USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 586 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 25 ASN : amide:sc= 0.557 K(o=1.7,f=-13!) USER MOD Set 1.2: A 29 LYS NZ :NH3+ 162:sc= 1.17 (180deg=0) USER MOD Single : A 1 MET CE :methyl 176:sc=-0.000451 (180deg=-0.018) USER MOD Single : A 1 MET N :NH3+ -166:sc= 0.502 (180deg=0.441) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot -120:sc= -1.05 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -169:sc= 1.11 (180deg=0.982) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -25:sc= 0.47 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -0.447 K(o=-0.45,f=-1.2) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0.104 X(o=0.1,f=-0.16) USER MOD Single : A 41 GLN : amide:sc= -1.03 X(o=-1,f=-1.1) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 55 THR OG1 : rot -64:sc= 0.333 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0.365 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 K(o=0,f=-1.9) USER MOD Single : A 63 LYS NZ :NH3+ 144:sc= 1.12 (180deg=-0.759!) USER MOD Single : A 65 SER OG : rot -140:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.072 X(o=-0.072,f=-0.51) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.920 31.498 16.484 1.00 0.00 N ATOM 2 CA MET A 1 13.050 31.216 17.919 1.00 0.00 C ATOM 3 C MET A 1 14.403 31.894 18.189 1.00 0.00 C ATOM 4 O MET A 1 15.314 31.703 17.381 1.00 0.00 O ATOM 5 CB MET A 1 13.011 29.741 18.296 1.00 0.00 C ATOM 6 CG MET A 1 13.251 29.202 19.707 1.00 0.00 C ATOM 7 SD MET A 1 13.001 27.421 19.877 1.00 0.00 S ATOM 8 CE MET A 1 14.683 26.819 19.612 1.00 0.00 C ATOM 0 H1 MET A 1 11.943 31.312 16.181 1.00 0.00 H new ATOM 0 H2 MET A 1 13.155 32.495 16.303 1.00 0.00 H new ATOM 0 H3 MET A 1 13.570 30.887 15.950 1.00 0.00 H new ATOM 0 HA MET A 1 12.218 31.580 18.521 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.027 29.379 17.998 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.741 29.246 17.655 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.271 29.444 20.007 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.585 29.718 20.398 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.710 25.739 19.756 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.999 27.058 18.597 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.357 27.296 20.324 1.00 0.00 H new ATOM 20 N GLN A 2 14.690 32.550 19.307 1.00 0.00 N ATOM 21 CA GLN A 2 16.020 32.920 19.720 1.00 0.00 C ATOM 22 C GLN A 2 16.501 31.856 20.698 1.00 0.00 C ATOM 23 O GLN A 2 15.739 31.488 21.583 1.00 0.00 O ATOM 24 CB GLN A 2 15.894 34.342 20.262 1.00 0.00 C ATOM 25 CG GLN A 2 15.864 35.517 19.267 1.00 0.00 C ATOM 26 CD GLN A 2 15.529 36.865 19.877 1.00 0.00 C ATOM 27 OE1 GLN A 2 14.511 36.980 20.551 1.00 0.00 O ATOM 28 NE2 GLN A 2 16.451 37.817 19.765 1.00 0.00 N ATOM 0 H GLN A 2 13.971 32.845 19.968 1.00 0.00 H new ATOM 0 HA GLN A 2 16.779 32.947 18.938 1.00 0.00 H new ATOM 0 HB2 GLN A 2 14.981 34.389 20.855 1.00 0.00 H new ATOM 0 HB3 GLN A 2 16.727 34.510 20.945 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.837 35.587 18.781 1.00 0.00 H new ATOM 0 HG3 GLN A 2 15.134 35.296 18.489 1.00 0.00 H new ATOM 0 HE21 GLN A 2 17.278 37.661 19.188 1.00 0.00 H new ATOM 0 HE22 GLN A 2 16.331 38.703 20.256 1.00 0.00 H new ATOM 37 N ILE A 3 17.757 31.436 20.565 1.00 0.00 N ATOM 38 CA ILE A 3 18.610 30.742 21.512 1.00 0.00 C ATOM 39 C ILE A 3 19.699 31.678 22.049 1.00 0.00 C ATOM 40 O ILE A 3 19.889 32.789 21.560 1.00 0.00 O ATOM 41 CB ILE A 3 19.113 29.399 21.002 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.166 29.602 19.905 1.00 0.00 C ATOM 43 CG2 ILE A 3 17.941 28.473 20.686 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.027 28.344 19.747 1.00 0.00 C ATOM 0 H ILE A 3 18.253 31.595 19.688 1.00 0.00 H new ATOM 0 HA ILE A 3 17.999 30.464 22.371 1.00 0.00 H new ATOM 0 HB ILE A 3 19.657 28.860 21.778 1.00 0.00 H new ATOM 0 HG12 ILE A 3 19.675 29.835 18.960 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.799 30.454 20.154 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.320 27.518 20.323 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.352 28.310 21.589 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.313 28.929 19.921 1.00 0.00 H new ATOM 0 HD11 ILE A 3 21.768 28.506 18.965 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.534 28.129 20.688 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.392 27.500 19.476 1.00 0.00 H new ATOM 56 N PHE A 4 20.461 31.300 23.064 1.00 0.00 N ATOM 57 CA PHE A 4 21.807 31.774 23.283 1.00 0.00 C ATOM 58 C PHE A 4 22.731 30.547 23.177 1.00 0.00 C ATOM 59 O PHE A 4 22.318 29.411 23.365 1.00 0.00 O ATOM 60 CB PHE A 4 21.898 32.402 24.670 1.00 0.00 C ATOM 61 CG PHE A 4 20.791 33.372 25.013 1.00 0.00 C ATOM 62 CD1 PHE A 4 20.696 34.619 24.373 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.673 32.962 25.748 1.00 0.00 C ATOM 64 CE1 PHE A 4 19.573 35.446 24.477 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.571 33.813 25.944 1.00 0.00 C ATOM 66 CZ PHE A 4 18.530 35.058 25.324 1.00 0.00 C ATOM 0 H PHE A 4 20.146 30.638 23.773 1.00 0.00 H new ATOM 0 HA PHE A 4 22.096 32.530 22.553 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.903 31.604 25.413 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.853 32.921 24.754 1.00 0.00 H new ATOM 0 HD1 PHE A 4 21.529 34.955 23.773 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.656 31.970 26.174 1.00 0.00 H new ATOM 0 HE1 PHE A 4 19.512 36.366 23.914 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.754 33.500 26.577 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.696 35.722 25.496 1.00 0.00 H new ATOM 76 N VAL A 5 24.000 30.797 22.872 1.00 0.00 N ATOM 77 CA VAL A 5 25.226 30.054 23.093 1.00 0.00 C ATOM 78 C VAL A 5 26.022 30.983 24.012 1.00 0.00 C ATOM 79 O VAL A 5 26.007 32.199 23.860 1.00 0.00 O ATOM 80 CB VAL A 5 25.935 29.598 21.820 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.201 28.800 22.157 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.019 28.986 20.759 1.00 0.00 C ATOM 0 H VAL A 5 24.218 31.667 22.386 1.00 0.00 H new ATOM 0 HA VAL A 5 25.060 29.079 23.551 1.00 0.00 H new ATOM 0 HB VAL A 5 26.278 30.494 21.302 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.689 28.486 21.235 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.883 29.425 22.733 1.00 0.00 H new ATOM 0 HG13 VAL A 5 26.932 27.921 22.743 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.611 28.692 19.892 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.520 28.109 21.171 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.272 29.720 20.456 1.00 0.00 H new ATOM 92 N LYS A 6 26.602 30.435 25.078 1.00 0.00 N ATOM 93 CA LYS A 6 27.382 31.183 26.037 1.00 0.00 C ATOM 94 C LYS A 6 28.755 30.511 26.040 1.00 0.00 C ATOM 95 O LYS A 6 28.853 29.302 26.241 1.00 0.00 O ATOM 96 CB LYS A 6 26.580 31.045 27.327 1.00 0.00 C ATOM 97 CG LYS A 6 27.072 31.805 28.559 1.00 0.00 C ATOM 98 CD LYS A 6 26.458 31.371 29.890 1.00 0.00 C ATOM 99 CE LYS A 6 26.631 32.437 30.971 1.00 0.00 C ATOM 100 NZ LYS A 6 26.045 31.932 32.229 1.00 0.00 N ATOM 0 H LYS A 6 26.536 29.441 25.295 1.00 0.00 H new ATOM 0 HA LYS A 6 27.552 32.244 25.851 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.559 31.366 27.122 1.00 0.00 H new ATOM 0 HB3 LYS A 6 26.537 29.986 27.582 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.154 31.693 28.625 1.00 0.00 H new ATOM 0 HG3 LYS A 6 26.869 32.866 28.414 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.397 31.164 29.750 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.923 30.442 30.219 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.687 32.666 31.111 1.00 0.00 H new ATOM 0 HE3 LYS A 6 26.141 33.363 30.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 26.155 32.648 32.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.034 31.734 32.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 26.532 31.058 32.513 1.00 0.00 H new ATOM 114 N THR A 7 29.829 31.241 25.764 1.00 0.00 N ATOM 115 CA THR A 7 31.131 30.764 26.169 1.00 0.00 C ATOM 116 C THR A 7 31.298 31.192 27.635 1.00 0.00 C ATOM 117 O THR A 7 31.227 32.397 27.864 1.00 0.00 O ATOM 118 CB THR A 7 32.249 31.292 25.271 1.00 0.00 C ATOM 119 OG1 THR A 7 32.237 30.960 23.900 1.00 0.00 O ATOM 120 CG2 THR A 7 33.652 30.754 25.531 1.00 0.00 C ATOM 0 H THR A 7 29.821 32.137 25.277 1.00 0.00 H new ATOM 0 HA THR A 7 31.200 29.681 26.071 1.00 0.00 H new ATOM 0 HB THR A 7 32.048 32.336 25.510 1.00 0.00 H new ATOM 0 HG1 THR A 7 33.057 30.472 23.674 1.00 0.00 H new ATOM 0 HG21 THR A 7 34.351 31.207 24.828 1.00 0.00 H new ATOM 0 HG22 THR A 7 33.952 30.999 26.550 1.00 0.00 H new ATOM 0 HG23 THR A 7 33.657 29.672 25.401 1.00 0.00 H new ATOM 128 N LEU A 8 31.578 30.260 28.532 1.00 0.00 N ATOM 129 CA LEU A 8 31.411 30.443 29.966 1.00 0.00 C ATOM 130 C LEU A 8 32.235 31.501 30.691 1.00 0.00 C ATOM 131 O LEU A 8 31.920 31.915 31.799 1.00 0.00 O ATOM 132 CB LEU A 8 31.418 29.112 30.731 1.00 0.00 C ATOM 133 CG LEU A 8 32.739 28.422 31.044 1.00 0.00 C ATOM 134 CD1 LEU A 8 33.700 28.283 29.868 1.00 0.00 C ATOM 135 CD2 LEU A 8 33.428 28.978 32.293 1.00 0.00 C ATOM 0 H LEU A 8 31.934 29.338 28.280 1.00 0.00 H new ATOM 0 HA LEU A 8 30.418 30.892 29.983 1.00 0.00 H new ATOM 0 HB2 LEU A 8 30.907 29.280 31.679 1.00 0.00 H new ATOM 0 HB3 LEU A 8 30.811 28.408 30.162 1.00 0.00 H new ATOM 0 HG LEU A 8 32.439 27.399 31.271 1.00 0.00 H new ATOM 0 HD11 LEU A 8 34.608 27.779 30.198 1.00 0.00 H new ATOM 0 HD12 LEU A 8 33.227 27.699 29.079 1.00 0.00 H new ATOM 0 HD13 LEU A 8 33.952 29.272 29.486 1.00 0.00 H new ATOM 0 HD21 LEU A 8 34.363 28.444 32.461 1.00 0.00 H new ATOM 0 HD22 LEU A 8 33.636 30.039 32.152 1.00 0.00 H new ATOM 0 HD23 LEU A 8 32.776 28.848 33.157 1.00 0.00 H new ATOM 147 N THR A 9 33.192 32.054 29.935 1.00 0.00 N ATOM 148 CA THR A 9 34.143 33.074 30.328 1.00 0.00 C ATOM 149 C THR A 9 33.572 34.483 30.191 1.00 0.00 C ATOM 150 O THR A 9 34.198 35.426 30.661 1.00 0.00 O ATOM 151 CB THR A 9 35.412 33.012 29.484 1.00 0.00 C ATOM 152 OG1 THR A 9 35.156 33.039 28.095 1.00 0.00 O ATOM 153 CG2 THR A 9 36.265 31.786 29.830 1.00 0.00 C ATOM 0 H THR A 9 33.322 31.772 28.963 1.00 0.00 H new ATOM 0 HA THR A 9 34.370 32.870 31.374 1.00 0.00 H new ATOM 0 HB THR A 9 35.969 33.915 29.733 1.00 0.00 H new ATOM 0 HG1 THR A 9 36.004 32.999 27.605 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.160 31.778 29.207 1.00 0.00 H new ATOM 0 HG22 THR A 9 36.554 31.828 30.880 1.00 0.00 H new ATOM 0 HG23 THR A 9 35.689 30.879 29.649 1.00 0.00 H new ATOM 161 N GLY A 10 32.347 34.567 29.673 1.00 0.00 N ATOM 162 CA GLY A 10 31.464 35.680 29.962 1.00 0.00 C ATOM 163 C GLY A 10 30.932 36.417 28.736 1.00 0.00 C ATOM 164 O GLY A 10 30.711 37.632 28.716 1.00 0.00 O ATOM 0 H GLY A 10 31.948 33.868 29.047 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.617 35.312 30.541 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.996 36.392 30.593 1.00 0.00 H new ATOM 168 N LYS A 11 30.752 35.616 27.690 1.00 0.00 N ATOM 169 CA LYS A 11 30.419 36.007 26.342 1.00 0.00 C ATOM 170 C LYS A 11 29.209 35.216 25.854 1.00 0.00 C ATOM 171 O LYS A 11 29.244 33.985 25.824 1.00 0.00 O ATOM 172 CB LYS A 11 31.591 35.699 25.405 1.00 0.00 C ATOM 173 CG LYS A 11 32.888 36.378 25.826 1.00 0.00 C ATOM 174 CD LYS A 11 33.824 36.638 24.643 1.00 0.00 C ATOM 175 CE LYS A 11 33.432 37.726 23.645 1.00 0.00 C ATOM 176 NZ LYS A 11 34.311 37.716 22.477 1.00 0.00 N ATOM 0 H LYS A 11 30.844 34.604 27.779 1.00 0.00 H new ATOM 0 HA LYS A 11 30.200 37.075 26.339 1.00 0.00 H new ATOM 0 HB2 LYS A 11 31.747 34.621 25.371 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.333 36.016 24.394 1.00 0.00 H new ATOM 0 HG2 LYS A 11 32.657 37.323 26.317 1.00 0.00 H new ATOM 0 HG3 LYS A 11 33.399 35.755 26.560 1.00 0.00 H new ATOM 0 HD2 LYS A 11 34.806 36.890 25.043 1.00 0.00 H new ATOM 0 HD3 LYS A 11 33.934 35.704 24.093 1.00 0.00 H new ATOM 0 HE2 LYS A 11 32.400 37.577 23.328 1.00 0.00 H new ATOM 0 HE3 LYS A 11 33.479 38.701 24.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 34.145 38.572 21.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 35.303 37.695 22.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 34.112 36.874 21.900 1.00 0.00 H new ATOM 190 N THR A 12 28.147 35.904 25.439 1.00 0.00 N ATOM 191 CA THR A 12 26.916 35.307 24.973 1.00 0.00 C ATOM 192 C THR A 12 26.766 35.617 23.479 1.00 0.00 C ATOM 193 O THR A 12 26.873 36.776 23.093 1.00 0.00 O ATOM 194 CB THR A 12 25.791 35.885 25.834 1.00 0.00 C ATOM 195 OG1 THR A 12 26.015 35.473 27.161 1.00 0.00 O ATOM 196 CG2 THR A 12 24.402 35.300 25.570 1.00 0.00 C ATOM 0 H THR A 12 28.128 36.924 25.421 1.00 0.00 H new ATOM 0 HA THR A 12 26.896 34.222 25.071 1.00 0.00 H new ATOM 0 HB THR A 12 25.805 36.954 25.623 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.309 35.831 27.738 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.676 35.775 26.230 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.122 35.481 24.532 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.417 34.227 25.760 1.00 0.00 H new ATOM 204 N ILE A 13 26.539 34.624 22.632 1.00 0.00 N ATOM 205 CA ILE A 13 26.061 34.725 21.269 1.00 0.00 C ATOM 206 C ILE A 13 24.561 34.444 21.323 1.00 0.00 C ATOM 207 O ILE A 13 24.180 33.485 21.982 1.00 0.00 O ATOM 208 CB ILE A 13 26.798 33.708 20.395 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.330 33.623 20.390 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.319 33.674 18.944 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.687 32.411 21.251 1.00 0.00 C ATOM 0 H ILE A 13 26.698 33.654 22.905 1.00 0.00 H new ATOM 0 HA ILE A 13 26.244 35.708 20.835 1.00 0.00 H new ATOM 0 HB ILE A 13 26.494 32.830 20.965 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.711 33.507 19.375 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.773 34.533 20.795 1.00 0.00 H new ATOM 0 HG21 ILE A 13 26.890 32.929 18.390 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.261 33.415 18.916 1.00 0.00 H new ATOM 0 HG23 ILE A 13 26.465 34.654 18.490 1.00 0.00 H new ATOM 0 HD11 ILE A 13 29.770 32.297 21.287 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.304 32.557 22.261 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.241 31.514 20.820 1.00 0.00 H new ATOM 223 N THR A 14 23.770 35.273 20.654 1.00 0.00 N ATOM 224 CA THR A 14 22.325 35.216 20.550 1.00 0.00 C ATOM 225 C THR A 14 22.079 34.800 19.096 1.00 0.00 C ATOM 226 O THR A 14 22.673 35.383 18.193 1.00 0.00 O ATOM 227 CB THR A 14 21.532 36.453 20.966 1.00 0.00 C ATOM 228 OG1 THR A 14 20.131 36.284 20.855 1.00 0.00 O ATOM 229 CG2 THR A 14 21.901 37.726 20.185 1.00 0.00 C ATOM 0 H THR A 14 24.155 36.060 20.132 1.00 0.00 H new ATOM 0 HA THR A 14 21.939 34.512 21.287 1.00 0.00 H new ATOM 0 HB THR A 14 21.813 36.577 22.012 1.00 0.00 H new ATOM 0 HG1 THR A 14 19.679 37.107 21.136 1.00 0.00 H new ATOM 0 HG21 THR A 14 21.294 38.559 20.539 1.00 0.00 H new ATOM 0 HG22 THR A 14 22.956 37.954 20.339 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.715 37.568 19.123 1.00 0.00 H new ATOM 237 N LEU A 15 21.327 33.730 18.850 1.00 0.00 N ATOM 238 CA LEU A 15 21.060 33.223 17.510 1.00 0.00 C ATOM 239 C LEU A 15 19.570 32.897 17.311 1.00 0.00 C ATOM 240 O LEU A 15 18.973 32.190 18.116 1.00 0.00 O ATOM 241 CB LEU A 15 22.049 32.080 17.339 1.00 0.00 C ATOM 242 CG LEU A 15 22.455 31.720 15.913 1.00 0.00 C ATOM 243 CD1 LEU A 15 23.031 32.902 15.115 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.594 30.709 15.939 1.00 0.00 C ATOM 0 H LEU A 15 20.881 33.184 19.587 1.00 0.00 H new ATOM 0 HA LEU A 15 21.219 33.948 16.712 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.953 32.328 17.896 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.623 31.191 17.804 1.00 0.00 H new ATOM 0 HG LEU A 15 21.538 31.355 15.450 1.00 0.00 H new ATOM 0 HD11 LEU A 15 23.297 32.569 14.112 1.00 0.00 H new ATOM 0 HD12 LEU A 15 22.285 33.694 15.049 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.920 33.282 15.618 1.00 0.00 H new ATOM 0 HD21 LEU A 15 23.879 30.456 14.918 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.450 31.139 16.459 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.269 29.808 16.459 1.00 0.00 H new ATOM 256 N GLU A 16 19.044 33.226 16.131 1.00 0.00 N ATOM 257 CA GLU A 16 17.710 33.065 15.600 1.00 0.00 C ATOM 258 C GLU A 16 17.831 31.753 14.804 1.00 0.00 C ATOM 259 O GLU A 16 18.622 31.684 13.863 1.00 0.00 O ATOM 260 CB GLU A 16 17.395 34.203 14.625 1.00 0.00 C ATOM 261 CG GLU A 16 17.324 35.588 15.255 1.00 0.00 C ATOM 262 CD GLU A 16 18.571 36.431 15.485 1.00 0.00 C ATOM 263 OE1 GLU A 16 19.671 35.953 15.120 1.00 0.00 O ATOM 264 OE2 GLU A 16 18.417 37.504 16.108 1.00 0.00 O ATOM 0 H GLU A 16 19.639 33.675 15.435 1.00 0.00 H new ATOM 0 HA GLU A 16 16.934 33.063 16.366 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.156 34.214 13.844 1.00 0.00 H new ATOM 0 HB3 GLU A 16 16.442 33.992 14.139 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.652 36.182 14.635 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.841 35.469 16.225 1.00 0.00 H new ATOM 271 N VAL A 17 17.068 30.766 15.263 1.00 0.00 N ATOM 272 CA VAL A 17 17.217 29.360 14.952 1.00 0.00 C ATOM 273 C VAL A 17 15.792 28.800 14.950 1.00 0.00 C ATOM 274 O VAL A 17 14.968 29.500 15.536 1.00 0.00 O ATOM 275 CB VAL A 17 18.136 28.575 15.893 1.00 0.00 C ATOM 276 CG1 VAL A 17 19.604 29.022 15.909 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.640 28.609 17.331 1.00 0.00 C ATOM 0 H VAL A 17 16.288 30.942 15.896 1.00 0.00 H new ATOM 0 HA VAL A 17 17.720 29.252 13.991 1.00 0.00 H new ATOM 0 HB VAL A 17 18.099 27.568 15.477 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.166 28.401 16.607 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.027 28.918 14.910 1.00 0.00 H new ATOM 0 HG13 VAL A 17 19.663 30.065 16.221 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.321 28.040 17.964 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.599 29.642 17.678 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.644 28.170 17.383 1.00 0.00 H new ATOM 287 N GLU A 18 15.599 27.659 14.295 1.00 0.00 N ATOM 288 CA GLU A 18 14.382 26.867 14.298 1.00 0.00 C ATOM 289 C GLU A 18 14.669 25.560 15.043 1.00 0.00 C ATOM 290 O GLU A 18 15.749 25.050 14.747 1.00 0.00 O ATOM 291 CB GLU A 18 14.031 26.528 12.859 1.00 0.00 C ATOM 292 CG GLU A 18 12.924 27.262 12.106 1.00 0.00 C ATOM 293 CD GLU A 18 11.536 27.004 12.682 1.00 0.00 C ATOM 294 OE1 GLU A 18 10.992 25.984 12.227 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.044 27.716 13.587 1.00 0.00 O ATOM 0 H GLU A 18 16.330 27.243 13.718 1.00 0.00 H new ATOM 0 HA GLU A 18 13.566 27.412 14.773 1.00 0.00 H new ATOM 0 HB2 GLU A 18 14.943 26.649 12.275 1.00 0.00 H new ATOM 0 HB3 GLU A 18 13.777 25.468 12.838 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.126 28.333 12.128 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.939 26.956 11.060 1.00 0.00 H new ATOM 302 N PRO A 19 13.794 24.910 15.793 1.00 0.00 N ATOM 303 CA PRO A 19 13.951 23.690 16.564 1.00 0.00 C ATOM 304 C PRO A 19 14.597 22.513 15.822 1.00 0.00 C ATOM 305 O PRO A 19 15.256 21.669 16.421 1.00 0.00 O ATOM 306 CB PRO A 19 12.556 23.368 17.096 1.00 0.00 C ATOM 307 CG PRO A 19 11.889 24.731 17.288 1.00 0.00 C ATOM 308 CD PRO A 19 12.538 25.541 16.168 1.00 0.00 C ATOM 0 HA PRO A 19 14.672 23.855 17.364 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.997 22.749 16.394 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.608 22.817 18.035 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.806 24.677 17.182 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.092 25.153 18.272 1.00 0.00 H new ATOM 0 HD2 PRO A 19 11.872 25.594 15.307 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.715 26.565 16.498 1.00 0.00 H new ATOM 316 N SER A 20 14.465 22.379 14.513 1.00 0.00 N ATOM 317 CA SER A 20 14.997 21.336 13.649 1.00 0.00 C ATOM 318 C SER A 20 16.386 21.596 13.054 1.00 0.00 C ATOM 319 O SER A 20 16.912 20.814 12.275 1.00 0.00 O ATOM 320 CB SER A 20 13.945 21.080 12.570 1.00 0.00 C ATOM 321 OG SER A 20 14.246 20.083 11.620 1.00 0.00 O ATOM 0 H SER A 20 13.932 23.063 13.976 1.00 0.00 H new ATOM 0 HA SER A 20 15.179 20.454 14.263 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.010 20.811 13.062 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.767 22.015 12.038 1.00 0.00 H new ATOM 0 HG SER A 20 15.218 19.980 11.551 1.00 0.00 H new ATOM 327 N ASP A 21 17.034 22.678 13.492 1.00 0.00 N ATOM 328 CA ASP A 21 18.307 23.094 12.946 1.00 0.00 C ATOM 329 C ASP A 21 19.450 22.245 13.521 1.00 0.00 C ATOM 330 O ASP A 21 19.299 21.787 14.648 1.00 0.00 O ATOM 331 CB ASP A 21 18.575 24.590 13.170 1.00 0.00 C ATOM 332 CG ASP A 21 17.719 25.513 12.326 1.00 0.00 C ATOM 333 OD1 ASP A 21 17.273 25.127 11.225 1.00 0.00 O ATOM 334 OD2 ASP A 21 17.646 26.720 12.676 1.00 0.00 O ATOM 0 H ASP A 21 16.683 23.283 14.235 1.00 0.00 H new ATOM 0 HA ASP A 21 18.261 22.934 11.869 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.410 24.823 14.222 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.625 24.794 12.959 1.00 0.00 H new ATOM 339 N THR A 22 20.501 22.053 12.732 1.00 0.00 N ATOM 340 CA THR A 22 21.578 21.186 13.177 1.00 0.00 C ATOM 341 C THR A 22 22.606 21.963 13.996 1.00 0.00 C ATOM 342 O THR A 22 22.775 23.170 13.933 1.00 0.00 O ATOM 343 CB THR A 22 22.243 20.593 11.937 1.00 0.00 C ATOM 344 OG1 THR A 22 22.815 21.562 11.087 1.00 0.00 O ATOM 345 CG2 THR A 22 21.293 19.635 11.238 1.00 0.00 C ATOM 0 H THR A 22 20.627 22.472 11.811 1.00 0.00 H new ATOM 0 HA THR A 22 21.175 20.399 13.815 1.00 0.00 H new ATOM 0 HB THR A 22 23.103 20.009 12.266 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.225 21.119 10.315 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.779 19.219 10.356 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.025 18.827 11.919 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.392 20.170 10.937 1.00 0.00 H new ATOM 353 N ILE A 23 23.308 21.217 14.850 1.00 0.00 N ATOM 354 CA ILE A 23 24.428 21.699 15.632 1.00 0.00 C ATOM 355 C ILE A 23 25.595 22.293 14.836 1.00 0.00 C ATOM 356 O ILE A 23 26.243 23.235 15.286 1.00 0.00 O ATOM 357 CB ILE A 23 24.993 20.587 16.516 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.931 19.779 17.268 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.291 20.915 17.258 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.132 20.591 18.281 1.00 0.00 C ATOM 0 H ILE A 23 23.100 20.232 15.016 1.00 0.00 H new ATOM 0 HA ILE A 23 23.995 22.513 16.214 1.00 0.00 H new ATOM 0 HB ILE A 23 25.375 19.851 15.809 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.243 19.342 16.545 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.418 18.952 17.785 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.598 20.054 17.853 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.072 21.154 16.536 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.129 21.770 17.914 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.402 19.946 18.770 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.808 21.006 19.029 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.614 21.403 17.770 1.00 0.00 H new ATOM 372 N GLU A 24 25.751 21.825 13.597 1.00 0.00 N ATOM 373 CA GLU A 24 26.910 22.074 12.772 1.00 0.00 C ATOM 374 C GLU A 24 26.697 23.409 12.058 1.00 0.00 C ATOM 375 O GLU A 24 27.619 24.222 11.928 1.00 0.00 O ATOM 376 CB GLU A 24 26.924 20.938 11.756 1.00 0.00 C ATOM 377 CG GLU A 24 28.236 20.450 11.139 1.00 0.00 C ATOM 378 CD GLU A 24 28.596 21.097 9.811 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.643 21.594 9.174 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.788 21.106 9.433 1.00 0.00 O ATOM 0 H GLU A 24 25.048 21.247 13.136 1.00 0.00 H new ATOM 0 HA GLU A 24 27.843 22.119 13.334 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.456 20.077 12.233 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.276 21.238 10.933 1.00 0.00 H new ATOM 0 HG2 GLU A 24 29.044 20.633 11.847 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.175 19.371 10.997 1.00 0.00 H new ATOM 387 N ASN A 25 25.459 23.664 11.640 1.00 0.00 N ATOM 388 CA ASN A 25 25.057 25.002 11.268 1.00 0.00 C ATOM 389 C ASN A 25 25.191 25.972 12.444 1.00 0.00 C ATOM 390 O ASN A 25 25.801 27.015 12.209 1.00 0.00 O ATOM 391 CB ASN A 25 23.638 24.981 10.715 1.00 0.00 C ATOM 392 CG ASN A 25 23.243 26.286 10.040 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.834 27.238 10.708 1.00 0.00 O ATOM 394 ND2 ASN A 25 23.469 26.419 8.734 1.00 0.00 N ATOM 0 H ASN A 25 24.726 22.960 11.554 1.00 0.00 H new ATOM 0 HA ASN A 25 25.725 25.362 10.486 1.00 0.00 H new ATOM 0 HB2 ASN A 25 23.546 24.165 9.998 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.941 24.773 11.527 1.00 0.00 H new ATOM 0 HD21 ASN A 25 23.304 27.316 8.277 1.00 0.00 H new ATOM 0 HD22 ASN A 25 23.807 25.624 8.191 1.00 0.00 H new ATOM 401 N VAL A 26 24.888 25.651 13.700 1.00 0.00 N ATOM 402 CA VAL A 26 25.243 26.439 14.854 1.00 0.00 C ATOM 403 C VAL A 26 26.719 26.770 15.063 1.00 0.00 C ATOM 404 O VAL A 26 27.144 27.927 14.976 1.00 0.00 O ATOM 405 CB VAL A 26 24.531 25.982 16.125 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.733 26.855 17.365 1.00 0.00 C ATOM 407 CG2 VAL A 26 23.013 25.868 15.958 1.00 0.00 C ATOM 0 H VAL A 26 24.371 24.805 13.939 1.00 0.00 H new ATOM 0 HA VAL A 26 24.847 27.420 14.591 1.00 0.00 H new ATOM 0 HB VAL A 26 25.008 25.015 16.284 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.180 26.431 18.203 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.794 26.895 17.613 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.370 27.863 17.164 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.567 25.539 16.897 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.603 26.840 15.683 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.786 25.144 15.175 1.00 0.00 H new ATOM 417 N LYS A 27 27.552 25.743 15.170 1.00 0.00 N ATOM 418 CA LYS A 27 28.958 25.836 15.507 1.00 0.00 C ATOM 419 C LYS A 27 29.835 26.495 14.436 1.00 0.00 C ATOM 420 O LYS A 27 30.813 27.140 14.817 1.00 0.00 O ATOM 421 CB LYS A 27 29.324 24.352 15.570 1.00 0.00 C ATOM 422 CG LYS A 27 30.726 24.056 16.115 1.00 0.00 C ATOM 423 CD LYS A 27 31.159 22.606 15.870 1.00 0.00 C ATOM 424 CE LYS A 27 30.335 21.517 16.564 1.00 0.00 C ATOM 425 NZ LYS A 27 30.781 20.177 16.175 1.00 0.00 N ATOM 0 H LYS A 27 27.248 24.782 15.016 1.00 0.00 H new ATOM 0 HA LYS A 27 29.118 26.442 16.399 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.592 23.838 16.193 1.00 0.00 H new ATOM 0 HB3 LYS A 27 29.243 23.930 14.568 1.00 0.00 H new ATOM 0 HG2 LYS A 27 31.444 24.730 15.647 1.00 0.00 H new ATOM 0 HG3 LYS A 27 30.747 24.262 17.185 1.00 0.00 H new ATOM 0 HD2 LYS A 27 31.134 22.420 14.796 1.00 0.00 H new ATOM 0 HD3 LYS A 27 32.197 22.502 16.187 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.418 21.630 17.645 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.282 21.639 16.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.203 19.463 16.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.678 20.062 15.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.779 20.053 16.439 1.00 0.00 H new ATOM 439 N ALA A 28 29.305 26.556 13.221 1.00 0.00 N ATOM 440 CA ALA A 28 29.905 27.324 12.149 1.00 0.00 C ATOM 441 C ALA A 28 29.467 28.794 12.196 1.00 0.00 C ATOM 442 O ALA A 28 30.277 29.680 11.930 1.00 0.00 O ATOM 443 CB ALA A 28 29.371 26.844 10.793 1.00 0.00 C ATOM 0 H ALA A 28 28.447 26.073 12.956 1.00 0.00 H new ATOM 0 HA ALA A 28 30.982 27.206 12.265 1.00 0.00 H new ATOM 0 HB1 ALA A 28 29.829 27.428 9.994 1.00 0.00 H new ATOM 0 HB2 ALA A 28 29.616 25.790 10.658 1.00 0.00 H new ATOM 0 HB3 ALA A 28 28.289 26.972 10.762 1.00 0.00 H new ATOM 449 N LYS A 29 28.227 29.077 12.580 1.00 0.00 N ATOM 450 CA LYS A 29 27.775 30.450 12.541 1.00 0.00 C ATOM 451 C LYS A 29 28.416 31.331 13.629 1.00 0.00 C ATOM 452 O LYS A 29 28.528 32.524 13.415 1.00 0.00 O ATOM 453 CB LYS A 29 26.259 30.455 12.752 1.00 0.00 C ATOM 454 CG LYS A 29 25.576 30.195 11.419 1.00 0.00 C ATOM 455 CD LYS A 29 24.054 30.109 11.484 1.00 0.00 C ATOM 456 CE LYS A 29 23.332 30.061 10.134 1.00 0.00 C ATOM 457 NZ LYS A 29 21.915 29.699 10.283 1.00 0.00 N ATOM 0 H LYS A 29 27.543 28.396 12.910 1.00 0.00 H new ATOM 0 HA LYS A 29 28.065 30.864 11.575 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.977 29.691 13.476 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.938 31.414 13.159 1.00 0.00 H new ATOM 0 HG2 LYS A 29 25.851 30.989 10.725 1.00 0.00 H new ATOM 0 HG3 LYS A 29 25.961 29.263 11.006 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.783 29.219 12.052 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.684 30.969 12.043 1.00 0.00 H new ATOM 0 HE2 LYS A 29 23.409 31.033 9.646 1.00 0.00 H new ATOM 0 HE3 LYS A 29 23.825 29.338 9.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.396 29.967 9.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 21.833 28.673 10.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 21.513 30.200 11.101 1.00 0.00 H new ATOM 471 N ILE A 30 28.861 30.687 14.711 1.00 0.00 N ATOM 472 CA ILE A 30 29.671 31.270 15.761 1.00 0.00 C ATOM 473 C ILE A 30 31.077 31.563 15.247 1.00 0.00 C ATOM 474 O ILE A 30 31.772 32.469 15.715 1.00 0.00 O ATOM 475 CB ILE A 30 29.783 30.319 16.958 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.383 29.954 17.437 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.469 30.797 18.243 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.196 28.814 18.435 1.00 0.00 C ATOM 0 H ILE A 30 28.652 29.703 14.878 1.00 0.00 H new ATOM 0 HA ILE A 30 29.186 32.195 16.074 1.00 0.00 H new ATOM 0 HB ILE A 30 30.403 29.529 16.534 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.947 30.849 17.881 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.790 29.714 16.555 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.457 29.995 18.982 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.500 31.073 18.024 1.00 0.00 H new ATOM 0 HG23 ILE A 30 29.938 31.663 18.639 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.136 28.698 18.660 1.00 0.00 H new ATOM 0 HD12 ILE A 30 28.579 27.888 18.006 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.739 29.041 19.352 1.00 0.00 H new ATOM 490 N GLN A 31 31.548 30.939 14.167 1.00 0.00 N ATOM 491 CA GLN A 31 32.859 31.146 13.589 1.00 0.00 C ATOM 492 C GLN A 31 32.789 32.395 12.709 1.00 0.00 C ATOM 493 O GLN A 31 33.744 33.172 12.707 1.00 0.00 O ATOM 494 CB GLN A 31 33.243 29.963 12.698 1.00 0.00 C ATOM 495 CG GLN A 31 34.580 30.081 11.965 1.00 0.00 C ATOM 496 CD GLN A 31 34.928 29.021 10.931 1.00 0.00 C ATOM 497 OE1 GLN A 31 34.202 28.111 10.513 1.00 0.00 O ATOM 498 NE2 GLN A 31 36.047 29.204 10.233 1.00 0.00 N ATOM 0 H GLN A 31 30.997 30.249 13.656 1.00 0.00 H new ATOM 0 HA GLN A 31 33.595 31.251 14.386 1.00 0.00 H new ATOM 0 HB2 GLN A 31 33.267 29.063 13.313 1.00 0.00 H new ATOM 0 HB3 GLN A 31 32.456 29.822 11.957 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.603 31.051 11.468 1.00 0.00 H new ATOM 0 HG3 GLN A 31 35.371 30.088 12.715 1.00 0.00 H new ATOM 0 HE21 GLN A 31 36.705 29.933 10.507 1.00 0.00 H new ATOM 0 HE22 GLN A 31 36.246 28.615 9.425 1.00 0.00 H new ATOM 507 N ASP A 32 31.717 32.649 11.959 1.00 0.00 N ATOM 508 CA ASP A 32 31.465 33.784 11.094 1.00 0.00 C ATOM 509 C ASP A 32 31.298 35.078 11.890 1.00 0.00 C ATOM 510 O ASP A 32 31.746 36.106 11.404 1.00 0.00 O ATOM 511 CB ASP A 32 30.171 33.502 10.325 1.00 0.00 C ATOM 512 CG ASP A 32 29.840 34.461 9.200 1.00 0.00 C ATOM 513 OD1 ASP A 32 30.568 34.587 8.191 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.792 35.120 9.384 1.00 0.00 O ATOM 0 H ASP A 32 30.932 31.998 11.946 1.00 0.00 H new ATOM 0 HA ASP A 32 32.315 33.915 10.424 1.00 0.00 H new ATOM 0 HB2 ASP A 32 30.231 32.495 9.911 1.00 0.00 H new ATOM 0 HB3 ASP A 32 29.343 33.506 11.034 1.00 0.00 H new ATOM 519 N LYS A 33 30.584 34.994 13.011 1.00 0.00 N ATOM 520 CA LYS A 33 30.071 36.044 13.876 1.00 0.00 C ATOM 521 C LYS A 33 30.975 36.321 15.078 1.00 0.00 C ATOM 522 O LYS A 33 30.946 37.403 15.660 1.00 0.00 O ATOM 523 CB LYS A 33 28.726 35.589 14.430 1.00 0.00 C ATOM 524 CG LYS A 33 27.627 35.648 13.358 1.00 0.00 C ATOM 525 CD LYS A 33 26.248 35.340 13.921 1.00 0.00 C ATOM 526 CE LYS A 33 25.064 35.392 12.950 1.00 0.00 C ATOM 527 NZ LYS A 33 24.511 36.730 12.669 1.00 0.00 N ATOM 0 H LYS A 33 30.323 34.077 13.373 1.00 0.00 H new ATOM 0 HA LYS A 33 30.005 36.952 13.276 1.00 0.00 H new ATOM 0 HB2 LYS A 33 28.813 34.570 14.808 1.00 0.00 H new ATOM 0 HB3 LYS A 33 28.447 36.220 15.274 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.618 36.640 12.905 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.859 34.938 12.565 1.00 0.00 H new ATOM 0 HD2 LYS A 33 26.279 34.344 14.362 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.050 36.041 14.732 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.375 34.945 12.006 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.265 34.768 13.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 23.717 36.645 12.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 24.175 37.160 13.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.250 37.331 12.252 1.00 0.00 H new ATOM 541 N GLU A 34 31.829 35.391 15.500 1.00 0.00 N ATOM 542 CA GLU A 34 32.590 35.397 16.727 1.00 0.00 C ATOM 543 C GLU A 34 34.041 34.949 16.512 1.00 0.00 C ATOM 544 O GLU A 34 34.848 35.295 17.378 1.00 0.00 O ATOM 545 CB GLU A 34 31.940 34.919 18.027 1.00 0.00 C ATOM 546 CG GLU A 34 31.685 36.014 19.072 1.00 0.00 C ATOM 547 CD GLU A 34 32.917 36.600 19.738 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.442 36.004 20.713 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.445 37.617 19.232 1.00 0.00 O ATOM 0 H GLU A 34 32.014 34.556 14.945 1.00 0.00 H new ATOM 0 HA GLU A 34 32.600 36.459 16.972 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.990 34.442 17.785 1.00 0.00 H new ATOM 0 HB3 GLU A 34 32.577 34.155 18.473 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.135 36.824 18.593 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.038 35.604 19.847 1.00 0.00 H new ATOM 556 N GLY A 35 34.356 34.199 15.466 1.00 0.00 N ATOM 557 CA GLY A 35 35.731 34.013 15.056 1.00 0.00 C ATOM 558 C GLY A 35 36.405 32.666 15.355 1.00 0.00 C ATOM 559 O GLY A 35 37.580 32.493 15.057 1.00 0.00 O ATOM 0 H GLY A 35 33.673 33.710 14.888 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.782 34.178 13.980 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.327 34.795 15.527 1.00 0.00 H new ATOM 563 N ILE A 36 35.712 31.688 15.945 1.00 0.00 N ATOM 564 CA ILE A 36 36.246 30.446 16.462 1.00 0.00 C ATOM 565 C ILE A 36 35.888 29.325 15.479 1.00 0.00 C ATOM 566 O ILE A 36 34.681 29.184 15.269 1.00 0.00 O ATOM 567 CB ILE A 36 35.550 30.196 17.795 1.00 0.00 C ATOM 568 CG1 ILE A 36 36.193 31.100 18.844 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.649 28.773 18.354 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.232 31.522 19.966 1.00 0.00 C ATOM 0 H ILE A 36 34.703 31.756 16.077 1.00 0.00 H new ATOM 0 HA ILE A 36 37.328 30.484 16.589 1.00 0.00 H new ATOM 0 HB ILE A 36 34.496 30.389 17.596 1.00 0.00 H new ATOM 0 HG12 ILE A 36 37.046 30.583 19.283 1.00 0.00 H new ATOM 0 HG13 ILE A 36 36.580 31.993 18.354 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.117 28.717 19.304 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.204 28.073 17.647 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.697 28.515 18.509 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.758 32.162 20.674 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.391 32.068 19.539 1.00 0.00 H new ATOM 0 HD13 ILE A 36 34.864 30.635 20.483 1.00 0.00 H new ATOM 582 N PRO A 37 36.806 28.519 14.957 1.00 0.00 N ATOM 583 CA PRO A 37 36.500 27.400 14.094 1.00 0.00 C ATOM 584 C PRO A 37 35.768 26.240 14.774 1.00 0.00 C ATOM 585 O PRO A 37 36.010 26.038 15.963 1.00 0.00 O ATOM 586 CB PRO A 37 37.847 26.900 13.546 1.00 0.00 C ATOM 587 CG PRO A 37 38.889 27.327 14.575 1.00 0.00 C ATOM 588 CD PRO A 37 38.235 28.586 15.152 1.00 0.00 C ATOM 0 HA PRO A 37 35.813 27.748 13.322 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.842 25.817 13.419 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.059 27.335 12.569 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.054 26.563 15.335 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.856 27.537 14.119 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.464 28.673 16.214 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.638 29.474 14.665 1.00 0.00 H new ATOM 596 N PRO A 38 34.936 25.536 14.008 1.00 0.00 N ATOM 597 CA PRO A 38 34.202 24.415 14.560 1.00 0.00 C ATOM 598 C PRO A 38 35.101 23.283 15.061 1.00 0.00 C ATOM 599 O PRO A 38 34.841 22.827 16.169 1.00 0.00 O ATOM 600 CB PRO A 38 33.253 23.943 13.448 1.00 0.00 C ATOM 601 CG PRO A 38 33.828 24.479 12.142 1.00 0.00 C ATOM 602 CD PRO A 38 34.809 25.561 12.568 1.00 0.00 C ATOM 0 HA PRO A 38 33.656 24.728 15.450 1.00 0.00 H new ATOM 0 HB2 PRO A 38 33.188 22.855 13.427 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.243 24.319 13.612 1.00 0.00 H new ATOM 0 HG2 PRO A 38 34.327 23.692 11.577 1.00 0.00 H new ATOM 0 HG3 PRO A 38 33.045 24.884 11.501 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.780 25.395 12.101 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.459 26.539 12.237 1.00 0.00 H new ATOM 610 N ASP A 39 36.199 22.962 14.385 1.00 0.00 N ATOM 611 CA ASP A 39 37.209 22.018 14.805 1.00 0.00 C ATOM 612 C ASP A 39 37.618 22.066 16.278 1.00 0.00 C ATOM 613 O ASP A 39 37.840 20.993 16.826 1.00 0.00 O ATOM 614 CB ASP A 39 38.463 22.081 13.929 1.00 0.00 C ATOM 615 CG ASP A 39 39.353 20.850 14.044 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.908 19.703 13.841 1.00 0.00 O ATOM 617 OD2 ASP A 39 40.557 21.107 14.281 1.00 0.00 O ATOM 0 H ASP A 39 36.413 23.381 13.480 1.00 0.00 H new ATOM 0 HA ASP A 39 36.699 21.063 14.673 1.00 0.00 H new ATOM 0 HB2 ASP A 39 38.163 22.205 12.889 1.00 0.00 H new ATOM 0 HB3 ASP A 39 39.042 22.964 14.201 1.00 0.00 H new ATOM 622 N GLN A 40 37.823 23.177 16.980 1.00 0.00 N ATOM 623 CA GLN A 40 38.218 23.376 18.361 1.00 0.00 C ATOM 624 C GLN A 40 37.063 23.581 19.342 1.00 0.00 C ATOM 625 O GLN A 40 37.248 24.003 20.487 1.00 0.00 O ATOM 626 CB GLN A 40 39.236 24.517 18.410 1.00 0.00 C ATOM 627 CG GLN A 40 40.363 24.357 17.391 1.00 0.00 C ATOM 628 CD GLN A 40 41.290 23.238 17.853 1.00 0.00 C ATOM 629 OE1 GLN A 40 41.816 23.192 18.968 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.611 22.298 16.976 1.00 0.00 N ATOM 0 H GLN A 40 37.696 24.080 16.523 1.00 0.00 H new ATOM 0 HA GLN A 40 38.671 22.448 18.709 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.723 25.462 18.231 1.00 0.00 H new ATOM 0 HB3 GLN A 40 39.664 24.572 19.411 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.953 24.125 16.408 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.918 25.290 17.293 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.195 22.306 16.045 1.00 0.00 H new ATOM 0 HE22 GLN A 40 42.274 21.567 17.232 1.00 0.00 H new ATOM 639 N GLN A 41 35.816 23.611 18.881 1.00 0.00 N ATOM 640 CA GLN A 41 34.671 24.136 19.590 1.00 0.00 C ATOM 641 C GLN A 41 33.811 22.905 19.916 1.00 0.00 C ATOM 642 O GLN A 41 33.329 22.157 19.075 1.00 0.00 O ATOM 643 CB GLN A 41 33.939 25.019 18.583 1.00 0.00 C ATOM 644 CG GLN A 41 32.814 25.919 19.082 1.00 0.00 C ATOM 645 CD GLN A 41 32.214 26.825 18.006 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.243 27.528 18.292 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.758 26.795 16.798 1.00 0.00 N ATOM 0 H GLN A 41 35.573 23.251 17.958 1.00 0.00 H new ATOM 0 HA GLN A 41 34.909 24.699 20.492 1.00 0.00 H new ATOM 0 HB2 GLN A 41 34.681 25.654 18.099 1.00 0.00 H new ATOM 0 HB3 GLN A 41 33.525 24.369 17.812 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.023 25.296 19.499 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.193 26.539 19.894 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.562 26.194 16.615 1.00 0.00 H new ATOM 0 HE22 GLN A 41 32.373 27.373 16.051 1.00 0.00 H new ATOM 656 N ARG A 42 33.698 22.645 21.214 1.00 0.00 N ATOM 657 CA ARG A 42 32.763 21.762 21.881 1.00 0.00 C ATOM 658 C ARG A 42 31.651 22.594 22.517 1.00 0.00 C ATOM 659 O ARG A 42 31.808 23.636 23.166 1.00 0.00 O ATOM 660 CB ARG A 42 33.527 20.933 22.911 1.00 0.00 C ATOM 661 CG ARG A 42 32.693 19.920 23.700 1.00 0.00 C ATOM 662 CD ARG A 42 33.554 18.879 24.416 1.00 0.00 C ATOM 663 NE ARG A 42 34.298 17.984 23.519 1.00 0.00 N ATOM 664 CZ ARG A 42 35.547 18.181 23.072 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.339 19.169 23.503 1.00 0.00 N ATOM 666 NH2 ARG A 42 36.149 17.348 22.209 1.00 0.00 N ATOM 0 H ARG A 42 34.322 23.093 21.885 1.00 0.00 H new ATOM 0 HA ARG A 42 32.295 21.077 21.174 1.00 0.00 H new ATOM 0 HB2 ARG A 42 34.326 20.397 22.398 1.00 0.00 H new ATOM 0 HB3 ARG A 42 34.002 21.614 23.618 1.00 0.00 H new ATOM 0 HG2 ARG A 42 32.084 20.449 24.433 1.00 0.00 H new ATOM 0 HG3 ARG A 42 32.006 19.414 23.022 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.263 19.395 25.064 1.00 0.00 H new ATOM 0 HD3 ARG A 42 32.913 18.277 25.060 1.00 0.00 H new ATOM 0 HE ARG A 42 33.822 17.137 23.209 1.00 0.00 H new ATOM 0 HH11 ARG A 42 36.001 19.823 24.209 1.00 0.00 H new ATOM 0 HH12 ARG A 42 37.281 19.269 23.125 1.00 0.00 H new ATOM 0 HH21 ARG A 42 35.654 16.525 21.866 1.00 0.00 H new ATOM 0 HH22 ARG A 42 37.101 17.538 21.896 1.00 0.00 H new ATOM 680 N LEU A 43 30.445 22.150 22.169 1.00 0.00 N ATOM 681 CA LEU A 43 29.214 22.799 22.584 1.00 0.00 C ATOM 682 C LEU A 43 28.494 21.793 23.473 1.00 0.00 C ATOM 683 O LEU A 43 28.285 20.653 23.049 1.00 0.00 O ATOM 684 CB LEU A 43 28.400 23.043 21.321 1.00 0.00 C ATOM 685 CG LEU A 43 28.940 24.233 20.524 1.00 0.00 C ATOM 686 CD1 LEU A 43 28.398 24.054 19.105 1.00 0.00 C ATOM 687 CD2 LEU A 43 28.359 25.494 21.170 1.00 0.00 C ATOM 0 H LEU A 43 30.299 21.325 21.588 1.00 0.00 H new ATOM 0 HA LEU A 43 29.373 23.739 23.112 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.417 22.149 20.698 1.00 0.00 H new ATOM 0 HB3 LEU A 43 27.359 23.225 21.588 1.00 0.00 H new ATOM 0 HG LEU A 43 30.028 24.304 20.509 1.00 0.00 H new ATOM 0 HD11 LEU A 43 28.746 24.874 18.476 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.753 23.108 18.697 1.00 0.00 H new ATOM 0 HD13 LEU A 43 27.308 24.053 19.129 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.716 26.374 20.635 1.00 0.00 H new ATOM 0 HD22 LEU A 43 27.271 25.458 21.124 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.676 25.549 22.211 1.00 0.00 H new ATOM 699 N ILE A 44 27.944 22.288 24.577 1.00 0.00 N ATOM 700 CA ILE A 44 27.300 21.578 25.652 1.00 0.00 C ATOM 701 C ILE A 44 25.820 21.971 25.694 1.00 0.00 C ATOM 702 O ILE A 44 25.527 23.156 25.543 1.00 0.00 O ATOM 703 CB ILE A 44 28.114 21.752 26.939 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.337 20.831 26.879 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.260 21.361 28.144 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.243 20.850 28.106 1.00 0.00 C ATOM 0 H ILE A 44 27.944 23.294 24.748 1.00 0.00 H new ATOM 0 HA ILE A 44 27.285 20.499 25.501 1.00 0.00 H new ATOM 0 HB ILE A 44 28.427 22.792 27.036 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.991 19.809 26.722 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.932 21.104 26.007 1.00 0.00 H new ATOM 0 HG21 ILE A 44 27.841 21.486 29.058 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.377 21.998 28.186 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.952 20.320 28.049 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.075 20.162 27.955 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.628 21.858 28.258 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.674 20.543 28.983 1.00 0.00 H new ATOM 718 N PHE A 45 24.872 21.035 25.727 1.00 0.00 N ATOM 719 CA PHE A 45 23.607 21.459 26.281 1.00 0.00 C ATOM 720 C PHE A 45 23.082 20.444 27.308 1.00 0.00 C ATOM 721 O PHE A 45 22.987 19.257 26.981 1.00 0.00 O ATOM 722 CB PHE A 45 22.507 21.824 25.287 1.00 0.00 C ATOM 723 CG PHE A 45 21.178 22.277 25.842 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.954 23.594 26.249 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.132 21.345 25.886 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.673 23.953 26.698 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.847 21.718 26.266 1.00 0.00 C ATOM 728 CZ PHE A 45 18.627 23.023 26.713 1.00 0.00 C ATOM 0 H PHE A 45 24.946 20.069 25.408 1.00 0.00 H new ATOM 0 HA PHE A 45 23.853 22.404 26.765 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.888 22.616 24.642 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.327 20.956 24.653 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.751 24.322 26.219 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.328 20.317 25.620 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.492 24.962 27.037 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.033 21.010 26.216 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.650 23.314 27.070 1.00 0.00 H new ATOM 738 N ALA A 46 22.613 20.892 28.469 1.00 0.00 N ATOM 739 CA ALA A 46 21.960 20.046 29.446 1.00 0.00 C ATOM 740 C ALA A 46 22.844 19.053 30.206 1.00 0.00 C ATOM 741 O ALA A 46 22.333 18.181 30.911 1.00 0.00 O ATOM 742 CB ALA A 46 20.692 19.407 28.887 1.00 0.00 C ATOM 0 H ALA A 46 22.680 21.869 28.756 1.00 0.00 H new ATOM 0 HA ALA A 46 21.675 20.744 30.233 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.233 18.780 29.652 1.00 0.00 H new ATOM 0 HB2 ALA A 46 19.992 20.188 28.589 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.944 18.796 28.020 1.00 0.00 H new ATOM 748 N GLY A 47 24.149 19.014 29.944 1.00 0.00 N ATOM 749 CA GLY A 47 25.170 18.122 30.448 1.00 0.00 C ATOM 750 C GLY A 47 25.710 17.295 29.266 1.00 0.00 C ATOM 751 O GLY A 47 26.725 16.652 29.513 1.00 0.00 O ATOM 0 H GLY A 47 24.554 19.690 29.296 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.975 18.690 30.914 1.00 0.00 H new ATOM 0 HA3 GLY A 47 24.757 17.466 31.214 1.00 0.00 H new ATOM 755 N LYS A 48 25.065 17.318 28.109 1.00 0.00 N ATOM 756 CA LYS A 48 25.451 16.471 26.997 1.00 0.00 C ATOM 757 C LYS A 48 26.362 17.233 26.043 1.00 0.00 C ATOM 758 O LYS A 48 25.959 18.326 25.626 1.00 0.00 O ATOM 759 CB LYS A 48 24.237 15.952 26.224 1.00 0.00 C ATOM 760 CG LYS A 48 23.335 15.060 27.071 1.00 0.00 C ATOM 761 CD LYS A 48 22.071 15.675 27.675 1.00 0.00 C ATOM 762 CE LYS A 48 21.121 14.563 28.119 1.00 0.00 C ATOM 763 NZ LYS A 48 19.998 15.081 28.907 1.00 0.00 N ATOM 0 H LYS A 48 24.265 17.921 27.918 1.00 0.00 H new ATOM 0 HA LYS A 48 25.981 15.616 27.416 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.659 16.798 25.853 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.578 15.393 25.353 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.032 14.213 26.456 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.935 14.661 27.889 1.00 0.00 H new ATOM 0 HD2 LYS A 48 22.332 16.305 28.525 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.580 16.315 26.942 1.00 0.00 H new ATOM 0 HE2 LYS A 48 20.738 14.042 27.242 1.00 0.00 H new ATOM 0 HE3 LYS A 48 21.671 13.831 28.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 19.379 14.294 29.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 20.361 15.556 29.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.457 15.761 28.335 1.00 0.00 H new ATOM 777 N GLN A 49 27.543 16.708 25.735 1.00 0.00 N ATOM 778 CA GLN A 49 28.447 17.130 24.681 1.00 0.00 C ATOM 779 C GLN A 49 27.735 16.946 23.343 1.00 0.00 C ATOM 780 O GLN A 49 27.475 15.829 22.921 1.00 0.00 O ATOM 781 CB GLN A 49 29.668 16.209 24.791 1.00 0.00 C ATOM 782 CG GLN A 49 29.515 14.752 25.210 1.00 0.00 C ATOM 783 CD GLN A 49 30.693 13.815 24.949 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.843 14.204 24.783 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.336 12.553 24.729 1.00 0.00 N ATOM 0 H GLN A 49 27.918 15.916 26.258 1.00 0.00 H new ATOM 0 HA GLN A 49 28.749 18.174 24.762 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.159 16.212 23.818 1.00 0.00 H new ATOM 0 HB3 GLN A 49 30.356 16.674 25.497 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.298 14.730 26.278 1.00 0.00 H new ATOM 0 HG3 GLN A 49 28.642 14.345 24.699 1.00 0.00 H new ATOM 0 HE21 GLN A 49 29.369 12.263 24.877 1.00 0.00 H new ATOM 0 HE22 GLN A 49 31.029 11.875 24.412 1.00 0.00 H new ATOM 794 N LEU A 50 27.412 18.062 22.697 1.00 0.00 N ATOM 795 CA LEU A 50 26.501 17.884 21.581 1.00 0.00 C ATOM 796 C LEU A 50 27.204 17.557 20.266 1.00 0.00 C ATOM 797 O LEU A 50 28.208 18.219 19.977 1.00 0.00 O ATOM 798 CB LEU A 50 25.800 19.192 21.209 1.00 0.00 C ATOM 799 CG LEU A 50 25.016 19.820 22.362 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.212 21.012 21.834 1.00 0.00 C ATOM 801 CD2 LEU A 50 24.098 18.783 23.010 1.00 0.00 C ATOM 0 H LEU A 50 27.731 19.009 22.900 1.00 0.00 H new ATOM 0 HA LEU A 50 25.844 17.088 21.931 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.545 19.906 20.857 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.120 19.006 20.378 1.00 0.00 H new ATOM 0 HG LEU A 50 25.709 20.172 23.126 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.651 21.464 22.652 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.892 21.750 21.410 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.520 20.672 21.064 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.547 19.246 23.829 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.395 18.405 22.268 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.697 17.958 23.396 1.00 0.00 H new ATOM 813 N GLU A 51 26.742 16.530 19.560 1.00 0.00 N ATOM 814 CA GLU A 51 27.209 15.979 18.303 1.00 0.00 C ATOM 815 C GLU A 51 26.099 16.065 17.244 1.00 0.00 C ATOM 816 O GLU A 51 24.934 16.184 17.609 1.00 0.00 O ATOM 817 CB GLU A 51 27.603 14.528 18.549 1.00 0.00 C ATOM 818 CG GLU A 51 28.703 14.301 19.580 1.00 0.00 C ATOM 819 CD GLU A 51 28.451 12.951 20.247 1.00 0.00 C ATOM 820 OE1 GLU A 51 27.306 12.546 20.531 1.00 0.00 O ATOM 821 OE2 GLU A 51 29.473 12.240 20.420 1.00 0.00 O ATOM 0 H GLU A 51 25.936 16.006 19.901 1.00 0.00 H new ATOM 0 HA GLU A 51 28.066 16.542 17.933 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.716 13.980 18.866 1.00 0.00 H new ATOM 0 HB3 GLU A 51 27.924 14.094 17.602 1.00 0.00 H new ATOM 0 HG2 GLU A 51 29.682 14.313 19.102 1.00 0.00 H new ATOM 0 HG3 GLU A 51 28.701 15.099 20.322 1.00 0.00 H new ATOM 828 N ASP A 52 26.484 16.064 15.969 1.00 0.00 N ATOM 829 CA ASP A 52 25.703 16.081 14.753 1.00 0.00 C ATOM 830 C ASP A 52 25.144 14.707 14.378 1.00 0.00 C ATOM 831 O ASP A 52 25.854 13.743 14.629 1.00 0.00 O ATOM 832 CB ASP A 52 26.567 16.664 13.629 1.00 0.00 C ATOM 833 CG ASP A 52 26.449 16.221 12.182 1.00 0.00 C ATOM 834 OD1 ASP A 52 25.347 16.185 11.596 1.00 0.00 O ATOM 835 OD2 ASP A 52 27.564 15.906 11.706 1.00 0.00 O ATOM 0 H ASP A 52 27.480 16.049 15.747 1.00 0.00 H new ATOM 0 HA ASP A 52 24.827 16.709 14.915 1.00 0.00 H new ATOM 0 HB2 ASP A 52 26.400 17.741 13.637 1.00 0.00 H new ATOM 0 HB3 ASP A 52 27.605 16.500 13.919 1.00 0.00 H new ATOM 840 N GLY A 53 23.918 14.684 13.854 1.00 0.00 N ATOM 841 CA GLY A 53 23.073 13.511 13.843 1.00 0.00 C ATOM 842 C GLY A 53 21.766 13.703 14.604 1.00 0.00 C ATOM 843 O GLY A 53 20.713 13.168 14.249 1.00 0.00 O ATOM 0 H GLY A 53 23.486 15.500 13.420 1.00 0.00 H new ATOM 0 HA2 GLY A 53 22.848 13.243 12.811 1.00 0.00 H new ATOM 0 HA3 GLY A 53 23.619 12.674 14.278 1.00 0.00 H new ATOM 847 N ARG A 54 21.794 14.623 15.567 1.00 0.00 N ATOM 848 CA ARG A 54 20.672 15.054 16.380 1.00 0.00 C ATOM 849 C ARG A 54 20.536 16.561 16.156 1.00 0.00 C ATOM 850 O ARG A 54 21.506 17.290 16.322 1.00 0.00 O ATOM 851 CB ARG A 54 20.963 14.630 17.817 1.00 0.00 C ATOM 852 CG ARG A 54 20.777 13.127 18.063 1.00 0.00 C ATOM 853 CD ARG A 54 21.377 12.657 19.385 1.00 0.00 C ATOM 854 NE ARG A 54 22.832 12.528 19.258 1.00 0.00 N ATOM 855 CZ ARG A 54 23.565 11.441 19.001 1.00 0.00 C ATOM 856 NH1 ARG A 54 23.035 10.273 18.607 1.00 0.00 N ATOM 857 NH2 ARG A 54 24.896 11.546 19.008 1.00 0.00 N ATOM 0 H ARG A 54 22.655 15.113 15.810 1.00 0.00 H new ATOM 0 HA ARG A 54 19.713 14.604 16.123 1.00 0.00 H new ATOM 0 HB2 ARG A 54 21.987 14.907 18.069 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.308 15.184 18.490 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.713 12.892 18.050 1.00 0.00 H new ATOM 0 HG3 ARG A 54 21.236 12.572 17.245 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.134 13.366 20.176 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.942 11.699 19.671 1.00 0.00 H new ATOM 0 HE ARG A 54 23.360 13.392 19.384 1.00 0.00 H new ATOM 0 HH11 ARG A 54 22.026 10.185 18.490 1.00 0.00 H new ATOM 0 HH12 ARG A 54 23.642 9.474 18.424 1.00 0.00 H new ATOM 0 HH21 ARG A 54 25.336 12.445 19.207 1.00 0.00 H new ATOM 0 HH22 ARG A 54 25.473 10.728 18.814 1.00 0.00 H new ATOM 871 N THR A 55 19.305 17.012 15.929 1.00 0.00 N ATOM 872 CA THR A 55 18.939 18.411 15.851 1.00 0.00 C ATOM 873 C THR A 55 18.737 19.078 17.222 1.00 0.00 C ATOM 874 O THR A 55 19.003 18.537 18.292 1.00 0.00 O ATOM 875 CB THR A 55 17.595 18.535 15.146 1.00 0.00 C ATOM 876 OG1 THR A 55 16.546 17.865 15.816 1.00 0.00 O ATOM 877 CG2 THR A 55 17.665 17.937 13.739 1.00 0.00 C ATOM 0 H THR A 55 18.512 16.386 15.790 1.00 0.00 H new ATOM 0 HA THR A 55 19.762 18.899 15.329 1.00 0.00 H new ATOM 0 HB THR A 55 17.384 19.604 15.126 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.723 16.901 15.820 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.694 18.036 13.253 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.419 18.466 13.156 1.00 0.00 H new ATOM 0 HG23 THR A 55 17.932 16.882 13.805 1.00 0.00 H new ATOM 885 N LEU A 56 18.309 20.329 17.236 1.00 0.00 N ATOM 886 CA LEU A 56 17.980 21.109 18.415 1.00 0.00 C ATOM 887 C LEU A 56 16.789 20.499 19.149 1.00 0.00 C ATOM 888 O LEU A 56 16.747 20.614 20.368 1.00 0.00 O ATOM 889 CB LEU A 56 17.630 22.559 18.109 1.00 0.00 C ATOM 890 CG LEU A 56 18.681 23.632 18.423 1.00 0.00 C ATOM 891 CD1 LEU A 56 19.914 23.441 17.543 1.00 0.00 C ATOM 892 CD2 LEU A 56 18.068 25.032 18.346 1.00 0.00 C ATOM 0 H LEU A 56 18.174 20.857 16.374 1.00 0.00 H new ATOM 0 HA LEU A 56 18.881 21.092 19.027 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.388 22.628 17.048 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.723 22.808 18.660 1.00 0.00 H new ATOM 0 HG LEU A 56 19.025 23.520 19.451 1.00 0.00 H new ATOM 0 HD11 LEU A 56 20.651 24.209 17.777 1.00 0.00 H new ATOM 0 HD12 LEU A 56 20.345 22.457 17.729 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.628 23.520 16.494 1.00 0.00 H new ATOM 0 HD21 LEU A 56 18.831 25.776 18.572 1.00 0.00 H new ATOM 0 HD22 LEU A 56 17.679 25.204 17.342 1.00 0.00 H new ATOM 0 HD23 LEU A 56 17.256 25.114 19.069 1.00 0.00 H new ATOM 904 N SER A 57 15.797 19.988 18.415 1.00 0.00 N ATOM 905 CA SER A 57 14.739 19.230 19.060 1.00 0.00 C ATOM 906 C SER A 57 15.156 17.923 19.744 1.00 0.00 C ATOM 907 O SER A 57 14.859 17.674 20.914 1.00 0.00 O ATOM 908 CB SER A 57 13.702 18.960 17.970 1.00 0.00 C ATOM 909 OG SER A 57 13.000 20.155 17.692 1.00 0.00 O ATOM 0 H SER A 57 15.710 20.084 17.403 1.00 0.00 H new ATOM 0 HA SER A 57 14.362 19.824 19.892 1.00 0.00 H new ATOM 0 HB2 SER A 57 14.192 18.593 17.068 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.009 18.184 18.295 1.00 0.00 H new ATOM 0 HG SER A 57 12.335 19.988 16.992 1.00 0.00 H new ATOM 915 N ASP A 58 15.941 17.050 19.119 1.00 0.00 N ATOM 916 CA ASP A 58 16.618 15.932 19.752 1.00 0.00 C ATOM 917 C ASP A 58 17.367 16.218 21.055 1.00 0.00 C ATOM 918 O ASP A 58 17.257 15.381 21.960 1.00 0.00 O ATOM 919 CB ASP A 58 17.510 15.242 18.725 1.00 0.00 C ATOM 920 CG ASP A 58 16.694 14.596 17.612 1.00 0.00 C ATOM 921 OD1 ASP A 58 15.830 13.714 17.818 1.00 0.00 O ATOM 922 OD2 ASP A 58 16.855 14.975 16.431 1.00 0.00 O ATOM 0 H ASP A 58 16.128 17.108 18.118 1.00 0.00 H new ATOM 0 HA ASP A 58 15.820 15.270 20.090 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.200 15.969 18.296 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.115 14.483 19.220 1.00 0.00 H new ATOM 927 N TYR A 59 18.064 17.322 21.264 1.00 0.00 N ATOM 928 CA TYR A 59 18.583 17.648 22.581 1.00 0.00 C ATOM 929 C TYR A 59 17.705 18.500 23.507 1.00 0.00 C ATOM 930 O TYR A 59 18.099 18.713 24.648 1.00 0.00 O ATOM 931 CB TYR A 59 19.931 18.332 22.351 1.00 0.00 C ATOM 932 CG TYR A 59 21.009 17.416 21.821 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.489 16.413 22.672 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.514 17.548 20.523 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.602 15.652 22.291 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.454 16.628 20.064 1.00 0.00 C ATOM 937 CZ TYR A 59 23.088 15.777 20.983 1.00 0.00 C ATOM 938 OH TYR A 59 24.136 14.991 20.591 1.00 0.00 O ATOM 0 H TYR A 59 18.283 18.006 20.540 1.00 0.00 H new ATOM 0 HA TYR A 59 18.641 16.708 23.129 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.793 19.155 21.650 1.00 0.00 H new ATOM 0 HB3 TYR A 59 20.270 18.767 23.291 1.00 0.00 H new ATOM 0 HD1 TYR A 59 21.003 16.227 23.618 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.179 18.353 19.885 1.00 0.00 H new ATOM 0 HE1 TYR A 59 23.076 14.982 22.992 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.692 16.570 19.012 1.00 0.00 H new ATOM 0 HH TYR A 59 24.112 14.144 21.083 1.00 0.00 H new ATOM 948 N ASN A 60 16.545 18.971 23.050 1.00 0.00 N ATOM 949 CA ASN A 60 15.422 19.639 23.666 1.00 0.00 C ATOM 950 C ASN A 60 15.645 21.141 23.850 1.00 0.00 C ATOM 951 O ASN A 60 15.314 21.681 24.905 1.00 0.00 O ATOM 952 CB ASN A 60 14.923 18.880 24.899 1.00 0.00 C ATOM 953 CG ASN A 60 14.079 17.665 24.514 1.00 0.00 C ATOM 954 OD1 ASN A 60 12.886 17.822 24.251 1.00 0.00 O ATOM 955 ND2 ASN A 60 14.603 16.441 24.482 1.00 0.00 N ATOM 0 H ASN A 60 16.352 18.865 22.054 1.00 0.00 H new ATOM 0 HA ASN A 60 14.586 19.605 22.968 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.775 18.556 25.496 1.00 0.00 H new ATOM 0 HB3 ASN A 60 14.332 19.550 25.524 1.00 0.00 H new ATOM 0 HD21 ASN A 60 14.017 15.642 24.241 1.00 0.00 H new ATOM 0 HD22 ASN A 60 15.590 16.303 24.699 1.00 0.00 H new ATOM 962 N ILE A 61 16.287 21.822 22.893 1.00 0.00 N ATOM 963 CA ILE A 61 16.774 23.168 23.087 1.00 0.00 C ATOM 964 C ILE A 61 15.596 24.019 22.612 1.00 0.00 C ATOM 965 O ILE A 61 14.953 23.724 21.598 1.00 0.00 O ATOM 966 CB ILE A 61 18.019 23.335 22.217 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.184 22.565 22.857 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.426 24.790 22.046 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.437 22.294 22.012 1.00 0.00 C ATOM 0 H ILE A 61 16.477 21.443 21.965 1.00 0.00 H new ATOM 0 HA ILE A 61 17.067 23.434 24.103 1.00 0.00 H new ATOM 0 HB ILE A 61 17.780 22.943 21.228 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.496 23.115 23.745 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.799 21.603 23.196 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.316 24.848 21.419 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.613 25.342 21.574 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.641 25.225 23.022 1.00 0.00 H new ATOM 0 HD11 ILE A 61 21.165 21.742 22.607 1.00 0.00 H new ATOM 0 HD12 ILE A 61 20.165 21.706 21.135 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.873 23.241 21.693 1.00 0.00 H new ATOM 981 N GLN A 62 15.422 25.111 23.336 1.00 0.00 N ATOM 982 CA GLN A 62 14.118 25.741 23.431 1.00 0.00 C ATOM 983 C GLN A 62 14.227 27.269 23.357 1.00 0.00 C ATOM 984 O GLN A 62 15.310 27.806 23.150 1.00 0.00 O ATOM 985 CB GLN A 62 13.445 25.182 24.685 1.00 0.00 C ATOM 986 CG GLN A 62 12.433 24.095 24.300 1.00 0.00 C ATOM 987 CD GLN A 62 11.008 24.501 23.941 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.641 25.671 24.080 1.00 0.00 O ATOM 989 NE2 GLN A 62 10.225 23.516 23.510 1.00 0.00 N ATOM 0 H GLN A 62 16.161 25.576 23.863 1.00 0.00 H new ATOM 0 HA GLN A 62 13.480 25.504 22.580 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.197 24.768 25.357 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.941 25.984 25.225 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.843 23.551 23.450 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.375 23.392 25.131 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.598 22.571 23.420 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.252 23.706 23.270 1.00 0.00 H new ATOM 998 N LYS A 63 13.130 27.966 23.644 1.00 0.00 N ATOM 999 CA LYS A 63 13.086 29.413 23.766 1.00 0.00 C ATOM 1000 C LYS A 63 14.027 29.904 24.860 1.00 0.00 C ATOM 1001 O LYS A 63 14.025 29.417 25.994 1.00 0.00 O ATOM 1002 CB LYS A 63 11.685 29.951 24.046 1.00 0.00 C ATOM 1003 CG LYS A 63 11.652 31.467 23.792 1.00 0.00 C ATOM 1004 CD LYS A 63 10.297 32.176 23.841 1.00 0.00 C ATOM 1005 CE LYS A 63 10.269 33.630 23.383 1.00 0.00 C ATOM 1006 NZ LYS A 63 10.536 34.536 24.515 1.00 0.00 N ATOM 0 H LYS A 63 12.225 27.523 23.802 1.00 0.00 H new ATOM 0 HA LYS A 63 13.406 29.794 22.796 1.00 0.00 H new ATOM 0 HB2 LYS A 63 10.958 29.450 23.407 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.403 29.739 25.077 1.00 0.00 H new ATOM 0 HG2 LYS A 63 12.304 31.942 24.525 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.089 31.650 22.810 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.595 31.612 23.227 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.928 32.135 24.866 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.014 33.785 22.602 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.297 33.861 22.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 11.094 35.349 24.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.635 34.872 24.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.068 34.027 25.249 1.00 0.00 H new ATOM 1020 N GLU A 64 14.955 30.816 24.565 1.00 0.00 N ATOM 1021 CA GLU A 64 15.764 31.431 25.596 1.00 0.00 C ATOM 1022 C GLU A 64 16.802 30.516 26.239 1.00 0.00 C ATOM 1023 O GLU A 64 17.342 30.713 27.328 1.00 0.00 O ATOM 1024 CB GLU A 64 14.925 32.207 26.607 1.00 0.00 C ATOM 1025 CG GLU A 64 14.734 33.712 26.414 1.00 0.00 C ATOM 1026 CD GLU A 64 13.501 34.110 25.623 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.418 33.811 26.164 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.532 34.630 24.491 1.00 0.00 O ATOM 0 H GLU A 64 15.158 31.139 23.619 1.00 0.00 H new ATOM 0 HA GLU A 64 16.373 32.164 25.067 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.935 31.751 26.632 1.00 0.00 H new ATOM 0 HB3 GLU A 64 15.371 32.056 27.590 1.00 0.00 H new ATOM 0 HG2 GLU A 64 14.685 34.185 27.395 1.00 0.00 H new ATOM 0 HG3 GLU A 64 15.614 34.112 25.911 1.00 0.00 H new ATOM 1035 N SER A 65 16.991 29.324 25.679 1.00 0.00 N ATOM 1036 CA SER A 65 17.787 28.236 26.213 1.00 0.00 C ATOM 1037 C SER A 65 19.227 28.495 25.767 1.00 0.00 C ATOM 1038 O SER A 65 19.407 29.234 24.807 1.00 0.00 O ATOM 1039 CB SER A 65 17.343 26.847 25.736 1.00 0.00 C ATOM 1040 OG SER A 65 16.020 26.676 26.176 1.00 0.00 O ATOM 0 H SER A 65 16.563 29.083 24.785 1.00 0.00 H new ATOM 0 HA SER A 65 17.672 28.220 27.297 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.403 26.773 24.650 1.00 0.00 H new ATOM 0 HB3 SER A 65 17.991 26.071 26.145 1.00 0.00 H new ATOM 0 HG SER A 65 15.895 25.755 26.488 1.00 0.00 H new ATOM 1046 N THR A 66 20.186 28.086 26.599 1.00 0.00 N ATOM 1047 CA THR A 66 21.597 28.349 26.445 1.00 0.00 C ATOM 1048 C THR A 66 22.527 27.133 26.390 1.00 0.00 C ATOM 1049 O THR A 66 22.554 26.357 27.347 1.00 0.00 O ATOM 1050 CB THR A 66 22.034 29.142 27.679 1.00 0.00 C ATOM 1051 OG1 THR A 66 21.093 30.196 27.675 1.00 0.00 O ATOM 1052 CG2 THR A 66 23.409 29.809 27.548 1.00 0.00 C ATOM 0 H THR A 66 19.979 27.538 27.434 1.00 0.00 H new ATOM 0 HA THR A 66 21.690 28.852 25.482 1.00 0.00 H new ATOM 0 HB THR A 66 22.088 28.494 28.554 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.265 30.791 28.435 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.640 30.349 28.466 1.00 0.00 H new ATOM 0 HG22 THR A 66 24.168 29.046 27.375 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.397 30.506 26.710 1.00 0.00 H new ATOM 1060 N LEU A 67 23.298 27.065 25.319 1.00 0.00 N ATOM 1061 CA LEU A 67 24.310 26.093 24.937 1.00 0.00 C ATOM 1062 C LEU A 67 25.616 26.660 25.481 1.00 0.00 C ATOM 1063 O LEU A 67 25.746 27.881 25.470 1.00 0.00 O ATOM 1064 CB LEU A 67 24.536 25.871 23.450 1.00 0.00 C ATOM 1065 CG LEU A 67 23.342 25.273 22.693 1.00 0.00 C ATOM 1066 CD1 LEU A 67 22.176 26.246 22.605 1.00 0.00 C ATOM 1067 CD2 LEU A 67 23.801 24.944 21.269 1.00 0.00 C ATOM 0 H LEU A 67 23.218 27.786 24.602 1.00 0.00 H new ATOM 0 HA LEU A 67 23.977 25.130 25.323 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.797 26.825 22.991 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.394 25.211 23.323 1.00 0.00 H new ATOM 0 HG LEU A 67 23.004 24.387 23.231 1.00 0.00 H new ATOM 0 HD11 LEU A 67 21.354 25.781 22.061 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.844 26.508 23.610 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.493 27.148 22.081 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.970 24.517 20.708 1.00 0.00 H new ATOM 0 HD22 LEU A 67 24.141 25.855 20.777 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.620 24.226 21.308 1.00 0.00 H new ATOM 1079 N HIS A 68 26.493 25.809 25.998 1.00 0.00 N ATOM 1080 CA HIS A 68 27.768 26.146 26.610 1.00 0.00 C ATOM 1081 C HIS A 68 28.860 25.855 25.585 1.00 0.00 C ATOM 1082 O HIS A 68 29.158 24.665 25.505 1.00 0.00 O ATOM 1083 CB HIS A 68 27.957 25.598 28.030 1.00 0.00 C ATOM 1084 CG HIS A 68 26.911 26.193 28.932 1.00 0.00 C ATOM 1085 ND1 HIS A 68 25.569 25.841 28.861 1.00 0.00 N ATOM 1086 CD2 HIS A 68 27.069 27.049 30.001 1.00 0.00 C ATOM 1087 CE1 HIS A 68 24.931 26.571 29.768 1.00 0.00 C ATOM 1088 NE2 HIS A 68 25.801 27.316 30.475 1.00 0.00 N ATOM 0 H HIS A 68 26.321 24.804 26.000 1.00 0.00 H new ATOM 0 HA HIS A 68 27.820 27.211 26.838 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.876 24.511 28.027 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.954 25.843 28.398 1.00 0.00 H new ATOM 0 HD2 HIS A 68 28.000 27.434 30.390 1.00 0.00 H new ATOM 0 HE1 HIS A 68 23.861 26.568 29.918 1.00 0.00 H new ATOM 0 HE2 HIS A 68 25.565 27.963 31.227 1.00 0.00 H new ATOM 1096 N LEU A 69 29.584 26.860 25.116 1.00 0.00 N ATOM 1097 CA LEU A 69 30.763 26.698 24.288 1.00 0.00 C ATOM 1098 C LEU A 69 31.948 26.615 25.247 1.00 0.00 C ATOM 1099 O LEU A 69 32.130 27.414 26.163 1.00 0.00 O ATOM 1100 CB LEU A 69 30.868 27.989 23.469 1.00 0.00 C ATOM 1101 CG LEU A 69 31.735 27.764 22.229 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.655 29.009 21.349 1.00 0.00 C ATOM 1103 CD2 LEU A 69 33.198 27.512 22.596 1.00 0.00 C ATOM 0 H LEU A 69 29.359 27.836 25.308 1.00 0.00 H new ATOM 0 HA LEU A 69 30.732 25.822 23.641 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.873 28.320 23.170 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.297 28.782 24.082 1.00 0.00 H new ATOM 0 HG LEU A 69 31.362 26.883 21.706 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.268 28.866 20.459 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.620 29.179 21.053 1.00 0.00 H new ATOM 0 HD13 LEU A 69 32.020 29.872 21.906 1.00 0.00 H new ATOM 0 HD21 LEU A 69 33.780 27.357 21.687 1.00 0.00 H new ATOM 0 HD22 LEU A 69 33.591 28.373 23.136 1.00 0.00 H new ATOM 0 HD23 LEU A 69 33.267 26.626 23.227 1.00 0.00 H new ATOM 1115 N VAL A 70 32.719 25.536 25.111 1.00 0.00 N ATOM 1116 CA VAL A 70 33.996 25.366 25.774 1.00 0.00 C ATOM 1117 C VAL A 70 35.131 25.046 24.797 1.00 0.00 C ATOM 1118 O VAL A 70 35.094 24.054 24.079 1.00 0.00 O ATOM 1119 CB VAL A 70 33.979 24.388 26.940 1.00 0.00 C ATOM 1120 CG1 VAL A 70 33.532 25.051 28.243 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.065 23.179 26.737 1.00 0.00 C ATOM 0 H VAL A 70 32.461 24.744 24.523 1.00 0.00 H new ATOM 0 HA VAL A 70 34.198 26.343 26.213 1.00 0.00 H new ATOM 0 HB VAL A 70 35.014 24.052 26.995 1.00 0.00 H new ATOM 0 HG11 VAL A 70 33.536 24.314 29.046 1.00 0.00 H new ATOM 0 HG12 VAL A 70 34.216 25.862 28.492 1.00 0.00 H new ATOM 0 HG13 VAL A 70 32.525 25.450 28.121 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.113 22.535 27.615 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.039 23.518 26.592 1.00 0.00 H new ATOM 0 HG23 VAL A 70 33.390 22.621 25.859 1.00 0.00 H new ATOM 1131 N LEU A 71 36.044 25.945 24.441 1.00 0.00 N ATOM 1132 CA LEU A 71 37.061 25.904 23.411 1.00 0.00 C ATOM 1133 C LEU A 71 38.278 25.091 23.857 1.00 0.00 C ATOM 1134 O LEU A 71 38.835 25.187 24.951 1.00 0.00 O ATOM 1135 CB LEU A 71 37.510 27.360 23.320 1.00 0.00 C ATOM 1136 CG LEU A 71 38.623 27.571 22.293 1.00 0.00 C ATOM 1137 CD1 LEU A 71 38.301 27.156 20.859 1.00 0.00 C ATOM 1138 CD2 LEU A 71 39.105 29.015 22.442 1.00 0.00 C ATOM 0 H LEU A 71 36.087 26.834 24.939 1.00 0.00 H new ATOM 0 HA LEU A 71 36.682 25.463 22.489 1.00 0.00 H new ATOM 0 HB2 LEU A 71 36.656 27.984 23.057 1.00 0.00 H new ATOM 0 HB3 LEU A 71 37.857 27.691 24.299 1.00 0.00 H new ATOM 0 HG LEU A 71 39.434 26.877 22.514 1.00 0.00 H new ATOM 0 HD11 LEU A 71 39.163 27.352 20.221 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.064 26.092 20.833 1.00 0.00 H new ATOM 0 HD13 LEU A 71 37.446 27.727 20.498 1.00 0.00 H new ATOM 0 HD21 LEU A 71 39.903 29.208 21.725 1.00 0.00 H new ATOM 0 HD22 LEU A 71 38.275 29.697 22.255 1.00 0.00 H new ATOM 0 HD23 LEU A 71 39.481 29.171 23.453 1.00 0.00 H new