USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 793 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 32:sc= 1.21 USER MOD Single : A 22 ASN :FLIP amide:sc= -1.02 F(o=-2.8!,f=-1) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0653 USER MOD Single : A 31 GLN : amide:sc=-0.00582 X(o=-0.0058,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot -39:sc= 1.07 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= -1.72 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 130:sc= -1.21 USER MOD Single : A 62 CYS SG : rot 103:sc= -3.64! USER MOD Single : A 64 TYR OH : rot 32:sc= -2.67! USER MOD Single : A 65 GLN : amide:sc= -0.166 K(o=-0.17,f=-0.82) USER MOD Single : A 67 GLN :FLIP amide:sc= -11.3! C(o=-12!,f=-11!) USER MOD Single : A 69 THR OG1 : rot -170:sc= -0.813 USER MOD Single : A 72 SER OG : rot 83:sc= 0.288 USER MOD Single : A 74 MET CE :methyl -158:sc= -4.46! (180deg=-6.94!) USER MOD Single : A 76 ASN : amide:sc= -2.42! C(o=-2.4!,f=-3.6!) USER MOD Single : A 78 ASN : amide:sc= -1.45! C(o=-1.4!,f=-1!) USER MOD Single : A 83 SER OG : rot 56:sc= -0.0893 USER MOD Single : A 91 ASN :FLIP amide:sc= -0.697! C(o=-4.7!,f=-0.7!) USER MOD Single : A 94 SER OG : rot 170:sc= -0.0212 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -4.13! C(o=-4.1!,f=-4.7!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 8 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA ASP A 8 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C ASP A 8 1.153 0.432 -2.389 1.00 0.00 C ATOM 4 O ASP A 8 0.674 -0.404 -3.154 1.00 0.00 O ATOM 5 CB ASP A 8 2.605 -1.398 -1.569 1.00 0.00 C ATOM 6 CG ASP A 8 3.289 -1.531 -2.931 1.00 0.00 C ATOM 7 OD1 ASP A 8 4.391 -0.957 -3.071 1.00 0.00 O ATOM 8 OD2 ASP A 8 2.694 -2.202 -3.801 1.00 0.00 O ATOM 0 HA ASP A 8 2.911 0.688 -1.134 1.00 0.00 H new ATOM 0 HB2 ASP A 8 3.314 -1.689 -0.794 1.00 0.00 H new ATOM 0 HB3 ASP A 8 1.776 -2.105 -1.525 1.00 0.00 H new ATOM 13 N PRO A 9 0.926 1.770 -2.470 1.00 0.00 N ATOM 14 CA PRO A 9 0.071 2.323 -3.507 1.00 0.00 C ATOM 15 C PRO A 9 0.784 2.326 -4.861 1.00 0.00 C ATOM 16 O PRO A 9 0.281 1.763 -5.832 1.00 0.00 O ATOM 17 CB PRO A 9 -0.286 3.718 -3.020 1.00 0.00 C ATOM 18 CG PRO A 9 0.749 4.068 -1.963 1.00 0.00 C ATOM 19 CD PRO A 9 1.476 2.789 -1.581 1.00 0.00 C ATOM 0 HA PRO A 9 -0.829 1.731 -3.671 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -0.265 4.435 -3.840 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -1.293 3.740 -2.603 1.00 0.00 H new ATOM 0 HG2 PRO A 9 1.452 4.807 -2.347 1.00 0.00 H new ATOM 0 HG3 PRO A 9 0.269 4.509 -1.090 1.00 0.00 H new ATOM 0 HD2 PRO A 9 2.553 2.891 -1.714 1.00 0.00 H new ATOM 0 HD3 PRO A 9 1.307 2.535 -0.535 1.00 0.00 H new ATOM 27 N ALA A 10 1.943 2.967 -4.882 1.00 0.00 N ATOM 28 CA ALA A 10 2.729 3.051 -6.101 1.00 0.00 C ATOM 29 C ALA A 10 4.051 3.762 -5.802 1.00 0.00 C ATOM 30 O ALA A 10 4.159 4.975 -5.975 1.00 0.00 O ATOM 31 CB ALA A 10 1.917 3.761 -7.185 1.00 0.00 C ATOM 0 H ALA A 10 2.357 3.433 -4.075 1.00 0.00 H new ATOM 0 HA ALA A 10 2.967 2.055 -6.473 1.00 0.00 H new ATOM 0 HB1 ALA A 10 2.507 3.824 -8.099 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.003 3.200 -7.381 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.661 4.766 -6.849 1.00 0.00 H new ATOM 37 N VAL A 11 5.022 2.977 -5.359 1.00 0.00 N ATOM 38 CA VAL A 11 6.331 3.517 -5.035 1.00 0.00 C ATOM 39 C VAL A 11 7.038 3.939 -6.325 1.00 0.00 C ATOM 40 O VAL A 11 7.803 4.902 -6.331 1.00 0.00 O ATOM 41 CB VAL A 11 7.131 2.497 -4.222 1.00 0.00 C ATOM 42 CG1 VAL A 11 8.455 3.095 -3.742 1.00 0.00 C ATOM 43 CG2 VAL A 11 6.309 1.969 -3.044 1.00 0.00 C ATOM 0 H VAL A 11 4.928 1.971 -5.217 1.00 0.00 H new ATOM 0 HA VAL A 11 6.233 4.406 -4.412 1.00 0.00 H new ATOM 0 HB VAL A 11 7.361 1.655 -4.875 1.00 0.00 H new ATOM 0 HG11 VAL A 11 9.004 2.349 -3.167 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.050 3.399 -4.603 1.00 0.00 H new ATOM 0 HG13 VAL A 11 8.256 3.963 -3.114 1.00 0.00 H new ATOM 0 HG21 VAL A 11 6.901 1.246 -2.483 1.00 0.00 H new ATOM 0 HG22 VAL A 11 6.034 2.798 -2.391 1.00 0.00 H new ATOM 0 HG23 VAL A 11 5.406 1.487 -3.418 1.00 0.00 H new ATOM 53 N ASP A 12 6.756 3.197 -7.386 1.00 0.00 N ATOM 54 CA ASP A 12 7.356 3.482 -8.679 1.00 0.00 C ATOM 55 C ASP A 12 6.805 4.807 -9.210 1.00 0.00 C ATOM 56 O ASP A 12 7.521 5.562 -9.867 1.00 0.00 O ATOM 57 CB ASP A 12 7.019 2.389 -9.695 1.00 0.00 C ATOM 58 CG ASP A 12 8.221 1.808 -10.442 1.00 0.00 C ATOM 59 OD1 ASP A 12 9.227 2.541 -10.555 1.00 0.00 O ATOM 60 OD2 ASP A 12 8.107 0.644 -10.883 1.00 0.00 O ATOM 0 H ASP A 12 6.120 2.399 -7.377 1.00 0.00 H new ATOM 0 HA ASP A 12 8.437 3.530 -8.547 1.00 0.00 H new ATOM 0 HB2 ASP A 12 6.506 1.579 -9.177 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.319 2.796 -10.425 1.00 0.00 H new ATOM 65 N ARG A 13 5.539 5.050 -8.905 1.00 0.00 N ATOM 66 CA ARG A 13 4.885 6.271 -9.343 1.00 0.00 C ATOM 67 C ARG A 13 5.650 7.495 -8.837 1.00 0.00 C ATOM 68 O ARG A 13 5.750 8.502 -9.535 1.00 0.00 O ATOM 69 CB ARG A 13 3.442 6.335 -8.838 1.00 0.00 C ATOM 70 CG ARG A 13 2.518 6.948 -9.892 1.00 0.00 C ATOM 71 CD ARG A 13 1.503 5.920 -10.395 1.00 0.00 C ATOM 72 NE ARG A 13 0.139 6.302 -9.965 1.00 0.00 N ATOM 73 CZ ARG A 13 -0.920 5.483 -10.011 1.00 0.00 C ATOM 74 NH1 ARG A 13 -0.780 4.231 -10.467 1.00 0.00 N ATOM 75 NH2 ARG A 13 -2.120 5.915 -9.599 1.00 0.00 N ATOM 0 H ARG A 13 4.949 4.422 -8.360 1.00 0.00 H new ATOM 0 HA ARG A 13 4.877 6.269 -10.433 1.00 0.00 H new ATOM 0 HB2 ARG A 13 3.097 5.332 -8.586 1.00 0.00 H new ATOM 0 HB3 ARG A 13 3.399 6.927 -7.924 1.00 0.00 H new ATOM 0 HG2 ARG A 13 1.994 7.804 -9.468 1.00 0.00 H new ATOM 0 HG3 ARG A 13 3.110 7.319 -10.728 1.00 0.00 H new ATOM 0 HD2 ARG A 13 1.546 5.857 -11.482 1.00 0.00 H new ATOM 0 HD3 ARG A 13 1.752 4.932 -10.008 1.00 0.00 H new ATOM 0 HE ARG A 13 -0.003 7.248 -9.612 1.00 0.00 H new ATOM 0 HH11 ARG A 13 0.133 3.901 -10.779 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -1.587 3.608 -10.502 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -2.227 6.868 -9.250 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -2.926 5.291 -9.634 1.00 0.00 H new ATOM 89 N SER A 14 6.172 7.367 -7.626 1.00 0.00 N ATOM 90 CA SER A 14 6.925 8.450 -7.017 1.00 0.00 C ATOM 91 C SER A 14 8.156 8.773 -7.867 1.00 0.00 C ATOM 92 O SER A 14 8.500 9.940 -8.049 1.00 0.00 O ATOM 93 CB SER A 14 7.344 8.096 -5.589 1.00 0.00 C ATOM 94 OG SER A 14 6.576 8.800 -4.617 1.00 0.00 O ATOM 0 H SER A 14 6.088 6.529 -7.050 1.00 0.00 H new ATOM 0 HA SER A 14 6.282 9.329 -6.970 1.00 0.00 H new ATOM 0 HB2 SER A 14 7.230 7.023 -5.433 1.00 0.00 H new ATOM 0 HB3 SER A 14 8.400 8.327 -5.453 1.00 0.00 H new ATOM 0 HG SER A 14 6.873 8.545 -3.718 1.00 0.00 H new ATOM 100 N LEU A 15 8.786 7.719 -8.364 1.00 0.00 N ATOM 101 CA LEU A 15 9.971 7.875 -9.190 1.00 0.00 C ATOM 102 C LEU A 15 9.573 8.486 -10.535 1.00 0.00 C ATOM 103 O LEU A 15 10.430 8.933 -11.295 1.00 0.00 O ATOM 104 CB LEU A 15 10.716 6.545 -9.315 1.00 0.00 C ATOM 105 CG LEU A 15 11.509 6.102 -8.084 1.00 0.00 C ATOM 106 CD1 LEU A 15 10.594 5.446 -7.049 1.00 0.00 C ATOM 107 CD2 LEU A 15 12.672 5.189 -8.480 1.00 0.00 C ATOM 0 H LEU A 15 8.498 6.753 -8.210 1.00 0.00 H new ATOM 0 HA LEU A 15 10.674 8.564 -8.722 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.992 5.767 -9.555 1.00 0.00 H new ATOM 0 HB3 LEU A 15 11.402 6.614 -10.159 1.00 0.00 H new ATOM 0 HG LEU A 15 11.939 6.989 -7.618 1.00 0.00 H new ATOM 0 HD11 LEU A 15 11.183 5.141 -6.184 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.831 6.158 -6.735 1.00 0.00 H new ATOM 0 HD13 LEU A 15 10.115 4.571 -7.489 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.219 4.889 -7.586 1.00 0.00 H new ATOM 0 HD22 LEU A 15 12.284 4.303 -8.983 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.342 5.724 -9.153 1.00 0.00 H new ATOM 119 N ARG A 16 8.272 8.487 -10.787 1.00 0.00 N ATOM 120 CA ARG A 16 7.750 9.036 -12.026 1.00 0.00 C ATOM 121 C ARG A 16 7.075 10.384 -11.767 1.00 0.00 C ATOM 122 O ARG A 16 6.028 10.679 -12.341 1.00 0.00 O ATOM 123 CB ARG A 16 6.740 8.083 -12.669 1.00 0.00 C ATOM 124 CG ARG A 16 7.407 6.766 -13.069 1.00 0.00 C ATOM 125 CD ARG A 16 6.877 6.270 -14.416 1.00 0.00 C ATOM 126 NE ARG A 16 5.467 6.686 -14.589 1.00 0.00 N ATOM 127 CZ ARG A 16 4.417 5.986 -14.139 1.00 0.00 C ATOM 128 NH1 ARG A 16 4.611 4.832 -13.486 1.00 0.00 N ATOM 129 NH2 ARG A 16 3.173 6.440 -14.341 1.00 0.00 N ATOM 0 H ARG A 16 7.564 8.116 -10.153 1.00 0.00 H new ATOM 0 HA ARG A 16 8.590 9.171 -12.708 1.00 0.00 H new ATOM 0 HB2 ARG A 16 5.926 7.885 -11.972 1.00 0.00 H new ATOM 0 HB3 ARG A 16 6.299 8.553 -13.548 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.487 6.904 -13.127 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.223 6.013 -12.302 1.00 0.00 H new ATOM 0 HD2 ARG A 16 7.485 6.672 -15.226 1.00 0.00 H new ATOM 0 HD3 ARG A 16 6.954 5.184 -14.469 1.00 0.00 H new ATOM 0 HE ARG A 16 5.283 7.560 -15.082 1.00 0.00 H new ATOM 0 HH11 ARG A 16 5.558 4.486 -13.331 1.00 0.00 H new ATOM 0 HH12 ARG A 16 3.812 4.299 -13.143 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.025 7.319 -14.837 1.00 0.00 H new ATOM 0 HH22 ARG A 16 2.374 5.907 -13.998 1.00 0.00 H new ATOM 143 N SER A 17 7.703 11.167 -10.902 1.00 0.00 N ATOM 144 CA SER A 17 7.176 12.477 -10.560 1.00 0.00 C ATOM 145 C SER A 17 8.311 13.394 -10.101 1.00 0.00 C ATOM 146 O SER A 17 9.120 13.012 -9.256 1.00 0.00 O ATOM 147 CB SER A 17 6.105 12.373 -9.472 1.00 0.00 C ATOM 148 OG SER A 17 6.352 11.288 -8.582 1.00 0.00 O ATOM 0 H SER A 17 8.572 10.919 -10.428 1.00 0.00 H new ATOM 0 HA SER A 17 6.712 12.902 -11.450 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.070 13.305 -8.907 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.127 12.245 -9.937 1.00 0.00 H new ATOM 0 HG SER A 17 7.318 11.149 -8.496 1.00 0.00 H new ATOM 154 N VAL A 18 8.336 14.587 -10.678 1.00 0.00 N ATOM 155 CA VAL A 18 9.359 15.561 -10.339 1.00 0.00 C ATOM 156 C VAL A 18 8.690 16.870 -9.914 1.00 0.00 C ATOM 157 O VAL A 18 7.874 17.422 -10.651 1.00 0.00 O ATOM 158 CB VAL A 18 10.324 15.737 -11.513 1.00 0.00 C ATOM 159 CG1 VAL A 18 11.533 14.809 -11.372 1.00 0.00 C ATOM 160 CG2 VAL A 18 9.611 15.511 -12.847 1.00 0.00 C ATOM 0 H VAL A 18 7.664 14.901 -11.378 1.00 0.00 H new ATOM 0 HA VAL A 18 9.955 15.211 -9.496 1.00 0.00 H new ATOM 0 HB VAL A 18 10.687 16.765 -11.498 1.00 0.00 H new ATOM 0 HG11 VAL A 18 12.203 14.954 -12.219 1.00 0.00 H new ATOM 0 HG12 VAL A 18 12.062 15.039 -10.447 1.00 0.00 H new ATOM 0 HG13 VAL A 18 11.196 13.773 -11.349 1.00 0.00 H new ATOM 0 HG21 VAL A 18 10.319 15.642 -13.665 1.00 0.00 H new ATOM 0 HG22 VAL A 18 9.206 14.499 -12.876 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.799 16.230 -12.952 1.00 0.00 H new ATOM 170 N PHE A 19 9.060 17.329 -8.727 1.00 0.00 N ATOM 171 CA PHE A 19 8.506 18.562 -8.196 1.00 0.00 C ATOM 172 C PHE A 19 9.172 19.783 -8.834 1.00 0.00 C ATOM 173 O PHE A 19 10.398 19.858 -8.906 1.00 0.00 O ATOM 174 CB PHE A 19 8.789 18.569 -6.692 1.00 0.00 C ATOM 175 CG PHE A 19 8.812 19.966 -6.070 1.00 0.00 C ATOM 176 CD1 PHE A 19 9.962 20.692 -6.071 1.00 0.00 C ATOM 177 CD2 PHE A 19 7.683 20.482 -5.515 1.00 0.00 C ATOM 178 CE1 PHE A 19 9.984 21.989 -5.493 1.00 0.00 C ATOM 179 CE2 PHE A 19 7.704 21.779 -4.937 1.00 0.00 C ATOM 180 CZ PHE A 19 8.854 22.505 -4.938 1.00 0.00 C ATOM 0 H PHE A 19 9.737 16.869 -8.118 1.00 0.00 H new ATOM 0 HA PHE A 19 7.438 18.612 -8.409 1.00 0.00 H new ATOM 0 HB2 PHE A 19 8.031 17.970 -6.187 1.00 0.00 H new ATOM 0 HB3 PHE A 19 9.749 18.086 -6.511 1.00 0.00 H new ATOM 0 HD1 PHE A 19 10.859 20.282 -6.512 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.770 19.905 -5.514 1.00 0.00 H new ATOM 0 HE1 PHE A 19 10.897 22.565 -5.494 1.00 0.00 H new ATOM 0 HE2 PHE A 19 6.807 22.189 -4.497 1.00 0.00 H new ATOM 0 HZ PHE A 19 8.870 23.491 -4.498 1.00 0.00 H new ATOM 190 N VAL A 20 8.335 20.708 -9.280 1.00 0.00 N ATOM 191 CA VAL A 20 8.828 21.921 -9.910 1.00 0.00 C ATOM 192 C VAL A 20 8.370 23.134 -9.098 1.00 0.00 C ATOM 193 O VAL A 20 7.226 23.190 -8.650 1.00 0.00 O ATOM 194 CB VAL A 20 8.375 21.974 -11.371 1.00 0.00 C ATOM 195 CG1 VAL A 20 9.308 22.857 -12.202 1.00 0.00 C ATOM 196 CG2 VAL A 20 8.277 20.568 -11.965 1.00 0.00 C ATOM 0 H VAL A 20 7.319 20.642 -9.218 1.00 0.00 H new ATOM 0 HA VAL A 20 9.918 21.930 -9.921 1.00 0.00 H new ATOM 0 HB VAL A 20 7.380 22.419 -11.398 1.00 0.00 H new ATOM 0 HG11 VAL A 20 8.964 22.878 -13.236 1.00 0.00 H new ATOM 0 HG12 VAL A 20 9.306 23.870 -11.798 1.00 0.00 H new ATOM 0 HG13 VAL A 20 10.320 22.454 -12.164 1.00 0.00 H new ATOM 0 HG21 VAL A 20 7.953 20.634 -13.004 1.00 0.00 H new ATOM 0 HG22 VAL A 20 9.253 20.085 -11.919 1.00 0.00 H new ATOM 0 HG23 VAL A 20 7.555 19.982 -11.396 1.00 0.00 H new ATOM 206 N GLY A 21 9.288 24.076 -8.932 1.00 0.00 N ATOM 207 CA GLY A 21 8.993 25.284 -8.182 1.00 0.00 C ATOM 208 C GLY A 21 9.738 26.487 -8.764 1.00 0.00 C ATOM 209 O GLY A 21 10.437 26.362 -9.768 1.00 0.00 O ATOM 0 H GLY A 21 10.236 24.026 -9.304 1.00 0.00 H new ATOM 0 HA2 GLY A 21 7.920 25.474 -8.199 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.276 25.147 -7.138 1.00 0.00 H new ATOM 213 N ASN A 22 9.563 27.625 -8.108 1.00 0.00 N ATOM 214 CA ASN A 22 10.211 28.849 -8.548 1.00 0.00 C ATOM 215 C ASN A 22 9.723 29.202 -9.955 1.00 0.00 C ATOM 216 O ASN A 22 10.415 29.893 -10.701 1.00 0.00 O ATOM 217 CB ASN A 22 11.730 28.680 -8.603 1.00 0.00 C ATOM 218 CG ASN A 22 12.441 29.949 -8.130 1.00 0.00 C ATOM 219 OD1 ASN A 22 13.487 30.294 -8.876 1.00 0.00 O flip ATOM 220 ND2 ASN A 22 12.064 30.575 -7.152 1.00 0.00 N flip ATOM 0 H ASN A 22 8.982 27.725 -7.276 1.00 0.00 H new ATOM 0 HA ASN A 22 9.962 29.636 -7.837 1.00 0.00 H new ATOM 0 HB2 ASN A 22 12.028 27.838 -7.979 1.00 0.00 H new ATOM 0 HB3 ASN A 22 12.037 28.446 -9.622 1.00 0.00 H new ATOM 0 HD21 ASN A 22 11.253 30.255 -6.623 1.00 0.00 H new ATOM 0 HD22 ASN A 22 12.560 31.418 -6.864 1.00 0.00 H new ATOM 227 N ILE A 23 8.535 28.710 -10.275 1.00 0.00 N ATOM 228 CA ILE A 23 7.947 28.965 -11.580 1.00 0.00 C ATOM 229 C ILE A 23 7.003 30.165 -11.483 1.00 0.00 C ATOM 230 O ILE A 23 5.980 30.102 -10.803 1.00 0.00 O ATOM 231 CB ILE A 23 7.279 27.700 -12.122 1.00 0.00 C ATOM 232 CG1 ILE A 23 8.048 26.448 -11.695 1.00 0.00 C ATOM 233 CG2 ILE A 23 7.109 27.778 -13.641 1.00 0.00 C ATOM 234 CD1 ILE A 23 7.281 25.178 -12.072 1.00 0.00 C ATOM 0 H ILE A 23 7.964 28.137 -9.654 1.00 0.00 H new ATOM 0 HA ILE A 23 8.720 29.225 -12.303 1.00 0.00 H new ATOM 0 HB ILE A 23 6.281 27.628 -11.689 1.00 0.00 H new ATOM 0 HG12 ILE A 23 9.029 26.439 -12.171 1.00 0.00 H new ATOM 0 HG13 ILE A 23 8.216 26.470 -10.618 1.00 0.00 H new ATOM 0 HG21 ILE A 23 6.632 26.866 -14.001 1.00 0.00 H new ATOM 0 HG22 ILE A 23 6.488 28.637 -13.894 1.00 0.00 H new ATOM 0 HG23 ILE A 23 8.086 27.886 -14.111 1.00 0.00 H new ATOM 0 HD11 ILE A 23 7.849 24.303 -11.757 1.00 0.00 H new ATOM 0 HD12 ILE A 23 6.311 25.178 -11.576 1.00 0.00 H new ATOM 0 HD13 ILE A 23 7.136 25.148 -13.152 1.00 0.00 H new ATOM 246 N PRO A 24 7.391 31.259 -12.192 1.00 0.00 N ATOM 247 CA PRO A 24 6.591 32.472 -12.193 1.00 0.00 C ATOM 248 C PRO A 24 5.344 32.306 -13.065 1.00 0.00 C ATOM 249 O PRO A 24 5.141 31.255 -13.669 1.00 0.00 O ATOM 250 CB PRO A 24 7.526 33.560 -12.696 1.00 0.00 C ATOM 251 CG PRO A 24 8.667 32.838 -13.396 1.00 0.00 C ATOM 252 CD PRO A 24 8.596 31.370 -13.009 1.00 0.00 C ATOM 0 HA PRO A 24 6.206 32.722 -11.205 1.00 0.00 H new ATOM 0 HB2 PRO A 24 7.010 34.232 -13.382 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.896 34.169 -11.871 1.00 0.00 H new ATOM 0 HG2 PRO A 24 8.585 32.952 -14.477 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.626 33.264 -13.102 1.00 0.00 H new ATOM 0 HD2 PRO A 24 8.537 30.731 -13.890 1.00 0.00 H new ATOM 0 HD3 PRO A 24 9.482 31.064 -12.452 1.00 0.00 H new ATOM 260 N TYR A 25 4.542 33.360 -13.101 1.00 0.00 N ATOM 261 CA TYR A 25 3.321 33.344 -13.888 1.00 0.00 C ATOM 262 C TYR A 25 3.628 33.481 -15.380 1.00 0.00 C ATOM 263 O TYR A 25 2.721 33.453 -16.210 1.00 0.00 O ATOM 264 CB TYR A 25 2.510 34.560 -13.433 1.00 0.00 C ATOM 265 CG TYR A 25 2.185 34.567 -11.938 1.00 0.00 C ATOM 266 CD1 TYR A 25 1.049 33.934 -11.476 1.00 0.00 C ATOM 267 CD2 TYR A 25 3.027 35.207 -11.051 1.00 0.00 C ATOM 268 CE1 TYR A 25 0.743 33.941 -10.069 1.00 0.00 C ATOM 269 CE2 TYR A 25 2.721 35.213 -9.644 1.00 0.00 C ATOM 270 CZ TYR A 25 1.594 34.580 -9.223 1.00 0.00 C ATOM 271 OH TYR A 25 1.304 34.586 -7.894 1.00 0.00 O ATOM 0 H TYR A 25 4.714 34.230 -12.598 1.00 0.00 H new ATOM 0 HA TYR A 25 2.785 32.406 -13.745 1.00 0.00 H new ATOM 0 HB2 TYR A 25 3.064 35.466 -13.678 1.00 0.00 H new ATOM 0 HB3 TYR A 25 1.578 34.594 -13.997 1.00 0.00 H new ATOM 0 HD1 TYR A 25 0.390 33.433 -12.170 1.00 0.00 H new ATOM 0 HD2 TYR A 25 3.915 35.703 -11.412 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -0.143 33.450 -9.694 1.00 0.00 H new ATOM 0 HE2 TYR A 25 3.372 35.709 -8.939 1.00 0.00 H new ATOM 0 HH TYR A 25 1.999 35.078 -7.410 1.00 0.00 H new ATOM 281 N GLU A 26 4.912 33.625 -15.676 1.00 0.00 N ATOM 282 CA GLU A 26 5.350 33.766 -17.054 1.00 0.00 C ATOM 283 C GLU A 26 5.684 32.396 -17.648 1.00 0.00 C ATOM 284 O GLU A 26 5.899 32.273 -18.853 1.00 0.00 O ATOM 285 CB GLU A 26 6.547 34.714 -17.155 1.00 0.00 C ATOM 286 CG GLU A 26 6.198 35.952 -17.983 1.00 0.00 C ATOM 287 CD GLU A 26 5.959 37.165 -17.082 1.00 0.00 C ATOM 288 OE1 GLU A 26 4.890 37.189 -16.435 1.00 0.00 O ATOM 289 OE2 GLU A 26 6.851 38.040 -17.060 1.00 0.00 O ATOM 0 H GLU A 26 5.662 33.647 -14.985 1.00 0.00 H new ATOM 0 HA GLU A 26 4.534 34.201 -17.631 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.861 35.017 -16.156 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.390 34.194 -17.610 1.00 0.00 H new ATOM 0 HG2 GLU A 26 7.007 36.167 -18.681 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.307 35.756 -18.579 1.00 0.00 H new ATOM 296 N ALA A 27 5.718 31.401 -16.774 1.00 0.00 N ATOM 297 CA ALA A 27 6.023 30.044 -17.196 1.00 0.00 C ATOM 298 C ALA A 27 4.898 29.110 -16.746 1.00 0.00 C ATOM 299 O ALA A 27 4.848 28.707 -15.585 1.00 0.00 O ATOM 300 CB ALA A 27 7.385 29.629 -16.637 1.00 0.00 C ATOM 0 H ALA A 27 5.539 31.507 -15.775 1.00 0.00 H new ATOM 0 HA ALA A 27 6.086 29.985 -18.283 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.613 28.611 -16.954 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.153 30.306 -17.010 1.00 0.00 H new ATOM 0 HB3 ALA A 27 7.360 29.673 -15.548 1.00 0.00 H new ATOM 306 N THR A 28 4.023 28.792 -17.688 1.00 0.00 N ATOM 307 CA THR A 28 2.902 27.913 -17.403 1.00 0.00 C ATOM 308 C THR A 28 3.275 26.459 -17.701 1.00 0.00 C ATOM 309 O THR A 28 4.357 26.186 -18.218 1.00 0.00 O ATOM 310 CB THR A 28 1.696 28.407 -18.204 1.00 0.00 C ATOM 311 OG1 THR A 28 2.240 28.741 -19.479 1.00 0.00 O ATOM 312 CG2 THR A 28 1.145 29.733 -17.675 1.00 0.00 C ATOM 0 H THR A 28 4.068 29.128 -18.650 1.00 0.00 H new ATOM 0 HA THR A 28 2.639 27.939 -16.345 1.00 0.00 H new ATOM 0 HB THR A 28 0.910 27.652 -18.180 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.525 29.069 -20.064 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.290 30.039 -18.279 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.831 29.609 -16.639 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.920 30.497 -17.730 1.00 0.00 H new ATOM 320 N GLU A 29 2.358 25.565 -17.362 1.00 0.00 N ATOM 321 CA GLU A 29 2.577 24.146 -17.587 1.00 0.00 C ATOM 322 C GLU A 29 2.842 23.879 -19.070 1.00 0.00 C ATOM 323 O GLU A 29 3.563 22.945 -19.417 1.00 0.00 O ATOM 324 CB GLU A 29 1.390 23.322 -17.085 1.00 0.00 C ATOM 325 CG GLU A 29 1.715 22.649 -15.750 1.00 0.00 C ATOM 326 CD GLU A 29 0.948 21.334 -15.597 1.00 0.00 C ATOM 327 OE1 GLU A 29 0.526 20.798 -16.644 1.00 0.00 O ATOM 328 OE2 GLU A 29 0.801 20.895 -14.436 1.00 0.00 O ATOM 0 H GLU A 29 1.462 25.796 -16.933 1.00 0.00 H new ATOM 0 HA GLU A 29 3.456 23.839 -17.020 1.00 0.00 H new ATOM 0 HB2 GLU A 29 0.519 23.966 -16.969 1.00 0.00 H new ATOM 0 HB3 GLU A 29 1.130 22.565 -17.824 1.00 0.00 H new ATOM 0 HG2 GLU A 29 2.786 22.459 -15.686 1.00 0.00 H new ATOM 0 HG3 GLU A 29 1.461 23.320 -14.929 1.00 0.00 H new ATOM 335 N GLU A 30 2.244 24.716 -19.906 1.00 0.00 N ATOM 336 CA GLU A 30 2.407 24.582 -21.343 1.00 0.00 C ATOM 337 C GLU A 30 3.879 24.740 -21.728 1.00 0.00 C ATOM 338 O GLU A 30 4.349 24.107 -22.672 1.00 0.00 O ATOM 339 CB GLU A 30 1.532 25.591 -22.091 1.00 0.00 C ATOM 340 CG GLU A 30 0.873 24.947 -23.312 1.00 0.00 C ATOM 341 CD GLU A 30 -0.595 25.363 -23.426 1.00 0.00 C ATOM 342 OE1 GLU A 30 -1.420 24.728 -22.734 1.00 0.00 O ATOM 343 OE2 GLU A 30 -0.859 26.307 -24.202 1.00 0.00 O ATOM 0 H GLU A 30 1.646 25.489 -19.615 1.00 0.00 H new ATOM 0 HA GLU A 30 2.082 23.583 -21.634 1.00 0.00 H new ATOM 0 HB2 GLU A 30 0.764 25.979 -21.421 1.00 0.00 H new ATOM 0 HB3 GLU A 30 2.138 26.440 -22.406 1.00 0.00 H new ATOM 0 HG2 GLU A 30 1.409 25.239 -24.215 1.00 0.00 H new ATOM 0 HG3 GLU A 30 0.942 23.862 -23.237 1.00 0.00 H new ATOM 350 N GLN A 31 4.565 25.590 -20.978 1.00 0.00 N ATOM 351 CA GLN A 31 5.974 25.840 -21.229 1.00 0.00 C ATOM 352 C GLN A 31 6.837 24.853 -20.440 1.00 0.00 C ATOM 353 O GLN A 31 7.791 24.291 -20.976 1.00 0.00 O ATOM 354 CB GLN A 31 6.344 27.285 -20.889 1.00 0.00 C ATOM 355 CG GLN A 31 5.659 28.265 -21.842 1.00 0.00 C ATOM 356 CD GLN A 31 6.589 29.427 -22.196 1.00 0.00 C ATOM 357 OE1 GLN A 31 7.014 30.196 -21.350 1.00 0.00 O ATOM 358 NE2 GLN A 31 6.881 29.511 -23.491 1.00 0.00 N ATOM 0 H GLN A 31 4.171 26.114 -20.197 1.00 0.00 H new ATOM 0 HA GLN A 31 6.165 25.691 -22.292 1.00 0.00 H new ATOM 0 HB2 GLN A 31 6.053 27.507 -19.862 1.00 0.00 H new ATOM 0 HB3 GLN A 31 7.425 27.411 -20.948 1.00 0.00 H new ATOM 0 HG2 GLN A 31 5.360 27.744 -22.752 1.00 0.00 H new ATOM 0 HG3 GLN A 31 4.749 28.650 -21.381 1.00 0.00 H new ATOM 0 HE21 GLN A 31 6.491 28.834 -24.147 1.00 0.00 H new ATOM 0 HE22 GLN A 31 7.495 30.252 -23.828 1.00 0.00 H new ATOM 367 N LEU A 32 6.471 24.672 -19.180 1.00 0.00 N ATOM 368 CA LEU A 32 7.200 23.763 -18.312 1.00 0.00 C ATOM 369 C LEU A 32 7.216 22.368 -18.940 1.00 0.00 C ATOM 370 O LEU A 32 8.268 21.739 -19.038 1.00 0.00 O ATOM 371 CB LEU A 32 6.620 23.793 -16.896 1.00 0.00 C ATOM 372 CG LEU A 32 6.852 25.081 -16.104 1.00 0.00 C ATOM 373 CD1 LEU A 32 7.843 25.997 -16.825 1.00 0.00 C ATOM 374 CD2 LEU A 32 5.528 25.789 -15.809 1.00 0.00 C ATOM 0 H LEU A 32 5.679 25.139 -18.739 1.00 0.00 H new ATOM 0 HA LEU A 32 8.238 24.081 -18.213 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.546 23.618 -16.961 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.045 22.962 -16.333 1.00 0.00 H new ATOM 0 HG LEU A 32 7.297 24.817 -15.145 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.990 26.905 -16.241 1.00 0.00 H new ATOM 0 HD12 LEU A 32 8.797 25.482 -16.941 1.00 0.00 H new ATOM 0 HD13 LEU A 32 7.449 26.257 -17.808 1.00 0.00 H new ATOM 0 HD21 LEU A 32 5.721 26.702 -15.245 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.033 26.040 -16.747 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.886 25.130 -15.224 1.00 0.00 H new ATOM 386 N LYS A 33 6.036 21.924 -19.349 1.00 0.00 N ATOM 387 CA LYS A 33 5.901 20.615 -19.965 1.00 0.00 C ATOM 388 C LYS A 33 6.733 20.572 -21.248 1.00 0.00 C ATOM 389 O LYS A 33 7.342 19.550 -21.563 1.00 0.00 O ATOM 390 CB LYS A 33 4.425 20.273 -20.178 1.00 0.00 C ATOM 391 CG LYS A 33 4.199 18.761 -20.121 1.00 0.00 C ATOM 392 CD LYS A 33 2.819 18.435 -19.545 1.00 0.00 C ATOM 393 CE LYS A 33 1.889 17.886 -20.629 1.00 0.00 C ATOM 394 NZ LYS A 33 0.479 18.210 -20.315 1.00 0.00 N ATOM 0 H LYS A 33 5.165 22.448 -19.266 1.00 0.00 H new ATOM 0 HA LYS A 33 6.292 19.841 -19.305 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.821 20.764 -19.415 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.094 20.658 -21.143 1.00 0.00 H new ATOM 0 HG2 LYS A 33 4.289 18.338 -21.122 1.00 0.00 H new ATOM 0 HG3 LYS A 33 4.972 18.297 -19.508 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.919 17.704 -18.742 1.00 0.00 H new ATOM 0 HD3 LYS A 33 2.383 19.332 -19.106 1.00 0.00 H new ATOM 0 HE2 LYS A 33 2.159 18.309 -21.597 1.00 0.00 H new ATOM 0 HE3 LYS A 33 2.011 16.806 -20.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -0.139 17.830 -21.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.220 17.785 -19.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.363 19.242 -20.262 1.00 0.00 H new ATOM 408 N ASP A 34 6.733 21.693 -21.954 1.00 0.00 N ATOM 409 CA ASP A 34 7.481 21.796 -23.196 1.00 0.00 C ATOM 410 C ASP A 34 8.977 21.683 -22.896 1.00 0.00 C ATOM 411 O ASP A 34 9.720 21.058 -23.652 1.00 0.00 O ATOM 412 CB ASP A 34 7.236 23.144 -23.876 1.00 0.00 C ATOM 413 CG ASP A 34 7.000 23.073 -25.386 1.00 0.00 C ATOM 414 OD1 ASP A 34 7.288 21.998 -25.955 1.00 0.00 O ATOM 415 OD2 ASP A 34 6.538 24.095 -25.937 1.00 0.00 O ATOM 0 H ASP A 34 6.227 22.538 -21.690 1.00 0.00 H new ATOM 0 HA ASP A 34 7.151 20.994 -23.856 1.00 0.00 H new ATOM 0 HB2 ASP A 34 6.372 23.617 -23.410 1.00 0.00 H new ATOM 0 HB3 ASP A 34 8.093 23.790 -23.687 1.00 0.00 H new ATOM 420 N ILE A 35 9.375 22.296 -21.791 1.00 0.00 N ATOM 421 CA ILE A 35 10.769 22.272 -21.382 1.00 0.00 C ATOM 422 C ILE A 35 11.151 20.849 -20.971 1.00 0.00 C ATOM 423 O ILE A 35 12.192 20.338 -21.381 1.00 0.00 O ATOM 424 CB ILE A 35 11.026 23.316 -20.293 1.00 0.00 C ATOM 425 CG1 ILE A 35 10.603 24.710 -20.760 1.00 0.00 C ATOM 426 CG2 ILE A 35 12.486 23.284 -19.836 1.00 0.00 C ATOM 427 CD1 ILE A 35 9.994 25.513 -19.608 1.00 0.00 C ATOM 0 H ILE A 35 8.756 22.813 -21.166 1.00 0.00 H new ATOM 0 HA ILE A 35 11.415 22.548 -22.215 1.00 0.00 H new ATOM 0 HB ILE A 35 10.412 23.065 -19.428 1.00 0.00 H new ATOM 0 HG12 ILE A 35 11.466 25.241 -21.161 1.00 0.00 H new ATOM 0 HG13 ILE A 35 9.878 24.622 -21.570 1.00 0.00 H new ATOM 0 HG21 ILE A 35 12.642 24.036 -19.062 1.00 0.00 H new ATOM 0 HG22 ILE A 35 12.721 22.297 -19.436 1.00 0.00 H new ATOM 0 HG23 ILE A 35 13.137 23.496 -20.684 1.00 0.00 H new ATOM 0 HD11 ILE A 35 9.702 26.500 -19.967 1.00 0.00 H new ATOM 0 HD12 ILE A 35 9.117 24.992 -19.225 1.00 0.00 H new ATOM 0 HD13 ILE A 35 10.729 25.620 -18.810 1.00 0.00 H new ATOM 439 N PHE A 36 10.287 20.248 -20.165 1.00 0.00 N ATOM 440 CA PHE A 36 10.521 18.893 -19.694 1.00 0.00 C ATOM 441 C PHE A 36 10.425 17.889 -20.844 1.00 0.00 C ATOM 442 O PHE A 36 11.072 16.843 -20.815 1.00 0.00 O ATOM 443 CB PHE A 36 9.429 18.582 -18.668 1.00 0.00 C ATOM 444 CG PHE A 36 9.645 19.249 -17.308 1.00 0.00 C ATOM 445 CD1 PHE A 36 10.863 19.187 -16.706 1.00 0.00 C ATOM 446 CD2 PHE A 36 8.619 19.904 -16.702 1.00 0.00 C ATOM 447 CE1 PHE A 36 11.063 19.806 -15.444 1.00 0.00 C ATOM 448 CE2 PHE A 36 8.819 20.523 -15.439 1.00 0.00 C ATOM 449 CZ PHE A 36 10.037 20.461 -14.837 1.00 0.00 C ATOM 0 H PHE A 36 9.424 20.674 -19.826 1.00 0.00 H new ATOM 0 HA PHE A 36 11.519 18.816 -19.262 1.00 0.00 H new ATOM 0 HB2 PHE A 36 8.467 18.901 -19.069 1.00 0.00 H new ATOM 0 HB3 PHE A 36 9.374 17.503 -18.527 1.00 0.00 H new ATOM 0 HD1 PHE A 36 11.678 18.667 -17.188 1.00 0.00 H new ATOM 0 HD2 PHE A 36 7.652 19.954 -17.181 1.00 0.00 H new ATOM 0 HE1 PHE A 36 12.030 19.757 -14.966 1.00 0.00 H new ATOM 0 HE2 PHE A 36 8.004 21.043 -14.957 1.00 0.00 H new ATOM 0 HZ PHE A 36 10.190 20.932 -13.877 1.00 0.00 H new ATOM 459 N SER A 37 9.612 18.241 -21.829 1.00 0.00 N ATOM 460 CA SER A 37 9.423 17.383 -22.986 1.00 0.00 C ATOM 461 C SER A 37 10.742 17.230 -23.745 1.00 0.00 C ATOM 462 O SER A 37 11.011 16.178 -24.324 1.00 0.00 O ATOM 463 CB SER A 37 8.339 17.939 -23.913 1.00 0.00 C ATOM 464 OG SER A 37 8.794 19.074 -24.645 1.00 0.00 O ATOM 0 H SER A 37 9.077 19.109 -21.850 1.00 0.00 H new ATOM 0 HA SER A 37 9.097 16.404 -22.636 1.00 0.00 H new ATOM 0 HB2 SER A 37 8.023 17.162 -24.609 1.00 0.00 H new ATOM 0 HB3 SER A 37 7.464 18.214 -23.324 1.00 0.00 H new ATOM 0 HG SER A 37 9.351 19.635 -24.066 1.00 0.00 H new ATOM 470 N GLU A 38 11.531 18.294 -23.718 1.00 0.00 N ATOM 471 CA GLU A 38 12.816 18.291 -24.396 1.00 0.00 C ATOM 472 C GLU A 38 13.783 17.334 -23.697 1.00 0.00 C ATOM 473 O GLU A 38 14.838 17.006 -24.238 1.00 0.00 O ATOM 474 CB GLU A 38 13.400 19.703 -24.470 1.00 0.00 C ATOM 475 CG GLU A 38 12.290 20.752 -24.561 1.00 0.00 C ATOM 476 CD GLU A 38 12.663 21.861 -25.547 1.00 0.00 C ATOM 477 OE1 GLU A 38 13.611 22.609 -25.228 1.00 0.00 O ATOM 478 OE2 GLU A 38 11.990 21.935 -26.598 1.00 0.00 O ATOM 0 H GLU A 38 11.305 19.165 -23.237 1.00 0.00 H new ATOM 0 HA GLU A 38 12.665 17.942 -25.417 1.00 0.00 H new ATOM 0 HB2 GLU A 38 14.013 19.893 -23.589 1.00 0.00 H new ATOM 0 HB3 GLU A 38 14.054 19.785 -25.338 1.00 0.00 H new ATOM 0 HG2 GLU A 38 11.361 20.277 -24.877 1.00 0.00 H new ATOM 0 HG3 GLU A 38 12.109 21.182 -23.576 1.00 0.00 H new ATOM 485 N VAL A 39 13.388 16.911 -22.504 1.00 0.00 N ATOM 486 CA VAL A 39 14.207 15.998 -21.725 1.00 0.00 C ATOM 487 C VAL A 39 13.608 14.592 -21.802 1.00 0.00 C ATOM 488 O VAL A 39 14.064 13.681 -21.112 1.00 0.00 O ATOM 489 CB VAL A 39 14.345 16.512 -20.291 1.00 0.00 C ATOM 490 CG1 VAL A 39 15.590 15.931 -19.618 1.00 0.00 C ATOM 491 CG2 VAL A 39 14.365 18.041 -20.256 1.00 0.00 C ATOM 0 H VAL A 39 12.512 17.184 -22.059 1.00 0.00 H new ATOM 0 HA VAL A 39 15.216 15.945 -22.134 1.00 0.00 H new ATOM 0 HB VAL A 39 13.473 16.176 -19.729 1.00 0.00 H new ATOM 0 HG11 VAL A 39 15.665 16.312 -18.600 1.00 0.00 H new ATOM 0 HG12 VAL A 39 15.517 14.844 -19.594 1.00 0.00 H new ATOM 0 HG13 VAL A 39 16.477 16.222 -20.180 1.00 0.00 H new ATOM 0 HG21 VAL A 39 14.464 18.380 -19.225 1.00 0.00 H new ATOM 0 HG22 VAL A 39 15.209 18.407 -20.841 1.00 0.00 H new ATOM 0 HG23 VAL A 39 13.437 18.427 -20.677 1.00 0.00 H new ATOM 501 N GLY A 40 12.597 14.459 -22.647 1.00 0.00 N ATOM 502 CA GLY A 40 11.931 13.179 -22.822 1.00 0.00 C ATOM 503 C GLY A 40 10.413 13.357 -22.898 1.00 0.00 C ATOM 504 O GLY A 40 9.912 14.479 -22.844 1.00 0.00 O ATOM 0 H GLY A 40 12.222 15.216 -23.218 1.00 0.00 H new ATOM 0 HA2 GLY A 40 12.291 12.699 -23.732 1.00 0.00 H new ATOM 0 HA3 GLY A 40 12.182 12.518 -21.993 1.00 0.00 H new ATOM 508 N PRO A 41 9.705 12.203 -23.024 1.00 0.00 N ATOM 509 CA PRO A 41 8.255 12.220 -23.107 1.00 0.00 C ATOM 510 C PRO A 41 7.630 12.493 -21.737 1.00 0.00 C ATOM 511 O PRO A 41 7.834 11.730 -20.795 1.00 0.00 O ATOM 512 CB PRO A 41 7.877 10.860 -23.671 1.00 0.00 C ATOM 513 CG PRO A 41 9.086 9.965 -23.447 1.00 0.00 C ATOM 514 CD PRO A 41 10.265 10.856 -23.091 1.00 0.00 C ATOM 0 HA PRO A 41 7.880 13.020 -23.746 1.00 0.00 H new ATOM 0 HB2 PRO A 41 6.996 10.460 -23.168 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.634 10.931 -24.731 1.00 0.00 H new ATOM 0 HG2 PRO A 41 8.890 9.252 -22.646 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.303 9.385 -24.344 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.709 10.564 -22.139 1.00 0.00 H new ATOM 0 HD3 PRO A 41 11.052 10.791 -23.843 1.00 0.00 H new ATOM 522 N VAL A 42 6.882 13.585 -21.671 1.00 0.00 N ATOM 523 CA VAL A 42 6.227 13.969 -20.432 1.00 0.00 C ATOM 524 C VAL A 42 4.856 13.293 -20.355 1.00 0.00 C ATOM 525 O VAL A 42 4.020 13.474 -21.239 1.00 0.00 O ATOM 526 CB VAL A 42 6.148 15.493 -20.332 1.00 0.00 C ATOM 527 CG1 VAL A 42 5.289 15.921 -19.141 1.00 0.00 C ATOM 528 CG2 VAL A 42 7.546 16.110 -20.250 1.00 0.00 C ATOM 0 H VAL A 42 6.715 14.216 -22.455 1.00 0.00 H new ATOM 0 HA VAL A 42 6.806 13.630 -19.573 1.00 0.00 H new ATOM 0 HB VAL A 42 5.671 15.864 -21.239 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.250 17.009 -19.093 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.280 15.526 -19.260 1.00 0.00 H new ATOM 0 HG13 VAL A 42 5.724 15.533 -18.220 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.462 17.194 -20.180 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.061 15.728 -19.368 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.113 15.847 -21.143 1.00 0.00 H new ATOM 538 N VAL A 43 4.668 12.529 -19.289 1.00 0.00 N ATOM 539 CA VAL A 43 3.413 11.825 -19.085 1.00 0.00 C ATOM 540 C VAL A 43 2.323 12.833 -18.714 1.00 0.00 C ATOM 541 O VAL A 43 1.496 13.194 -19.549 1.00 0.00 O ATOM 542 CB VAL A 43 3.594 10.726 -18.037 1.00 0.00 C ATOM 543 CG1 VAL A 43 2.266 10.401 -17.349 1.00 0.00 C ATOM 544 CG2 VAL A 43 4.211 9.472 -18.658 1.00 0.00 C ATOM 0 H VAL A 43 5.363 12.382 -18.557 1.00 0.00 H new ATOM 0 HA VAL A 43 3.098 11.330 -20.004 1.00 0.00 H new ATOM 0 HB VAL A 43 4.283 11.097 -17.278 1.00 0.00 H new ATOM 0 HG11 VAL A 43 2.422 9.617 -16.608 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.883 11.295 -16.856 1.00 0.00 H new ATOM 0 HG13 VAL A 43 1.545 10.060 -18.092 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.329 8.706 -17.891 1.00 0.00 H new ATOM 0 HG22 VAL A 43 3.559 9.098 -19.447 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.186 9.717 -19.079 1.00 0.00 H new ATOM 554 N SER A 44 2.358 13.258 -17.459 1.00 0.00 N ATOM 555 CA SER A 44 1.383 14.217 -16.967 1.00 0.00 C ATOM 556 C SER A 44 2.092 15.339 -16.206 1.00 0.00 C ATOM 557 O SER A 44 3.309 15.304 -16.034 1.00 0.00 O ATOM 558 CB SER A 44 0.348 13.537 -16.068 1.00 0.00 C ATOM 559 OG SER A 44 -0.881 13.306 -16.750 1.00 0.00 O ATOM 0 H SER A 44 3.046 12.956 -16.769 1.00 0.00 H new ATOM 0 HA SER A 44 0.858 14.642 -17.823 1.00 0.00 H new ATOM 0 HB2 SER A 44 0.747 12.588 -15.709 1.00 0.00 H new ATOM 0 HB3 SER A 44 0.165 14.158 -15.191 1.00 0.00 H new ATOM 0 HG SER A 44 -1.515 12.869 -16.143 1.00 0.00 H new ATOM 565 N PHE A 45 1.300 16.308 -15.772 1.00 0.00 N ATOM 566 CA PHE A 45 1.836 17.439 -15.034 1.00 0.00 C ATOM 567 C PHE A 45 0.711 18.301 -14.458 1.00 0.00 C ATOM 568 O PHE A 45 -0.124 18.816 -15.200 1.00 0.00 O ATOM 569 CB PHE A 45 2.648 18.276 -16.025 1.00 0.00 C ATOM 570 CG PHE A 45 3.700 19.172 -15.368 1.00 0.00 C ATOM 571 CD1 PHE A 45 3.685 19.363 -14.021 1.00 0.00 C ATOM 572 CD2 PHE A 45 4.649 19.777 -16.130 1.00 0.00 C ATOM 573 CE1 PHE A 45 4.661 20.194 -13.411 1.00 0.00 C ATOM 574 CE2 PHE A 45 5.625 20.609 -15.520 1.00 0.00 C ATOM 575 CZ PHE A 45 5.611 20.800 -14.174 1.00 0.00 C ATOM 0 H PHE A 45 0.291 16.333 -15.917 1.00 0.00 H new ATOM 0 HA PHE A 45 2.447 17.085 -14.204 1.00 0.00 H new ATOM 0 HB2 PHE A 45 3.144 17.607 -16.729 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.966 18.899 -16.603 1.00 0.00 H new ATOM 0 HD1 PHE A 45 2.931 18.882 -13.416 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.661 19.625 -17.199 1.00 0.00 H new ATOM 0 HE1 PHE A 45 4.650 20.345 -12.342 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.379 21.090 -16.126 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.354 21.432 -13.710 1.00 0.00 H new ATOM 585 N ARG A 46 0.725 18.432 -13.139 1.00 0.00 N ATOM 586 CA ARG A 46 -0.284 19.224 -12.455 1.00 0.00 C ATOM 587 C ARG A 46 0.360 20.064 -11.351 1.00 0.00 C ATOM 588 O ARG A 46 1.191 19.568 -10.593 1.00 0.00 O ATOM 589 CB ARG A 46 -1.363 18.329 -11.843 1.00 0.00 C ATOM 590 CG ARG A 46 -2.350 17.850 -12.910 1.00 0.00 C ATOM 591 CD ARG A 46 -3.389 18.930 -13.219 1.00 0.00 C ATOM 592 NE ARG A 46 -4.025 18.659 -14.528 1.00 0.00 N ATOM 593 CZ ARG A 46 -4.918 19.470 -15.111 1.00 0.00 C ATOM 594 NH1 ARG A 46 -5.288 20.606 -14.505 1.00 0.00 N ATOM 595 NH2 ARG A 46 -5.443 19.144 -16.300 1.00 0.00 N ATOM 0 H ARG A 46 1.419 18.003 -12.526 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.747 19.881 -13.191 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -0.897 17.469 -11.362 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -1.898 18.877 -11.068 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -1.809 17.589 -13.820 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -2.852 16.945 -12.567 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -4.146 18.953 -12.435 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -2.914 19.911 -13.232 1.00 0.00 H new ATOM 0 HE ARG A 46 -3.767 17.801 -15.017 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -4.890 20.854 -13.599 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -5.968 21.223 -14.949 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -5.163 18.278 -16.761 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -6.123 19.761 -16.744 1.00 0.00 H new ATOM 609 N LEU A 47 -0.050 21.323 -11.295 1.00 0.00 N ATOM 610 CA LEU A 47 0.477 22.238 -10.296 1.00 0.00 C ATOM 611 C LEU A 47 -0.640 22.620 -9.322 1.00 0.00 C ATOM 612 O LEU A 47 -1.785 22.207 -9.493 1.00 0.00 O ATOM 613 CB LEU A 47 1.144 23.439 -10.968 1.00 0.00 C ATOM 614 CG LEU A 47 1.688 23.202 -12.379 1.00 0.00 C ATOM 615 CD1 LEU A 47 2.217 24.502 -12.988 1.00 0.00 C ATOM 616 CD2 LEU A 47 2.745 22.097 -12.380 1.00 0.00 C ATOM 0 H LEU A 47 -0.741 21.731 -11.925 1.00 0.00 H new ATOM 0 HA LEU A 47 1.260 21.754 -9.711 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.421 24.254 -11.011 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.965 23.774 -10.335 1.00 0.00 H new ATOM 0 HG LEU A 47 0.866 22.862 -13.010 1.00 0.00 H new ATOM 0 HD11 LEU A 47 2.598 24.306 -13.990 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.410 25.233 -13.043 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.021 24.895 -12.365 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.115 21.948 -13.394 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.572 22.384 -11.730 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.302 21.170 -12.016 1.00 0.00 H new ATOM 628 N VAL A 48 -0.266 23.404 -8.322 1.00 0.00 N ATOM 629 CA VAL A 48 -1.221 23.846 -7.320 1.00 0.00 C ATOM 630 C VAL A 48 -1.841 25.173 -7.764 1.00 0.00 C ATOM 631 O VAL A 48 -1.130 26.154 -7.977 1.00 0.00 O ATOM 632 CB VAL A 48 -0.543 23.932 -5.952 1.00 0.00 C ATOM 633 CG1 VAL A 48 -0.368 22.541 -5.338 1.00 0.00 C ATOM 634 CG2 VAL A 48 0.799 24.660 -6.049 1.00 0.00 C ATOM 0 H VAL A 48 0.685 23.745 -8.184 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.032 23.124 -7.221 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.191 24.510 -5.294 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.116 22.631 -4.366 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.344 22.072 -5.215 1.00 0.00 H new ATOM 0 HG13 VAL A 48 0.249 21.928 -5.995 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.260 24.707 -5.062 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.457 24.121 -6.731 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.638 25.671 -6.423 1.00 0.00 H new ATOM 644 N TYR A 49 -3.160 25.160 -7.890 1.00 0.00 N ATOM 645 CA TYR A 49 -3.884 26.350 -8.304 1.00 0.00 C ATOM 646 C TYR A 49 -4.954 26.726 -7.277 1.00 0.00 C ATOM 647 O TYR A 49 -5.861 25.942 -7.005 1.00 0.00 O ATOM 648 CB TYR A 49 -4.567 25.989 -9.625 1.00 0.00 C ATOM 649 CG TYR A 49 -3.909 26.616 -10.856 1.00 0.00 C ATOM 650 CD1 TYR A 49 -2.839 25.988 -11.462 1.00 0.00 C ATOM 651 CD2 TYR A 49 -4.385 27.808 -11.361 1.00 0.00 C ATOM 652 CE1 TYR A 49 -2.220 26.578 -12.621 1.00 0.00 C ATOM 653 CE2 TYR A 49 -3.767 28.398 -12.520 1.00 0.00 C ATOM 654 CZ TYR A 49 -2.715 27.753 -13.093 1.00 0.00 C ATOM 655 OH TYR A 49 -2.130 28.310 -14.187 1.00 0.00 O ATOM 0 H TYR A 49 -3.746 24.344 -7.713 1.00 0.00 H new ATOM 0 HA TYR A 49 -3.206 27.198 -8.401 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -4.567 24.905 -9.738 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -5.609 26.305 -9.582 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -2.466 25.054 -11.067 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -5.222 28.299 -10.887 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -1.382 26.098 -13.104 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -4.130 29.331 -12.925 1.00 0.00 H new ATOM 0 HH TYR A 49 -2.588 29.147 -14.413 1.00 0.00 H new ATOM 665 N ASP A 50 -4.812 27.927 -6.735 1.00 0.00 N ATOM 666 CA ASP A 50 -5.755 28.417 -5.744 1.00 0.00 C ATOM 667 C ASP A 50 -7.081 28.750 -6.430 1.00 0.00 C ATOM 668 O ASP A 50 -7.171 29.724 -7.176 1.00 0.00 O ATOM 669 CB ASP A 50 -5.236 29.690 -5.073 1.00 0.00 C ATOM 670 CG ASP A 50 -4.472 29.468 -3.766 1.00 0.00 C ATOM 671 OD1 ASP A 50 -4.532 28.326 -3.261 1.00 0.00 O ATOM 672 OD2 ASP A 50 -3.846 30.444 -3.301 1.00 0.00 O ATOM 0 H ASP A 50 -4.058 28.575 -6.963 1.00 0.00 H new ATOM 0 HA ASP A 50 -5.887 27.641 -4.990 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -4.584 30.211 -5.773 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -6.082 30.348 -4.874 1.00 0.00 H new ATOM 677 N ARG A 51 -8.078 27.923 -6.152 1.00 0.00 N ATOM 678 CA ARG A 51 -9.396 28.117 -6.733 1.00 0.00 C ATOM 679 C ARG A 51 -10.092 29.313 -6.080 1.00 0.00 C ATOM 680 O ARG A 51 -10.905 29.984 -6.714 1.00 0.00 O ATOM 681 CB ARG A 51 -10.265 26.871 -6.556 1.00 0.00 C ATOM 682 CG ARG A 51 -9.808 25.747 -7.489 1.00 0.00 C ATOM 683 CD ARG A 51 -10.608 24.467 -7.237 1.00 0.00 C ATOM 684 NE ARG A 51 -10.397 24.004 -5.847 1.00 0.00 N ATOM 685 CZ ARG A 51 -11.115 24.427 -4.798 1.00 0.00 C ATOM 686 NH1 ARG A 51 -12.093 25.325 -4.973 1.00 0.00 N ATOM 687 NH2 ARG A 51 -10.853 23.951 -3.572 1.00 0.00 N ATOM 0 H ARG A 51 -8.000 27.117 -5.532 1.00 0.00 H new ATOM 0 HA ARG A 51 -9.265 28.305 -7.799 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -10.215 26.532 -5.521 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -11.307 27.118 -6.761 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -9.930 26.058 -8.526 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -8.746 25.553 -7.337 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -11.668 24.651 -7.411 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -10.300 23.692 -7.938 1.00 0.00 H new ATOM 0 HE ARG A 51 -9.659 23.320 -5.677 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -12.292 25.687 -5.906 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -12.639 25.646 -4.174 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -10.108 23.268 -3.439 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -11.399 24.272 -2.773 1.00 0.00 H new ATOM 701 N GLU A 52 -9.748 29.543 -4.822 1.00 0.00 N ATOM 702 CA GLU A 52 -10.329 30.646 -4.076 1.00 0.00 C ATOM 703 C GLU A 52 -9.804 31.982 -4.607 1.00 0.00 C ATOM 704 O GLU A 52 -10.505 32.991 -4.561 1.00 0.00 O ATOM 705 CB GLU A 52 -10.050 30.504 -2.579 1.00 0.00 C ATOM 706 CG GLU A 52 -11.184 29.751 -1.879 1.00 0.00 C ATOM 707 CD GLU A 52 -10.776 28.309 -1.571 1.00 0.00 C ATOM 708 OE1 GLU A 52 -9.583 28.111 -1.257 1.00 0.00 O ATOM 709 OE2 GLU A 52 -11.668 27.437 -1.656 1.00 0.00 O ATOM 0 H GLU A 52 -9.074 28.984 -4.300 1.00 0.00 H new ATOM 0 HA GLU A 52 -11.410 30.622 -4.214 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.110 29.973 -2.429 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -9.934 31.491 -2.132 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.449 30.263 -0.954 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -12.072 29.754 -2.511 1.00 0.00 H new ATOM 716 N THR A 53 -8.574 31.944 -5.098 1.00 0.00 N ATOM 717 CA THR A 53 -7.946 33.138 -5.637 1.00 0.00 C ATOM 718 C THR A 53 -7.817 33.033 -7.158 1.00 0.00 C ATOM 719 O THR A 53 -7.362 33.970 -7.813 1.00 0.00 O ATOM 720 CB THR A 53 -6.605 33.330 -4.926 1.00 0.00 C ATOM 721 OG1 THR A 53 -5.735 32.402 -5.569 1.00 0.00 O ATOM 722 CG2 THR A 53 -6.642 32.859 -3.470 1.00 0.00 C ATOM 0 H THR A 53 -7.995 31.105 -5.134 1.00 0.00 H new ATOM 0 HA THR A 53 -8.557 34.022 -5.454 1.00 0.00 H new ATOM 0 HB THR A 53 -6.323 34.382 -4.960 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.842 32.461 -5.170 1.00 0.00 H new ATOM 0 HG21 THR A 53 -5.666 33.017 -3.011 1.00 0.00 H new ATOM 0 HG22 THR A 53 -7.396 33.426 -2.923 1.00 0.00 H new ATOM 0 HG23 THR A 53 -6.891 31.798 -3.437 1.00 0.00 H new ATOM 730 N GLY A 54 -8.226 31.884 -7.677 1.00 0.00 N ATOM 731 CA GLY A 54 -8.162 31.644 -9.108 1.00 0.00 C ATOM 732 C GLY A 54 -6.769 31.964 -9.656 1.00 0.00 C ATOM 733 O GLY A 54 -6.604 32.174 -10.857 1.00 0.00 O ATOM 0 H GLY A 54 -8.603 31.109 -7.131 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -8.409 30.603 -9.317 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -8.906 32.256 -9.617 1.00 0.00 H new ATOM 737 N LYS A 55 -5.804 31.990 -8.749 1.00 0.00 N ATOM 738 CA LYS A 55 -4.431 32.280 -9.127 1.00 0.00 C ATOM 739 C LYS A 55 -3.550 31.073 -8.798 1.00 0.00 C ATOM 740 O LYS A 55 -3.781 30.383 -7.807 1.00 0.00 O ATOM 741 CB LYS A 55 -3.960 33.581 -8.474 1.00 0.00 C ATOM 742 CG LYS A 55 -4.617 34.795 -9.134 1.00 0.00 C ATOM 743 CD LYS A 55 -4.627 35.996 -8.186 1.00 0.00 C ATOM 744 CE LYS A 55 -4.205 37.274 -8.914 1.00 0.00 C ATOM 745 NZ LYS A 55 -3.537 38.207 -7.980 1.00 0.00 N ATOM 0 H LYS A 55 -5.945 31.815 -7.754 1.00 0.00 H new ATOM 0 HA LYS A 55 -4.358 32.445 -10.202 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.200 33.566 -7.411 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.876 33.661 -8.555 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -4.080 35.052 -10.047 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -5.638 34.548 -9.424 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -5.625 36.125 -7.767 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -3.952 35.810 -7.350 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -3.531 37.027 -9.734 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -5.079 37.754 -9.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.257 39.069 -8.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -4.192 38.457 -7.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -2.692 37.752 -7.580 1.00 0.00 H new ATOM 759 N PRO A 56 -2.532 30.850 -9.672 1.00 0.00 N ATOM 760 CA PRO A 56 -1.615 29.738 -9.484 1.00 0.00 C ATOM 761 C PRO A 56 -0.627 30.027 -8.353 1.00 0.00 C ATOM 762 O PRO A 56 -0.107 31.137 -8.246 1.00 0.00 O ATOM 763 CB PRO A 56 -0.938 29.555 -10.832 1.00 0.00 C ATOM 764 CG PRO A 56 -1.155 30.856 -11.588 1.00 0.00 C ATOM 765 CD PRO A 56 -2.228 31.646 -10.857 1.00 0.00 C ATOM 0 HA PRO A 56 -2.121 28.822 -9.180 1.00 0.00 H new ATOM 0 HB2 PRO A 56 0.125 29.347 -10.710 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -1.368 28.712 -11.374 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -0.228 31.427 -11.639 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -1.462 30.655 -12.614 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -1.872 32.640 -10.586 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -3.112 31.783 -11.480 1.00 0.00 H new ATOM 773 N LYS A 57 -0.397 29.010 -7.536 1.00 0.00 N ATOM 774 CA LYS A 57 0.520 29.141 -6.416 1.00 0.00 C ATOM 775 C LYS A 57 1.899 29.551 -6.937 1.00 0.00 C ATOM 776 O LYS A 57 2.432 30.587 -6.544 1.00 0.00 O ATOM 777 CB LYS A 57 0.534 27.858 -5.582 1.00 0.00 C ATOM 778 CG LYS A 57 -0.881 27.469 -5.150 1.00 0.00 C ATOM 779 CD LYS A 57 -1.007 27.465 -3.626 1.00 0.00 C ATOM 780 CE LYS A 57 -1.667 28.752 -3.126 1.00 0.00 C ATOM 781 NZ LYS A 57 -0.681 29.597 -2.416 1.00 0.00 N ATOM 0 H LYS A 57 -0.830 28.091 -7.627 1.00 0.00 H new ATOM 0 HA LYS A 57 0.187 29.929 -5.741 1.00 0.00 H new ATOM 0 HB2 LYS A 57 0.977 27.048 -6.162 1.00 0.00 H new ATOM 0 HB3 LYS A 57 1.161 27.999 -4.702 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -1.600 28.168 -5.576 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -1.126 26.482 -5.541 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -1.595 26.604 -3.309 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -0.020 27.360 -3.176 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -2.088 29.303 -3.967 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -2.494 28.508 -2.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -1.145 30.466 -2.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -0.299 29.075 -1.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 0.094 29.844 -3.064 1.00 0.00 H new ATOM 795 N GLY A 58 2.437 28.716 -7.814 1.00 0.00 N ATOM 796 CA GLY A 58 3.744 28.978 -8.393 1.00 0.00 C ATOM 797 C GLY A 58 4.571 27.695 -8.484 1.00 0.00 C ATOM 798 O GLY A 58 5.574 27.647 -9.195 1.00 0.00 O ATOM 0 H GLY A 58 1.992 27.857 -8.138 1.00 0.00 H new ATOM 0 HA2 GLY A 58 3.625 29.410 -9.387 1.00 0.00 H new ATOM 0 HA3 GLY A 58 4.273 29.714 -7.787 1.00 0.00 H new ATOM 802 N TYR A 59 4.121 26.685 -7.753 1.00 0.00 N ATOM 803 CA TYR A 59 4.807 25.405 -7.742 1.00 0.00 C ATOM 804 C TYR A 59 3.847 24.265 -8.090 1.00 0.00 C ATOM 805 O TYR A 59 2.636 24.395 -7.920 1.00 0.00 O ATOM 806 CB TYR A 59 5.314 25.210 -6.312 1.00 0.00 C ATOM 807 CG TYR A 59 4.233 25.375 -5.241 1.00 0.00 C ATOM 808 CD1 TYR A 59 3.939 26.628 -4.745 1.00 0.00 C ATOM 809 CD2 TYR A 59 3.552 24.270 -4.772 1.00 0.00 C ATOM 810 CE1 TYR A 59 2.922 26.784 -3.737 1.00 0.00 C ATOM 811 CE2 TYR A 59 2.535 24.425 -3.764 1.00 0.00 C ATOM 812 CZ TYR A 59 2.270 25.674 -3.297 1.00 0.00 C ATOM 813 OH TYR A 59 1.310 25.821 -2.345 1.00 0.00 O ATOM 0 H TYR A 59 3.289 26.728 -7.164 1.00 0.00 H new ATOM 0 HA TYR A 59 5.613 25.396 -8.476 1.00 0.00 H new ATOM 0 HB2 TYR A 59 5.749 24.215 -6.224 1.00 0.00 H new ATOM 0 HB3 TYR A 59 6.114 25.925 -6.120 1.00 0.00 H new ATOM 0 HD1 TYR A 59 4.472 27.493 -5.113 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.782 23.289 -5.161 1.00 0.00 H new ATOM 0 HE1 TYR A 59 2.683 27.759 -3.340 1.00 0.00 H new ATOM 0 HE2 TYR A 59 1.995 23.569 -3.388 1.00 0.00 H new ATOM 0 HH TYR A 59 0.494 25.358 -2.629 1.00 0.00 H new ATOM 823 N GLY A 60 4.425 23.174 -8.572 1.00 0.00 N ATOM 824 CA GLY A 60 3.636 22.013 -8.945 1.00 0.00 C ATOM 825 C GLY A 60 4.521 20.774 -9.096 1.00 0.00 C ATOM 826 O GLY A 60 5.714 20.820 -8.803 1.00 0.00 O ATOM 0 H GLY A 60 5.430 23.070 -8.713 1.00 0.00 H new ATOM 0 HA2 GLY A 60 2.873 21.829 -8.189 1.00 0.00 H new ATOM 0 HA3 GLY A 60 3.115 22.209 -9.882 1.00 0.00 H new ATOM 830 N PHE A 61 3.901 19.695 -9.553 1.00 0.00 N ATOM 831 CA PHE A 61 4.618 18.446 -9.746 1.00 0.00 C ATOM 832 C PHE A 61 4.310 17.844 -11.119 1.00 0.00 C ATOM 833 O PHE A 61 3.155 17.808 -11.540 1.00 0.00 O ATOM 834 CB PHE A 61 4.137 17.482 -8.660 1.00 0.00 C ATOM 835 CG PHE A 61 4.366 17.988 -7.234 1.00 0.00 C ATOM 836 CD1 PHE A 61 3.583 18.980 -6.731 1.00 0.00 C ATOM 837 CD2 PHE A 61 5.351 17.445 -6.470 1.00 0.00 C ATOM 838 CE1 PHE A 61 3.795 19.449 -5.407 1.00 0.00 C ATOM 839 CE2 PHE A 61 5.563 17.914 -5.146 1.00 0.00 C ATOM 840 CZ PHE A 61 4.780 18.906 -4.643 1.00 0.00 C ATOM 0 H PHE A 61 2.911 19.660 -9.795 1.00 0.00 H new ATOM 0 HA PHE A 61 5.692 18.621 -9.688 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.073 17.293 -8.801 1.00 0.00 H new ATOM 0 HB3 PHE A 61 4.649 16.528 -8.783 1.00 0.00 H new ATOM 0 HD1 PHE A 61 2.800 19.411 -7.338 1.00 0.00 H new ATOM 0 HD2 PHE A 61 5.972 16.657 -6.870 1.00 0.00 H new ATOM 0 HE1 PHE A 61 3.174 20.237 -5.007 1.00 0.00 H new ATOM 0 HE2 PHE A 61 6.346 17.483 -4.539 1.00 0.00 H new ATOM 0 HZ PHE A 61 4.941 19.263 -3.636 1.00 0.00 H new ATOM 850 N CYS A 62 5.364 17.386 -11.778 1.00 0.00 N ATOM 851 CA CYS A 62 5.220 16.787 -13.094 1.00 0.00 C ATOM 852 C CYS A 62 5.415 15.276 -12.958 1.00 0.00 C ATOM 853 O CYS A 62 6.110 14.815 -12.054 1.00 0.00 O ATOM 854 CB CYS A 62 6.194 17.399 -14.104 1.00 0.00 C ATOM 855 SG CYS A 62 5.698 16.945 -15.806 1.00 0.00 S ATOM 0 H CYS A 62 6.321 17.418 -11.426 1.00 0.00 H new ATOM 0 HA CYS A 62 4.222 16.990 -13.481 1.00 0.00 H new ATOM 0 HB2 CYS A 62 6.207 18.484 -13.997 1.00 0.00 H new ATOM 0 HB3 CYS A 62 7.206 17.047 -13.905 1.00 0.00 H new ATOM 0 HG CYS A 62 5.116 17.959 -16.374 1.00 0.00 H new ATOM 861 N GLU A 63 4.790 14.546 -13.870 1.00 0.00 N ATOM 862 CA GLU A 63 4.885 13.096 -13.863 1.00 0.00 C ATOM 863 C GLU A 63 5.503 12.599 -15.172 1.00 0.00 C ATOM 864 O GLU A 63 4.993 12.890 -16.253 1.00 0.00 O ATOM 865 CB GLU A 63 3.516 12.457 -13.625 1.00 0.00 C ATOM 866 CG GLU A 63 3.553 11.514 -12.421 1.00 0.00 C ATOM 867 CD GLU A 63 2.181 11.428 -11.749 1.00 0.00 C ATOM 868 OE1 GLU A 63 1.657 12.505 -11.389 1.00 0.00 O ATOM 869 OE2 GLU A 63 1.686 10.289 -11.612 1.00 0.00 O ATOM 0 H GLU A 63 4.215 14.932 -14.619 1.00 0.00 H new ATOM 0 HA GLU A 63 5.535 12.798 -13.040 1.00 0.00 H new ATOM 0 HB2 GLU A 63 2.771 13.235 -13.459 1.00 0.00 H new ATOM 0 HB3 GLU A 63 3.208 11.906 -14.514 1.00 0.00 H new ATOM 0 HG2 GLU A 63 3.867 10.521 -12.742 1.00 0.00 H new ATOM 0 HG3 GLU A 63 4.293 11.866 -11.702 1.00 0.00 H new ATOM 876 N TYR A 64 6.591 11.856 -15.031 1.00 0.00 N ATOM 877 CA TYR A 64 7.283 11.315 -16.189 1.00 0.00 C ATOM 878 C TYR A 64 6.956 9.833 -16.380 1.00 0.00 C ATOM 879 O TYR A 64 6.109 9.285 -15.677 1.00 0.00 O ATOM 880 CB TYR A 64 8.777 11.462 -15.894 1.00 0.00 C ATOM 881 CG TYR A 64 9.414 12.709 -16.510 1.00 0.00 C ATOM 882 CD1 TYR A 64 9.929 12.660 -17.790 1.00 0.00 C ATOM 883 CD2 TYR A 64 9.473 13.883 -15.787 1.00 0.00 C ATOM 884 CE1 TYR A 64 10.528 13.834 -18.370 1.00 0.00 C ATOM 885 CE2 TYR A 64 10.072 15.057 -16.367 1.00 0.00 C ATOM 886 CZ TYR A 64 10.570 14.974 -17.630 1.00 0.00 C ATOM 887 OH TYR A 64 11.136 16.083 -18.178 1.00 0.00 O ATOM 0 H TYR A 64 7.010 11.616 -14.133 1.00 0.00 H new ATOM 0 HA TYR A 64 6.982 11.840 -17.096 1.00 0.00 H new ATOM 0 HB2 TYR A 64 8.923 11.488 -14.814 1.00 0.00 H new ATOM 0 HB3 TYR A 64 9.298 10.580 -16.265 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.883 11.741 -18.356 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.070 13.921 -14.786 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.935 13.810 -19.370 1.00 0.00 H new ATOM 0 HE2 TYR A 64 10.125 15.982 -15.812 1.00 0.00 H new ATOM 0 HH TYR A 64 10.983 16.084 -19.146 1.00 0.00 H new ATOM 897 N GLN A 65 7.644 9.226 -17.336 1.00 0.00 N ATOM 898 CA GLN A 65 7.438 7.818 -17.628 1.00 0.00 C ATOM 899 C GLN A 65 8.686 7.012 -17.265 1.00 0.00 C ATOM 900 O GLN A 65 8.603 5.809 -17.021 1.00 0.00 O ATOM 901 CB GLN A 65 7.061 7.613 -19.097 1.00 0.00 C ATOM 902 CG GLN A 65 6.233 6.340 -19.278 1.00 0.00 C ATOM 903 CD GLN A 65 7.108 5.179 -19.755 1.00 0.00 C ATOM 904 OE1 GLN A 65 7.991 5.333 -20.583 1.00 0.00 O ATOM 905 NE2 GLN A 65 6.815 4.012 -19.189 1.00 0.00 N ATOM 0 H GLN A 65 8.345 9.684 -17.918 1.00 0.00 H new ATOM 0 HA GLN A 65 6.608 7.458 -17.020 1.00 0.00 H new ATOM 0 HB2 GLN A 65 6.495 8.473 -19.454 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.965 7.552 -19.703 1.00 0.00 H new ATOM 0 HG2 GLN A 65 5.755 6.076 -18.335 1.00 0.00 H new ATOM 0 HG3 GLN A 65 5.436 6.520 -20.000 1.00 0.00 H new ATOM 0 HE21 GLN A 65 6.063 3.953 -18.503 1.00 0.00 H new ATOM 0 HE22 GLN A 65 7.342 3.176 -19.441 1.00 0.00 H new ATOM 914 N ASP A 66 9.814 7.707 -17.239 1.00 0.00 N ATOM 915 CA ASP A 66 11.078 7.070 -16.909 1.00 0.00 C ATOM 916 C ASP A 66 11.726 7.810 -15.736 1.00 0.00 C ATOM 917 O ASP A 66 11.775 9.039 -15.724 1.00 0.00 O ATOM 918 CB ASP A 66 12.046 7.121 -18.093 1.00 0.00 C ATOM 919 CG ASP A 66 11.382 7.144 -19.471 1.00 0.00 C ATOM 920 OD1 ASP A 66 10.937 8.242 -19.869 1.00 0.00 O ATOM 921 OD2 ASP A 66 11.334 6.062 -20.095 1.00 0.00 O ATOM 0 H ASP A 66 9.879 8.705 -17.441 1.00 0.00 H new ATOM 0 HA ASP A 66 10.875 6.030 -16.654 1.00 0.00 H new ATOM 0 HB2 ASP A 66 12.672 8.008 -17.993 1.00 0.00 H new ATOM 0 HB3 ASP A 66 12.707 6.256 -18.040 1.00 0.00 H new ATOM 926 N GLN A 67 12.206 7.030 -14.779 1.00 0.00 N ATOM 927 CA GLN A 67 12.848 7.596 -13.605 1.00 0.00 C ATOM 928 C GLN A 67 14.086 8.397 -14.012 1.00 0.00 C ATOM 929 O GLN A 67 14.288 9.516 -13.542 1.00 0.00 O ATOM 930 CB GLN A 67 13.209 6.502 -12.597 1.00 0.00 C ATOM 931 CG GLN A 67 14.063 7.066 -11.459 1.00 0.00 C ATOM 932 CD GLN A 67 13.393 8.286 -10.824 1.00 0.00 C ATOM 933 OE1 GLN A 67 13.176 8.164 -9.517 1.00 0.00 O flip ATOM 934 NE2 GLN A 67 13.093 9.272 -11.476 1.00 0.00 N flip ATOM 0 H GLN A 67 12.163 6.011 -14.793 1.00 0.00 H new ATOM 0 HA GLN A 67 12.145 8.273 -13.120 1.00 0.00 H new ATOM 0 HB2 GLN A 67 12.298 6.063 -12.190 1.00 0.00 H new ATOM 0 HB3 GLN A 67 13.751 5.702 -13.101 1.00 0.00 H new ATOM 0 HG2 GLN A 67 14.220 6.298 -10.702 1.00 0.00 H new ATOM 0 HG3 GLN A 67 15.046 7.343 -11.840 1.00 0.00 H new ATOM 0 HE21 GLN A 67 13.288 9.300 -12.477 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.647 10.068 -11.020 1.00 0.00 H new ATOM 943 N GLU A 68 14.884 7.793 -14.880 1.00 0.00 N ATOM 944 CA GLU A 68 16.097 8.436 -15.356 1.00 0.00 C ATOM 945 C GLU A 68 15.754 9.719 -16.116 1.00 0.00 C ATOM 946 O GLU A 68 16.466 10.717 -16.009 1.00 0.00 O ATOM 947 CB GLU A 68 16.917 7.484 -16.229 1.00 0.00 C ATOM 948 CG GLU A 68 18.087 8.216 -16.888 1.00 0.00 C ATOM 949 CD GLU A 68 18.819 7.302 -17.874 1.00 0.00 C ATOM 950 OE1 GLU A 68 19.372 6.285 -17.402 1.00 0.00 O ATOM 951 OE2 GLU A 68 18.810 7.642 -19.077 1.00 0.00 O ATOM 0 H GLU A 68 14.714 6.864 -15.266 1.00 0.00 H new ATOM 0 HA GLU A 68 16.708 8.700 -14.493 1.00 0.00 H new ATOM 0 HB2 GLU A 68 17.294 6.661 -15.621 1.00 0.00 H new ATOM 0 HB3 GLU A 68 16.278 7.047 -16.996 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.720 9.100 -17.409 1.00 0.00 H new ATOM 0 HG3 GLU A 68 18.782 8.562 -16.123 1.00 0.00 H new ATOM 958 N THR A 69 14.665 9.652 -16.866 1.00 0.00 N ATOM 959 CA THR A 69 14.220 10.795 -17.644 1.00 0.00 C ATOM 960 C THR A 69 13.773 11.929 -16.718 1.00 0.00 C ATOM 961 O THR A 69 14.083 13.094 -16.963 1.00 0.00 O ATOM 962 CB THR A 69 13.121 10.320 -18.597 1.00 0.00 C ATOM 963 OG1 THR A 69 13.755 9.319 -19.388 1.00 0.00 O ATOM 964 CG2 THR A 69 12.718 11.395 -19.609 1.00 0.00 C ATOM 0 H THR A 69 14.077 8.823 -16.952 1.00 0.00 H new ATOM 0 HA THR A 69 15.033 11.207 -18.242 1.00 0.00 H new ATOM 0 HB THR A 69 12.247 10.019 -18.020 1.00 0.00 H new ATOM 0 HG1 THR A 69 13.168 9.070 -20.132 1.00 0.00 H new ATOM 0 HG21 THR A 69 11.936 11.006 -20.261 1.00 0.00 H new ATOM 0 HG22 THR A 69 12.346 12.272 -19.079 1.00 0.00 H new ATOM 0 HG23 THR A 69 13.585 11.673 -20.209 1.00 0.00 H new ATOM 972 N ALA A 70 13.053 11.547 -15.674 1.00 0.00 N ATOM 973 CA ALA A 70 12.561 12.517 -14.710 1.00 0.00 C ATOM 974 C ALA A 70 13.740 13.084 -13.917 1.00 0.00 C ATOM 975 O ALA A 70 13.776 14.278 -13.620 1.00 0.00 O ATOM 976 CB ALA A 70 11.516 11.856 -13.809 1.00 0.00 C ATOM 0 H ALA A 70 12.798 10.580 -15.474 1.00 0.00 H new ATOM 0 HA ALA A 70 12.074 13.350 -15.217 1.00 0.00 H new ATOM 0 HB1 ALA A 70 11.147 12.583 -13.086 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.686 11.496 -14.417 1.00 0.00 H new ATOM 0 HB3 ALA A 70 11.969 11.017 -13.281 1.00 0.00 H new ATOM 982 N LEU A 71 14.675 12.202 -13.595 1.00 0.00 N ATOM 983 CA LEU A 71 15.852 12.600 -12.842 1.00 0.00 C ATOM 984 C LEU A 71 16.746 13.473 -13.725 1.00 0.00 C ATOM 985 O LEU A 71 17.358 14.426 -13.245 1.00 0.00 O ATOM 986 CB LEU A 71 16.563 11.372 -12.270 1.00 0.00 C ATOM 987 CG LEU A 71 16.240 11.027 -10.815 1.00 0.00 C ATOM 988 CD1 LEU A 71 16.233 9.512 -10.599 1.00 0.00 C ATOM 989 CD2 LEU A 71 17.199 11.738 -9.858 1.00 0.00 C ATOM 0 H LEU A 71 14.641 11.213 -13.842 1.00 0.00 H new ATOM 0 HA LEU A 71 15.567 13.204 -11.981 1.00 0.00 H new ATOM 0 HB2 LEU A 71 16.314 10.511 -12.891 1.00 0.00 H new ATOM 0 HB3 LEU A 71 17.639 11.527 -12.356 1.00 0.00 H new ATOM 0 HG LEU A 71 15.236 11.388 -10.593 1.00 0.00 H new ATOM 0 HD11 LEU A 71 16.001 9.294 -9.557 1.00 0.00 H new ATOM 0 HD12 LEU A 71 15.480 9.056 -11.241 1.00 0.00 H new ATOM 0 HD13 LEU A 71 17.214 9.105 -10.845 1.00 0.00 H new ATOM 0 HD21 LEU A 71 16.948 11.476 -8.830 1.00 0.00 H new ATOM 0 HD22 LEU A 71 18.222 11.429 -10.072 1.00 0.00 H new ATOM 0 HD23 LEU A 71 17.111 12.816 -9.989 1.00 0.00 H new ATOM 1001 N SER A 72 16.793 13.116 -15.000 1.00 0.00 N ATOM 1002 CA SER A 72 17.602 13.855 -15.954 1.00 0.00 C ATOM 1003 C SER A 72 16.966 15.218 -16.235 1.00 0.00 C ATOM 1004 O SER A 72 17.664 16.228 -16.317 1.00 0.00 O ATOM 1005 CB SER A 72 17.771 13.070 -17.257 1.00 0.00 C ATOM 1006 OG SER A 72 18.766 12.056 -17.143 1.00 0.00 O ATOM 0 H SER A 72 16.284 12.325 -15.394 1.00 0.00 H new ATOM 0 HA SER A 72 18.591 14.005 -15.520 1.00 0.00 H new ATOM 0 HB2 SER A 72 16.819 12.615 -17.532 1.00 0.00 H new ATOM 0 HB3 SER A 72 18.041 13.755 -18.061 1.00 0.00 H new ATOM 0 HG SER A 72 18.374 11.258 -16.731 1.00 0.00 H new ATOM 1012 N ALA A 73 15.648 15.203 -16.374 1.00 0.00 N ATOM 1013 CA ALA A 73 14.911 16.426 -16.644 1.00 0.00 C ATOM 1014 C ALA A 73 14.969 17.334 -15.414 1.00 0.00 C ATOM 1015 O ALA A 73 15.235 18.529 -15.532 1.00 0.00 O ATOM 1016 CB ALA A 73 13.475 16.078 -17.044 1.00 0.00 C ATOM 0 H ALA A 73 15.072 14.364 -16.305 1.00 0.00 H new ATOM 0 HA ALA A 73 15.360 16.969 -17.476 1.00 0.00 H new ATOM 0 HB1 ALA A 73 12.921 16.995 -17.247 1.00 0.00 H new ATOM 0 HB2 ALA A 73 13.487 15.456 -17.939 1.00 0.00 H new ATOM 0 HB3 ALA A 73 12.992 15.535 -16.231 1.00 0.00 H new ATOM 1022 N MET A 74 14.717 16.732 -14.261 1.00 0.00 N ATOM 1023 CA MET A 74 14.737 17.471 -13.010 1.00 0.00 C ATOM 1024 C MET A 74 16.153 17.945 -12.677 1.00 0.00 C ATOM 1025 O MET A 74 16.343 19.071 -12.218 1.00 0.00 O ATOM 1026 CB MET A 74 14.218 16.578 -11.881 1.00 0.00 C ATOM 1027 CG MET A 74 15.349 15.741 -11.280 1.00 0.00 C ATOM 1028 SD MET A 74 14.700 14.650 -10.025 1.00 0.00 S ATOM 1029 CE MET A 74 16.126 14.521 -8.959 1.00 0.00 C ATOM 0 H MET A 74 14.498 15.740 -14.167 1.00 0.00 H new ATOM 0 HA MET A 74 14.096 18.346 -13.116 1.00 0.00 H new ATOM 0 HB2 MET A 74 13.765 17.194 -11.104 1.00 0.00 H new ATOM 0 HB3 MET A 74 13.437 15.920 -12.263 1.00 0.00 H new ATOM 0 HG2 MET A 74 15.837 15.160 -12.062 1.00 0.00 H new ATOM 0 HG3 MET A 74 16.107 16.395 -10.849 1.00 0.00 H new ATOM 0 HE1 MET A 74 16.054 13.611 -8.363 1.00 0.00 H new ATOM 0 HE2 MET A 74 17.031 14.487 -9.565 1.00 0.00 H new ATOM 0 HE3 MET A 74 16.165 15.386 -8.297 1.00 0.00 H new ATOM 1039 N ARG A 75 17.111 17.062 -12.920 1.00 0.00 N ATOM 1040 CA ARG A 75 18.504 17.376 -12.651 1.00 0.00 C ATOM 1041 C ARG A 75 19.039 18.353 -13.700 1.00 0.00 C ATOM 1042 O ARG A 75 19.911 19.170 -13.405 1.00 0.00 O ATOM 1043 CB ARG A 75 19.365 16.112 -12.656 1.00 0.00 C ATOM 1044 CG ARG A 75 20.819 16.437 -12.310 1.00 0.00 C ATOM 1045 CD ARG A 75 21.777 15.456 -12.989 1.00 0.00 C ATOM 1046 NE ARG A 75 23.178 15.873 -12.758 1.00 0.00 N ATOM 1047 CZ ARG A 75 23.866 15.605 -11.639 1.00 0.00 C ATOM 1048 NH1 ARG A 75 23.287 14.919 -10.644 1.00 0.00 N ATOM 1049 NH2 ARG A 75 25.133 16.023 -11.516 1.00 0.00 N ATOM 0 H ARG A 75 16.950 16.129 -13.300 1.00 0.00 H new ATOM 0 HA ARG A 75 18.556 17.833 -11.663 1.00 0.00 H new ATOM 0 HB2 ARG A 75 18.968 15.395 -11.938 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.318 15.640 -13.637 1.00 0.00 H new ATOM 0 HG2 ARG A 75 21.052 17.455 -12.623 1.00 0.00 H new ATOM 0 HG3 ARG A 75 20.957 16.397 -11.230 1.00 0.00 H new ATOM 0 HD2 ARG A 75 21.619 14.451 -12.597 1.00 0.00 H new ATOM 0 HD3 ARG A 75 21.572 15.417 -14.059 1.00 0.00 H new ATOM 0 HE ARG A 75 23.649 16.397 -13.496 1.00 0.00 H new ATOM 0 HH11 ARG A 75 22.323 14.601 -10.738 1.00 0.00 H new ATOM 0 HH12 ARG A 75 23.811 14.715 -9.793 1.00 0.00 H new ATOM 0 HH21 ARG A 75 25.574 16.545 -12.274 1.00 0.00 H new ATOM 0 HH22 ARG A 75 25.657 15.819 -10.665 1.00 0.00 H new ATOM 1063 N ASN A 76 18.495 18.238 -14.902 1.00 0.00 N ATOM 1064 CA ASN A 76 18.907 19.101 -15.996 1.00 0.00 C ATOM 1065 C ASN A 76 18.244 20.471 -15.837 1.00 0.00 C ATOM 1066 O ASN A 76 18.851 21.497 -16.138 1.00 0.00 O ATOM 1067 CB ASN A 76 18.479 18.522 -17.346 1.00 0.00 C ATOM 1068 CG ASN A 76 19.418 17.396 -17.782 1.00 0.00 C ATOM 1069 OD1 ASN A 76 20.309 16.981 -17.060 1.00 0.00 O ATOM 1070 ND2 ASN A 76 19.171 16.927 -19.002 1.00 0.00 N ATOM 0 H ASN A 76 17.772 17.560 -15.143 1.00 0.00 H new ATOM 0 HA ASN A 76 19.993 19.185 -15.968 1.00 0.00 H new ATOM 0 HB2 ASN A 76 17.459 18.143 -17.277 1.00 0.00 H new ATOM 0 HB3 ASN A 76 18.476 19.310 -18.099 1.00 0.00 H new ATOM 0 HD21 ASN A 76 19.744 16.175 -19.385 1.00 0.00 H new ATOM 0 HD22 ASN A 76 18.409 17.319 -19.555 1.00 0.00 H new ATOM 1077 N LEU A 77 17.006 20.442 -15.365 1.00 0.00 N ATOM 1078 CA LEU A 77 16.254 21.668 -15.163 1.00 0.00 C ATOM 1079 C LEU A 77 16.572 22.234 -13.777 1.00 0.00 C ATOM 1080 O LEU A 77 16.459 23.438 -13.553 1.00 0.00 O ATOM 1081 CB LEU A 77 14.762 21.427 -15.401 1.00 0.00 C ATOM 1082 CG LEU A 77 14.314 21.390 -16.863 1.00 0.00 C ATOM 1083 CD1 LEU A 77 14.752 20.089 -17.538 1.00 0.00 C ATOM 1084 CD2 LEU A 77 12.805 21.616 -16.980 1.00 0.00 C ATOM 0 H LEU A 77 16.505 19.589 -15.117 1.00 0.00 H new ATOM 0 HA LEU A 77 16.552 22.422 -15.892 1.00 0.00 H new ATOM 0 HB2 LEU A 77 14.488 20.481 -14.934 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.202 22.210 -14.890 1.00 0.00 H new ATOM 0 HG LEU A 77 14.804 22.208 -17.391 1.00 0.00 H new ATOM 0 HD11 LEU A 77 14.421 20.088 -18.576 1.00 0.00 H new ATOM 0 HD12 LEU A 77 15.839 20.009 -17.504 1.00 0.00 H new ATOM 0 HD13 LEU A 77 14.309 19.241 -17.016 1.00 0.00 H new ATOM 0 HD21 LEU A 77 12.513 21.585 -18.030 1.00 0.00 H new ATOM 0 HD22 LEU A 77 12.277 20.835 -16.433 1.00 0.00 H new ATOM 0 HD23 LEU A 77 12.549 22.589 -16.561 1.00 0.00 H new ATOM 1096 N ASN A 78 16.963 21.338 -12.883 1.00 0.00 N ATOM 1097 CA ASN A 78 17.298 21.733 -11.525 1.00 0.00 C ATOM 1098 C ASN A 78 18.409 22.784 -11.564 1.00 0.00 C ATOM 1099 O ASN A 78 19.590 22.446 -11.501 1.00 0.00 O ATOM 1100 CB ASN A 78 17.804 20.539 -10.714 1.00 0.00 C ATOM 1101 CG ASN A 78 18.695 20.999 -9.558 1.00 0.00 C ATOM 1102 OD1 ASN A 78 18.248 21.610 -8.601 1.00 0.00 O ATOM 1103 ND2 ASN A 78 19.977 20.673 -9.699 1.00 0.00 N ATOM 0 H ASN A 78 17.055 20.340 -13.072 1.00 0.00 H new ATOM 0 HA ASN A 78 16.398 22.131 -11.057 1.00 0.00 H new ATOM 0 HB2 ASN A 78 16.957 19.975 -10.323 1.00 0.00 H new ATOM 0 HB3 ASN A 78 18.363 19.865 -11.363 1.00 0.00 H new ATOM 0 HD21 ASN A 78 20.652 20.935 -8.981 1.00 0.00 H new ATOM 0 HD22 ASN A 78 20.285 20.161 -10.525 1.00 0.00 H new ATOM 1110 N GLY A 79 17.991 24.037 -11.666 1.00 0.00 N ATOM 1111 CA GLY A 79 18.937 25.139 -11.713 1.00 0.00 C ATOM 1112 C GLY A 79 18.984 25.761 -13.111 1.00 0.00 C ATOM 1113 O GLY A 79 19.783 26.661 -13.367 1.00 0.00 O ATOM 0 H GLY A 79 17.011 24.314 -11.717 1.00 0.00 H new ATOM 0 HA2 GLY A 79 18.654 25.897 -10.983 1.00 0.00 H new ATOM 0 HA3 GLY A 79 19.929 24.783 -11.435 1.00 0.00 H new ATOM 1117 N ARG A 80 18.117 25.258 -13.977 1.00 0.00 N ATOM 1118 CA ARG A 80 18.050 25.753 -15.342 1.00 0.00 C ATOM 1119 C ARG A 80 17.212 27.032 -15.401 1.00 0.00 C ATOM 1120 O ARG A 80 16.066 27.049 -14.956 1.00 0.00 O ATOM 1121 CB ARG A 80 17.439 24.708 -16.277 1.00 0.00 C ATOM 1122 CG ARG A 80 17.253 25.275 -17.686 1.00 0.00 C ATOM 1123 CD ARG A 80 18.162 24.561 -18.689 1.00 0.00 C ATOM 1124 NE ARG A 80 17.409 24.254 -19.925 1.00 0.00 N ATOM 1125 CZ ARG A 80 17.777 23.324 -20.817 1.00 0.00 C ATOM 1126 NH1 ARG A 80 18.889 22.604 -20.615 1.00 0.00 N ATOM 1127 NH2 ARG A 80 17.032 23.114 -21.911 1.00 0.00 N ATOM 0 H ARG A 80 17.455 24.513 -13.760 1.00 0.00 H new ATOM 0 HA ARG A 80 19.068 25.965 -15.669 1.00 0.00 H new ATOM 0 HB2 ARG A 80 18.083 23.829 -16.317 1.00 0.00 H new ATOM 0 HB3 ARG A 80 16.477 24.380 -15.883 1.00 0.00 H new ATOM 0 HG2 ARG A 80 16.212 25.166 -17.991 1.00 0.00 H new ATOM 0 HG3 ARG A 80 17.475 26.342 -17.685 1.00 0.00 H new ATOM 0 HD2 ARG A 80 19.022 25.188 -18.924 1.00 0.00 H new ATOM 0 HD3 ARG A 80 18.549 23.641 -18.251 1.00 0.00 H new ATOM 0 HE ARG A 80 16.557 24.783 -20.110 1.00 0.00 H new ATOM 0 HH11 ARG A 80 19.456 22.764 -19.782 1.00 0.00 H new ATOM 0 HH12 ARG A 80 19.169 21.896 -21.294 1.00 0.00 H new ATOM 0 HH21 ARG A 80 16.185 23.662 -22.064 1.00 0.00 H new ATOM 0 HH22 ARG A 80 17.312 22.406 -22.590 1.00 0.00 H new ATOM 1141 N GLU A 81 17.818 28.072 -15.955 1.00 0.00 N ATOM 1142 CA GLU A 81 17.142 29.353 -16.078 1.00 0.00 C ATOM 1143 C GLU A 81 16.146 29.318 -17.238 1.00 0.00 C ATOM 1144 O GLU A 81 16.431 28.745 -18.289 1.00 0.00 O ATOM 1145 CB GLU A 81 18.151 30.490 -16.256 1.00 0.00 C ATOM 1146 CG GLU A 81 19.292 30.374 -15.243 1.00 0.00 C ATOM 1147 CD GLU A 81 20.651 30.533 -15.928 1.00 0.00 C ATOM 1148 OE1 GLU A 81 20.827 29.903 -16.993 1.00 0.00 O ATOM 1149 OE2 GLU A 81 21.483 31.281 -15.371 1.00 0.00 O ATOM 0 H GLU A 81 18.769 28.054 -16.324 1.00 0.00 H new ATOM 0 HA GLU A 81 16.591 29.541 -15.157 1.00 0.00 H new ATOM 0 HB2 GLU A 81 18.555 30.467 -17.268 1.00 0.00 H new ATOM 0 HB3 GLU A 81 17.648 31.449 -16.135 1.00 0.00 H new ATOM 0 HG2 GLU A 81 19.178 31.136 -14.472 1.00 0.00 H new ATOM 0 HG3 GLU A 81 19.243 29.406 -14.744 1.00 0.00 H new ATOM 1156 N PHE A 82 14.997 29.937 -17.009 1.00 0.00 N ATOM 1157 CA PHE A 82 13.957 29.984 -18.022 1.00 0.00 C ATOM 1158 C PHE A 82 12.905 31.041 -17.679 1.00 0.00 C ATOM 1159 O PHE A 82 12.677 31.338 -16.508 1.00 0.00 O ATOM 1160 CB PHE A 82 13.291 28.606 -18.043 1.00 0.00 C ATOM 1161 CG PHE A 82 12.126 28.493 -19.028 1.00 0.00 C ATOM 1162 CD1 PHE A 82 10.885 28.919 -18.667 1.00 0.00 C ATOM 1163 CD2 PHE A 82 12.330 27.968 -20.266 1.00 0.00 C ATOM 1164 CE1 PHE A 82 9.804 28.814 -19.581 1.00 0.00 C ATOM 1165 CE2 PHE A 82 11.249 27.863 -21.180 1.00 0.00 C ATOM 1166 CZ PHE A 82 10.009 28.288 -20.819 1.00 0.00 C ATOM 0 H PHE A 82 14.764 30.410 -16.136 1.00 0.00 H new ATOM 0 HA PHE A 82 14.390 30.242 -18.989 1.00 0.00 H new ATOM 0 HB2 PHE A 82 14.040 27.855 -18.295 1.00 0.00 H new ATOM 0 HB3 PHE A 82 12.930 28.373 -17.041 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.722 29.337 -17.685 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.315 27.631 -20.554 1.00 0.00 H new ATOM 0 HE1 PHE A 82 8.819 29.152 -19.294 1.00 0.00 H new ATOM 0 HE2 PHE A 82 11.412 27.445 -22.163 1.00 0.00 H new ATOM 0 HZ PHE A 82 9.187 28.208 -21.515 1.00 0.00 H new ATOM 1176 N SER A 83 12.291 31.579 -18.723 1.00 0.00 N ATOM 1177 CA SER A 83 11.269 32.597 -18.547 1.00 0.00 C ATOM 1178 C SER A 83 11.814 33.744 -17.695 1.00 0.00 C ATOM 1179 O SER A 83 11.049 34.468 -17.060 1.00 0.00 O ATOM 1180 CB SER A 83 10.011 32.009 -17.905 1.00 0.00 C ATOM 1181 OG SER A 83 9.232 31.266 -18.838 1.00 0.00 O ATOM 0 H SER A 83 12.482 31.329 -19.693 1.00 0.00 H new ATOM 0 HA SER A 83 10.996 32.982 -19.530 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.296 31.363 -17.075 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.406 32.815 -17.488 1.00 0.00 H new ATOM 0 HG SER A 83 9.786 30.567 -19.243 1.00 0.00 H new ATOM 1187 N GLY A 84 13.132 33.874 -17.708 1.00 0.00 N ATOM 1188 CA GLY A 84 13.789 34.921 -16.944 1.00 0.00 C ATOM 1189 C GLY A 84 13.921 34.525 -15.472 1.00 0.00 C ATOM 1190 O GLY A 84 14.352 35.328 -14.646 1.00 0.00 O ATOM 0 H GLY A 84 13.763 33.271 -18.236 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.777 35.116 -17.362 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.220 35.847 -17.026 1.00 0.00 H new ATOM 1194 N ARG A 85 13.543 33.287 -15.189 1.00 0.00 N ATOM 1195 CA ARG A 85 13.615 32.774 -13.832 1.00 0.00 C ATOM 1196 C ARG A 85 14.428 31.479 -13.796 1.00 0.00 C ATOM 1197 O ARG A 85 15.169 31.180 -14.731 1.00 0.00 O ATOM 1198 CB ARG A 85 12.217 32.507 -13.270 1.00 0.00 C ATOM 1199 CG ARG A 85 11.969 33.330 -12.004 1.00 0.00 C ATOM 1200 CD ARG A 85 13.001 33.000 -10.924 1.00 0.00 C ATOM 1201 NE ARG A 85 12.984 34.040 -9.872 1.00 0.00 N ATOM 1202 CZ ARG A 85 13.643 35.204 -9.955 1.00 0.00 C ATOM 1203 NH1 ARG A 85 14.376 35.483 -11.042 1.00 0.00 N ATOM 1204 NH2 ARG A 85 13.570 36.089 -8.952 1.00 0.00 N ATOM 0 H ARG A 85 13.186 32.624 -15.877 1.00 0.00 H new ATOM 0 HA ARG A 85 14.103 33.530 -13.217 1.00 0.00 H new ATOM 0 HB2 ARG A 85 11.466 32.753 -14.021 1.00 0.00 H new ATOM 0 HB3 ARG A 85 12.108 31.446 -13.046 1.00 0.00 H new ATOM 0 HG2 ARG A 85 12.014 34.393 -12.242 1.00 0.00 H new ATOM 0 HG3 ARG A 85 10.966 33.130 -11.627 1.00 0.00 H new ATOM 0 HD2 ARG A 85 12.783 32.026 -10.487 1.00 0.00 H new ATOM 0 HD3 ARG A 85 13.995 32.935 -11.367 1.00 0.00 H new ATOM 0 HE ARG A 85 12.436 33.860 -9.031 1.00 0.00 H new ATOM 0 HH11 ARG A 85 14.432 34.809 -11.806 1.00 0.00 H new ATOM 0 HH12 ARG A 85 14.878 36.369 -11.105 1.00 0.00 H new ATOM 0 HH21 ARG A 85 13.013 35.877 -8.124 1.00 0.00 H new ATOM 0 HH22 ARG A 85 14.072 36.975 -9.016 1.00 0.00 H new ATOM 1218 N ALA A 86 14.261 30.743 -12.706 1.00 0.00 N ATOM 1219 CA ALA A 86 14.970 29.486 -12.536 1.00 0.00 C ATOM 1220 C ALA A 86 13.959 28.341 -12.466 1.00 0.00 C ATOM 1221 O ALA A 86 12.806 28.547 -12.089 1.00 0.00 O ATOM 1222 CB ALA A 86 15.852 29.563 -11.288 1.00 0.00 C ATOM 0 H ALA A 86 13.645 30.993 -11.932 1.00 0.00 H new ATOM 0 HA ALA A 86 15.624 29.296 -13.387 1.00 0.00 H new ATOM 0 HB1 ALA A 86 16.384 28.620 -11.160 1.00 0.00 H new ATOM 0 HB2 ALA A 86 16.572 30.374 -11.401 1.00 0.00 H new ATOM 0 HB3 ALA A 86 15.229 29.750 -10.413 1.00 0.00 H new ATOM 1228 N LEU A 87 14.427 27.157 -12.835 1.00 0.00 N ATOM 1229 CA LEU A 87 13.577 25.978 -12.819 1.00 0.00 C ATOM 1230 C LEU A 87 14.034 25.042 -11.699 1.00 0.00 C ATOM 1231 O LEU A 87 14.982 24.277 -11.872 1.00 0.00 O ATOM 1232 CB LEU A 87 13.550 25.319 -14.199 1.00 0.00 C ATOM 1233 CG LEU A 87 12.184 25.254 -14.884 1.00 0.00 C ATOM 1234 CD1 LEU A 87 12.311 25.513 -16.387 1.00 0.00 C ATOM 1235 CD2 LEU A 87 11.485 23.925 -14.589 1.00 0.00 C ATOM 0 H LEU A 87 15.384 26.989 -13.147 1.00 0.00 H new ATOM 0 HA LEU A 87 12.545 26.254 -12.603 1.00 0.00 H new ATOM 0 HB2 LEU A 87 14.236 25.859 -14.851 1.00 0.00 H new ATOM 0 HB3 LEU A 87 13.935 24.304 -14.103 1.00 0.00 H new ATOM 0 HG LEU A 87 11.558 26.046 -14.472 1.00 0.00 H new ATOM 0 HD11 LEU A 87 11.325 25.461 -16.850 1.00 0.00 H new ATOM 0 HD12 LEU A 87 12.737 26.503 -16.551 1.00 0.00 H new ATOM 0 HD13 LEU A 87 12.961 24.760 -16.832 1.00 0.00 H new ATOM 0 HD21 LEU A 87 10.516 23.905 -15.088 1.00 0.00 H new ATOM 0 HD22 LEU A 87 12.099 23.102 -14.955 1.00 0.00 H new ATOM 0 HD23 LEU A 87 11.342 23.820 -13.514 1.00 0.00 H new ATOM 1247 N ARG A 88 13.338 25.132 -10.575 1.00 0.00 N ATOM 1248 CA ARG A 88 13.660 24.302 -9.426 1.00 0.00 C ATOM 1249 C ARG A 88 12.947 22.953 -9.530 1.00 0.00 C ATOM 1250 O ARG A 88 11.826 22.800 -9.045 1.00 0.00 O ATOM 1251 CB ARG A 88 13.254 24.987 -8.120 1.00 0.00 C ATOM 1252 CG ARG A 88 14.457 25.152 -7.190 1.00 0.00 C ATOM 1253 CD ARG A 88 14.894 26.616 -7.113 1.00 0.00 C ATOM 1254 NE ARG A 88 16.030 26.756 -6.174 1.00 0.00 N ATOM 1255 CZ ARG A 88 15.917 26.680 -4.841 1.00 0.00 C ATOM 1256 NH1 ARG A 88 14.719 26.464 -4.282 1.00 0.00 N ATOM 1257 NH2 ARG A 88 17.003 26.819 -4.068 1.00 0.00 N ATOM 0 H ARG A 88 12.552 25.767 -10.435 1.00 0.00 H new ATOM 0 HA ARG A 88 14.739 24.147 -9.421 1.00 0.00 H new ATOM 0 HB2 ARG A 88 12.821 25.964 -8.337 1.00 0.00 H new ATOM 0 HB3 ARG A 88 12.483 24.400 -7.622 1.00 0.00 H new ATOM 0 HG2 ARG A 88 14.203 24.792 -6.193 1.00 0.00 H new ATOM 0 HG3 ARG A 88 15.285 24.540 -7.548 1.00 0.00 H new ATOM 0 HD2 ARG A 88 15.183 26.970 -8.102 1.00 0.00 H new ATOM 0 HD3 ARG A 88 14.060 27.236 -6.783 1.00 0.00 H new ATOM 0 HE ARG A 88 16.957 26.921 -6.566 1.00 0.00 H new ATOM 0 HH11 ARG A 88 13.893 26.357 -4.871 1.00 0.00 H new ATOM 0 HH12 ARG A 88 14.633 26.406 -3.267 1.00 0.00 H new ATOM 0 HH21 ARG A 88 17.915 26.983 -4.494 1.00 0.00 H new ATOM 0 HH22 ARG A 88 16.917 26.761 -3.053 1.00 0.00 H new ATOM 1271 N VAL A 89 13.625 22.008 -10.165 1.00 0.00 N ATOM 1272 CA VAL A 89 13.070 20.676 -10.338 1.00 0.00 C ATOM 1273 C VAL A 89 13.786 19.704 -9.399 1.00 0.00 C ATOM 1274 O VAL A 89 15.010 19.587 -9.437 1.00 0.00 O ATOM 1275 CB VAL A 89 13.155 20.261 -11.808 1.00 0.00 C ATOM 1276 CG1 VAL A 89 12.094 19.210 -12.144 1.00 0.00 C ATOM 1277 CG2 VAL A 89 13.034 21.476 -12.729 1.00 0.00 C ATOM 0 H VAL A 89 14.554 22.138 -10.566 1.00 0.00 H new ATOM 0 HA VAL A 89 12.013 20.665 -10.072 1.00 0.00 H new ATOM 0 HB VAL A 89 14.135 19.812 -11.973 1.00 0.00 H new ATOM 0 HG11 VAL A 89 12.177 18.933 -13.195 1.00 0.00 H new ATOM 0 HG12 VAL A 89 12.247 18.327 -11.523 1.00 0.00 H new ATOM 0 HG13 VAL A 89 11.102 19.620 -11.954 1.00 0.00 H new ATOM 0 HG21 VAL A 89 13.098 21.153 -13.768 1.00 0.00 H new ATOM 0 HG22 VAL A 89 12.076 21.967 -12.560 1.00 0.00 H new ATOM 0 HG23 VAL A 89 13.842 22.176 -12.517 1.00 0.00 H new ATOM 1287 N ASP A 90 12.993 19.030 -8.579 1.00 0.00 N ATOM 1288 CA ASP A 90 13.536 18.071 -7.632 1.00 0.00 C ATOM 1289 C ASP A 90 12.617 16.850 -7.565 1.00 0.00 C ATOM 1290 O ASP A 90 11.395 16.986 -7.595 1.00 0.00 O ATOM 1291 CB ASP A 90 13.625 18.673 -6.228 1.00 0.00 C ATOM 1292 CG ASP A 90 13.249 20.153 -6.134 1.00 0.00 C ATOM 1293 OD1 ASP A 90 13.646 20.899 -7.055 1.00 0.00 O ATOM 1294 OD2 ASP A 90 12.572 20.505 -5.144 1.00 0.00 O ATOM 0 H ASP A 90 11.978 19.129 -8.551 1.00 0.00 H new ATOM 0 HA ASP A 90 14.534 17.793 -7.969 1.00 0.00 H new ATOM 0 HB2 ASP A 90 12.974 18.105 -5.564 1.00 0.00 H new ATOM 0 HB3 ASP A 90 14.643 18.548 -5.859 1.00 0.00 H new ATOM 1299 N ASN A 91 13.240 15.684 -7.476 1.00 0.00 N ATOM 1300 CA ASN A 91 12.493 14.440 -7.404 1.00 0.00 C ATOM 1301 C ASN A 91 11.252 14.644 -6.533 1.00 0.00 C ATOM 1302 O ASN A 91 11.356 15.108 -5.398 1.00 0.00 O ATOM 1303 CB ASN A 91 13.335 13.328 -6.776 1.00 0.00 C ATOM 1304 CG ASN A 91 13.186 12.020 -7.557 1.00 0.00 C ATOM 1305 OD1 ASN A 91 12.577 11.052 -6.879 1.00 0.00 O flip ATOM 1306 ND2 ASN A 91 13.598 11.899 -8.699 1.00 0.00 N flip ATOM 0 H ASN A 91 14.254 15.575 -7.452 1.00 0.00 H new ATOM 0 HA ASN A 91 12.217 14.154 -8.419 1.00 0.00 H new ATOM 0 HB2 ASN A 91 14.383 13.627 -6.757 1.00 0.00 H new ATOM 0 HB3 ASN A 91 13.028 13.175 -5.741 1.00 0.00 H new ATOM 0 HD21 ASN A 91 14.057 12.684 -9.161 1.00 0.00 H new ATOM 0 HD22 ASN A 91 13.483 11.013 -9.191 1.00 0.00 H new ATOM 1313 N ALA A 92 10.107 14.287 -7.095 1.00 0.00 N ATOM 1314 CA ALA A 92 8.848 14.426 -6.384 1.00 0.00 C ATOM 1315 C ALA A 92 8.807 13.422 -5.230 1.00 0.00 C ATOM 1316 O ALA A 92 7.903 13.465 -4.397 1.00 0.00 O ATOM 1317 CB ALA A 92 7.686 14.239 -7.361 1.00 0.00 C ATOM 0 H ALA A 92 10.025 13.901 -8.036 1.00 0.00 H new ATOM 0 HA ALA A 92 8.756 15.425 -5.957 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.741 14.343 -6.827 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.745 14.994 -8.145 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.742 13.246 -7.808 1.00 0.00 H new ATOM 1323 N ALA A 93 9.797 12.541 -5.218 1.00 0.00 N ATOM 1324 CA ALA A 93 9.885 11.528 -4.180 1.00 0.00 C ATOM 1325 C ALA A 93 10.726 12.064 -3.020 1.00 0.00 C ATOM 1326 O ALA A 93 11.291 11.290 -2.248 1.00 0.00 O ATOM 1327 CB ALA A 93 10.461 10.240 -4.771 1.00 0.00 C ATOM 0 H ALA A 93 10.545 12.508 -5.911 1.00 0.00 H new ATOM 0 HA ALA A 93 8.895 11.293 -3.789 1.00 0.00 H new ATOM 0 HB1 ALA A 93 10.527 9.480 -3.992 1.00 0.00 H new ATOM 0 HB2 ALA A 93 9.811 9.884 -5.571 1.00 0.00 H new ATOM 0 HB3 ALA A 93 11.456 10.436 -5.172 1.00 0.00 H new ATOM 1333 N SER A 94 10.783 13.385 -2.933 1.00 0.00 N ATOM 1334 CA SER A 94 11.546 14.034 -1.881 1.00 0.00 C ATOM 1335 C SER A 94 10.745 14.034 -0.577 1.00 0.00 C ATOM 1336 O SER A 94 9.516 14.099 -0.600 1.00 0.00 O ATOM 1337 CB SER A 94 11.920 15.464 -2.273 1.00 0.00 C ATOM 1338 OG SER A 94 12.966 15.986 -1.457 1.00 0.00 O ATOM 0 H SER A 94 10.313 14.024 -3.574 1.00 0.00 H new ATOM 0 HA SER A 94 12.469 13.473 -1.734 1.00 0.00 H new ATOM 0 HB2 SER A 94 12.231 15.484 -3.317 1.00 0.00 H new ATOM 0 HB3 SER A 94 11.042 16.104 -2.190 1.00 0.00 H new ATOM 0 HG SER A 94 13.286 16.831 -1.836 1.00 0.00 H new ATOM 1344 N GLU A 95 11.472 13.959 0.527 1.00 0.00 N ATOM 1345 CA GLU A 95 10.844 13.949 1.838 1.00 0.00 C ATOM 1346 C GLU A 95 10.146 15.285 2.102 1.00 0.00 C ATOM 1347 O GLU A 95 9.121 15.330 2.779 1.00 0.00 O ATOM 1348 CB GLU A 95 11.866 13.639 2.933 1.00 0.00 C ATOM 1349 CG GLU A 95 11.173 13.376 4.271 1.00 0.00 C ATOM 1350 CD GLU A 95 11.855 12.234 5.028 1.00 0.00 C ATOM 1351 OE1 GLU A 95 13.086 12.097 4.857 1.00 0.00 O ATOM 1352 OE2 GLU A 95 11.131 11.525 5.759 1.00 0.00 O ATOM 0 H GLU A 95 12.490 13.905 0.542 1.00 0.00 H new ATOM 0 HA GLU A 95 10.093 13.159 1.854 1.00 0.00 H new ATOM 0 HB2 GLU A 95 12.457 12.768 2.648 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.559 14.474 3.036 1.00 0.00 H new ATOM 0 HG2 GLU A 95 11.191 14.281 4.878 1.00 0.00 H new ATOM 0 HG3 GLU A 95 10.125 13.129 4.099 1.00 0.00 H new ATOM 1359 N LYS A 96 10.730 16.340 1.553 1.00 0.00 N ATOM 1360 CA LYS A 96 10.177 17.673 1.720 1.00 0.00 C ATOM 1361 C LYS A 96 9.034 17.875 0.724 1.00 0.00 C ATOM 1362 O LYS A 96 8.062 18.569 1.020 1.00 0.00 O ATOM 1363 CB LYS A 96 11.280 18.728 1.613 1.00 0.00 C ATOM 1364 CG LYS A 96 11.694 18.943 0.156 1.00 0.00 C ATOM 1365 CD LYS A 96 12.655 20.127 0.028 1.00 0.00 C ATOM 1366 CE LYS A 96 11.997 21.289 -0.720 1.00 0.00 C ATOM 1367 NZ LYS A 96 13.021 22.250 -1.187 1.00 0.00 N ATOM 0 H LYS A 96 11.581 16.299 0.992 1.00 0.00 H new ATOM 0 HA LYS A 96 9.754 17.788 2.718 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.931 19.669 2.038 1.00 0.00 H new ATOM 0 HB3 LYS A 96 12.145 18.416 2.198 1.00 0.00 H new ATOM 0 HG2 LYS A 96 12.170 18.041 -0.227 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.809 19.121 -0.455 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.965 20.457 1.019 1.00 0.00 H new ATOM 0 HD3 LYS A 96 13.556 19.814 -0.500 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.432 20.908 -1.571 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.286 21.795 -0.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.558 23.032 -1.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 13.542 22.626 -0.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.683 21.768 -1.828 1.00 0.00 H new ATOM 1381 N ASN A 97 9.188 17.257 -0.438 1.00 0.00 N ATOM 1382 CA ASN A 97 8.181 17.361 -1.480 1.00 0.00 C ATOM 1383 C ASN A 97 6.948 16.550 -1.074 1.00 0.00 C ATOM 1384 O ASN A 97 5.857 16.767 -1.600 1.00 0.00 O ATOM 1385 CB ASN A 97 8.700 16.800 -2.806 1.00 0.00 C ATOM 1386 CG ASN A 97 9.762 17.719 -3.412 1.00 0.00 C ATOM 1387 OD1 ASN A 97 10.011 18.817 -2.941 1.00 0.00 O ATOM 1388 ND2 ASN A 97 10.372 17.211 -4.479 1.00 0.00 N ATOM 0 H ASN A 97 9.995 16.682 -0.681 1.00 0.00 H new ATOM 0 HA ASN A 97 7.934 18.415 -1.606 1.00 0.00 H new ATOM 0 HB2 ASN A 97 9.122 15.808 -2.645 1.00 0.00 H new ATOM 0 HB3 ASN A 97 7.872 16.685 -3.505 1.00 0.00 H new ATOM 0 HD21 ASN A 97 11.097 17.747 -4.955 1.00 0.00 H new ATOM 0 HD22 ASN A 97 10.115 16.285 -4.821 1.00 0.00 H new ATOM 1395 N LYS A 98 7.163 15.633 -0.142 1.00 0.00 N ATOM 1396 CA LYS A 98 6.083 14.790 0.340 1.00 0.00 C ATOM 1397 C LYS A 98 5.037 15.658 1.043 1.00 0.00 C ATOM 1398 O LYS A 98 3.837 15.440 0.886 1.00 0.00 O ATOM 1399 CB LYS A 98 6.634 13.662 1.215 1.00 0.00 C ATOM 1400 CG LYS A 98 6.633 14.064 2.692 1.00 0.00 C ATOM 1401 CD LYS A 98 5.249 13.867 3.313 1.00 0.00 C ATOM 1402 CE LYS A 98 4.937 14.976 4.319 1.00 0.00 C ATOM 1403 NZ LYS A 98 5.282 14.543 5.692 1.00 0.00 N ATOM 0 H LYS A 98 8.069 15.456 0.292 1.00 0.00 H new ATOM 0 HA LYS A 98 5.582 14.300 -0.495 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.032 12.764 1.078 1.00 0.00 H new ATOM 0 HB3 LYS A 98 7.649 13.416 0.902 1.00 0.00 H new ATOM 0 HG2 LYS A 98 7.367 13.469 3.235 1.00 0.00 H new ATOM 0 HG3 LYS A 98 6.934 15.107 2.789 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.492 13.859 2.529 1.00 0.00 H new ATOM 0 HD3 LYS A 98 5.204 12.898 3.809 1.00 0.00 H new ATOM 0 HE2 LYS A 98 5.498 15.875 4.063 1.00 0.00 H new ATOM 0 HE3 LYS A 98 3.879 15.234 4.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.064 15.308 6.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 4.728 13.698 5.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 6.296 14.319 5.741 1.00 0.00 H new ATOM 1417 N GLU A 99 5.532 16.625 1.802 1.00 0.00 N ATOM 1418 CA GLU A 99 4.655 17.528 2.529 1.00 0.00 C ATOM 1419 C GLU A 99 3.776 18.314 1.554 1.00 0.00 C ATOM 1420 O GLU A 99 2.578 18.474 1.783 1.00 0.00 O ATOM 1421 CB GLU A 99 5.461 18.472 3.424 1.00 0.00 C ATOM 1422 CG GLU A 99 4.978 18.397 4.874 1.00 0.00 C ATOM 1423 CD GLU A 99 4.866 19.794 5.487 1.00 0.00 C ATOM 1424 OE1 GLU A 99 5.930 20.346 5.840 1.00 0.00 O ATOM 1425 OE2 GLU A 99 3.718 20.278 5.589 1.00 0.00 O ATOM 0 H GLU A 99 6.528 16.803 1.929 1.00 0.00 H new ATOM 0 HA GLU A 99 4.007 16.934 3.173 1.00 0.00 H new ATOM 0 HB2 GLU A 99 6.518 18.211 3.375 1.00 0.00 H new ATOM 0 HB3 GLU A 99 5.367 19.494 3.058 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.009 17.900 4.913 1.00 0.00 H new ATOM 0 HG3 GLU A 99 5.670 17.793 5.461 1.00 0.00 H new ATOM 1432 N GLU A 100 4.405 18.784 0.487 1.00 0.00 N ATOM 1433 CA GLU A 100 3.695 19.550 -0.524 1.00 0.00 C ATOM 1434 C GLU A 100 2.771 18.635 -1.330 1.00 0.00 C ATOM 1435 O GLU A 100 1.679 19.042 -1.724 1.00 0.00 O ATOM 1436 CB GLU A 100 4.673 20.287 -1.441 1.00 0.00 C ATOM 1437 CG GLU A 100 5.257 21.517 -0.743 1.00 0.00 C ATOM 1438 CD GLU A 100 4.396 22.755 -1.001 1.00 0.00 C ATOM 1439 OE1 GLU A 100 3.185 22.676 -0.701 1.00 0.00 O ATOM 1440 OE2 GLU A 100 4.967 23.752 -1.492 1.00 0.00 O ATOM 0 H GLU A 100 5.399 18.649 0.300 1.00 0.00 H new ATOM 0 HA GLU A 100 3.084 20.300 -0.022 1.00 0.00 H new ATOM 0 HB2 GLU A 100 5.479 19.614 -1.735 1.00 0.00 H new ATOM 0 HB3 GLU A 100 4.162 20.591 -2.355 1.00 0.00 H new ATOM 0 HG2 GLU A 100 5.324 21.333 0.329 1.00 0.00 H new ATOM 0 HG3 GLU A 100 6.272 21.695 -1.100 1.00 0.00 H new ATOM 1447 N LEU A 101 3.243 17.417 -1.552 1.00 0.00 N ATOM 1448 CA LEU A 101 2.472 16.442 -2.304 1.00 0.00 C ATOM 1449 C LEU A 101 1.164 16.151 -1.565 1.00 0.00 C ATOM 1450 O LEU A 101 0.125 15.948 -2.191 1.00 0.00 O ATOM 1451 CB LEU A 101 3.312 15.193 -2.581 1.00 0.00 C ATOM 1452 CG LEU A 101 4.149 15.218 -3.862 1.00 0.00 C ATOM 1453 CD1 LEU A 101 5.562 14.692 -3.603 1.00 0.00 C ATOM 1454 CD2 LEU A 101 3.450 14.455 -4.988 1.00 0.00 C ATOM 0 H LEU A 101 4.149 17.083 -1.224 1.00 0.00 H new ATOM 0 HA LEU A 101 2.204 16.842 -3.282 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.982 15.035 -1.736 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.644 14.332 -2.624 1.00 0.00 H new ATOM 0 HG LEU A 101 4.246 16.254 -4.188 1.00 0.00 H new ATOM 0 HD11 LEU A 101 6.136 14.720 -4.529 1.00 0.00 H new ATOM 0 HD12 LEU A 101 6.051 15.315 -2.854 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.507 13.665 -3.241 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.066 14.488 -5.887 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.302 13.418 -4.687 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.483 14.915 -5.193 1.00 0.00 H new ATOM 1466 N LYS A 102 1.258 16.141 -0.244 1.00 0.00 N ATOM 1467 CA LYS A 102 0.096 15.879 0.587 1.00 0.00 C ATOM 1468 C LYS A 102 -1.094 16.684 0.061 1.00 0.00 C ATOM 1469 O LYS A 102 -2.242 16.264 0.198 1.00 0.00 O ATOM 1470 CB LYS A 102 0.417 16.148 2.059 1.00 0.00 C ATOM 1471 CG LYS A 102 -0.549 15.397 2.977 1.00 0.00 C ATOM 1472 CD LYS A 102 0.128 14.176 3.605 1.00 0.00 C ATOM 1473 CE LYS A 102 -0.786 12.952 3.547 1.00 0.00 C ATOM 1474 NZ LYS A 102 -0.028 11.758 3.109 1.00 0.00 N ATOM 0 H LYS A 102 2.122 16.310 0.272 1.00 0.00 H new ATOM 0 HA LYS A 102 -0.181 14.826 0.532 1.00 0.00 H new ATOM 0 HB2 LYS A 102 1.441 15.841 2.274 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.356 17.218 2.258 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.903 16.065 3.762 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.424 15.080 2.409 1.00 0.00 H new ATOM 0 HD2 LYS A 102 1.060 13.963 3.082 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.387 14.392 4.642 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -1.224 12.772 4.528 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -1.611 13.139 2.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -0.664 10.936 3.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 0.370 11.927 2.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 0.744 11.571 3.781 1.00 0.00 H new ATOM 1488 N SER A 103 -0.779 17.827 -0.531 1.00 0.00 N ATOM 1489 CA SER A 103 -1.808 18.695 -1.079 1.00 0.00 C ATOM 1490 C SER A 103 -2.154 18.260 -2.504 1.00 0.00 C ATOM 1491 O SER A 103 -3.316 18.303 -2.905 1.00 0.00 O ATOM 1492 CB SER A 103 -1.360 20.158 -1.064 1.00 0.00 C ATOM 1493 OG SER A 103 -1.879 20.864 0.060 1.00 0.00 O ATOM 0 H SER A 103 0.174 18.172 -0.643 1.00 0.00 H new ATOM 0 HA SER A 103 -2.697 18.609 -0.454 1.00 0.00 H new ATOM 0 HB2 SER A 103 -0.271 20.204 -1.049 1.00 0.00 H new ATOM 0 HB3 SER A 103 -1.687 20.647 -1.982 1.00 0.00 H new ATOM 0 HG SER A 103 -1.569 21.793 0.034 1.00 0.00 H new ATOM 1499 N LEU A 104 -1.124 17.852 -3.231 1.00 0.00 N ATOM 1500 CA LEU A 104 -1.305 17.410 -4.603 1.00 0.00 C ATOM 1501 C LEU A 104 -1.837 15.975 -4.607 1.00 0.00 C ATOM 1502 O LEU A 104 -2.055 15.393 -5.668 1.00 0.00 O ATOM 1503 CB LEU A 104 -0.010 17.588 -5.398 1.00 0.00 C ATOM 1504 CG LEU A 104 0.210 18.967 -6.022 1.00 0.00 C ATOM 1505 CD1 LEU A 104 -1.077 19.491 -6.662 1.00 0.00 C ATOM 1506 CD2 LEU A 104 0.781 19.948 -4.996 1.00 0.00 C ATOM 0 H LEU A 104 -0.161 17.818 -2.895 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.049 18.027 -5.107 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.830 17.371 -4.739 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.009 16.844 -6.194 1.00 0.00 H new ATOM 0 HG LEU A 104 0.948 18.868 -6.818 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.893 20.473 -7.098 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.402 18.803 -7.442 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -1.854 19.572 -5.902 1.00 0.00 H new ATOM 0 HD21 LEU A 104 0.928 20.921 -5.465 1.00 0.00 H new ATOM 0 HD22 LEU A 104 0.086 20.049 -4.163 1.00 0.00 H new ATOM 0 HD23 LEU A 104 1.737 19.575 -4.628 1.00 0.00 H new ATOM 1518 N GLY A 105 -2.031 15.447 -3.407 1.00 0.00 N ATOM 1519 CA GLY A 105 -2.533 14.092 -3.259 1.00 0.00 C ATOM 1520 C GLY A 105 -4.004 14.095 -2.839 1.00 0.00 C ATOM 1521 O GLY A 105 -4.475 15.047 -2.218 1.00 0.00 O ATOM 0 H GLY A 105 -1.850 15.933 -2.529 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -2.421 13.554 -4.200 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.940 13.560 -2.515 1.00 0.00 H new ATOM 1525 N THR A 106 -4.690 13.019 -3.196 1.00 0.00 N ATOM 1526 CA THR A 106 -6.099 12.886 -2.864 1.00 0.00 C ATOM 1527 C THR A 106 -6.780 14.256 -2.871 1.00 0.00 C ATOM 1528 O THR A 106 -6.836 14.930 -1.844 1.00 0.00 O ATOM 1529 CB THR A 106 -6.202 12.162 -1.520 1.00 0.00 C ATOM 1530 OG1 THR A 106 -7.604 12.055 -1.290 1.00 0.00 O ATOM 1531 CG2 THR A 106 -5.698 13.017 -0.355 1.00 0.00 C ATOM 0 H THR A 106 -4.297 12.232 -3.712 1.00 0.00 H new ATOM 0 HA THR A 106 -6.627 12.292 -3.610 1.00 0.00 H new ATOM 0 HB THR A 106 -5.632 11.234 -1.563 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.762 11.596 -0.439 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.793 12.457 0.575 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.651 13.274 -0.519 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.290 13.930 -0.291 1.00 0.00 H new ATOM 1539 N GLY A 107 -7.282 14.626 -4.040 1.00 0.00 N ATOM 1540 CA GLY A 107 -7.957 15.903 -4.194 1.00 0.00 C ATOM 1541 C GLY A 107 -7.922 16.370 -5.650 1.00 0.00 C ATOM 1542 O GLY A 107 -6.850 16.511 -6.235 1.00 0.00 O ATOM 0 H GLY A 107 -7.235 14.063 -4.890 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.991 15.814 -3.862 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.481 16.649 -3.558 1.00 0.00 H new ATOM 1546 N ALA A 108 -9.109 16.597 -6.194 1.00 0.00 N ATOM 1547 CA ALA A 108 -9.228 17.044 -7.571 1.00 0.00 C ATOM 1548 C ALA A 108 -10.677 17.454 -7.846 1.00 0.00 C ATOM 1549 O ALA A 108 -11.453 16.673 -8.396 1.00 0.00 O ATOM 1550 CB ALA A 108 -8.747 15.937 -8.511 1.00 0.00 C ATOM 0 H ALA A 108 -9.997 16.480 -5.706 1.00 0.00 H new ATOM 0 HA ALA A 108 -8.599 17.917 -7.747 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -8.836 16.273 -9.544 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -7.705 15.703 -8.294 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -9.357 15.045 -8.365 1.00 0.00 H new ATOM 1556 N PRO A 109 -11.006 18.710 -7.441 1.00 0.00 N ATOM 1557 CA PRO A 109 -12.347 19.232 -7.638 1.00 0.00 C ATOM 1558 C PRO A 109 -12.580 19.606 -9.103 1.00 0.00 C ATOM 1559 O PRO A 109 -11.628 19.764 -9.866 1.00 0.00 O ATOM 1560 CB PRO A 109 -12.448 20.422 -6.698 1.00 0.00 C ATOM 1561 CG PRO A 109 -11.017 20.804 -6.355 1.00 0.00 C ATOM 1562 CD PRO A 109 -10.113 19.662 -6.787 1.00 0.00 C ATOM 0 HA PRO A 109 -13.121 18.498 -7.414 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -12.971 21.252 -7.173 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -13.009 20.164 -5.800 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -10.736 21.726 -6.863 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -10.917 20.986 -5.285 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -9.336 20.008 -7.468 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -9.610 19.210 -5.932 1.00 0.00 H new ATOM 1570 N VAL A 110 -13.852 19.738 -9.452 1.00 0.00 N ATOM 1571 CA VAL A 110 -14.222 20.091 -10.812 1.00 0.00 C ATOM 1572 C VAL A 110 -15.340 21.134 -10.778 1.00 0.00 C ATOM 1573 O VAL A 110 -16.164 21.136 -9.864 1.00 0.00 O ATOM 1574 CB VAL A 110 -14.602 18.832 -11.594 1.00 0.00 C ATOM 1575 CG1 VAL A 110 -15.924 18.251 -11.089 1.00 0.00 C ATOM 1576 CG2 VAL A 110 -14.666 19.118 -13.096 1.00 0.00 C ATOM 0 H VAL A 110 -14.639 19.607 -8.816 1.00 0.00 H new ATOM 0 HA VAL A 110 -13.376 20.539 -11.334 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.824 18.087 -11.428 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -16.171 17.357 -11.662 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -15.828 17.992 -10.035 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -16.716 18.990 -11.210 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -14.938 18.207 -13.629 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -15.414 19.888 -13.288 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -13.692 19.464 -13.442 1.00 0.00 H new ATOM 1586 N ILE A 111 -15.334 21.995 -11.784 1.00 0.00 N ATOM 1587 CA ILE A 111 -16.338 23.041 -11.881 1.00 0.00 C ATOM 1588 C ILE A 111 -17.730 22.421 -11.735 1.00 0.00 C ATOM 1589 O ILE A 111 -18.471 22.761 -10.815 1.00 0.00 O ATOM 1590 CB ILE A 111 -16.154 23.843 -13.170 1.00 0.00 C ATOM 1591 CG1 ILE A 111 -16.963 25.142 -13.128 1.00 0.00 C ATOM 1592 CG2 ILE A 111 -16.496 22.995 -14.397 1.00 0.00 C ATOM 1593 CD1 ILE A 111 -18.463 24.856 -13.212 1.00 0.00 C ATOM 0 H ILE A 111 -14.649 21.990 -12.540 1.00 0.00 H new ATOM 0 HA ILE A 111 -16.221 23.758 -11.068 1.00 0.00 H new ATOM 0 HB ILE A 111 -15.103 24.120 -13.253 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -16.743 25.682 -12.207 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -16.665 25.787 -13.955 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -16.357 23.589 -15.300 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -15.842 22.124 -14.431 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -17.534 22.667 -14.335 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -19.015 25.795 -13.180 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -18.683 24.337 -14.145 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -18.762 24.231 -12.371 1.00 0.00 H new TER 1605 ILE A 111