 1452 CA LYS A 92 11.406 -14.604 -5.057 1.00 0.00 C ATOM 1453 C LYS A 92 12.405 -14.495 -6.252 1.00 0.00 C ATOM 1454 O LYS A 92 11.989 -14.339 -7.406 1.00 0.00 O ATOM 1455 CB LYS A 92 10.149 -15.457 -5.404 1.00 0.00 C ATOM 1456 CG LYS A 92 9.124 -15.704 -4.265 1.00 0.00 C ATOM 1457 CD LYS A 92 9.591 -16.752 -3.232 1.00 0.00 C ATOM 1458 CE LYS A 92 8.515 -17.153 -2.207 1.00 0.00 C ATOM 1459 NZ LYS A 92 7.529 -18.078 -2.801 1.00 0.00 N ATOM 0 H LYS A 92 10.183 -12.886 -5.235 1.00 0.00 H new ATOM 0 HA LYS A 92 11.926 -15.099 -4.237 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.628 -14.971 -6.228 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.489 -16.426 -5.769 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.929 -14.762 -3.752 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.180 -16.031 -4.701 1.00 0.00 H new ATOM 0 HD2 LYS A 92 9.922 -17.645 -3.762 1.00 0.00 H new ATOM 0 HD3 LYS A 92 10.456 -16.359 -2.698 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.988 -17.625 -1.346 1.00 0.00 H new ATOM 0 HE3 LYS A 92 8.006 -16.261 -1.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 6.816 -18.331 -2.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 7.062 -17.617 -3.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 8.013 -18.939 -3.127 1.00 0.00 H new ATOM 1472 N PHE A 93 13.721 -14.511 -5.968 1.00 0.00 N ATOM 1473 CA PHE A 93 14.774 -14.204 -6.980 1.00 0.00 C ATOM 1474 C PHE A 93 15.745 -15.403 -7.135 1.00 0.00 C ATOM 1475 O PHE A 93 16.447 -15.774 -6.191 1.00 0.00 O ATOM 1476 CB PHE A 93 15.563 -12.928 -6.572 1.00 0.00 C ATOM 1477 CG PHE A 93 14.821 -11.605 -6.794 1.00 0.00 C ATOM 1478 CD1 PHE A 93 14.857 -10.980 -8.045 1.00 0.00 C ATOM 1479 CD2 PHE A 93 14.055 -11.044 -5.770 1.00 0.00 C ATOM 1480 CE1 PHE A 93 14.088 -9.846 -8.285 1.00 0.00 C ATOM 1481 CE2 PHE A 93 13.301 -9.897 -6.005 1.00 0.00 C ATOM 1482 CZ PHE A 93 13.308 -9.311 -7.265 1.00 0.00 C ATOM 0 H PHE A 93 14.091 -14.733 -5.044 1.00 0.00 H new ATOM 0 HA PHE A 93 14.286 -14.024 -7.938 1.00 0.00 H new ATOM 0 HB2 PHE A 93 15.828 -13.005 -5.518 1.00 0.00 H new ATOM 0 HB3 PHE A 93 16.496 -12.902 -7.134 1.00 0.00 H new ATOM 0 HD1 PHE A 93 15.485 -11.380 -8.828 1.00 0.00 H new ATOM 0 HD2 PHE A 93 14.047 -11.502 -4.792 1.00 0.00 H new ATOM 0 HE1 PHE A 93 14.096 -9.382 -9.260 1.00 0.00 H new ATOM 0 HE2 PHE A 93 12.712 -9.464 -5.210 1.00 0.00 H new ATOM 0 HZ PHE A 93 12.705 -8.435 -7.453 1.00 0.00 H new ATOM 1492 N LYS A 94 15.836 -15.984 -8.340 1.00 0.00 N ATOM 1493 CA LYS A 94 16.769 -17.104 -8.608 1.00 0.00 C ATOM 1494 C LYS A 94 18.192 -16.610 -9.032 1.00 0.00 C ATOM 1495 O LYS A 94 18.363 -15.677 -9.825 1.00 0.00 O ATOM 1496 CB LYS A 94 16.098 -18.067 -9.619 1.00 0.00 C ATOM 1497 CG LYS A 94 16.790 -19.449 -9.695 1.00 0.00 C ATOM 1498 CD LYS A 94 16.079 -20.490 -10.586 1.00 0.00 C ATOM 1499 CE LYS A 94 14.734 -21.046 -10.074 1.00 0.00 C ATOM 1500 NZ LYS A 94 14.872 -21.793 -8.806 1.00 0.00 N ATOM 0 H LYS A 94 15.279 -15.703 -9.147 1.00 0.00 H new ATOM 0 HA LYS A 94 16.959 -17.660 -7.690 1.00 0.00 H new ATOM 0 HB2 LYS A 94 15.053 -18.206 -9.341 1.00 0.00 H new ATOM 0 HB3 LYS A 94 16.106 -17.609 -10.608 1.00 0.00 H new ATOM 0 HG2 LYS A 94 17.805 -19.310 -10.066 1.00 0.00 H new ATOM 0 HG3 LYS A 94 16.872 -19.853 -8.686 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.909 -20.040 -11.564 1.00 0.00 H new ATOM 0 HD3 LYS A 94 16.758 -21.329 -10.735 1.00 0.00 H new ATOM 0 HE2 LYS A 94 14.035 -20.222 -9.931 1.00 0.00 H new ATOM 0 HE3 LYS A 94 14.304 -21.701 -10.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 14.400 -22.715 -8.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 15.880 -21.939 -8.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.433 -21.251 -8.034 1.00 0.00 H new ATOM 1513 N ARG A 95 19.212 -17.304 -8.507 1.00 0.00 N ATOM 1514 CA ARG A 95 20.622 -17.182 -8.962 1.00 0.00 C ATOM 1515 C ARG A 95 20.852 -17.638 -10.442 1.00 0.00 C ATOM 1516 O ARG A 95 20.406 -18.717 -10.847 1.00 0.00 O ATOM 1517 CB ARG A 95 21.464 -18.096 -8.013 1.00 0.00 C ATOM 1518 CG ARG A 95 21.772 -17.543 -6.597 1.00 0.00 C ATOM 1519 CD ARG A 95 22.991 -16.607 -6.514 1.00 0.00 C ATOM 1520 NE ARG A 95 24.298 -17.284 -6.800 1.00 0.00 N ATOM 1521 CZ ARG A 95 25.269 -17.460 -5.912 1.00 0.00 C ATOM 1522 NH1 ARG A 95 25.055 -17.604 -4.640 1.00 0.00 N ATOM 1523 NH2 ARG A 95 26.503 -17.506 -6.320 1.00 0.00 N ATOM 0 H ARG A 95 19.090 -17.974 -7.748 1.00 0.00 H new ATOM 0 HA ARG A 95 20.911 -16.131 -8.927 1.00 0.00 H new ATOM 0 HB2 ARG A 95 20.938 -19.044 -7.900 1.00 0.00 H new ATOM 0 HB3 ARG A 95 22.412 -18.314 -8.505 1.00 0.00 H new ATOM 0 HG2 ARG A 95 20.895 -17.006 -6.235 1.00 0.00 H new ATOM 0 HG3 ARG A 95 21.932 -18.384 -5.922 1.00 0.00 H new ATOM 0 HD2 ARG A 95 22.856 -15.787 -7.219 1.00 0.00 H new ATOM 0 HD3 ARG A 95 23.031 -16.167 -5.518 1.00 0.00 H new ATOM 0 HE ARG A 95 24.452 -17.635 -7.745 1.00 0.00 H new ATOM 0 HH11 ARG A 95 24.102 -17.585 -4.278 1.00 0.00 H new ATOM 0 HH12 ARG A 95 25.840 -17.736 -4.003 1.00 0.00 H new ATOM 0 HH21 ARG A 95 26.716 -17.407 -7.313 1.00 0.00 H new ATOM 0 HH22 ARG A 95 27.258 -17.641 -5.647 1.00 0.00 H new ATOM 1537 N THR A 96 21.681 -16.889 -11.193 1.00 0.00 N ATOM 1538 CA THR A 96 22.455 -17.458 -12.352 1.00 0.00 C ATOM 1539 C THR A 96 23.310 -18.736 -12.065 1.00 0.00 C ATOM 1540 O THR A 96 23.365 -19.653 -12.887 1.00 0.00 O ATOM 1541 CB THR A 96 23.394 -16.386 -13.006 1.00 0.00 C ATOM 1542 OG1 THR A 96 24.095 -15.583 -12.041 1.00 0.00 O ATOM 1543 CG2 THR A 96 22.638 -15.455 -13.957 1.00 0.00 C ATOM 0 H THR A 96 21.843 -15.895 -11.033 1.00 0.00 H new ATOM 0 HA THR A 96 21.658 -17.767 -13.029 1.00 0.00 H new ATOM 0 HB THR A 96 24.124 -16.968 -13.569 1.00 0.00 H new ATOM 0 HG1 THR A 96 24.557 -16.167 -11.403 1.00 0.00 H new ATOM 0 HG21 THR A 96 23.331 -14.731 -14.385 1.00 0.00 H new ATOM 0 HG22 THR A 96 22.186 -16.041 -14.757 1.00 0.00 H new ATOM 0 HG23 THR A 96 21.857 -14.929 -13.407 1.00 0.00 H new ATOM 1551 N ASP A 97 24.013 -18.737 -10.929 1.00 0.00 N ATOM 1552 CA ASP A 97 25.216 -19.580 -10.710 1.00 0.00 C ATOM 1553 C ASP A 97 24.843 -20.996 -10.152 1.00 0.00 C ATOM 1554 O ASP A 97 25.197 -22.015 -10.748 1.00 0.00 O ATOM 1555 CB ASP A 97 26.244 -18.805 -9.816 1.00 0.00 C ATOM 1556 CG ASP A 97 26.362 -17.267 -9.890 1.00 0.00 C ATOM 1557 OD1 ASP A 97 25.977 -16.639 -10.903 1.00 0.00 O ATOM 1558 OD2 ASP A 97 26.754 -16.673 -8.861 1.00 0.00 O ATOM 0 H ASP A 97 23.772 -18.155 -10.126 1.00 0.00 H new ATOM 0 HA ASP A 97 25.698 -19.775 -11.668 1.00 0.00 H new ATOM 0 HB2 ASP A 97 26.021 -19.058 -8.780 1.00 0.00 H new ATOM 0 HB3 ASP A 97 27.231 -19.212 -10.038 1.00 0.00 H new ATOM 1563 N ASN A 98 24.110 -21.046 -9.022 1.00 0.00 N ATOM 1564 CA ASN A 98 23.605 -22.314 -8.415 1.00 0.00 C ATOM 1565 C ASN A 98 22.149 -22.724 -8.830 1.00 0.00 C ATOM 1566 O ASN A 98 21.834 -23.916 -8.811 1.00 0.00 O ATOM 1567 CB ASN A 98 23.667 -22.210 -6.863 1.00 0.00 C ATOM 1568 CG ASN A 98 25.016 -21.840 -6.231 1.00 0.00 C ATOM 1569 OD1 ASN A 98 26.087 -22.285 -6.627 1.00 0.00 O ATOM 1570 ND2 ASN A 98 25.002 -20.984 -5.244 1.00 0.00 N ATOM 0 H ASN A 98 23.846 -20.212 -8.497 1.00 0.00 H new ATOM 0 HA ASN A 98 24.261 -23.093 -8.803 1.00 0.00 H new ATOM 0 HB2 ASN A 98 22.933 -21.470 -6.546 1.00 0.00 H new ATOM 0 HB3 ASN A 98 23.353 -23.168 -6.449 1.00 0.00 H new ATOM 0 HD21 ASN A 98 25.878 -20.692 -4.810 1.00 0.00 H new ATOM 0 HD22 ASN A 98 24.116 -20.608 -4.907 1.00 0.00 H new ATOM 1577 N GLY A 99 21.240 -21.760 -9.088 1.00 0.00 N ATOM 1578 CA GLY A 99 19.771 -22.022 -9.135 1.00 0.00 C ATOM 1579 C GLY A 99 18.973 -22.097 -7.799 1.00 0.00 C ATOM 1580 O GLY A 99 17.780 -22.399 -7.845 1.00 0.00 O ATOM 0 H GLY A 99 21.491 -20.788 -9.268 1.00 0.00 H new ATOM 0 HA2 GLY A 99 19.317 -21.242 -9.746 1.00 0.00 H new ATOM 0 HA3 GLY A 99 19.622 -22.965 -9.661 1.00 0.00 H new ATOM 1584 N ASN A 100 19.588 -21.818 -6.634 1.00 0.00 N ATOM 1585 CA ASN A 100 19.013 -22.178 -5.293 1.00 0.00 C ATOM 1586 C ASN A 100 17.950 -21.215 -4.647 1.00 0.00 C ATOM 1587 O ASN A 100 17.419 -21.541 -3.583 1.00 0.00 O ATOM 1588 CB ASN A 100 20.192 -22.420 -4.304 1.00 0.00 C ATOM 1589 CG ASN A 100 21.078 -23.652 -4.556 1.00 0.00 C ATOM 1590 OD1 ASN A 100 20.830 -24.502 -5.405 1.00 0.00 O ATOM 1591 ND2 ASN A 100 22.146 -23.801 -3.815 1.00 0.00 N ATOM 0 H ASN A 100 20.489 -21.342 -6.579 1.00 0.00 H new ATOM 0 HA ASN A 100 18.419 -23.070 -5.489 1.00 0.00 H new ATOM 0 HB2 ASN A 100 20.830 -21.536 -4.316 1.00 0.00 H new ATOM 0 HB3 ASN A 100 19.779 -22.501 -3.299 1.00 0.00 H new ATOM 0 HD21 ASN A 100 22.751 -24.611 -3.950 1.00 0.00 H new ATOM 0 HD22 ASN A 100 22.373 -23.107 -3.102 1.00 0.00 H new ATOM 1598 N GLU A 101 17.629 -20.064 -5.268 1.00 0.00 N ATOM 1599 CA GLU A 101 16.615 -19.095 -4.793 1.00 0.00 C ATOM 1600 C GLU A 101 16.994 -18.239 -3.535 1.00 0.00 C ATOM 1601 O GLU A 101 17.173 -18.730 -2.417 1.00 0.00 O ATOM 1602 CB GLU A 101 15.168 -19.659 -4.739 1.00 0.00 C ATOM 1603 CG GLU A 101 14.121 -18.586 -5.127 1.00 0.00 C ATOM 1604 CD GLU A 101 12.682 -18.916 -4.773 1.00 0.00 C ATOM 1605 OE1 GLU A 101 12.346 -18.925 -3.569 1.00 0.00 O ATOM 1606 OE2 GLU A 101 11.872 -19.123 -5.700 1.00 0.00 O ATOM 0 H GLU A 101 18.077 -19.772 -6.136 1.00 0.00 H new ATOM 0 HA GLU A 101 16.622 -18.360 -5.598 1.00 0.00 H new ATOM 0 HB2 GLU A 101 15.084 -20.511 -5.414 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.958 -20.026 -3.735 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.390 -17.649 -4.640 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.182 -18.416 -6.202 1.00 0.00 H new ATOM 1613 N LEU A 102 17.039 -16.917 -3.740 1.00 0.00 N ATOM 1614 CA LEU A 102 16.996 -15.906 -2.658 1.00 0.00 C ATOM 1615 C LEU A 102 15.527 -15.474 -2.337 1.00 0.00 C ATOM 1616 O LEU A 102 14.715 -15.211 -3.232 1.00 0.00 O ATOM 1617 CB LEU A 102 17.894 -14.743 -3.156 1.00 0.00 C ATOM 1618 CG LEU A 102 17.902 -13.444 -2.303 1.00 0.00 C ATOM 1619 CD1 LEU A 102 19.314 -12.877 -2.217 1.00 0.00 C ATOM 1620 CD2 LEU A 102 16.969 -12.377 -2.902 1.00 0.00 C ATOM 0 H LEU A 102 17.107 -16.507 -4.671 1.00 0.00 H new ATOM 0 HA LEU A 102 17.368 -16.291 -1.708 1.00 0.00 H new ATOM 0 HB2 LEU A 102 18.918 -15.110 -3.224 1.00 0.00 H new ATOM 0 HB3 LEU A 102 17.581 -14.483 -4.167 1.00 0.00 H new ATOM 0 HG LEU A 102 17.546 -13.704 -1.306 1.00 0.00 H new ATOM 0 HD11 LEU A 102 19.305 -11.967 -1.617 1.00 0.00 H new ATOM 0 HD12 LEU A 102 19.973 -13.611 -1.754 1.00 0.00 H new ATOM 0 HD13 LEU A 102 19.675 -12.647 -3.219 1.00 0.00 H new ATOM 0 HD21 LEU A 102 16.997 -11.480 -2.283 1.00 0.00 H new ATOM 0 HD22 LEU A 102 17.298 -12.131 -3.911 1.00 0.00 H new ATOM 0 HD23 LEU A 102 15.950 -12.763 -2.937 1.00 0.00 H new ATOM 1632 N ASN A 103 15.231 -15.350 -1.033 1.00 0.00 N ATOM 1633 CA ASN A 103 13.917 -14.856 -0.535 1.00 0.00 C ATOM 1634 C ASN A 103 14.130 -13.504 0.211 1.00 0.00 C ATOM 1635 O ASN A 103 14.693 -13.480 1.310 1.00 0.00 O ATOM 1636 CB ASN A 103 13.291 -15.950 0.377 1.00 0.00 C ATOM 1637 CG ASN A 103 12.580 -17.089 -0.363 1.00 0.00 C ATOM 1638 OD1 ASN A 103 11.359 -17.174 -0.368 1.00 0.00 O ATOM 1639 ND2 ASN A 103 13.301 -17.973 -1.012 1.00 0.00 N ATOM 0 H ASN A 103 15.887 -15.586 -0.289 1.00 0.00 H new ATOM 0 HA ASN A 103 13.225 -14.668 -1.355 1.00 0.00 H new ATOM 0 HB2 ASN A 103 14.079 -16.377 0.997 1.00 0.00 H new ATOM 0 HB3 ASN A 103 12.578 -15.475 1.050 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.844 -18.730 -1.520 1.00 0.00 H new ATOM 0 HD22 ASN A 103 14.319 -17.903 -1.008 1.00 0.00 H new ATOM 1646 N THR A 104 13.698 -12.377 -0.385 1.00 0.00 N ATOM 1647 CA THR A 104 13.870 -11.017 0.219 1.00 0.00 C ATOM 1648 C THR A 104 12.506 -10.370 0.619 1.00 0.00 C ATOM 1649 O THR A 104 11.669 -10.078 -0.235 1.00 0.00 O ATOM 1650 CB THR A 104 14.829 -10.125 -0.622 1.00 0.00 C ATOM 1651 OG1 THR A 104 14.998 -8.857 0.005 1.00 0.00 O ATOM 1652 CG2 THR A 104 14.460 -9.877 -2.089 1.00 0.00 C ATOM 0 H THR A 104 13.224 -12.369 -1.288 1.00 0.00 H new ATOM 0 HA THR A 104 14.386 -11.127 1.173 1.00 0.00 H new ATOM 0 HB THR A 104 15.743 -10.718 -0.651 1.00 0.00 H new ATOM 0 HG1 THR A 104 15.951 -8.633 0.038 1.00 0.00 H new ATOM 0 HG21 THR A 104 15.215 -9.241 -2.551 1.00 0.00 H new ATOM 0 HG22 THR A 104 14.414 -10.829 -2.618 1.00 0.00 H new ATOM 0 HG23 THR A 104 13.489 -9.385 -2.142 1.00 0.00 H new ATOM 1660 N VAL A 105 12.272 -10.155 1.925 1.00 0.00 N ATOM 1661 CA VAL A 105 10.978 -9.609 2.455 1.00 0.00 C ATOM 1662 C VAL A 105 11.170 -8.104 2.845 1.00 0.00 C ATOM 1663 O VAL A 105 12.131 -7.760 3.537 1.00 0.00 O ATOM 1664 CB VAL A 105 10.462 -10.488 3.653 1.00 0.00 C ATOM 1665 CG1 VAL A 105 9.162 -9.956 4.310 1.00 0.00 C ATOM 1666 CG2 VAL A 105 10.191 -11.964 3.268 1.00 0.00 C ATOM 0 H VAL A 105 12.961 -10.349 2.652 1.00 0.00 H new ATOM 0 HA VAL A 105 10.208 -9.654 1.684 1.00 0.00 H new ATOM 0 HB VAL A 105 11.289 -10.427 4.361 1.00 0.00 H new ATOM 0 HG11 VAL A 105 8.871 -10.616 5.127 1.00 0.00 H new ATOM 0 HG12 VAL A 105 9.335 -8.952 4.698 1.00 0.00 H new ATOM 0 HG13 VAL A 105 8.365 -9.925 3.567 1.00 0.00 H new ATOM 0 HG21 VAL A 105 9.838 -12.509 4.143 1.00 0.00 H new ATOM 0 HG22 VAL A 105 9.433 -12.003 2.486 1.00 0.00 H new ATOM 0 HG23 VAL A 105 11.112 -12.420 2.903 1.00 0.00 H new ATOM 1676 N ARG A 106 10.237 -7.212 2.459 1.00 0.00 N ATOM 1677 CA ARG A 106 10.174 -5.824 3.005 1.00 0.00 C ATOM 1678 C ARG A 106 8.884 -5.632 3.867 1.00 0.00 C ATOM 1679 O ARG A 106 7.762 -5.733 3.353 1.00 0.00 O ATOM 1680 CB ARG A 106 10.236 -4.691 1.939 1.00 0.00 C ATOM 1681 CG ARG A 106 10.989 -4.906 0.611 1.00 0.00 C ATOM 1682 CD ARG A 106 11.136 -3.579 -0.152 1.00 0.00 C ATOM 1683 NE ARG A 106 11.380 -3.812 -1.597 1.00 0.00 N ATOM 1684 CZ ARG A 106 11.910 -2.935 -2.451 1.00 0.00 C ATOM 1685 NH1 ARG A 106 12.501 -1.831 -2.081 1.00 0.00 N ATOM 1686 NH2 ARG A 106 11.859 -3.200 -3.723 1.00 0.00 N ATOM 0 H ARG A 106 9.512 -7.419 1.772 1.00 0.00 H new ATOM 0 HA ARG A 106 11.075 -5.728 3.610 1.00 0.00 H new ATOM 0 HB2 ARG A 106 9.208 -4.430 1.687 1.00 0.00 H new ATOM 0 HB3 ARG A 106 10.678 -3.819 2.422 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.974 -5.328 0.810 1.00 0.00 H new ATOM 0 HG3 ARG A 106 10.452 -5.628 -0.005 1.00 0.00 H new ATOM 0 HD2 ARG A 106 10.233 -2.982 -0.025 1.00 0.00 H new ATOM 0 HD3 ARG A 106 11.960 -3.004 0.270 1.00 0.00 H new ATOM 0 HE ARG A 106 11.119 -4.724 -1.971 1.00 0.00 H new ATOM 0 HH11 ARG A 106 12.576 -1.600 -1.090 1.00 0.00 H new ATOM 0 HH12 ARG A 106 12.887 -1.199 -2.783 1.00 0.00 H new ATOM 0 HH21 ARG A 106 11.421 -4.062 -4.047 1.00 0.00 H new ATOM 0 HH22 ARG A 106 12.257 -2.546 -4.397 1.00 0.00 H new ATOM 1700 N GLU A 107 9.061 -5.276 5.148 1.00 0.00 N ATOM 1701 CA GLU A 107 7.948 -4.838 6.043 1.00 0.00 C ATOM 1702 C GLU A 107 8.307 -3.517 6.816 1.00 0.00 C ATOM 1703 O GLU A 107 9.420 -2.984 6.711 1.00 0.00 O ATOM 1704 CB GLU A 107 7.461 -6.037 6.910 1.00 0.00 C ATOM 1705 CG GLU A 107 8.436 -6.606 7.972 1.00 0.00 C ATOM 1706 CD GLU A 107 7.871 -7.768 8.768 1.00 0.00 C ATOM 1707 OE1 GLU A 107 7.830 -8.899 8.239 1.00 0.00 O ATOM 1708 OE2 GLU A 107 7.450 -7.557 9.924 1.00 0.00 O ATOM 0 H GLU A 107 9.973 -5.279 5.604 1.00 0.00 H new ATOM 0 HA GLU A 107 7.080 -4.545 5.453 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.549 -5.731 7.423 1.00 0.00 H new ATOM 0 HB3 GLU A 107 7.190 -6.849 6.236 1.00 0.00 H new ATOM 0 HG2 GLU A 107 9.350 -6.930 7.475 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.713 -5.808 8.661 1.00 0.00 H new ATOM 1715 N ILE A 108 7.326 -2.940 7.538 1.00 0.00 N ATOM 1716 CA ILE A 108 7.428 -1.552 8.093 1.00 0.00 C ATOM 1717 C ILE A 108 7.418 -1.613 9.653 1.00 0.00 C ATOM 1718 O ILE A 108 6.363 -1.828 10.260 1.00 0.00 O ATOM 1719 CB ILE A 108 6.306 -0.609 7.512 1.00 0.00 C ATOM 1720 CG1 ILE A 108 6.165 -0.599 5.959 1.00 0.00 C ATOM 1721 CG2 ILE A 108 6.426 0.855 8.017 1.00 0.00 C ATOM 1722 CD1 ILE A 108 7.426 -0.215 5.168 1.00 0.00 C ATOM 0 H ILE A 108 6.446 -3.406 7.758 1.00 0.00 H new ATOM 0 HA ILE A 108 8.374 -1.110 7.780 1.00 0.00 H new ATOM 0 HB ILE A 108 5.398 -1.065 7.905 1.00 0.00 H new ATOM 0 HG12 ILE A 108 5.847 -1.591 5.637 1.00 0.00 H new ATOM 0 HG13 ILE A 108 5.368 0.094 5.691 1.00 0.00 H new ATOM 0 HG21 ILE A 108 5.627 1.456 7.583 1.00 0.00 H new ATOM 0 HG22 ILE A 108 6.344 0.873 9.104 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.391 1.265 7.719 1.00 0.00 H new ATOM 0 HD11 ILE A 108 7.208 -0.243 4.100 1.00 0.00 H new ATOM 0 HD12 ILE A 108 7.739 0.791 5.449 1.00 0.00 H new ATOM 0 HD13 ILE A 108 8.226 -0.920 5.393 1.00 0.00 H new ATOM 1734 N ILE A 109 8.567 -1.349 10.306 1.00 0.00 N ATOM 1735 CA ILE A 109 8.623 -1.149 11.791 1.00 0.00 C ATOM 1736 C ILE A 109 8.595 0.385 12.120 1.00 0.00 C ATOM 1737 O ILE A 109 9.631 1.053 12.199 1.00 0.00 O ATOM 1738 CB ILE A 109 9.761 -2.015 12.445 1.00 0.00 C ATOM 1739 CG1 ILE A 109 9.700 -2.083 13.999 1.00 0.00 C ATOM 1740 CG2 ILE A 109 11.204 -1.635 12.034 1.00 0.00 C ATOM 1741 CD1 ILE A 109 8.476 -2.818 14.575 1.00 0.00 C ATOM 0 H ILE A 109 9.472 -1.267 9.842 1.00 0.00 H new ATOM 0 HA ILE A 109 7.730 -1.541 12.278 1.00 0.00 H new ATOM 0 HB ILE A 109 9.540 -2.999 12.031 1.00 0.00 H new ATOM 0 HG12 ILE A 109 10.603 -2.575 14.361 1.00 0.00 H new ATOM 0 HG13 ILE A 109 9.712 -1.066 14.392 1.00 0.00 H new ATOM 0 HG21 ILE A 109 11.911 -2.292 12.540 1.00 0.00 H new ATOM 0 HG22 ILE A 109 11.316 -1.744 10.955 1.00 0.00 H new ATOM 0 HG23 ILE A 109 11.403 -0.601 12.317 1.00 0.00 H new ATOM 0 HD11 ILE A 109 8.526 -2.811 15.664 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.564 -2.316 14.251 1.00 0.00 H new ATOM 0 HD13 ILE A 109 8.469 -3.848 14.219 1.00 0.00 H new ATOM 1753 N GLY A 110 7.382 0.960 12.259 1.00 0.00 N ATOM 1754 CA GLY A 110 7.205 2.428 12.451 1.00 0.00 C ATOM 1755 C GLY A 110 7.362 3.257 11.158 1.00 0.00 C ATOM 1756 O GLY A 110 6.393 3.463 10.425 1.00 0.00 O ATOM 0 H GLY A 110 6.507 0.436 12.243 1.00 0.00 H new ATOM 0 HA2 GLY A 110 6.216 2.612 12.870 1.00 0.00 H new ATOM 0 HA3 GLY A 110 7.932 2.778 13.184 1.00 0.00 H new ATOM 1760 N ASP A 111 8.597 3.697 10.876 1.00 0.00 N ATOM 1761 CA ASP A 111 8.973 4.230 9.529 1.00 0.00 C ATOM 1762 C ASP A 111 10.368 3.708 9.033 1.00 0.00 C ATOM 1763 O ASP A 111 11.234 4.496 8.626 1.00 0.00 O ATOM 1764 CB ASP A 111 8.777 5.776 9.484 1.00 0.00 C ATOM 1765 CG ASP A 111 9.642 6.660 10.393 1.00 0.00 C ATOM 1766 OD1 ASP A 111 10.978 6.514 10.146 1.00 0.00 O ATOM 1767 OD2 ASP A 111 9.172 7.427 11.227 1.00 0.00 O ATOM 0 H ASP A 111 9.361 3.700 11.551 1.00 0.00 H new ATOM 0 HA ASP A 111 8.287 3.824 8.785 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.942 6.099 8.456 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.733 5.983 9.720 1.00 0.00 H new ATOM 1772 N GLU A 112 10.555 2.378 9.045 1.00 0.00 N ATOM 1773 CA GLU A 112 11.803 1.707 8.601 1.00 0.00 C ATOM 1774 C GLU A 112 11.418 0.526 7.662 1.00 0.00 C ATOM 1775 O GLU A 112 10.707 -0.403 8.066 1.00 0.00 O ATOM 1776 CB GLU A 112 12.607 1.158 9.810 1.00 0.00 C ATOM 1777 CG GLU A 112 13.278 2.178 10.760 1.00 0.00 C ATOM 1778 CD GLU A 112 14.206 1.586 11.820 1.00 0.00 C ATOM 1779 OE1 GLU A 112 14.194 0.368 12.104 1.00 0.00 O ATOM 1780 OE2 GLU A 112 15.016 2.356 12.369 1.00 0.00 O ATOM 0 H GLU A 112 9.840 1.725 9.366 1.00 0.00 H new ATOM 0 HA GLU A 112 12.428 2.432 8.080 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.935 0.540 10.405 1.00 0.00 H new ATOM 0 HB3 GLU A 112 13.385 0.501 9.423 1.00 0.00 H new ATOM 0 HG2 GLU A 112 13.848 2.886 10.159 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.496 2.746 11.264 1.00 0.00 H new ATOM 1787 N LEU A 113 11.927 0.538 6.420 1.00 0.00 N ATOM 1788 CA LEU A 113 11.760 -0.589 5.466 1.00 0.00 C ATOM 1789 C LEU A 113 12.838 -1.683 5.742 1.00 0.00 C ATOM 1790 O LEU A 113 14.011 -1.536 5.372 1.00 0.00 O ATOM 1791 CB LEU A 113 11.821 0.006 4.032 1.00 0.00 C ATOM 1792 CG LEU A 113 11.417 -0.928 2.861 1.00 0.00 C ATOM 1793 CD1 LEU A 113 9.906 -1.212 2.864 1.00 0.00 C ATOM 1794 CD2 LEU A 113 11.797 -0.285 1.514 1.00 0.00 C ATOM 0 H LEU A 113 12.463 1.319 6.043 1.00 0.00 H new ATOM 0 HA LEU A 113 10.800 -1.091 5.585 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.176 0.884 4.002 1.00 0.00 H new ATOM 0 HB3 LEU A 113 12.839 0.352 3.853 1.00 0.00 H new ATOM 0 HG LEU A 113 11.953 -1.868 2.994 1.00 0.00 H new ATOM 0 HD11 LEU A 113 9.658 -1.869 2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.628 -1.694 3.801 1.00 0.00 H new ATOM 0 HD13 LEU A 113 9.359 -0.275 2.762 1.00 0.00 H new ATOM 0 HD21 LEU A 113 11.509 -0.949 0.699 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.278 0.667 1.406 1.00 0.00 H new ATOM 0 HD23 LEU A 113 12.874 -0.117 1.482 1.00 0.00 H new ATOM 1806 N VAL A 114 12.432 -2.773 6.416 1.00 0.00 N ATOM 1807 CA VAL A 114 13.369 -3.864 6.839 1.00 0.00 C ATOM 1808 C VAL A 114 13.576 -4.891 5.674 1.00 0.00 C ATOM 1809 O VAL A 114 12.923 -5.936 5.597 1.00 0.00 O ATOM 1810 CB VAL A 114 12.998 -4.499 8.228 1.00 0.00 C ATOM 1811 CG1 VAL A 114 13.122 -3.511 9.410 1.00 0.00 C ATOM 1812 CG2 VAL A 114 11.607 -5.159 8.334 1.00 0.00 C ATOM 0 H VAL A 114 11.462 -2.935 6.687 1.00 0.00 H new ATOM 0 HA VAL A 114 14.346 -3.419 7.029 1.00 0.00 H new ATOM 0 HB VAL A 114 13.748 -5.288 8.292 1.00 0.00 H new ATOM 0 HG11 VAL A 114 12.851 -4.017 10.337 1.00 0.00 H new ATOM 0 HG12 VAL A 114 14.149 -3.153 9.479 1.00 0.00 H new ATOM 0 HG13 VAL A 114 12.453 -2.665 9.249 1.00 0.00 H new ATOM 0 HG21 VAL A 114 11.470 -5.559 9.338 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.835 -4.416 8.131 1.00 0.00 H new ATOM 0 HG23 VAL A 114 11.532 -5.968 7.608 1.00 0.00 H new ATOM 1822 N GLN A 115 14.497 -4.576 4.744 1.00 0.00 N ATOM 1823 CA GLN A 115 14.674 -5.336 3.476 1.00 0.00 C ATOM 1824 C GLN A 115 15.577 -6.588 3.725 1.00 0.00 C ATOM 1825 O GLN A 115 16.800 -6.498 3.885 1.00 0.00 O ATOM 1826 CB GLN A 115 15.183 -4.304 2.438 1.00 0.00 C ATOM 1827 CG GLN A 115 15.178 -4.734 0.949 1.00 0.00 C ATOM 1828 CD GLN A 115 15.184 -3.542 -0.023 1.00 0.00 C ATOM 1829 OE1 GLN A 115 14.335 -2.657 0.032 1.00 0.00 O ATOM 1830 NE2 GLN A 115 16.112 -3.453 -0.944 1.00 0.00 N ATOM 0 H GLN A 115 15.141 -3.791 4.843 1.00 0.00 H new ATOM 0 HA GLN A 115 13.758 -5.773 3.079 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.576 -3.404 2.531 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.203 -4.030 2.707 1.00 0.00 H new ATOM 0 HG2 GLN A 115 16.050 -5.358 0.754 1.00 0.00 H new ATOM 0 HG3 GLN A 115 14.298 -5.347 0.757 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.831 -4.173 -1.015 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.115 -2.664 -1.590 1.00 0.00 H new ATOM 1839 N THR A 116 14.910 -7.742 3.864 1.00 0.00 N ATOM 1840 CA THR A 116 15.410 -8.891 4.670 1.00 0.00 C ATOM 1841 C THR A 116 15.792 -10.057 3.709 1.00 0.00 C ATOM 1842 O THR A 116 14.955 -10.894 3.364 1.00 0.00 O ATOM 1843 CB THR A 116 14.285 -9.230 5.701 1.00 0.00 C ATOM 1844 OG1 THR A 116 14.031 -8.124 6.571 1.00 0.00 O ATOM 1845 CG2 THR A 116 14.591 -10.415 6.624 1.00 0.00 C ATOM 0 H THR A 116 14.006 -7.917 3.425 1.00 0.00 H new ATOM 0 HA THR A 116 16.320 -8.673 5.229 1.00 0.00 H new ATOM 0 HB THR A 116 13.433 -9.480 5.068 1.00 0.00 H new ATOM 0 HG1 THR A 116 13.392 -7.514 6.147 1.00 0.00 H new ATOM 0 HG21 THR A 116 13.753 -10.573 7.303 1.00 0.00 H new ATOM 0 HG22 THR A 116 14.747 -11.312 6.025 1.00 0.00 H new ATOM 0 HG23 THR A 116 15.491 -10.204 7.201 1.00 0.00 H new ATOM 1853 N TYR A 117 17.058 -10.081 3.267 1.00 0.00 N ATOM 1854 CA TYR A 117 17.545 -10.982 2.188 1.00 0.00 C ATOM 1855 C TYR A 117 18.019 -12.350 2.776 1.00 0.00 C ATOM 1856 O TYR A 117 19.018 -12.408 3.499 1.00 0.00 O ATOM 1857 CB TYR A 117 18.718 -10.289 1.426 1.00 0.00 C ATOM 1858 CG TYR A 117 18.463 -8.984 0.635 1.00 0.00 C ATOM 1859 CD1 TYR A 117 18.549 -7.749 1.285 1.00 0.00 C ATOM 1860 CD2 TYR A 117 18.275 -9.010 -0.753 1.00 0.00 C ATOM 1861 CE1 TYR A 117 18.464 -6.563 0.560 1.00 0.00 C ATOM 1862 CE2 TYR A 117 18.167 -7.820 -1.476 1.00 0.00 C ATOM 1863 CZ TYR A 117 18.271 -6.599 -0.819 1.00 0.00 C ATOM 1864 OH TYR A 117 18.178 -5.411 -1.500 1.00 0.00 O ATOM 0 H TYR A 117 17.786 -9.475 3.645 1.00 0.00 H new ATOM 0 HA TYR A 117 16.725 -11.178 1.497 1.00 0.00 H new ATOM 0 HB2 TYR A 117 19.499 -10.078 2.156 1.00 0.00 H new ATOM 0 HB3 TYR A 117 19.125 -11.018 0.726 1.00 0.00 H new ATOM 0 HD1 TYR A 117 18.682 -7.715 2.356 1.00 0.00 H new ATOM 0 HD2 TYR A 117 18.213 -9.957 -1.268 1.00 0.00 H new ATOM 0 HE1 TYR A 117 18.548 -5.614 1.068 1.00 0.00 H new ATOM 0 HE2 TYR A 117 18.003 -7.848 -2.543 1.00 0.00 H new ATOM 0 HH TYR A 117 18.205 -5.584 -2.464 1.00 0.00 H new ATOM 1874 N VAL A 118 17.319 -13.446 2.446 1.00 0.00 N ATOM 1875 CA VAL A 118 17.633 -14.810 2.969 1.00 0.00 C ATOM 1876 C VAL A 118 18.233 -15.661 1.801 1.00 0.00 C ATOM 1877 O VAL A 118 17.595 -15.827 0.752 1.00 0.00 O ATOM 1878 CB VAL A 118 16.358 -15.473 3.601 1.00 0.00 C ATOM 1879 CG1 VAL A 118 16.650 -16.856 4.233 1.00 0.00 C ATOM 1880 CG2 VAL A 118 15.656 -14.629 4.696 1.00 0.00 C ATOM 0 H VAL A 118 16.520 -13.426 1.812 1.00 0.00 H new ATOM 0 HA VAL A 118 18.370 -14.748 3.770 1.00 0.00 H new ATOM 0 HB VAL A 118 15.695 -15.562 2.740 1.00 0.00 H new ATOM 0 HG11 VAL A 118 15.731 -17.265 4.654 1.00 0.00 H new ATOM 0 HG12 VAL A 118 17.032 -17.532 3.468 1.00 0.00 H new ATOM 0 HG13 VAL A 118 17.393 -16.746 5.023 1.00 0.00 H new ATOM 0 HG21 VAL A 118 14.787 -15.170 5.071 1.00 0.00 H new ATOM 0 HG22 VAL A 118 16.351 -14.445 5.515 1.00 0.00 H new ATOM 0 HG23 VAL A 118 15.335 -13.677 4.272 1.00 0.00 H new ATOM 1890 N TYR A 119 19.442 -16.222 1.997 1.00 0.00 N ATOM 1891 CA TYR A 119 20.075 -17.144 1.010 1.00 0.00 C ATOM 1892 C TYR A 119 20.829 -18.323 1.720 1.00 0.00 C ATOM 1893 O TYR A 119 21.643 -18.113 2.624 1.00 0.00 O ATOM 1894 CB TYR A 119 20.963 -16.303 0.051 1.00 0.00 C ATOM 1895 CG TYR A 119 21.522 -17.114 -1.122 1.00 0.00 C ATOM 1896 CD1 TYR A 119 20.686 -17.516 -2.170 1.00 0.00 C ATOM 1897 CD2 TYR A 119 22.821 -17.620 -1.044 1.00 0.00 C ATOM 1898 CE1 TYR A 119 21.130 -18.451 -3.100 1.00 0.00 C ATOM 1899 CE2 TYR A 119 23.270 -18.535 -1.989 1.00 0.00 C ATOM 1900 CZ TYR A 119 22.417 -18.971 -2.996 1.00 0.00 C ATOM 1901 OH TYR A 119 22.767 -20.086 -3.703 1.00 0.00 O ATOM 0 H TYR A 119 20.008 -16.058 2.829 1.00 0.00 H new ATOM 0 HA TYR A 119 19.314 -17.639 0.407 1.00 0.00 H new ATOM 0 HB2 TYR A 119 20.378 -15.470 -0.338 1.00 0.00 H new ATOM 0 HB3 TYR A 119 21.791 -15.875 0.615 1.00 0.00 H new ATOM 0 HD1 TYR A 119 19.693 -17.099 -2.257 1.00 0.00 H new ATOM 0 HD2 TYR A 119 23.478 -17.300 -0.248 1.00 0.00 H new ATOM 0 HE1 TYR A 119 20.479 -18.772 -3.899 1.00 0.00 H new ATOM 0 HE2 TYR A 119 24.283 -18.908 -1.941 1.00 0.00 H new ATOM 0 HH TYR A 119 23.130 -20.761 -3.092 1.00 0.00 H new ATOM 1911 N GLU A 120 20.525 -19.572 1.307 1.00 0.00 N ATOM 1912 CA GLU A 120 20.921 -20.833 2.021 1.00 0.00 C ATOM 1913 C GLU A 120 20.622 -20.875 3.571 1.00 0.00 C ATOM 1914 O GLU A 120 21.478 -21.245 4.382 1.00 0.00 O ATOM 1915 CB GLU A 120 22.367 -21.324 1.690 1.00 0.00 C ATOM 1916 CG GLU A 120 22.949 -21.248 0.256 1.00 0.00 C ATOM 1917 CD GLU A 120 22.211 -21.840 -0.937 1.00 0.00 C ATOM 1918 OE1 GLU A 120 21.061 -22.305 -0.823 1.00 0.00 O ATOM 1919 OE2 GLU A 120 22.797 -21.801 -2.044 1.00 0.00 O ATOM 0 H GLU A 120 19.990 -19.749 0.457 1.00 0.00 H new ATOM 0 HA GLU A 120 20.232 -21.560 1.592 1.00 0.00 H new ATOM 0 HB2 GLU A 120 23.045 -20.765 2.335 1.00 0.00 H new ATOM 0 HB3 GLU A 120 22.423 -22.368 1.998 1.00 0.00 H new ATOM 0 HG2 GLU A 120 23.111 -20.193 0.036 1.00 0.00 H new ATOM 0 HG3 GLU A 120 23.930 -21.721 0.287 1.00 0.00 H new ATOM 1926 N GLY A 121 19.424 -20.432 4.002 1.00 0.00 N ATOM 1927 CA GLY A 121 19.160 -20.133 5.441 1.00 0.00 C ATOM 1928 C GLY A 121 19.705 -18.812 6.057 1.00 0.00 C ATOM 1929 O GLY A 121 19.146 -18.360 7.057 1.00 0.00 O ATOM 0 H GLY A 121 18.625 -20.272 3.388 1.00 0.00 H new ATOM 0 HA2 GLY A 121 18.079 -20.140 5.584 1.00 0.00 H new ATOM 0 HA3 GLY A 121 19.564 -20.959 6.027 1.00 0.00 H new ATOM 1933 N VAL A 122 20.783 -18.208 5.524 1.00 0.00 N ATOM 1934 CA VAL A 122 21.478 -17.046 6.155 1.00 0.00 C ATOM 1935 C VAL A 122 20.734 -15.714 5.793 1.00 0.00 C ATOM 1936 O VAL A 122 20.654 -15.317 4.625 1.00 0.00 O ATOM 1937 CB VAL A 122 22.997 -17.055 5.755 1.00 0.00 C ATOM 1938 CG1 VAL A 122 23.803 -15.856 6.309 1.00 0.00 C ATOM 1939 CG2 VAL A 122 23.754 -18.328 6.217 1.00 0.00 C ATOM 0 H VAL A 122 21.205 -18.504 4.644 1.00 0.00 H new ATOM 0 HA VAL A 122 21.445 -17.125 7.242 1.00 0.00 H new ATOM 0 HB VAL A 122 22.947 -17.007 4.667 1.00 0.00 H new ATOM 0 HG11 VAL A 122 24.842 -15.936 5.988 1.00 0.00 H new ATOM 0 HG12 VAL A 122 23.378 -14.926 5.932 1.00 0.00 H new ATOM 0 HG13 VAL A 122 23.758 -15.860 7.398 1.00 0.00 H new ATOM 0 HG21 VAL A 122 24.797 -18.264 5.906 1.00 0.00 H new ATOM 0 HG22 VAL A 122 23.703 -18.407 7.303 1.00 0.00 H new ATOM 0 HG23 VAL A 122 23.294 -19.208 5.767 1.00 0.00 H new ATOM 1949 N GLU A 123 20.212 -15.037 6.829 1.00 0.00 N ATOM 1950 CA GLU A 123 19.471 -13.756 6.695 1.00 0.00 C ATOM 1951 C GLU A 123 20.401 -12.505 6.828 1.00 0.00 C ATOM 1952 O GLU A 123 21.282 -12.444 7.695 1.00 0.00 O ATOM 1953 CB GLU A 123 18.363 -13.780 7.784 1.00 0.00 C ATOM 1954 CG GLU A 123 17.381 -12.580 7.752 1.00 0.00 C ATOM 1955 CD GLU A 123 16.264 -12.665 8.775 1.00 0.00 C ATOM 1956 OE1 GLU A 123 16.453 -12.189 9.913 1.00 0.00 O ATOM 1957 OE2 GLU A 123 15.184 -13.189 8.433 1.00 0.00 O ATOM 0 H GLU A 123 20.289 -15.359 7.794 1.00 0.00 H new ATOM 0 HA GLU A 123 19.039 -13.667 5.698 1.00 0.00 H new ATOM 0 HB2 GLU A 123 17.790 -14.701 7.677 1.00 0.00 H new ATOM 0 HB3 GLU A 123 18.839 -13.813 8.764 1.00 0.00 H new ATOM 0 HG2 GLU A 123 17.942 -11.661 7.919 1.00 0.00 H new ATOM 0 HG3 GLU A 123 16.943 -12.510 6.757 1.00 0.00 H new ATOM 1964 N ALA A 124 20.144 -11.474 6.004 1.00 0.00 N ATOM 1965 CA ALA A 124 20.719 -10.121 6.208 1.00 0.00 C ATOM 1966 C ALA A 124 19.681 -8.983 5.993 1.00 0.00 C ATOM 1967 O ALA A 124 18.995 -8.922 4.967 1.00 0.00 O ATOM 1968 CB ALA A 124 21.906 -9.950 5.261 1.00 0.00 C ATOM 0 H ALA A 124 19.540 -11.547 5.185 1.00 0.00 H new ATOM 0 HA ALA A 124 21.041 -10.042 7.246 1.00 0.00 H new ATOM 0 HB1 ALA A 124 22.341 -8.960 5.398 1.00 0.00 H new ATOM 0 HB2 ALA A 124 22.657 -10.709 5.478 1.00 0.00 H new ATOM 0 HB3 ALA A 124 21.568 -10.058 4.230 1.00 0.00 H new ATOM 1974 N LYS A 125 19.605 -8.050 6.955 1.00 0.00 N ATOM 1975 CA LYS A 125 18.634 -6.926 6.912 1.00 0.00 C ATOM 1976 C LYS A 125 19.349 -5.607 6.494 1.00 0.00 C ATOM 1977 O LYS A 125 20.045 -4.983 7.303 1.00 0.00 O ATOM 1978 CB LYS A 125 17.913 -6.795 8.282 1.00 0.00 C ATOM 1979 CG LYS A 125 16.945 -7.944 8.644 1.00 0.00 C ATOM 1980 CD LYS A 125 16.099 -7.645 9.897 1.00 0.00 C ATOM 1981 CE LYS A 125 15.108 -8.779 10.196 1.00 0.00 C ATOM 1982 NZ LYS A 125 14.261 -8.432 11.353 1.00 0.00 N ATOM 0 H LYS A 125 20.205 -8.045 7.780 1.00 0.00 H new ATOM 0 HA LYS A 125 17.873 -7.131 6.159 1.00 0.00 H new ATOM 0 HB2 LYS A 125 18.669 -6.722 9.064 1.00 0.00 H new ATOM 0 HB3 LYS A 125 17.355 -5.859 8.290 1.00 0.00 H new ATOM 0 HG2 LYS A 125 16.281 -8.132 7.800 1.00 0.00 H new ATOM 0 HG3 LYS A 125 17.518 -8.857 8.808 1.00 0.00 H new ATOM 0 HD2 LYS A 125 16.757 -7.501 10.754 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.553 -6.713 9.754 1.00 0.00 H new ATOM 0 HE2 LYS A 125 14.483 -8.964 9.322 1.00 0.00 H new ATOM 0 HE3 LYS A 125 15.652 -9.701 10.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 13.596 -9.209 11.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 14.861 -8.278 12.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 13.728 -7.564 11.145 1.00 0.00 H new ATOM 1995 N ARG A 126 19.132 -5.140 5.248 1.00 0.00 N ATOM 1996 CA ARG A 126 19.437 -3.725 4.881 1.00 0.00 C ATOM 1997 C ARG A 126 18.220 -2.848 5.298 1.00 0.00 C ATOM 1998 O ARG A 126 17.166 -2.883 4.656 1.00 0.00 O ATOM 1999 CB ARG A 126 19.807 -3.555 3.383 1.00 0.00 C ATOM 2000 CG ARG A 126 21.066 -4.319 2.894 1.00 0.00 C ATOM 2001 CD ARG A 126 21.793 -3.667 1.696 1.00 0.00 C ATOM 2002 NE ARG A 126 22.717 -2.609 2.184 1.00 0.00 N ATOM 2003 CZ ARG A 126 23.399 -1.757 1.423 1.00 0.00 C ATOM 2004 NH1 ARG A 126 23.309 -1.677 0.123 1.00 0.00 N ATOM 2005 NH2 ARG A 126 24.222 -0.940 1.996 1.00 0.00 N ATOM 0 H ARG A 126 18.754 -5.702 4.485 1.00 0.00 H new ATOM 0 HA ARG A 126 20.327 -3.398 5.418 1.00 0.00 H new ATOM 0 HB2 ARG A 126 18.957 -3.877 2.782 1.00 0.00 H new ATOM 0 HB3 ARG A 126 19.953 -2.493 3.185 1.00 0.00 H new ATOM 0 HG2 ARG A 126 21.767 -4.405 3.724 1.00 0.00 H new ATOM 0 HG3 ARG A 126 20.775 -5.332 2.617 1.00 0.00 H new ATOM 0 HD2 ARG A 126 22.350 -4.422 1.142 1.00 0.00 H new ATOM 0 HD3 ARG A 126 21.066 -3.238 1.007 1.00 0.00 H new ATOM 0 HE ARG A 126 22.839 -2.529 3.194 1.00 0.00 H new ATOM 0 HH11 ARG A 126 22.678 -2.298 -0.384 1.00 0.00 H new ATOM 0 HH12 ARG A 126 23.869 -0.993 -0.386 1.00 0.00 H new ATOM 0 HH21 ARG A 126 24.336 -0.959 3.009 1.00 0.00 H new ATOM 0 HH22 ARG A 126 24.757 -0.277 1.434 1.00 0.00 H new ATOM 2019 N ILE A 127 18.337 -2.120 6.420 1.00 0.00 N ATOM 2020 CA ILE A 127 17.173 -1.422 7.042 1.00 0.00 C ATOM 2021 C ILE A 127 17.217 0.066 6.588 1.00 0.00 C ATOM 2022 O ILE A 127 18.147 0.810 6.920 1.00 0.00 O ATOM 2023 CB ILE A 127 17.085 -1.635 8.594 1.00 0.00 C ATOM 2024 CG1 ILE A 127 17.043 -3.149 8.972 1.00 0.00 C ATOM 2025 CG2 ILE A 127 15.843 -0.892 9.158 1.00 0.00 C ATOM 2026 CD1 ILE A 127 17.067 -3.502 10.465 1.00 0.00 C ATOM 0 H ILE A 127 19.216 -1.993 6.922 1.00 0.00 H new ATOM 0 HA ILE A 127 16.238 -1.861 6.693 1.00 0.00 H new ATOM 0 HB ILE A 127 17.987 -1.219 9.043 1.00 0.00 H new ATOM 0 HG12 ILE A 127 16.141 -3.580 8.538 1.00 0.00 H new ATOM 0 HG13 ILE A 127 17.892 -3.639 8.496 1.00 0.00 H new ATOM 0 HG21 ILE A 127 15.787 -1.043 10.236 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.929 0.174 8.945 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.940 -1.284 8.689 1.00 0.00 H new ATOM 0 HD11 ILE A 127 17.033 -4.585 10.583 1.00 0.00 H new ATOM 0 HD12 ILE A 127 17.981 -3.116 10.915 1.00 0.00 H new ATOM 0 HD13 ILE A 127 16.203 -3.056 10.958 1.00 0.00 H new ATOM 2038 N PHE A 128 16.197 0.477 5.819 1.00 0.00 N ATOM 2039 CA PHE A 128 16.164 1.817 5.185 1.00 0.00 C ATOM 2040 C PHE A 128 15.129 2.716 5.920 1.00 0.00 C ATOM 2041 O PHE A 128 13.924 2.448 5.906 1.00 0.00 O ATOM 2042 CB PHE A 128 15.844 1.722 3.666 1.00 0.00 C ATOM 2043 CG PHE A 128 16.777 0.872 2.794 1.00 0.00 C ATOM 2044 CD1 PHE A 128 16.546 -0.500 2.650 1.00 0.00 C ATOM 2045 CD2 PHE A 128 17.855 1.460 2.128 1.00 0.00 C ATOM 2046 CE1 PHE A 128 17.407 -1.276 1.880 1.00 0.00 C ATOM 2047 CE2 PHE A 128 18.712 0.678 1.359 1.00 0.00 C ATOM 2048 CZ PHE A 128 18.491 -0.690 1.240 1.00 0.00 C ATOM 0 H PHE A 128 15.378 -0.097 5.617 1.00 0.00 H new ATOM 0 HA PHE A 128 17.153 2.267 5.274 1.00 0.00 H new ATOM 0 HB2 PHE A 128 14.833 1.327 3.560 1.00 0.00 H new ATOM 0 HB3 PHE A 128 15.835 2.734 3.261 1.00 0.00 H new ATOM 0 HD1 PHE A 128 15.698 -0.958 3.137 1.00 0.00 H new ATOM 0 HD2 PHE A 128 18.024 2.524 2.210 1.00 0.00 H new ATOM 0 HE1 PHE A 128 17.232 -2.337 1.780 1.00 0.00 H new ATOM 0 HE2 PHE A 128 19.550 1.134 0.854 1.00 0.00 H new ATOM 0 HZ PHE A 128 19.162 -1.296 0.650 1.00 0.00 H new ATOM 2058 N LYS A 129 15.606 3.790 6.556 1.00 0.00 N ATOM 2059 CA LYS A 129 14.747 4.757 7.286 1.00 0.00 C ATOM 2060 C LYS A 129 14.142 5.839 6.330 1.00 0.00 C ATOM 2061 O LYS A 129 14.742 6.215 5.317 1.00 0.00 O ATOM 2062 CB LYS A 129 15.651 5.328 8.408 1.00 0.00 C ATOM 2063 CG LYS A 129 14.958 6.217 9.469 1.00 0.00 C ATOM 2064 CD LYS A 129 15.909 6.582 10.630 1.00 0.00 C ATOM 2065 CE LYS A 129 16.046 5.473 11.689 1.00 0.00 C ATOM 2066 NZ LYS A 129 17.200 5.748 12.567 1.00 0.00 N ATOM 0 H LYS A 129 16.599 4.023 6.586 1.00 0.00 H new ATOM 0 HA LYS A 129 13.862 4.290 7.718 1.00 0.00 H new ATOM 0 HB2 LYS A 129 16.126 4.492 8.921 1.00 0.00 H new ATOM 0 HB3 LYS A 129 16.446 5.910 7.942 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.596 7.130 8.996 1.00 0.00 H new ATOM 0 HG3 LYS A 129 14.086 5.696 9.865 1.00 0.00 H new ATOM 0 HD2 LYS A 129 16.895 6.808 10.223 1.00 0.00 H new ATOM 0 HD3 LYS A 129 15.548 7.490 11.112 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.134 5.412 12.283 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.173 4.507 11.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 17.139 5.152 13.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 18.082 5.536 12.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 17.194 6.750 12.845 1.00 0.00 H new ATOM 2079 N LYS A 130 12.936 6.339 6.660 1.00 0.00 N ATOM 2080 CA LYS A 130 12.228 7.372 5.850 1.00 0.00 C ATOM 2081 C LYS A 130 13.012 8.729 5.753 1.00 0.00 C ATOM 2082 O LYS A 130 13.182 9.439 6.749 1.00 0.00 O ATOM 2083 CB LYS A 130 10.807 7.527 6.465 1.00 0.00 C ATOM 2084 CG LYS A 130 9.813 8.448 5.711 1.00 0.00 C ATOM 2085 CD LYS A 130 9.307 7.918 4.348 1.00 0.00 C ATOM 2086 CE LYS A 130 8.247 6.801 4.423 1.00 0.00 C ATOM 2087 NZ LYS A 130 6.897 7.319 4.724 1.00 0.00 N ATOM 0 H LYS A 130 12.420 6.046 7.490 1.00 0.00 H new ATOM 0 HA LYS A 130 12.156 7.051 4.811 1.00 0.00 H new ATOM 0 HB2 LYS A 130 10.360 6.536 6.541 1.00 0.00 H new ATOM 0 HB3 LYS A 130 10.917 7.906 7.481 1.00 0.00 H new ATOM 0 HG2 LYS A 130 8.951 8.624 6.354 1.00 0.00 H new ATOM 0 HG3 LYS A 130 10.292 9.413 5.549 1.00 0.00 H new ATOM 0 HD2 LYS A 130 8.890 8.753 3.785 1.00 0.00 H new ATOM 0 HD3 LYS A 130 10.161 7.547 3.782 1.00 0.00 H new ATOM 0 HE2 LYS A 130 8.223 6.264 3.475 1.00 0.00 H new ATOM 0 HE3 LYS A 130 8.536 6.082 5.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.223 6.528 4.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.910 7.809 5.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.607 7.985 3.980 1.00 0.00 H new ATOM 2100 N ASP A 131 13.499 9.056 4.539 1.00 0.00 N ATOM 2101 CA ASP A 131 14.379 10.219 4.253 1.00 0.00 C ATOM 2102 C ASP A 131 15.752 10.117 4.951 1.00 0.00 C ATOM 2103 O ASP A 131 16.803 10.288 4.291 1.00 0.00 O ATOM 2104 CB ASP A 131 13.644 11.572 4.453 1.00 0.00 C ATOM 2105 CG ASP A 131 14.289 12.784 3.780 1.00 0.00 C ATOM 2106 OD1 ASP A 131 14.229 12.708 2.416 1.00 0.00 O ATOM 2107 OD2 ASP A 131 14.775 13.725 4.401 1.00 0.00 O ATOM 0 H ASP A 131 13.289 8.507 3.705 1.00 0.00 H new ATOM 0 HA ASP A 131 14.621 10.188 3.191 1.00 0.00 H new ATOM 0 HB2 ASP A 131 12.626 11.470 4.077 1.00 0.00 H new ATOM 0 HB3 ASP A 131 13.571 11.770 5.522 1.00 0.00 H new