USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 629 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= 2.52 (180deg=1.8) USER MOD Single : A 2 GLN : amide:sc= -0.655 K(o=-0.65,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 75:sc= 0.486 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.00582 USER MOD Single : A 11 LYS NZ :NH3+ 146:sc= 0.963 (180deg=0.347) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 62:sc= 1.25 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0754 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ -139:sc= 0.898 (180deg=0.168) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0.879 K(o=0.88,f=-3.6!) USER MOD Single : A 41 GLN : amide:sc=-0.00118 X(o=-0.0012,f=-0.23) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.217 K(o=0.22,f=-2.9) USER MOD Single : A 55 THR OG1 : rot -27:sc= 1.32 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 1:sc= 0.932 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 62 GLN : amide:sc= 0.556 K(o=0.56,f=-6.1!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 97:sc= 0.0263 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.279 K(o=-0.28,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.389 31.255 16.480 1.00 0.00 N ATOM 2 CA MET A 1 13.459 30.572 17.781 1.00 0.00 C ATOM 3 C MET A 1 14.740 31.046 18.469 1.00 0.00 C ATOM 4 O MET A 1 15.776 30.873 17.843 1.00 0.00 O ATOM 5 CB MET A 1 13.259 29.059 17.694 1.00 0.00 C ATOM 6 CG MET A 1 12.854 28.557 19.086 1.00 0.00 C ATOM 7 SD MET A 1 12.875 26.757 19.211 1.00 0.00 S ATOM 8 CE MET A 1 14.639 26.385 19.400 1.00 0.00 C ATOM 0 H1 MET A 1 12.416 31.209 16.116 1.00 0.00 H new ATOM 0 H2 MET A 1 13.669 32.250 16.595 1.00 0.00 H new ATOM 0 H3 MET A 1 14.033 30.790 15.809 1.00 0.00 H new ATOM 0 HA MET A 1 12.614 30.848 18.411 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.488 28.817 16.962 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.176 28.571 17.364 1.00 0.00 H new ATOM 0 HG2 MET A 1 13.531 28.977 19.830 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.855 28.922 19.323 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.776 25.307 19.486 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.183 26.752 18.530 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.019 26.872 20.298 1.00 0.00 H new ATOM 20 N GLN A 2 14.619 31.715 19.617 1.00 0.00 N ATOM 21 CA GLN A 2 15.749 32.402 20.220 1.00 0.00 C ATOM 22 C GLN A 2 16.464 31.460 21.174 1.00 0.00 C ATOM 23 O GLN A 2 15.818 30.659 21.859 1.00 0.00 O ATOM 24 CB GLN A 2 15.289 33.637 21.009 1.00 0.00 C ATOM 25 CG GLN A 2 14.530 34.709 20.231 1.00 0.00 C ATOM 26 CD GLN A 2 14.016 35.822 21.130 1.00 0.00 C ATOM 27 OE1 GLN A 2 13.074 36.474 20.693 1.00 0.00 O ATOM 28 NE2 GLN A 2 14.541 35.968 22.341 1.00 0.00 N ATOM 0 H GLN A 2 13.748 31.792 20.143 1.00 0.00 H new ATOM 0 HA GLN A 2 16.417 32.720 19.420 1.00 0.00 H new ATOM 0 HB2 GLN A 2 14.655 33.299 21.829 1.00 0.00 H new ATOM 0 HB3 GLN A 2 16.168 34.101 21.456 1.00 0.00 H new ATOM 0 HG2 GLN A 2 15.184 35.133 19.470 1.00 0.00 H new ATOM 0 HG3 GLN A 2 13.690 34.250 19.709 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.326 35.385 22.630 1.00 0.00 H new ATOM 0 HE22 GLN A 2 14.159 36.663 22.982 1.00 0.00 H new ATOM 37 N ILE A 3 17.783 31.602 21.264 1.00 0.00 N ATOM 38 CA ILE A 3 18.626 30.863 22.189 1.00 0.00 C ATOM 39 C ILE A 3 19.824 31.652 22.720 1.00 0.00 C ATOM 40 O ILE A 3 20.109 32.729 22.206 1.00 0.00 O ATOM 41 CB ILE A 3 18.976 29.461 21.695 1.00 0.00 C ATOM 42 CG1 ILE A 3 19.388 29.370 20.226 1.00 0.00 C ATOM 43 CG2 ILE A 3 17.946 28.399 22.077 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.199 28.125 19.848 1.00 0.00 C ATOM 0 H ILE A 3 18.306 32.253 20.678 1.00 0.00 H new ATOM 0 HA ILE A 3 18.004 30.710 23.071 1.00 0.00 H new ATOM 0 HB ILE A 3 19.884 29.227 22.250 1.00 0.00 H new ATOM 0 HG12 ILE A 3 18.488 29.398 19.611 1.00 0.00 H new ATOM 0 HG13 ILE A 3 19.973 30.255 19.975 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.263 27.430 21.692 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.861 28.348 23.163 1.00 0.00 H new ATOM 0 HG23 ILE A 3 16.978 28.661 21.650 1.00 0.00 H new ATOM 0 HD11 ILE A 3 20.441 28.157 18.786 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.121 28.101 20.429 1.00 0.00 H new ATOM 0 HD13 ILE A 3 19.613 27.231 20.060 1.00 0.00 H new ATOM 56 N PHE A 4 20.500 31.228 23.781 1.00 0.00 N ATOM 57 CA PHE A 4 21.576 31.966 24.410 1.00 0.00 C ATOM 58 C PHE A 4 22.782 31.039 24.516 1.00 0.00 C ATOM 59 O PHE A 4 22.719 29.849 24.823 1.00 0.00 O ATOM 60 CB PHE A 4 21.260 32.468 25.813 1.00 0.00 C ATOM 61 CG PHE A 4 20.199 33.520 25.621 1.00 0.00 C ATOM 62 CD1 PHE A 4 18.845 33.178 25.628 1.00 0.00 C ATOM 63 CD2 PHE A 4 20.568 34.846 25.350 1.00 0.00 C ATOM 64 CE1 PHE A 4 17.874 34.189 25.577 1.00 0.00 C ATOM 65 CE2 PHE A 4 19.620 35.870 25.314 1.00 0.00 C ATOM 66 CZ PHE A 4 18.269 35.525 25.444 1.00 0.00 C ATOM 0 H PHE A 4 20.305 30.336 24.236 1.00 0.00 H new ATOM 0 HA PHE A 4 21.754 32.844 23.790 1.00 0.00 H new ATOM 0 HB2 PHE A 4 20.903 31.659 26.450 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.146 32.884 26.292 1.00 0.00 H new ATOM 0 HD1 PHE A 4 18.547 32.141 25.672 1.00 0.00 H new ATOM 0 HD2 PHE A 4 21.606 35.079 25.166 1.00 0.00 H new ATOM 0 HE1 PHE A 4 16.826 33.937 25.640 1.00 0.00 H new ATOM 0 HE2 PHE A 4 19.920 36.900 25.189 1.00 0.00 H new ATOM 0 HZ PHE A 4 17.520 36.303 25.442 1.00 0.00 H new ATOM 76 N VAL A 5 24.015 31.528 24.386 1.00 0.00 N ATOM 77 CA VAL A 5 25.241 30.748 24.423 1.00 0.00 C ATOM 78 C VAL A 5 26.197 31.584 25.271 1.00 0.00 C ATOM 79 O VAL A 5 26.778 32.524 24.727 1.00 0.00 O ATOM 80 CB VAL A 5 25.767 30.408 23.030 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.229 29.959 22.932 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.803 29.550 22.215 1.00 0.00 C ATOM 0 H VAL A 5 24.189 32.523 24.246 1.00 0.00 H new ATOM 0 HA VAL A 5 25.095 29.761 24.861 1.00 0.00 H new ATOM 0 HB VAL A 5 25.801 31.384 22.545 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.476 29.749 21.891 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.879 30.750 23.306 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.374 29.058 23.529 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.237 29.345 21.236 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.623 28.610 22.737 1.00 0.00 H new ATOM 0 HG23 VAL A 5 23.860 30.082 22.089 1.00 0.00 H new ATOM 92 N LYS A 6 26.497 31.201 26.512 1.00 0.00 N ATOM 93 CA LYS A 6 27.619 31.669 27.298 1.00 0.00 C ATOM 94 C LYS A 6 28.947 31.026 26.887 1.00 0.00 C ATOM 95 O LYS A 6 29.172 29.815 26.904 1.00 0.00 O ATOM 96 CB LYS A 6 27.387 31.452 28.792 1.00 0.00 C ATOM 97 CG LYS A 6 28.450 32.091 29.686 1.00 0.00 C ATOM 98 CD LYS A 6 28.231 31.957 31.196 1.00 0.00 C ATOM 99 CE LYS A 6 29.275 32.664 32.062 1.00 0.00 C ATOM 100 NZ LYS A 6 29.082 32.224 33.456 1.00 0.00 N ATOM 0 H LYS A 6 25.929 30.520 27.015 1.00 0.00 H new ATOM 0 HA LYS A 6 27.691 32.738 27.097 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.411 31.856 29.060 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.354 30.381 28.992 1.00 0.00 H new ATOM 0 HG2 LYS A 6 29.416 31.650 29.439 1.00 0.00 H new ATOM 0 HG3 LYS A 6 28.512 33.151 29.441 1.00 0.00 H new ATOM 0 HD2 LYS A 6 27.246 32.354 31.442 1.00 0.00 H new ATOM 0 HD3 LYS A 6 28.222 30.898 31.455 1.00 0.00 H new ATOM 0 HE2 LYS A 6 30.281 32.421 31.721 1.00 0.00 H new ATOM 0 HE3 LYS A 6 29.165 33.746 31.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 29.781 32.691 34.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 28.123 32.477 33.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 29.205 31.193 33.515 1.00 0.00 H new ATOM 114 N THR A 7 29.932 31.877 26.604 1.00 0.00 N ATOM 115 CA THR A 7 31.292 31.532 26.242 1.00 0.00 C ATOM 116 C THR A 7 32.070 31.158 27.503 1.00 0.00 C ATOM 117 O THR A 7 31.718 31.663 28.563 1.00 0.00 O ATOM 118 CB THR A 7 31.930 32.679 25.460 1.00 0.00 C ATOM 119 OG1 THR A 7 31.090 33.308 24.526 1.00 0.00 O ATOM 120 CG2 THR A 7 33.252 32.347 24.756 1.00 0.00 C ATOM 0 H THR A 7 29.785 32.886 26.625 1.00 0.00 H new ATOM 0 HA THR A 7 31.306 30.663 25.584 1.00 0.00 H new ATOM 0 HB THR A 7 32.135 33.372 26.276 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.447 33.879 24.996 1.00 0.00 H new ATOM 0 HG21 THR A 7 33.617 33.230 24.232 1.00 0.00 H new ATOM 0 HG22 THR A 7 33.989 32.033 25.495 1.00 0.00 H new ATOM 0 HG23 THR A 7 33.091 31.541 24.040 1.00 0.00 H new ATOM 128 N LEU A 8 33.137 30.380 27.314 1.00 0.00 N ATOM 129 CA LEU A 8 34.194 30.156 28.275 1.00 0.00 C ATOM 130 C LEU A 8 34.856 31.379 28.931 1.00 0.00 C ATOM 131 O LEU A 8 35.351 31.341 30.048 1.00 0.00 O ATOM 132 CB LEU A 8 35.299 29.283 27.692 1.00 0.00 C ATOM 133 CG LEU A 8 35.513 27.884 28.266 1.00 0.00 C ATOM 134 CD1 LEU A 8 36.634 27.066 27.625 1.00 0.00 C ATOM 135 CD2 LEU A 8 35.899 27.871 29.747 1.00 0.00 C ATOM 0 H LEU A 8 33.285 29.870 26.443 1.00 0.00 H new ATOM 0 HA LEU A 8 33.644 29.667 29.079 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.106 29.176 26.625 1.00 0.00 H new ATOM 0 HB3 LEU A 8 36.238 29.828 27.793 1.00 0.00 H new ATOM 0 HG LEU A 8 34.532 27.452 28.066 1.00 0.00 H new ATOM 0 HD11 LEU A 8 36.696 26.092 28.110 1.00 0.00 H new ATOM 0 HD12 LEU A 8 36.425 26.931 26.564 1.00 0.00 H new ATOM 0 HD13 LEU A 8 37.582 27.592 27.744 1.00 0.00 H new ATOM 0 HD21 LEU A 8 36.033 26.841 30.079 1.00 0.00 H new ATOM 0 HD22 LEU A 8 36.830 28.421 29.885 1.00 0.00 H new ATOM 0 HD23 LEU A 8 35.109 28.341 30.333 1.00 0.00 H new ATOM 147 N THR A 9 34.968 32.448 28.144 1.00 0.00 N ATOM 148 CA THR A 9 35.615 33.698 28.471 1.00 0.00 C ATOM 149 C THR A 9 34.749 34.598 29.349 1.00 0.00 C ATOM 150 O THR A 9 35.232 35.627 29.830 1.00 0.00 O ATOM 151 CB THR A 9 36.085 34.438 27.213 1.00 0.00 C ATOM 152 OG1 THR A 9 35.098 34.522 26.204 1.00 0.00 O ATOM 153 CG2 THR A 9 37.320 33.705 26.685 1.00 0.00 C ATOM 0 H THR A 9 34.580 32.454 27.201 1.00 0.00 H new ATOM 0 HA THR A 9 36.497 33.440 29.058 1.00 0.00 H new ATOM 0 HB THR A 9 36.311 35.469 27.485 1.00 0.00 H new ATOM 0 HG1 THR A 9 35.460 35.005 25.432 1.00 0.00 H new ATOM 0 HG21 THR A 9 37.684 34.205 25.787 1.00 0.00 H new ATOM 0 HG22 THR A 9 38.101 33.713 27.446 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.057 32.675 26.445 1.00 0.00 H new ATOM 161 N GLY A 10 33.468 34.313 29.532 1.00 0.00 N ATOM 162 CA GLY A 10 32.555 35.003 30.426 1.00 0.00 C ATOM 163 C GLY A 10 31.484 35.766 29.639 1.00 0.00 C ATOM 164 O GLY A 10 30.508 36.150 30.296 1.00 0.00 O ATOM 0 H GLY A 10 33.014 33.550 29.031 1.00 0.00 H new ATOM 0 HA2 GLY A 10 32.078 34.283 31.091 1.00 0.00 H new ATOM 0 HA3 GLY A 10 33.112 35.697 31.055 1.00 0.00 H new ATOM 168 N LYS A 11 31.597 35.859 28.326 1.00 0.00 N ATOM 169 CA LYS A 11 30.723 36.633 27.461 1.00 0.00 C ATOM 170 C LYS A 11 29.570 35.748 26.961 1.00 0.00 C ATOM 171 O LYS A 11 29.729 34.553 26.757 1.00 0.00 O ATOM 172 CB LYS A 11 31.528 37.258 26.317 1.00 0.00 C ATOM 173 CG LYS A 11 31.756 36.467 25.037 1.00 0.00 C ATOM 174 CD LYS A 11 32.419 37.163 23.839 1.00 0.00 C ATOM 175 CE LYS A 11 32.167 36.557 22.454 1.00 0.00 C ATOM 176 NZ LYS A 11 33.001 37.173 21.406 1.00 0.00 N ATOM 0 H LYS A 11 32.333 35.376 27.810 1.00 0.00 H new ATOM 0 HA LYS A 11 30.280 37.456 28.021 1.00 0.00 H new ATOM 0 HB2 LYS A 11 31.033 38.189 26.041 1.00 0.00 H new ATOM 0 HB3 LYS A 11 32.507 37.524 26.715 1.00 0.00 H new ATOM 0 HG2 LYS A 11 32.364 35.599 25.291 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.788 36.092 24.705 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.083 38.200 23.821 1.00 0.00 H new ATOM 0 HD3 LYS A 11 33.495 37.180 24.010 1.00 0.00 H new ATOM 0 HE2 LYS A 11 32.366 35.486 22.488 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.115 36.678 22.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.252 36.456 20.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.471 37.942 20.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 33.868 37.556 21.833 1.00 0.00 H new ATOM 190 N THR A 12 28.474 36.356 26.515 1.00 0.00 N ATOM 191 CA THR A 12 27.327 35.592 26.064 1.00 0.00 C ATOM 192 C THR A 12 27.050 36.125 24.658 1.00 0.00 C ATOM 193 O THR A 12 27.031 37.314 24.354 1.00 0.00 O ATOM 194 CB THR A 12 26.137 35.949 26.949 1.00 0.00 C ATOM 195 OG1 THR A 12 26.378 35.454 28.250 1.00 0.00 O ATOM 196 CG2 THR A 12 24.929 35.061 26.620 1.00 0.00 C ATOM 0 H THR A 12 28.361 37.368 26.458 1.00 0.00 H new ATOM 0 HA THR A 12 27.492 34.515 26.092 1.00 0.00 H new ATOM 0 HB THR A 12 25.986 37.022 26.832 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.621 35.678 28.831 1.00 0.00 H new ATOM 0 HG21 THR A 12 24.092 35.333 27.263 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.646 35.203 25.577 1.00 0.00 H new ATOM 0 HG23 THR A 12 25.190 34.016 26.786 1.00 0.00 H new ATOM 204 N ILE A 13 26.783 35.201 23.739 1.00 0.00 N ATOM 205 CA ILE A 13 26.191 35.280 22.420 1.00 0.00 C ATOM 206 C ILE A 13 24.750 34.791 22.557 1.00 0.00 C ATOM 207 O ILE A 13 24.467 33.997 23.451 1.00 0.00 O ATOM 208 CB ILE A 13 27.017 34.500 21.395 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.442 35.057 21.272 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.339 34.376 20.030 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.580 34.043 21.243 1.00 0.00 C ATOM 0 H ILE A 13 27.018 34.230 23.945 1.00 0.00 H new ATOM 0 HA ILE A 13 26.185 36.301 22.038 1.00 0.00 H new ATOM 0 HB ILE A 13 27.087 33.484 21.784 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.496 35.653 20.361 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.614 35.736 22.107 1.00 0.00 H new ATOM 0 HG21 ILE A 13 26.982 33.811 19.354 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.387 33.858 20.143 1.00 0.00 H new ATOM 0 HG23 ILE A 13 26.165 35.370 19.619 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.532 34.567 21.154 1.00 0.00 H new ATOM 0 HD12 ILE A 13 29.572 33.460 22.164 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.451 33.376 20.390 1.00 0.00 H new ATOM 223 N THR A 14 23.911 35.158 21.595 1.00 0.00 N ATOM 224 CA THR A 14 22.561 34.766 21.226 1.00 0.00 C ATOM 225 C THR A 14 22.405 34.551 19.725 1.00 0.00 C ATOM 226 O THR A 14 23.068 35.137 18.872 1.00 0.00 O ATOM 227 CB THR A 14 21.451 35.585 21.905 1.00 0.00 C ATOM 228 OG1 THR A 14 20.139 35.333 21.451 1.00 0.00 O ATOM 229 CG2 THR A 14 21.633 37.101 21.820 1.00 0.00 C ATOM 0 H THR A 14 24.231 35.870 20.939 1.00 0.00 H new ATOM 0 HA THR A 14 22.405 33.778 21.658 1.00 0.00 H new ATOM 0 HB THR A 14 21.562 35.234 22.931 1.00 0.00 H new ATOM 0 HG1 THR A 14 19.905 34.398 21.630 1.00 0.00 H new ATOM 0 HG21 THR A 14 20.804 37.596 22.325 1.00 0.00 H new ATOM 0 HG22 THR A 14 22.570 37.382 22.300 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.655 37.407 20.774 1.00 0.00 H new ATOM 237 N LEU A 15 21.491 33.647 19.385 1.00 0.00 N ATOM 238 CA LEU A 15 21.277 33.187 18.029 1.00 0.00 C ATOM 239 C LEU A 15 19.765 33.019 17.838 1.00 0.00 C ATOM 240 O LEU A 15 19.074 32.659 18.790 1.00 0.00 O ATOM 241 CB LEU A 15 21.939 31.891 17.579 1.00 0.00 C ATOM 242 CG LEU A 15 23.460 32.037 17.496 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.227 31.551 18.731 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.941 31.169 16.322 1.00 0.00 C ATOM 0 H LEU A 15 20.869 33.208 20.064 1.00 0.00 H new ATOM 0 HA LEU A 15 21.756 33.950 17.416 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.687 31.092 18.276 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.547 31.600 16.604 1.00 0.00 H new ATOM 0 HG LEU A 15 23.657 33.104 17.391 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.296 31.696 18.576 1.00 0.00 H new ATOM 0 HD12 LEU A 15 23.907 32.119 19.605 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.024 30.492 18.892 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.024 31.248 16.231 1.00 0.00 H new ATOM 0 HD22 LEU A 15 23.667 30.130 16.502 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.474 31.513 15.399 1.00 0.00 H new ATOM 256 N GLU A 16 19.308 33.328 16.633 1.00 0.00 N ATOM 257 CA GLU A 16 18.014 32.866 16.166 1.00 0.00 C ATOM 258 C GLU A 16 18.227 31.648 15.261 1.00 0.00 C ATOM 259 O GLU A 16 19.100 31.598 14.389 1.00 0.00 O ATOM 260 CB GLU A 16 17.513 34.097 15.417 1.00 0.00 C ATOM 261 CG GLU A 16 16.027 33.967 15.084 1.00 0.00 C ATOM 262 CD GLU A 16 15.230 34.577 16.227 1.00 0.00 C ATOM 263 OE1 GLU A 16 15.399 35.765 16.577 1.00 0.00 O ATOM 264 OE2 GLU A 16 14.457 33.751 16.751 1.00 0.00 O ATOM 0 H GLU A 16 19.819 33.900 15.960 1.00 0.00 H new ATOM 0 HA GLU A 16 17.309 32.534 16.929 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.677 34.988 16.023 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.085 34.226 14.498 1.00 0.00 H new ATOM 0 HG2 GLU A 16 15.801 34.477 14.148 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.758 32.919 14.949 1.00 0.00 H new ATOM 271 N VAL A 17 17.514 30.574 15.564 1.00 0.00 N ATOM 272 CA VAL A 17 17.383 29.330 14.840 1.00 0.00 C ATOM 273 C VAL A 17 15.940 28.892 14.561 1.00 0.00 C ATOM 274 O VAL A 17 14.984 29.465 15.095 1.00 0.00 O ATOM 275 CB VAL A 17 18.197 28.277 15.601 1.00 0.00 C ATOM 276 CG1 VAL A 17 19.664 28.649 15.853 1.00 0.00 C ATOM 277 CG2 VAL A 17 17.599 27.920 16.952 1.00 0.00 C ATOM 0 H VAL A 17 16.955 30.557 16.417 1.00 0.00 H new ATOM 0 HA VAL A 17 17.777 29.468 13.833 1.00 0.00 H new ATOM 0 HB VAL A 17 18.158 27.427 14.920 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.156 27.842 16.397 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.169 28.804 14.900 1.00 0.00 H new ATOM 0 HG13 VAL A 17 19.711 29.565 16.442 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.222 27.170 17.439 1.00 0.00 H new ATOM 0 HG22 VAL A 17 17.551 28.813 17.576 1.00 0.00 H new ATOM 0 HG23 VAL A 17 16.595 27.521 16.811 1.00 0.00 H new ATOM 287 N GLU A 18 15.828 27.825 13.777 1.00 0.00 N ATOM 288 CA GLU A 18 14.764 26.839 13.752 1.00 0.00 C ATOM 289 C GLU A 18 15.298 25.595 14.461 1.00 0.00 C ATOM 290 O GLU A 18 16.466 25.222 14.404 1.00 0.00 O ATOM 291 CB GLU A 18 14.408 26.512 12.299 1.00 0.00 C ATOM 292 CG GLU A 18 13.388 27.518 11.784 1.00 0.00 C ATOM 293 CD GLU A 18 11.947 27.344 12.239 1.00 0.00 C ATOM 294 OE1 GLU A 18 11.530 26.159 12.272 1.00 0.00 O ATOM 295 OE2 GLU A 18 11.251 28.347 12.485 1.00 0.00 O ATOM 0 H GLU A 18 16.545 27.614 13.083 1.00 0.00 H new ATOM 0 HA GLU A 18 13.865 27.207 14.246 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.305 26.538 11.680 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.004 25.502 12.232 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.717 28.514 12.080 1.00 0.00 H new ATOM 0 HG3 GLU A 18 13.404 27.487 10.695 1.00 0.00 H new ATOM 302 N PRO A 19 14.417 24.850 15.129 1.00 0.00 N ATOM 303 CA PRO A 19 14.810 23.568 15.692 1.00 0.00 C ATOM 304 C PRO A 19 15.192 22.561 14.610 1.00 0.00 C ATOM 305 O PRO A 19 15.810 21.571 14.979 1.00 0.00 O ATOM 306 CB PRO A 19 13.700 23.026 16.588 1.00 0.00 C ATOM 307 CG PRO A 19 12.539 23.937 16.188 1.00 0.00 C ATOM 308 CD PRO A 19 13.019 25.133 15.357 1.00 0.00 C ATOM 0 HA PRO A 19 15.701 23.727 16.299 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.487 21.975 16.392 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.945 23.110 17.647 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.808 23.366 15.616 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.032 24.296 17.084 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.469 25.216 14.420 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.882 26.073 15.891 1.00 0.00 H new ATOM 316 N SER A 20 14.836 22.886 13.365 1.00 0.00 N ATOM 317 CA SER A 20 15.181 22.037 12.239 1.00 0.00 C ATOM 318 C SER A 20 16.570 22.379 11.693 1.00 0.00 C ATOM 319 O SER A 20 16.955 21.796 10.666 1.00 0.00 O ATOM 320 CB SER A 20 14.053 22.312 11.246 1.00 0.00 C ATOM 321 OG SER A 20 12.889 21.760 11.837 1.00 0.00 O ATOM 0 H SER A 20 14.313 23.726 13.119 1.00 0.00 H new ATOM 0 HA SER A 20 15.255 20.978 12.487 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.936 23.381 11.071 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.259 21.852 10.280 1.00 0.00 H new ATOM 0 HG SER A 20 12.121 21.906 11.245 1.00 0.00 H new ATOM 327 N ASP A 21 17.216 23.336 12.336 1.00 0.00 N ATOM 328 CA ASP A 21 18.575 23.658 11.965 1.00 0.00 C ATOM 329 C ASP A 21 19.495 22.770 12.818 1.00 0.00 C ATOM 330 O ASP A 21 19.175 22.319 13.915 1.00 0.00 O ATOM 331 CB ASP A 21 19.056 25.065 12.316 1.00 0.00 C ATOM 332 CG ASP A 21 18.422 26.264 11.636 1.00 0.00 C ATOM 333 OD1 ASP A 21 18.359 26.399 10.394 1.00 0.00 O ATOM 334 OD2 ASP A 21 17.892 27.053 12.451 1.00 0.00 O ATOM 0 H ASP A 21 16.829 23.890 13.100 1.00 0.00 H new ATOM 0 HA ASP A 21 18.603 23.533 10.883 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.929 25.195 13.391 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.126 25.104 12.114 1.00 0.00 H new ATOM 339 N THR A 22 20.597 22.333 12.209 1.00 0.00 N ATOM 340 CA THR A 22 21.483 21.307 12.721 1.00 0.00 C ATOM 341 C THR A 22 22.394 22.052 13.697 1.00 0.00 C ATOM 342 O THR A 22 22.550 23.267 13.760 1.00 0.00 O ATOM 343 CB THR A 22 22.320 20.723 11.586 1.00 0.00 C ATOM 344 OG1 THR A 22 23.051 21.650 10.823 1.00 0.00 O ATOM 345 CG2 THR A 22 21.523 19.822 10.631 1.00 0.00 C ATOM 0 H THR A 22 20.903 22.704 11.309 1.00 0.00 H new ATOM 0 HA THR A 22 20.943 20.483 13.186 1.00 0.00 H new ATOM 0 HB THR A 22 23.041 20.123 12.141 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.552 21.177 10.126 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.184 19.444 9.851 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.102 18.984 11.187 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.717 20.397 10.176 1.00 0.00 H new ATOM 353 N ILE A 23 23.036 21.254 14.546 1.00 0.00 N ATOM 354 CA ILE A 23 24.119 21.725 15.384 1.00 0.00 C ATOM 355 C ILE A 23 25.263 22.202 14.499 1.00 0.00 C ATOM 356 O ILE A 23 25.848 23.240 14.826 1.00 0.00 O ATOM 357 CB ILE A 23 24.523 20.626 16.377 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.476 20.111 17.360 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.755 21.029 17.185 1.00 0.00 C ATOM 360 CD1 ILE A 23 22.747 21.227 18.102 1.00 0.00 C ATOM 0 H ILE A 23 22.816 20.266 14.667 1.00 0.00 H new ATOM 0 HA ILE A 23 23.807 22.579 15.986 1.00 0.00 H new ATOM 0 HB ILE A 23 24.708 19.795 15.696 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.747 19.506 16.821 1.00 0.00 H new ATOM 0 HG13 ILE A 23 23.959 19.457 18.085 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.013 20.228 17.878 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.591 21.208 16.509 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.541 21.939 17.746 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.017 20.793 18.785 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.467 21.818 18.668 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.236 21.868 17.384 1.00 0.00 H new ATOM 372 N GLU A 24 25.653 21.458 13.474 1.00 0.00 N ATOM 373 CA GLU A 24 26.641 21.913 12.510 1.00 0.00 C ATOM 374 C GLU A 24 26.380 23.315 11.959 1.00 0.00 C ATOM 375 O GLU A 24 27.261 24.130 11.696 1.00 0.00 O ATOM 376 CB GLU A 24 26.775 20.787 11.490 1.00 0.00 C ATOM 377 CG GLU A 24 28.124 20.590 10.806 1.00 0.00 C ATOM 378 CD GLU A 24 27.911 20.589 9.297 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.160 19.702 8.838 1.00 0.00 O ATOM 380 OE2 GLU A 24 28.560 21.431 8.642 1.00 0.00 O ATOM 0 H GLU A 24 25.293 20.522 13.288 1.00 0.00 H new ATOM 0 HA GLU A 24 27.612 22.084 12.976 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.515 19.853 11.989 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.029 20.951 10.713 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.812 21.387 11.090 1.00 0.00 H new ATOM 0 HG3 GLU A 24 28.576 19.650 11.125 1.00 0.00 H new ATOM 387 N ASN A 25 25.126 23.710 11.801 1.00 0.00 N ATOM 388 CA ASN A 25 24.780 25.056 11.360 1.00 0.00 C ATOM 389 C ASN A 25 25.015 26.103 12.452 1.00 0.00 C ATOM 390 O ASN A 25 25.370 27.226 12.136 1.00 0.00 O ATOM 391 CB ASN A 25 23.284 25.157 11.078 1.00 0.00 C ATOM 392 CG ASN A 25 22.794 26.418 10.387 1.00 0.00 C ATOM 393 OD1 ASN A 25 22.043 27.243 10.891 1.00 0.00 O ATOM 394 ND2 ASN A 25 23.059 26.502 9.083 1.00 0.00 N ATOM 0 H ASN A 25 24.320 23.109 11.974 1.00 0.00 H new ATOM 0 HA ASN A 25 25.402 25.239 10.484 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.997 24.302 10.466 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.754 25.063 12.026 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.638 27.244 8.524 1.00 0.00 H new ATOM 0 HD22 ASN A 25 23.682 25.824 8.645 1.00 0.00 H new ATOM 401 N VAL A 26 24.801 25.794 13.735 1.00 0.00 N ATOM 402 CA VAL A 26 25.199 26.642 14.846 1.00 0.00 C ATOM 403 C VAL A 26 26.710 26.814 14.891 1.00 0.00 C ATOM 404 O VAL A 26 27.198 27.921 15.099 1.00 0.00 O ATOM 405 CB VAL A 26 24.604 26.105 16.147 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.871 27.073 17.304 1.00 0.00 C ATOM 407 CG2 VAL A 26 23.102 25.886 16.038 1.00 0.00 C ATOM 0 H VAL A 26 24.339 24.933 14.027 1.00 0.00 H new ATOM 0 HA VAL A 26 24.796 27.645 14.704 1.00 0.00 H new ATOM 0 HB VAL A 26 25.087 25.147 16.339 1.00 0.00 H new ATOM 0 HG11 VAL A 26 24.439 26.672 18.221 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.946 27.198 17.433 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.418 28.039 17.082 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.720 25.504 16.985 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.612 26.831 15.804 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.896 25.166 15.246 1.00 0.00 H new ATOM 417 N LYS A 27 27.505 25.787 14.576 1.00 0.00 N ATOM 418 CA LYS A 27 28.942 25.931 14.455 1.00 0.00 C ATOM 419 C LYS A 27 29.370 26.785 13.259 1.00 0.00 C ATOM 420 O LYS A 27 30.148 27.724 13.470 1.00 0.00 O ATOM 421 CB LYS A 27 29.692 24.608 14.407 1.00 0.00 C ATOM 422 CG LYS A 27 29.577 23.738 15.659 1.00 0.00 C ATOM 423 CD LYS A 27 30.512 22.538 15.774 1.00 0.00 C ATOM 424 CE LYS A 27 30.288 21.712 17.036 1.00 0.00 C ATOM 425 NZ LYS A 27 31.395 20.776 17.307 1.00 0.00 N ATOM 0 H LYS A 27 27.164 24.842 14.400 1.00 0.00 H new ATOM 0 HA LYS A 27 29.218 26.449 15.374 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.328 24.035 13.554 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.747 24.815 14.226 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.741 24.376 16.527 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.552 23.372 15.721 1.00 0.00 H new ATOM 0 HD2 LYS A 27 30.378 21.898 14.902 1.00 0.00 H new ATOM 0 HD3 LYS A 27 31.544 22.888 15.757 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.167 22.382 17.887 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.359 21.151 16.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 31.009 19.866 17.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 31.947 20.630 16.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 32.011 21.172 18.046 1.00 0.00 H new ATOM 439 N ALA A 28 28.778 26.720 12.077 1.00 0.00 N ATOM 440 CA ALA A 28 29.007 27.584 10.927 1.00 0.00 C ATOM 441 C ALA A 28 28.656 29.076 11.026 1.00 0.00 C ATOM 442 O ALA A 28 29.413 29.899 10.517 1.00 0.00 O ATOM 443 CB ALA A 28 28.182 27.069 9.756 1.00 0.00 C ATOM 0 H ALA A 28 28.073 26.010 11.881 1.00 0.00 H new ATOM 0 HA ALA A 28 30.091 27.537 10.828 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.344 27.708 8.888 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.485 26.049 9.518 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.125 27.081 10.022 1.00 0.00 H new ATOM 449 N LYS A 29 27.593 29.374 11.772 1.00 0.00 N ATOM 450 CA LYS A 29 27.015 30.643 12.167 1.00 0.00 C ATOM 451 C LYS A 29 27.877 31.359 13.210 1.00 0.00 C ATOM 452 O LYS A 29 27.974 32.584 13.331 1.00 0.00 O ATOM 453 CB LYS A 29 25.540 30.587 12.568 1.00 0.00 C ATOM 454 CG LYS A 29 24.567 30.424 11.402 1.00 0.00 C ATOM 455 CD LYS A 29 23.099 30.540 11.808 1.00 0.00 C ATOM 456 CE LYS A 29 22.292 30.909 10.556 1.00 0.00 C ATOM 457 NZ LYS A 29 20.870 31.232 10.686 1.00 0.00 N ATOM 0 H LYS A 29 27.043 28.611 12.167 1.00 0.00 H new ATOM 0 HA LYS A 29 27.018 31.245 11.258 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.397 29.758 13.261 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.289 31.500 13.108 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.787 31.180 10.648 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.731 29.452 10.937 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.744 29.599 12.228 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.975 31.300 12.580 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.781 31.766 10.093 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.376 30.078 9.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.478 31.457 9.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.364 30.416 11.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.756 32.052 11.315 1.00 0.00 H new ATOM 471 N ILE A 30 28.521 30.582 14.078 1.00 0.00 N ATOM 472 CA ILE A 30 29.555 30.992 15.005 1.00 0.00 C ATOM 473 C ILE A 30 30.966 31.145 14.433 1.00 0.00 C ATOM 474 O ILE A 30 31.594 32.183 14.655 1.00 0.00 O ATOM 475 CB ILE A 30 29.470 30.057 16.218 1.00 0.00 C ATOM 476 CG1 ILE A 30 28.111 30.192 16.905 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.717 30.259 17.076 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.758 29.150 17.968 1.00 0.00 C ATOM 0 H ILE A 30 28.316 29.586 14.151 1.00 0.00 H new ATOM 0 HA ILE A 30 29.356 32.024 15.295 1.00 0.00 H new ATOM 0 HB ILE A 30 29.492 29.004 15.938 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.063 31.177 17.369 1.00 0.00 H new ATOM 0 HG13 ILE A 30 27.339 30.164 16.136 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.672 29.601 17.944 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.605 30.025 16.488 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.765 31.296 17.409 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.769 29.364 18.373 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.759 28.157 17.519 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.494 29.186 18.771 1.00 0.00 H new ATOM 490 N GLN A 31 31.434 30.278 13.543 1.00 0.00 N ATOM 491 CA GLN A 31 32.409 30.541 12.502 1.00 0.00 C ATOM 492 C GLN A 31 32.195 31.845 11.732 1.00 0.00 C ATOM 493 O GLN A 31 33.126 32.642 11.632 1.00 0.00 O ATOM 494 CB GLN A 31 32.610 29.310 11.621 1.00 0.00 C ATOM 495 CG GLN A 31 34.074 29.266 11.163 1.00 0.00 C ATOM 496 CD GLN A 31 34.356 28.359 9.973 1.00 0.00 C ATOM 497 OE1 GLN A 31 33.468 28.026 9.191 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.655 28.142 9.762 1.00 0.00 N ATOM 0 H GLN A 31 31.118 29.308 13.533 1.00 0.00 H new ATOM 0 HA GLN A 31 33.357 30.729 13.007 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.360 28.405 12.174 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.945 29.350 10.758 1.00 0.00 H new ATOM 0 HG2 GLN A 31 34.389 30.278 10.910 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.690 28.940 12.001 1.00 0.00 H new ATOM 0 HE21 GLN A 31 36.341 28.444 10.453 1.00 0.00 H new ATOM 0 HE22 GLN A 31 35.962 27.674 8.909 1.00 0.00 H new ATOM 507 N ASP A 32 30.956 32.068 11.313 1.00 0.00 N ATOM 508 CA ASP A 32 30.648 33.295 10.612 1.00 0.00 C ATOM 509 C ASP A 32 31.046 34.588 11.343 1.00 0.00 C ATOM 510 O ASP A 32 31.457 35.546 10.691 1.00 0.00 O ATOM 511 CB ASP A 32 29.183 33.323 10.177 1.00 0.00 C ATOM 512 CG ASP A 32 28.686 34.602 9.509 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.094 34.865 8.359 1.00 0.00 O ATOM 514 OD2 ASP A 32 27.821 35.288 10.089 1.00 0.00 O ATOM 0 H ASP A 32 30.171 31.431 11.444 1.00 0.00 H new ATOM 0 HA ASP A 32 31.285 33.281 9.728 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.018 32.494 9.489 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.565 33.136 11.055 1.00 0.00 H new ATOM 519 N LYS A 33 30.721 34.596 12.631 1.00 0.00 N ATOM 520 CA LYS A 33 30.610 35.812 13.414 1.00 0.00 C ATOM 521 C LYS A 33 31.809 35.873 14.361 1.00 0.00 C ATOM 522 O LYS A 33 32.475 36.902 14.343 1.00 0.00 O ATOM 523 CB LYS A 33 29.313 35.832 14.220 1.00 0.00 C ATOM 524 CG LYS A 33 28.721 37.191 14.577 1.00 0.00 C ATOM 525 CD LYS A 33 27.240 37.153 14.968 1.00 0.00 C ATOM 526 CE LYS A 33 26.668 38.537 15.266 1.00 0.00 C ATOM 527 NZ LYS A 33 25.200 38.450 15.343 1.00 0.00 N ATOM 0 H LYS A 33 30.526 33.747 13.162 1.00 0.00 H new ATOM 0 HA LYS A 33 30.598 36.674 12.747 1.00 0.00 H new ATOM 0 HB2 LYS A 33 28.562 35.276 13.660 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.487 35.288 15.148 1.00 0.00 H new ATOM 0 HG2 LYS A 33 29.291 37.617 15.403 1.00 0.00 H new ATOM 0 HG3 LYS A 33 28.843 37.862 13.726 1.00 0.00 H new ATOM 0 HD2 LYS A 33 26.668 36.695 14.161 1.00 0.00 H new ATOM 0 HD3 LYS A 33 27.117 36.518 15.846 1.00 0.00 H new ATOM 0 HE2 LYS A 33 27.071 38.915 16.205 1.00 0.00 H new ATOM 0 HE3 LYS A 33 26.962 39.240 14.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.807 39.391 15.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 24.825 38.106 14.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.931 37.791 16.101 1.00 0.00 H new ATOM 541 N GLU A 34 32.126 34.827 15.118 1.00 0.00 N ATOM 542 CA GLU A 34 33.163 34.791 16.144 1.00 0.00 C ATOM 543 C GLU A 34 34.519 34.360 15.576 1.00 0.00 C ATOM 544 O GLU A 34 35.530 34.643 16.209 1.00 0.00 O ATOM 545 CB GLU A 34 32.724 33.827 17.240 1.00 0.00 C ATOM 546 CG GLU A 34 31.455 34.411 17.864 1.00 0.00 C ATOM 547 CD GLU A 34 31.794 35.569 18.790 1.00 0.00 C ATOM 548 OE1 GLU A 34 32.713 35.409 19.632 1.00 0.00 O ATOM 549 OE2 GLU A 34 31.274 36.698 18.692 1.00 0.00 O ATOM 0 H GLU A 34 31.641 33.934 15.027 1.00 0.00 H new ATOM 0 HA GLU A 34 33.291 35.796 16.545 1.00 0.00 H new ATOM 0 HB2 GLU A 34 32.531 32.836 16.828 1.00 0.00 H new ATOM 0 HB3 GLU A 34 33.506 33.714 17.990 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.782 34.753 17.078 1.00 0.00 H new ATOM 0 HG3 GLU A 34 30.928 33.636 18.421 1.00 0.00 H new ATOM 556 N GLY A 35 34.516 33.403 14.645 1.00 0.00 N ATOM 557 CA GLY A 35 35.639 32.995 13.832 1.00 0.00 C ATOM 558 C GLY A 35 36.159 31.606 14.193 1.00 0.00 C ATOM 559 O GLY A 35 37.163 31.224 13.601 1.00 0.00 O ATOM 0 H GLY A 35 33.674 32.867 14.435 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.345 33.006 12.783 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.445 33.720 13.944 1.00 0.00 H new ATOM 563 N ILE A 36 35.470 30.834 15.036 1.00 0.00 N ATOM 564 CA ILE A 36 35.943 29.584 15.606 1.00 0.00 C ATOM 565 C ILE A 36 35.661 28.383 14.707 1.00 0.00 C ATOM 566 O ILE A 36 34.511 28.214 14.309 1.00 0.00 O ATOM 567 CB ILE A 36 35.389 29.413 17.025 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.212 30.711 17.805 1.00 0.00 C ATOM 569 CG2 ILE A 36 36.203 28.409 17.848 1.00 0.00 C ATOM 570 CD1 ILE A 36 34.485 30.708 19.156 1.00 0.00 C ATOM 0 H ILE A 36 34.530 31.078 15.349 1.00 0.00 H new ATOM 0 HA ILE A 36 37.030 29.631 15.675 1.00 0.00 H new ATOM 0 HB ILE A 36 34.386 29.016 16.866 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.206 31.124 17.974 1.00 0.00 H new ATOM 0 HG13 ILE A 36 34.683 31.409 17.155 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.772 28.322 18.845 1.00 0.00 H new ATOM 0 HG22 ILE A 36 36.183 27.436 17.358 1.00 0.00 H new ATOM 0 HG23 ILE A 36 37.234 28.754 17.927 1.00 0.00 H new ATOM 0 HD11 ILE A 36 34.459 31.721 19.557 1.00 0.00 H new ATOM 0 HD12 ILE A 36 33.466 30.345 19.020 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.013 30.056 19.852 1.00 0.00 H new ATOM 582 N PRO A 37 36.631 27.567 14.307 1.00 0.00 N ATOM 583 CA PRO A 37 36.417 26.363 13.534 1.00 0.00 C ATOM 584 C PRO A 37 35.403 25.466 14.242 1.00 0.00 C ATOM 585 O PRO A 37 35.631 25.245 15.428 1.00 0.00 O ATOM 586 CB PRO A 37 37.757 25.656 13.349 1.00 0.00 C ATOM 587 CG PRO A 37 38.797 26.560 14.017 1.00 0.00 C ATOM 588 CD PRO A 37 38.038 27.736 14.611 1.00 0.00 C ATOM 0 HA PRO A 37 36.011 26.607 12.552 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.745 24.667 13.808 1.00 0.00 H new ATOM 0 HB3 PRO A 37 37.982 25.514 12.292 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.339 26.019 14.792 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.535 26.903 13.292 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.191 27.782 15.689 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.406 28.674 14.197 1.00 0.00 H new ATOM 596 N PRO A 38 34.435 24.887 13.528 1.00 0.00 N ATOM 597 CA PRO A 38 33.559 23.863 14.064 1.00 0.00 C ATOM 598 C PRO A 38 34.183 22.779 14.953 1.00 0.00 C ATOM 599 O PRO A 38 33.677 22.312 15.978 1.00 0.00 O ATOM 600 CB PRO A 38 32.754 23.332 12.877 1.00 0.00 C ATOM 601 CG PRO A 38 32.730 24.497 11.888 1.00 0.00 C ATOM 602 CD PRO A 38 34.015 25.265 12.197 1.00 0.00 C ATOM 0 HA PRO A 38 32.917 24.324 14.815 1.00 0.00 H new ATOM 0 HB2 PRO A 38 33.222 22.449 12.441 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.747 23.043 13.176 1.00 0.00 H new ATOM 0 HG2 PRO A 38 32.712 24.146 10.856 1.00 0.00 H new ATOM 0 HG3 PRO A 38 31.848 25.122 12.027 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.789 25.027 11.468 1.00 0.00 H new ATOM 0 HD3 PRO A 38 33.843 26.340 12.139 1.00 0.00 H new ATOM 610 N ASP A 39 35.221 22.179 14.395 1.00 0.00 N ATOM 611 CA ASP A 39 36.213 21.298 14.989 1.00 0.00 C ATOM 612 C ASP A 39 36.693 21.716 16.374 1.00 0.00 C ATOM 613 O ASP A 39 37.192 20.860 17.098 1.00 0.00 O ATOM 614 CB ASP A 39 37.334 20.985 13.998 1.00 0.00 C ATOM 615 CG ASP A 39 38.416 20.010 14.453 1.00 0.00 C ATOM 616 OD1 ASP A 39 38.074 18.814 14.558 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.592 20.401 14.621 1.00 0.00 O ATOM 0 H ASP A 39 35.410 22.313 13.402 1.00 0.00 H new ATOM 0 HA ASP A 39 35.703 20.357 15.196 1.00 0.00 H new ATOM 0 HB2 ASP A 39 36.881 20.587 13.090 1.00 0.00 H new ATOM 0 HB3 ASP A 39 37.817 21.924 13.728 1.00 0.00 H new ATOM 622 N GLN A 40 36.495 22.959 16.797 1.00 0.00 N ATOM 623 CA GLN A 40 37.127 23.547 17.960 1.00 0.00 C ATOM 624 C GLN A 40 36.211 24.368 18.874 1.00 0.00 C ATOM 625 O GLN A 40 36.634 25.323 19.509 1.00 0.00 O ATOM 626 CB GLN A 40 38.368 24.347 17.584 1.00 0.00 C ATOM 627 CG GLN A 40 39.440 23.669 16.737 1.00 0.00 C ATOM 628 CD GLN A 40 40.368 22.783 17.547 1.00 0.00 C ATOM 629 OE1 GLN A 40 41.107 23.335 18.367 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.463 21.524 17.123 1.00 0.00 N ATOM 0 H GLN A 40 35.866 23.604 16.318 1.00 0.00 H new ATOM 0 HA GLN A 40 37.417 22.683 18.558 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.039 25.239 17.051 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.839 24.683 18.508 1.00 0.00 H new ATOM 0 HG2 GLN A 40 38.959 23.070 15.964 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.029 24.432 16.228 1.00 0.00 H new ATOM 0 HE21 GLN A 40 39.797 21.165 16.439 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.202 20.919 17.482 1.00 0.00 H new ATOM 639 N GLN A 41 34.938 23.976 18.921 1.00 0.00 N ATOM 640 CA GLN A 41 33.863 24.360 19.814 1.00 0.00 C ATOM 641 C GLN A 41 32.994 23.150 20.164 1.00 0.00 C ATOM 642 O GLN A 41 32.817 22.246 19.354 1.00 0.00 O ATOM 643 CB GLN A 41 33.266 25.604 19.144 1.00 0.00 C ATOM 644 CG GLN A 41 32.749 25.313 17.736 1.00 0.00 C ATOM 645 CD GLN A 41 31.758 26.353 17.233 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.648 26.428 17.767 1.00 0.00 O ATOM 647 NE2 GLN A 41 31.988 27.123 16.179 1.00 0.00 N ATOM 0 H GLN A 41 34.602 23.293 18.242 1.00 0.00 H new ATOM 0 HA GLN A 41 34.128 24.661 20.828 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.450 25.987 19.756 1.00 0.00 H new ATOM 0 HB3 GLN A 41 34.023 26.387 19.096 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.594 25.264 17.049 1.00 0.00 H new ATOM 0 HG3 GLN A 41 32.273 24.333 17.726 1.00 0.00 H new ATOM 0 HE21 GLN A 41 32.893 27.089 15.711 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.260 27.749 15.836 1.00 0.00 H new ATOM 656 N ARG A 42 32.570 22.973 21.410 1.00 0.00 N ATOM 657 CA ARG A 42 31.668 21.918 21.839 1.00 0.00 C ATOM 658 C ARG A 42 30.713 22.610 22.808 1.00 0.00 C ATOM 659 O ARG A 42 31.124 23.386 23.668 1.00 0.00 O ATOM 660 CB ARG A 42 32.596 20.904 22.505 1.00 0.00 C ATOM 661 CG ARG A 42 31.964 19.557 22.872 1.00 0.00 C ATOM 662 CD ARG A 42 33.065 18.540 23.115 1.00 0.00 C ATOM 663 NE ARG A 42 33.123 17.536 22.042 1.00 0.00 N ATOM 664 CZ ARG A 42 34.179 16.929 21.469 1.00 0.00 C ATOM 665 NH1 ARG A 42 35.419 17.192 21.902 1.00 0.00 N ATOM 666 NH2 ARG A 42 33.986 16.089 20.455 1.00 0.00 N ATOM 0 H ARG A 42 32.857 23.584 22.175 1.00 0.00 H new ATOM 0 HA ARG A 42 31.076 21.411 21.077 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.438 20.718 21.838 1.00 0.00 H new ATOM 0 HB3 ARG A 42 33.001 21.352 23.412 1.00 0.00 H new ATOM 0 HG2 ARG A 42 31.346 19.662 23.764 1.00 0.00 H new ATOM 0 HG3 ARG A 42 31.310 19.218 22.069 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.024 19.052 23.187 1.00 0.00 H new ATOM 0 HD3 ARG A 42 32.897 18.043 24.070 1.00 0.00 H new ATOM 0 HE ARG A 42 32.215 17.254 21.672 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.563 17.852 22.666 1.00 0.00 H new ATOM 0 HH12 ARG A 42 36.219 16.732 21.468 1.00 0.00 H new ATOM 0 HH21 ARG A 42 33.041 15.908 20.116 1.00 0.00 H new ATOM 0 HH22 ARG A 42 34.783 15.626 20.017 1.00 0.00 H new ATOM 680 N LEU A 43 29.423 22.579 22.511 1.00 0.00 N ATOM 681 CA LEU A 43 28.367 23.129 23.345 1.00 0.00 C ATOM 682 C LEU A 43 27.892 22.071 24.339 1.00 0.00 C ATOM 683 O LEU A 43 27.798 20.893 23.998 1.00 0.00 O ATOM 684 CB LEU A 43 27.267 23.499 22.353 1.00 0.00 C ATOM 685 CG LEU A 43 27.526 24.792 21.573 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.681 24.903 20.305 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.235 25.999 22.460 1.00 0.00 C ATOM 0 H LEU A 43 29.071 22.155 21.653 1.00 0.00 H new ATOM 0 HA LEU A 43 28.683 23.987 23.938 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.144 22.680 21.644 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.326 23.598 22.893 1.00 0.00 H new ATOM 0 HG LEU A 43 28.574 24.769 21.274 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.909 25.840 19.796 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.906 24.067 19.643 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.624 24.882 20.569 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.421 26.915 21.900 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.193 25.974 22.779 1.00 0.00 H new ATOM 0 HD23 LEU A 43 27.883 25.971 23.336 1.00 0.00 H new ATOM 699 N ILE A 44 27.419 22.485 25.518 1.00 0.00 N ATOM 700 CA ILE A 44 26.959 21.561 26.526 1.00 0.00 C ATOM 701 C ILE A 44 25.672 22.185 27.071 1.00 0.00 C ATOM 702 O ILE A 44 25.622 23.373 27.358 1.00 0.00 O ATOM 703 CB ILE A 44 27.968 21.316 27.636 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.365 20.908 27.150 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.469 20.334 28.698 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.477 20.832 28.196 1.00 0.00 C ATOM 0 H ILE A 44 27.350 23.466 25.787 1.00 0.00 H new ATOM 0 HA ILE A 44 26.801 20.573 26.094 1.00 0.00 H new ATOM 0 HB ILE A 44 28.072 22.297 28.100 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.284 19.932 26.672 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.674 21.615 26.380 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.236 20.203 29.461 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.562 20.726 29.158 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.253 19.373 28.232 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.409 20.533 27.716 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.606 21.809 28.661 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.210 20.100 28.958 1.00 0.00 H new ATOM 718 N PHE A 45 24.664 21.319 27.049 1.00 0.00 N ATOM 719 CA PHE A 45 23.331 21.645 27.528 1.00 0.00 C ATOM 720 C PHE A 45 22.868 20.520 28.457 1.00 0.00 C ATOM 721 O PHE A 45 22.786 19.377 28.030 1.00 0.00 O ATOM 722 CB PHE A 45 22.366 21.908 26.364 1.00 0.00 C ATOM 723 CG PHE A 45 20.909 22.067 26.725 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.513 23.277 27.319 1.00 0.00 C ATOM 725 CD2 PHE A 45 19.953 21.096 26.388 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.215 23.446 27.801 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.645 21.337 26.799 1.00 0.00 C ATOM 728 CZ PHE A 45 18.232 22.522 27.430 1.00 0.00 C ATOM 0 H PHE A 45 24.752 20.366 26.696 1.00 0.00 H new ATOM 0 HA PHE A 45 23.348 22.575 28.096 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.691 22.811 25.848 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.455 21.086 25.654 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.223 24.087 27.404 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.219 20.206 25.837 1.00 0.00 H new ATOM 0 HE1 PHE A 45 18.973 24.275 28.449 1.00 0.00 H new ATOM 0 HE2 PHE A 45 17.906 20.569 26.623 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.187 22.714 27.623 1.00 0.00 H new ATOM 738 N ALA A 46 22.590 20.799 29.728 1.00 0.00 N ATOM 739 CA ALA A 46 21.920 20.015 30.742 1.00 0.00 C ATOM 740 C ALA A 46 22.574 18.703 31.210 1.00 0.00 C ATOM 741 O ALA A 46 21.996 17.871 31.897 1.00 0.00 O ATOM 742 CB ALA A 46 20.498 19.604 30.332 1.00 0.00 C ATOM 0 H ALA A 46 22.870 21.701 30.112 1.00 0.00 H new ATOM 0 HA ALA A 46 21.966 20.730 31.563 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.044 19.018 31.131 1.00 0.00 H new ATOM 0 HB2 ALA A 46 19.899 20.497 30.151 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.540 19.005 29.422 1.00 0.00 H new ATOM 748 N GLY A 47 23.831 18.535 30.844 1.00 0.00 N ATOM 749 CA GLY A 47 24.704 17.387 30.955 1.00 0.00 C ATOM 750 C GLY A 47 24.982 16.665 29.628 1.00 0.00 C ATOM 751 O GLY A 47 25.570 15.588 29.664 1.00 0.00 O ATOM 0 H GLY A 47 24.327 19.309 30.402 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.653 17.709 31.384 1.00 0.00 H new ATOM 0 HA3 GLY A 47 24.262 16.677 31.654 1.00 0.00 H new ATOM 755 N LYS A 48 24.438 17.240 28.558 1.00 0.00 N ATOM 756 CA LYS A 48 24.541 16.685 27.227 1.00 0.00 C ATOM 757 C LYS A 48 25.513 17.499 26.365 1.00 0.00 C ATOM 758 O LYS A 48 25.032 18.551 25.956 1.00 0.00 O ATOM 759 CB LYS A 48 23.127 16.683 26.663 1.00 0.00 C ATOM 760 CG LYS A 48 22.028 16.043 27.506 1.00 0.00 C ATOM 761 CD LYS A 48 20.872 15.418 26.732 1.00 0.00 C ATOM 762 CE LYS A 48 19.943 14.639 27.654 1.00 0.00 C ATOM 763 NZ LYS A 48 19.230 13.478 27.074 1.00 0.00 N ATOM 0 H LYS A 48 23.910 18.112 28.600 1.00 0.00 H new ATOM 0 HA LYS A 48 24.946 15.673 27.240 1.00 0.00 H new ATOM 0 HB2 LYS A 48 22.842 17.717 26.469 1.00 0.00 H new ATOM 0 HB3 LYS A 48 23.151 16.173 25.700 1.00 0.00 H new ATOM 0 HG2 LYS A 48 22.479 15.273 28.132 1.00 0.00 H new ATOM 0 HG3 LYS A 48 21.623 16.801 28.176 1.00 0.00 H new ATOM 0 HD2 LYS A 48 20.309 16.200 26.222 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.265 14.753 25.962 1.00 0.00 H new ATOM 0 HE2 LYS A 48 20.528 14.286 28.503 1.00 0.00 H new ATOM 0 HE3 LYS A 48 19.198 15.331 28.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.633 13.037 27.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 18.633 13.796 26.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.922 12.784 26.727 1.00 0.00 H new ATOM 777 N GLN A 49 26.732 17.006 26.202 1.00 0.00 N ATOM 778 CA GLN A 49 27.706 17.509 25.251 1.00 0.00 C ATOM 779 C GLN A 49 27.110 17.287 23.864 1.00 0.00 C ATOM 780 O GLN A 49 26.897 16.111 23.548 1.00 0.00 O ATOM 781 CB GLN A 49 29.057 16.825 25.407 1.00 0.00 C ATOM 782 CG GLN A 49 29.190 15.314 25.163 1.00 0.00 C ATOM 783 CD GLN A 49 30.232 14.635 26.041 1.00 0.00 C ATOM 784 OE1 GLN A 49 30.519 14.980 27.191 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.847 13.534 25.611 1.00 0.00 N ATOM 0 H GLN A 49 27.080 16.218 26.748 1.00 0.00 H new ATOM 0 HA GLN A 49 27.902 18.568 25.421 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.752 17.324 24.732 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.403 17.020 26.422 1.00 0.00 H new ATOM 0 HG2 GLN A 49 28.222 14.842 25.334 1.00 0.00 H new ATOM 0 HG3 GLN A 49 29.446 15.146 24.117 1.00 0.00 H new ATOM 0 HE21 GLN A 49 30.665 13.182 24.671 1.00 0.00 H new ATOM 0 HE22 GLN A 49 31.500 13.043 26.222 1.00 0.00 H new ATOM 794 N LEU A 50 26.699 18.356 23.196 1.00 0.00 N ATOM 795 CA LEU A 50 26.121 18.327 21.864 1.00 0.00 C ATOM 796 C LEU A 50 27.105 17.783 20.821 1.00 0.00 C ATOM 797 O LEU A 50 28.292 18.076 20.936 1.00 0.00 O ATOM 798 CB LEU A 50 25.654 19.706 21.425 1.00 0.00 C ATOM 799 CG LEU A 50 24.594 20.406 22.288 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.933 21.610 21.627 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.629 19.504 23.055 1.00 0.00 C ATOM 0 H LEU A 50 26.762 19.298 23.582 1.00 0.00 H new ATOM 0 HA LEU A 50 25.263 17.657 21.924 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.528 20.356 21.373 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.260 19.621 20.412 1.00 0.00 H new ATOM 0 HG LEU A 50 25.204 20.823 23.090 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.199 22.041 22.308 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.691 22.357 21.390 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.436 21.294 20.710 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.932 20.118 23.625 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.074 18.883 22.352 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.191 18.866 23.737 1.00 0.00 H new ATOM 813 N GLU A 51 26.619 17.102 19.785 1.00 0.00 N ATOM 814 CA GLU A 51 27.375 16.484 18.715 1.00 0.00 C ATOM 815 C GLU A 51 26.958 17.215 17.440 1.00 0.00 C ATOM 816 O GLU A 51 25.753 17.396 17.261 1.00 0.00 O ATOM 817 CB GLU A 51 27.051 14.991 18.685 1.00 0.00 C ATOM 818 CG GLU A 51 27.448 14.177 19.915 1.00 0.00 C ATOM 819 CD GLU A 51 26.429 13.135 20.346 1.00 0.00 C ATOM 820 OE1 GLU A 51 25.321 13.475 20.813 1.00 0.00 O ATOM 821 OE2 GLU A 51 26.811 11.952 20.193 1.00 0.00 O ATOM 0 H GLU A 51 25.615 16.962 19.670 1.00 0.00 H new ATOM 0 HA GLU A 51 28.455 16.561 18.839 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.977 14.879 18.535 1.00 0.00 H new ATOM 0 HB3 GLU A 51 27.541 14.554 17.815 1.00 0.00 H new ATOM 0 HG2 GLU A 51 28.395 13.677 19.712 1.00 0.00 H new ATOM 0 HG3 GLU A 51 27.621 14.861 20.746 1.00 0.00 H new ATOM 828 N ASP A 52 27.867 17.556 16.541 1.00 0.00 N ATOM 829 CA ASP A 52 27.649 17.410 15.119 1.00 0.00 C ATOM 830 C ASP A 52 27.008 16.094 14.666 1.00 0.00 C ATOM 831 O ASP A 52 27.433 15.061 15.184 1.00 0.00 O ATOM 832 CB ASP A 52 28.964 17.695 14.396 1.00 0.00 C ATOM 833 CG ASP A 52 30.162 16.821 14.723 1.00 0.00 C ATOM 834 OD1 ASP A 52 30.523 16.610 15.902 1.00 0.00 O ATOM 835 OD2 ASP A 52 30.837 16.350 13.778 1.00 0.00 O ATOM 0 H ASP A 52 28.779 17.943 16.783 1.00 0.00 H new ATOM 0 HA ASP A 52 26.889 18.142 14.844 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.779 17.620 13.324 1.00 0.00 H new ATOM 0 HB3 ASP A 52 29.240 18.730 14.600 1.00 0.00 H new ATOM 840 N GLY A 53 26.039 16.046 13.758 1.00 0.00 N ATOM 841 CA GLY A 53 25.276 14.915 13.275 1.00 0.00 C ATOM 842 C GLY A 53 23.808 14.869 13.704 1.00 0.00 C ATOM 843 O GLY A 53 23.086 14.018 13.185 1.00 0.00 O ATOM 0 H GLY A 53 25.740 16.903 13.293 1.00 0.00 H new ATOM 0 HA2 GLY A 53 25.317 14.912 12.186 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.763 14.001 13.615 1.00 0.00 H new ATOM 847 N ARG A 54 23.466 15.754 14.641 1.00 0.00 N ATOM 848 CA ARG A 54 22.150 15.887 15.223 1.00 0.00 C ATOM 849 C ARG A 54 21.651 17.326 15.031 1.00 0.00 C ATOM 850 O ARG A 54 22.389 18.205 14.599 1.00 0.00 O ATOM 851 CB ARG A 54 22.182 15.518 16.706 1.00 0.00 C ATOM 852 CG ARG A 54 22.963 14.240 17.012 1.00 0.00 C ATOM 853 CD ARG A 54 22.427 13.711 18.338 1.00 0.00 C ATOM 854 NE ARG A 54 23.420 12.771 18.870 1.00 0.00 N ATOM 855 CZ ARG A 54 23.564 11.465 18.589 1.00 0.00 C ATOM 856 NH1 ARG A 54 22.615 10.776 17.954 1.00 0.00 N ATOM 857 NH2 ARG A 54 24.612 10.876 19.172 1.00 0.00 N ATOM 0 H ARG A 54 24.135 16.422 15.025 1.00 0.00 H new ATOM 0 HA ARG A 54 21.464 15.204 14.723 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.622 16.343 17.266 1.00 0.00 H new ATOM 0 HB3 ARG A 54 21.159 15.401 17.063 1.00 0.00 H new ATOM 0 HG2 ARG A 54 22.829 13.505 16.219 1.00 0.00 H new ATOM 0 HG3 ARG A 54 24.031 14.445 17.080 1.00 0.00 H new ATOM 0 HD2 ARG A 54 22.260 14.529 19.038 1.00 0.00 H new ATOM 0 HD3 ARG A 54 21.468 13.214 18.193 1.00 0.00 H new ATOM 0 HE ARG A 54 24.086 13.158 19.538 1.00 0.00 H new ATOM 0 HH11 ARG A 54 21.753 11.240 17.669 1.00 0.00 H new ATOM 0 HH12 ARG A 54 22.752 9.785 17.754 1.00 0.00 H new ATOM 0 HH21 ARG A 54 25.230 11.417 19.777 1.00 0.00 H new ATOM 0 HH22 ARG A 54 24.795 9.885 19.012 1.00 0.00 H new ATOM 871 N THR A 55 20.462 17.539 15.585 1.00 0.00 N ATOM 872 CA THR A 55 19.695 18.764 15.484 1.00 0.00 C ATOM 873 C THR A 55 19.265 19.239 16.879 1.00 0.00 C ATOM 874 O THR A 55 19.545 18.516 17.829 1.00 0.00 O ATOM 875 CB THR A 55 18.487 18.559 14.573 1.00 0.00 C ATOM 876 OG1 THR A 55 17.556 17.620 15.071 1.00 0.00 O ATOM 877 CG2 THR A 55 18.728 18.312 13.083 1.00 0.00 C ATOM 0 H THR A 55 19.990 16.826 16.141 1.00 0.00 H new ATOM 0 HA THR A 55 20.322 19.539 15.043 1.00 0.00 H new ATOM 0 HB THR A 55 18.066 19.564 14.609 1.00 0.00 H new ATOM 0 HG1 THR A 55 18.018 16.973 15.643 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.771 18.186 12.576 1.00 0.00 H new ATOM 0 HG22 THR A 55 19.257 19.163 12.654 1.00 0.00 H new ATOM 0 HG23 THR A 55 19.327 17.410 12.956 1.00 0.00 H new ATOM 885 N LEU A 56 18.756 20.464 17.016 1.00 0.00 N ATOM 886 CA LEU A 56 18.327 21.065 18.263 1.00 0.00 C ATOM 887 C LEU A 56 17.229 20.326 19.023 1.00 0.00 C ATOM 888 O LEU A 56 17.246 20.265 20.257 1.00 0.00 O ATOM 889 CB LEU A 56 17.866 22.501 17.987 1.00 0.00 C ATOM 890 CG LEU A 56 18.962 23.549 17.753 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.532 24.752 16.911 1.00 0.00 C ATOM 892 CD2 LEU A 56 19.614 24.045 19.046 1.00 0.00 C ATOM 0 H LEU A 56 18.629 21.087 16.218 1.00 0.00 H new ATOM 0 HA LEU A 56 19.199 21.020 18.916 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.218 22.487 17.111 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.257 22.829 18.829 1.00 0.00 H new ATOM 0 HG LEU A 56 19.700 22.995 17.173 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.372 25.437 16.800 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.209 24.411 15.927 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.707 25.266 17.405 1.00 0.00 H new ATOM 0 HD21 LEU A 56 20.379 24.784 18.807 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.857 24.500 19.684 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.071 23.205 19.569 1.00 0.00 H new ATOM 904 N SER A 57 16.359 19.610 18.315 1.00 0.00 N ATOM 905 CA SER A 57 15.287 18.685 18.625 1.00 0.00 C ATOM 906 C SER A 57 15.714 17.375 19.292 1.00 0.00 C ATOM 907 O SER A 57 15.374 17.052 20.423 1.00 0.00 O ATOM 908 CB SER A 57 14.520 18.445 17.328 1.00 0.00 C ATOM 909 OG SER A 57 13.190 18.060 17.578 1.00 0.00 O ATOM 0 H SER A 57 16.414 19.694 17.300 1.00 0.00 H new ATOM 0 HA SER A 57 14.659 19.141 19.390 1.00 0.00 H new ATOM 0 HB2 SER A 57 14.530 19.353 16.725 1.00 0.00 H new ATOM 0 HB3 SER A 57 15.021 17.671 16.746 1.00 0.00 H new ATOM 0 HG SER A 57 12.726 17.916 16.727 1.00 0.00 H new ATOM 915 N ASP A 58 16.741 16.733 18.749 1.00 0.00 N ATOM 916 CA ASP A 58 17.469 15.582 19.266 1.00 0.00 C ATOM 917 C ASP A 58 17.931 15.561 20.715 1.00 0.00 C ATOM 918 O ASP A 58 18.200 14.465 21.206 1.00 0.00 O ATOM 919 CB ASP A 58 18.692 15.270 18.412 1.00 0.00 C ATOM 920 CG ASP A 58 18.515 14.777 16.983 1.00 0.00 C ATOM 921 OD1 ASP A 58 18.273 13.563 16.800 1.00 0.00 O ATOM 922 OD2 ASP A 58 18.838 15.478 15.996 1.00 0.00 O ATOM 0 H ASP A 58 17.120 17.034 17.851 1.00 0.00 H new ATOM 0 HA ASP A 58 16.677 14.835 19.217 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.298 16.175 18.370 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.276 14.519 18.944 1.00 0.00 H new ATOM 927 N TYR A 59 18.128 16.737 21.307 1.00 0.00 N ATOM 928 CA TYR A 59 18.521 17.112 22.656 1.00 0.00 C ATOM 929 C TYR A 59 17.484 17.919 23.438 1.00 0.00 C ATOM 930 O TYR A 59 17.770 18.274 24.589 1.00 0.00 O ATOM 931 CB TYR A 59 19.786 17.968 22.615 1.00 0.00 C ATOM 932 CG TYR A 59 20.957 17.330 21.916 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.618 16.297 22.596 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.410 17.795 20.667 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.732 15.720 21.985 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.536 17.208 20.095 1.00 0.00 C ATOM 937 CZ TYR A 59 23.144 16.099 20.697 1.00 0.00 C ATOM 938 OH TYR A 59 24.175 15.479 20.069 1.00 0.00 O ATOM 0 H TYR A 59 17.991 17.583 20.753 1.00 0.00 H new ATOM 0 HA TYR A 59 18.659 16.158 23.165 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.554 18.911 22.119 1.00 0.00 H new ATOM 0 HB3 TYR A 59 20.078 18.209 23.637 1.00 0.00 H new ATOM 0 HD1 TYR A 59 21.275 15.958 23.563 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.892 18.595 20.160 1.00 0.00 H new ATOM 0 HE1 TYR A 59 23.291 14.963 22.516 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.944 17.611 19.180 1.00 0.00 H new ATOM 0 HH TYR A 59 24.527 14.767 20.643 1.00 0.00 H new ATOM 948 N ASN A 60 16.326 18.169 22.839 1.00 0.00 N ATOM 949 CA ASN A 60 15.203 18.856 23.440 1.00 0.00 C ATOM 950 C ASN A 60 15.480 20.325 23.734 1.00 0.00 C ATOM 951 O ASN A 60 15.133 20.811 24.803 1.00 0.00 O ATOM 952 CB ASN A 60 14.450 18.148 24.570 1.00 0.00 C ATOM 953 CG ASN A 60 12.971 18.497 24.519 1.00 0.00 C ATOM 954 OD1 ASN A 60 12.256 18.164 23.573 1.00 0.00 O ATOM 955 ND2 ASN A 60 12.481 19.206 25.542 1.00 0.00 N ATOM 0 H ASN A 60 16.142 17.883 21.877 1.00 0.00 H new ATOM 0 HA ASN A 60 14.473 18.813 22.632 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.579 17.069 24.482 1.00 0.00 H new ATOM 0 HB3 ASN A 60 14.867 18.441 25.533 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.499 19.481 25.548 1.00 0.00 H new ATOM 0 HD22 ASN A 60 13.090 19.472 26.316 1.00 0.00 H new ATOM 962 N ILE A 61 16.005 21.135 22.813 1.00 0.00 N ATOM 963 CA ILE A 61 16.226 22.547 23.030 1.00 0.00 C ATOM 964 C ILE A 61 15.061 23.234 22.312 1.00 0.00 C ATOM 965 O ILE A 61 14.935 23.208 21.090 1.00 0.00 O ATOM 966 CB ILE A 61 17.585 22.896 22.419 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.697 22.170 23.184 1.00 0.00 C ATOM 968 CG2 ILE A 61 17.827 24.399 22.390 1.00 0.00 C ATOM 969 CD1 ILE A 61 19.956 21.934 22.350 1.00 0.00 C ATOM 0 H ILE A 61 16.289 20.815 21.887 1.00 0.00 H new ATOM 0 HA ILE A 61 16.252 22.855 24.075 1.00 0.00 H new ATOM 0 HB ILE A 61 17.589 22.560 21.382 1.00 0.00 H new ATOM 0 HG12 ILE A 61 18.960 22.752 24.067 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.318 21.210 23.536 1.00 0.00 H new ATOM 0 HG21 ILE A 61 18.803 24.602 21.949 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.052 24.881 21.794 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.800 24.792 23.406 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.701 21.416 22.954 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.708 21.326 21.480 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.359 22.892 22.020 1.00 0.00 H new ATOM 981 N GLN A 62 14.386 24.053 23.116 1.00 0.00 N ATOM 982 CA GLN A 62 13.334 24.951 22.685 1.00 0.00 C ATOM 983 C GLN A 62 13.741 26.411 22.880 1.00 0.00 C ATOM 984 O GLN A 62 14.825 26.761 23.325 1.00 0.00 O ATOM 985 CB GLN A 62 12.038 24.469 23.332 1.00 0.00 C ATOM 986 CG GLN A 62 11.099 23.729 22.374 1.00 0.00 C ATOM 987 CD GLN A 62 10.250 24.589 21.459 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.417 25.805 21.528 1.00 0.00 O ATOM 989 NE2 GLN A 62 9.445 24.060 20.532 1.00 0.00 N ATOM 0 H GLN A 62 14.568 24.106 24.118 1.00 0.00 H new ATOM 0 HA GLN A 62 13.152 24.926 21.611 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.283 23.810 24.165 1.00 0.00 H new ATOM 0 HB3 GLN A 62 11.511 25.327 23.749 1.00 0.00 H new ATOM 0 HG2 GLN A 62 11.699 23.062 21.755 1.00 0.00 H new ATOM 0 HG3 GLN A 62 10.433 23.101 22.966 1.00 0.00 H new ATOM 0 HE21 GLN A 62 9.315 23.049 20.486 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.960 24.667 19.871 1.00 0.00 H new ATOM 998 N LYS A 63 12.697 27.221 22.760 1.00 0.00 N ATOM 999 CA LYS A 63 12.707 28.629 23.079 1.00 0.00 C ATOM 1000 C LYS A 63 13.429 29.096 24.343 1.00 0.00 C ATOM 1001 O LYS A 63 13.226 28.552 25.428 1.00 0.00 O ATOM 1002 CB LYS A 63 11.245 29.055 22.907 1.00 0.00 C ATOM 1003 CG LYS A 63 10.680 30.245 23.674 1.00 0.00 C ATOM 1004 CD LYS A 63 9.182 30.435 23.433 1.00 0.00 C ATOM 1005 CE LYS A 63 8.550 31.542 24.283 1.00 0.00 C ATOM 1006 NZ LYS A 63 7.126 31.705 23.958 1.00 0.00 N ATOM 0 H LYS A 63 11.790 26.896 22.425 1.00 0.00 H new ATOM 0 HA LYS A 63 13.375 29.165 22.404 1.00 0.00 H new ATOM 0 HB2 LYS A 63 11.094 29.257 21.847 1.00 0.00 H new ATOM 0 HB3 LYS A 63 10.629 28.191 23.158 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.859 30.105 24.740 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.211 31.150 23.378 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.020 30.663 22.379 1.00 0.00 H new ATOM 0 HD3 LYS A 63 8.669 29.495 23.639 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.661 31.302 25.340 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.076 32.482 24.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.720 32.460 24.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.026 31.957 22.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.623 30.814 24.143 1.00 0.00 H new ATOM 1020 N GLU A 64 14.347 30.046 24.170 1.00 0.00 N ATOM 1021 CA GLU A 64 14.873 30.780 25.299 1.00 0.00 C ATOM 1022 C GLU A 64 15.876 29.986 26.127 1.00 0.00 C ATOM 1023 O GLU A 64 16.280 30.411 27.212 1.00 0.00 O ATOM 1024 CB GLU A 64 13.814 31.637 25.994 1.00 0.00 C ATOM 1025 CG GLU A 64 13.270 32.665 24.989 1.00 0.00 C ATOM 1026 CD GLU A 64 12.022 33.367 25.491 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.014 33.820 26.661 1.00 0.00 O ATOM 1028 OE2 GLU A 64 11.167 33.578 24.608 1.00 0.00 O ATOM 0 H GLU A 64 14.733 30.317 23.265 1.00 0.00 H new ATOM 0 HA GLU A 64 15.539 31.563 24.936 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.005 31.009 26.366 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.246 32.145 26.856 1.00 0.00 H new ATOM 0 HG2 GLU A 64 14.041 33.407 24.780 1.00 0.00 H new ATOM 0 HG3 GLU A 64 13.047 32.164 24.047 1.00 0.00 H new ATOM 1035 N SER A 65 16.423 28.919 25.551 1.00 0.00 N ATOM 1036 CA SER A 65 17.324 28.003 26.212 1.00 0.00 C ATOM 1037 C SER A 65 18.743 28.578 26.153 1.00 0.00 C ATOM 1038 O SER A 65 19.045 29.316 25.223 1.00 0.00 O ATOM 1039 CB SER A 65 17.276 26.597 25.613 1.00 0.00 C ATOM 1040 OG SER A 65 16.128 25.919 26.086 1.00 0.00 O ATOM 0 H SER A 65 16.240 28.667 24.580 1.00 0.00 H new ATOM 0 HA SER A 65 17.007 27.898 27.250 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.254 26.655 24.525 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.175 26.044 25.885 1.00 0.00 H new ATOM 0 HG SER A 65 15.411 25.986 25.421 1.00 0.00 H new ATOM 1046 N THR A 66 19.544 28.315 27.186 1.00 0.00 N ATOM 1047 CA THR A 66 20.866 28.880 27.332 1.00 0.00 C ATOM 1048 C THR A 66 21.768 27.637 27.384 1.00 0.00 C ATOM 1049 O THR A 66 21.569 26.629 28.049 1.00 0.00 O ATOM 1050 CB THR A 66 20.977 29.743 28.587 1.00 0.00 C ATOM 1051 OG1 THR A 66 19.885 30.619 28.739 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.279 30.530 28.640 1.00 0.00 C ATOM 0 H THR A 66 19.280 27.693 27.950 1.00 0.00 H new ATOM 0 HA THR A 66 21.139 29.559 26.524 1.00 0.00 H new ATOM 0 HB THR A 66 20.968 29.039 29.419 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.001 31.148 29.556 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.307 31.126 29.552 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.122 29.839 28.632 1.00 0.00 H new ATOM 0 HG23 THR A 66 22.342 31.189 27.774 1.00 0.00 H new ATOM 1060 N LEU A 67 22.834 27.685 26.580 1.00 0.00 N ATOM 1061 CA LEU A 67 23.949 26.759 26.516 1.00 0.00 C ATOM 1062 C LEU A 67 25.217 27.448 27.017 1.00 0.00 C ATOM 1063 O LEU A 67 25.254 28.651 27.248 1.00 0.00 O ATOM 1064 CB LEU A 67 24.091 26.375 25.046 1.00 0.00 C ATOM 1065 CG LEU A 67 22.829 25.728 24.479 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.948 26.701 23.697 1.00 0.00 C ATOM 1067 CD2 LEU A 67 23.185 24.530 23.605 1.00 0.00 C ATOM 0 H LEU A 67 22.940 28.440 25.903 1.00 0.00 H new ATOM 0 HA LEU A 67 23.787 25.878 27.138 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.330 27.265 24.464 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.929 25.686 24.934 1.00 0.00 H new ATOM 0 HG LEU A 67 22.247 25.397 25.339 1.00 0.00 H new ATOM 0 HD11 LEU A 67 21.069 26.176 23.322 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.633 27.514 24.352 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.512 27.109 22.858 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.272 24.083 23.211 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.815 24.857 22.778 1.00 0.00 H new ATOM 0 HD23 LEU A 67 23.722 23.792 24.201 1.00 0.00 H new ATOM 1079 N HIS A 68 26.181 26.591 27.348 1.00 0.00 N ATOM 1080 CA HIS A 68 27.558 27.044 27.479 1.00 0.00 C ATOM 1081 C HIS A 68 28.438 26.393 26.416 1.00 0.00 C ATOM 1082 O HIS A 68 28.203 25.301 25.886 1.00 0.00 O ATOM 1083 CB HIS A 68 27.992 26.695 28.910 1.00 0.00 C ATOM 1084 CG HIS A 68 29.318 27.307 29.240 1.00 0.00 C ATOM 1085 ND1 HIS A 68 30.519 26.862 28.676 1.00 0.00 N ATOM 1086 CD2 HIS A 68 29.700 28.196 30.210 1.00 0.00 C ATOM 1087 CE1 HIS A 68 31.507 27.497 29.310 1.00 0.00 C ATOM 1088 NE2 HIS A 68 31.074 28.327 30.263 1.00 0.00 N ATOM 0 H HIS A 68 26.036 25.597 27.527 1.00 0.00 H new ATOM 0 HA HIS A 68 27.654 28.118 27.317 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.240 27.047 29.617 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.051 25.612 29.021 1.00 0.00 H new ATOM 0 HD2 HIS A 68 29.013 28.727 30.852 1.00 0.00 H new ATOM 0 HE1 HIS A 68 32.552 27.354 29.076 1.00 0.00 H new ATOM 0 HE2 HIS A 68 31.627 28.918 30.883 1.00 0.00 H new ATOM 1096 N LEU A 69 29.380 27.173 25.907 1.00 0.00 N ATOM 1097 CA LEU A 69 30.319 26.784 24.865 1.00 0.00 C ATOM 1098 C LEU A 69 31.684 26.643 25.549 1.00 0.00 C ATOM 1099 O LEU A 69 32.163 27.650 26.073 1.00 0.00 O ATOM 1100 CB LEU A 69 30.287 27.811 23.735 1.00 0.00 C ATOM 1101 CG LEU A 69 31.156 27.446 22.536 1.00 0.00 C ATOM 1102 CD1 LEU A 69 30.340 27.713 21.268 1.00 0.00 C ATOM 1103 CD2 LEU A 69 32.514 28.149 22.627 1.00 0.00 C ATOM 0 H LEU A 69 29.517 28.134 26.222 1.00 0.00 H new ATOM 0 HA LEU A 69 30.068 25.835 24.392 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.257 27.934 23.400 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.612 28.775 24.126 1.00 0.00 H new ATOM 0 HG LEU A 69 31.418 26.388 22.515 1.00 0.00 H new ATOM 0 HD11 LEU A 69 30.937 27.461 20.391 1.00 0.00 H new ATOM 0 HD12 LEU A 69 29.437 27.102 21.281 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.064 28.767 21.228 1.00 0.00 H new ATOM 0 HD21 LEU A 69 33.122 27.878 21.764 1.00 0.00 H new ATOM 0 HD22 LEU A 69 32.365 29.229 22.641 1.00 0.00 H new ATOM 0 HD23 LEU A 69 33.023 27.841 23.541 1.00 0.00 H new ATOM 1115 N VAL A 70 32.405 25.564 25.277 1.00 0.00 N ATOM 1116 CA VAL A 70 33.829 25.404 25.497 1.00 0.00 C ATOM 1117 C VAL A 70 34.568 25.246 24.176 1.00 0.00 C ATOM 1118 O VAL A 70 33.968 24.799 23.199 1.00 0.00 O ATOM 1119 CB VAL A 70 33.983 24.277 26.520 1.00 0.00 C ATOM 1120 CG1 VAL A 70 33.455 24.525 27.926 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.368 22.987 25.987 1.00 0.00 C ATOM 0 H VAL A 70 31.982 24.729 24.872 1.00 0.00 H new ATOM 0 HA VAL A 70 34.308 26.287 25.921 1.00 0.00 H new ATOM 0 HB VAL A 70 35.064 24.209 26.640 1.00 0.00 H new ATOM 0 HG11 VAL A 70 33.631 23.643 28.542 1.00 0.00 H new ATOM 0 HG12 VAL A 70 33.970 25.381 28.362 1.00 0.00 H new ATOM 0 HG13 VAL A 70 32.385 24.729 27.882 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.486 22.195 26.727 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.308 23.144 25.789 1.00 0.00 H new ATOM 0 HG23 VAL A 70 33.870 22.699 25.064 1.00 0.00 H new ATOM 1131 N LEU A 71 35.849 25.618 24.148 1.00 0.00 N ATOM 1132 CA LEU A 71 36.550 25.614 22.888 1.00 0.00 C ATOM 1133 C LEU A 71 37.870 24.863 23.084 1.00 0.00 C ATOM 1134 O LEU A 71 38.700 25.391 23.806 1.00 0.00 O ATOM 1135 CB LEU A 71 36.597 27.042 22.322 1.00 0.00 C ATOM 1136 CG LEU A 71 37.474 28.136 22.929 1.00 0.00 C ATOM 1137 CD1 LEU A 71 38.086 29.014 21.837 1.00 0.00 C ATOM 1138 CD2 LEU A 71 36.787 29.038 23.954 1.00 0.00 C ATOM 0 H LEU A 71 36.395 25.914 24.957 1.00 0.00 H new ATOM 0 HA LEU A 71 36.042 25.062 22.097 1.00 0.00 H new ATOM 0 HB2 LEU A 71 36.888 26.953 21.275 1.00 0.00 H new ATOM 0 HB3 LEU A 71 35.574 27.418 22.337 1.00 0.00 H new ATOM 0 HG LEU A 71 38.241 27.584 23.472 1.00 0.00 H new ATOM 0 HD11 LEU A 71 38.706 29.785 22.295 1.00 0.00 H new ATOM 0 HD12 LEU A 71 38.699 28.400 21.177 1.00 0.00 H new ATOM 0 HD13 LEU A 71 37.290 29.484 21.259 1.00 0.00 H new ATOM 0 HD21 LEU A 71 37.498 29.778 24.321 1.00 0.00 H new ATOM 0 HD22 LEU A 71 35.944 29.545 23.485 1.00 0.00 H new ATOM 0 HD23 LEU A 71 36.429 28.434 24.788 1.00 0.00 H new ATOM 1150 N ARG A 72 37.979 23.672 22.489 1.00 0.00 N ATOM 1151 CA ARG A 72 39.109 22.778 22.461 1.00 0.00 C ATOM 1152 C ARG A 72 39.479 22.059 23.760 1.00 0.00 C ATOM 1153 O ARG A 72 39.808 20.873 23.788 1.00 0.00 O ATOM 1154 CB ARG A 72 40.321 23.460 21.813 1.00 0.00 C ATOM 1155 CG ARG A 72 41.727 22.849 21.796 1.00 0.00 C ATOM 1156 CD ARG A 72 42.711 23.850 21.188 1.00 0.00 C ATOM 1157 NE ARG A 72 44.011 23.261 20.889 1.00 0.00 N ATOM 1158 CZ ARG A 72 44.600 23.259 19.681 1.00 0.00 C ATOM 1159 NH1 ARG A 72 43.966 23.631 18.556 1.00 0.00 N ATOM 1160 NH2 ARG A 72 45.887 22.894 19.642 1.00 0.00 N ATOM 0 H ARG A 72 37.193 23.284 21.967 1.00 0.00 H new ATOM 0 HA ARG A 72 38.765 21.951 21.841 1.00 0.00 H new ATOM 0 HB2 ARG A 72 40.052 23.640 20.772 1.00 0.00 H new ATOM 0 HB3 ARG A 72 40.416 24.435 22.290 1.00 0.00 H new ATOM 0 HG2 ARG A 72 42.035 22.590 22.809 1.00 0.00 H new ATOM 0 HG3 ARG A 72 41.727 21.926 21.217 1.00 0.00 H new ATOM 0 HD2 ARG A 72 42.285 24.260 20.272 1.00 0.00 H new ATOM 0 HD3 ARG A 72 42.846 24.683 21.878 1.00 0.00 H new ATOM 0 HE ARG A 72 44.513 22.815 21.657 1.00 0.00 H new ATOM 0 HH11 ARG A 72 42.992 23.933 18.595 1.00 0.00 H new ATOM 0 HH12 ARG A 72 44.458 23.612 17.663 1.00 0.00 H new ATOM 0 HH21 ARG A 72 46.370 22.636 20.502 1.00 0.00 H new ATOM 0 HH22 ARG A 72 46.385 22.874 18.752 1.00 0.00 H new ATOM 1174 N LEU A 73 39.583 22.824 24.831 1.00 0.00 N ATOM 1175 CA LEU A 73 39.626 22.429 26.229 1.00 0.00 C ATOM 1176 C LEU A 73 38.191 22.465 26.783 1.00 0.00 C ATOM 1177 O LEU A 73 37.359 23.253 26.364 1.00 0.00 O ATOM 1178 CB LEU A 73 40.541 23.268 27.120 1.00 0.00 C ATOM 1179 CG LEU A 73 40.718 24.712 26.652 1.00 0.00 C ATOM 1180 CD1 LEU A 73 40.789 25.682 27.824 1.00 0.00 C ATOM 1181 CD2 LEU A 73 41.896 24.902 25.690 1.00 0.00 C ATOM 0 H LEU A 73 39.646 23.838 24.735 1.00 0.00 H new ATOM 0 HA LEU A 73 40.057 21.428 26.251 1.00 0.00 H new ATOM 0 HB2 LEU A 73 40.138 23.273 28.133 1.00 0.00 H new ATOM 0 HB3 LEU A 73 41.520 22.791 27.168 1.00 0.00 H new ATOM 0 HG LEU A 73 39.822 24.948 26.078 1.00 0.00 H new ATOM 0 HD11 LEU A 73 40.915 26.698 27.449 1.00 0.00 H new ATOM 0 HD12 LEU A 73 39.868 25.621 28.403 1.00 0.00 H new ATOM 0 HD13 LEU A 73 41.635 25.423 28.460 1.00 0.00 H new ATOM 0 HD21 LEU A 73 41.962 25.950 25.399 1.00 0.00 H new ATOM 0 HD22 LEU A 73 42.821 24.603 26.184 1.00 0.00 H new ATOM 0 HD23 LEU A 73 41.744 24.288 24.803 1.00 0.00 H new ATOM 1193 N ARG A 74 37.986 21.559 27.739 1.00 0.00 N ATOM 1194 CA ARG A 74 36.742 21.588 28.478 1.00 0.00 C ATOM 1195 C ARG A 74 36.910 22.407 29.760 1.00 0.00 C ATOM 1196 O ARG A 74 37.808 22.184 30.568 1.00 0.00 O ATOM 1197 CB ARG A 74 36.377 20.131 28.760 1.00 0.00 C ATOM 1198 CG ARG A 74 34.916 19.826 29.077 1.00 0.00 C ATOM 1199 CD ARG A 74 34.687 18.366 29.466 1.00 0.00 C ATOM 1200 NE ARG A 74 33.265 18.060 29.627 1.00 0.00 N ATOM 1201 CZ ARG A 74 32.607 17.059 29.029 1.00 0.00 C ATOM 1202 NH1 ARG A 74 33.042 16.497 27.894 1.00 0.00 N ATOM 1203 NH2 ARG A 74 31.482 16.635 29.606 1.00 0.00 N ATOM 0 H ARG A 74 38.642 20.826 28.007 1.00 0.00 H new ATOM 0 HA ARG A 74 35.941 22.069 27.917 1.00 0.00 H new ATOM 0 HB2 ARG A 74 36.666 19.537 27.893 1.00 0.00 H new ATOM 0 HB3 ARG A 74 36.983 19.787 29.598 1.00 0.00 H new ATOM 0 HG2 ARG A 74 34.583 20.471 29.891 1.00 0.00 H new ATOM 0 HG3 ARG A 74 34.303 20.066 28.209 1.00 0.00 H new ATOM 0 HD2 ARG A 74 35.114 17.716 28.702 1.00 0.00 H new ATOM 0 HD3 ARG A 74 35.212 18.152 30.397 1.00 0.00 H new ATOM 0 HE ARG A 74 32.728 18.663 30.250 1.00 0.00 H new ATOM 0 HH11 ARG A 74 33.901 16.830 27.457 1.00 0.00 H new ATOM 0 HH12 ARG A 74 32.514 15.736 27.467 1.00 0.00 H new ATOM 0 HH21 ARG A 74 31.155 17.071 30.468 1.00 0.00 H new ATOM 0 HH22 ARG A 74 30.948 15.875 29.185 1.00 0.00 H new ATOM 1217 N GLY A 75 35.903 23.210 30.097 1.00 0.00 N ATOM 1218 CA GLY A 75 35.754 23.779 31.421 1.00 0.00 C ATOM 1219 C GLY A 75 34.418 23.473 32.097 1.00 0.00 C ATOM 1220 O GLY A 75 33.378 24.016 31.741 1.00 0.00 O ATOM 0 H GLY A 75 35.165 23.482 29.448 1.00 0.00 H new ATOM 0 HA2 GLY A 75 36.560 23.409 32.054 1.00 0.00 H new ATOM 0 HA3 GLY A 75 35.873 24.860 31.353 1.00 0.00 H new ATOM 1224 N GLY A 76 34.606 22.604 33.086 1.00 0.00 N ATOM 1225 CA GLY A 76 33.825 22.184 34.241 1.00 0.00 C ATOM 1226 C GLY A 76 34.842 22.203 35.375 1.00 0.00 C ATOM 1227 O GLY A 76 35.023 23.265 35.994 1.00 0.00 O ATOM 1228 OXT GLY A 76 35.429 21.121 35.588 1.00 0.00 O ATOM 0 H GLY A 76 35.482 22.082 33.088 1.00 0.00 H new ATOM 0 HA2 GLY A 76 32.994 22.863 34.434 1.00 0.00 H new ATOM 0 HA3 GLY A 76 33.399 21.191 34.099 1.00 0.00 H new TER 1232 GLY A 76