USER MOD reduce.3.24.130724 H: found=0, std=0, add=939, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 937 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 22 THR OG1 : rot 180:sc= 0.493 USER MOD Set 1.2: A 25 ASN : amide:sc= 0.345 K(o=0.84,f=0.2) USER MOD Set 2.1: A 6 LYS NZ :NH3+ -168:sc= 1.18 (180deg=-0.0554) USER MOD Set 2.2: B 338 GLN : amide:sc= 1.05 K(o=2.2,f=-4.9) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 162:sc= 1.06 (180deg=0.873) USER MOD Single : A 2 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.22) USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.0863 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -84:sc= 1.16 USER MOD Single : A 19 SER OG : rot -12:sc= 0.0585 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -165:sc= 0.746 (180deg=0.585) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 155:sc= 0.749 (180deg=0.347) USER MOD Single : A 31 GLN : amide:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -1.36 K(o=-1.4,f=-2.9!) USER MOD Single : A 41 GLN : amide:sc= -0.766 K(o=-0.77,f=-2.7!) 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=-0.049) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 80:sc= 0.254 USER MOD Single : A 60 ASN : amide:sc=-0.00878 X(o=-0.0088,f=-0.1) USER MOD Single : A 62 GLN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -150:sc= 0.0642 USER MOD Single : A 66 THR OG1 : rot 48:sc= 0.0716 USER MOD Single : A 68 HIS : no HD1:sc= -0.124 X(o=-0.12,f=-0.13) USER MOD Single : B 332 TYR OH : rot 180:sc= 0.359 USER MOD Single : B 334 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 335 GLN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : B 340 ASN : amide:sc= 1.7 K(o=1.7,f=-7.2!) USER MOD Single : B 342 MET CE :methyl -164:sc= -0.221 (180deg=-0.801) USER MOD Single : B 350 ASN : amide:sc= 0.736 K(o=0.74,f=-3.6!) USER MOD Single : B 357 SER OG : rot -162:sc= 0.804 USER MOD Single : B 360 SER OG : rot 180:sc= 0 USER MOD Single : B 362 GLN :FLIP amide:sc= -0.805 F(o=-2.2!,f=-0.8) USER MOD Single : B 367 SER OG : rot 180:sc= 0 USER MOD Single : B 370 ASN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.113 14.353 -14.506 1.00 0.00 N ATOM 2 CA MET A 1 -2.021 13.205 -14.249 1.00 0.00 C ATOM 3 C MET A 1 -2.510 13.251 -12.794 1.00 0.00 C ATOM 4 O MET A 1 -2.213 14.200 -12.067 1.00 0.00 O ATOM 5 CB MET A 1 -1.375 11.864 -14.702 1.00 0.00 C ATOM 6 CG MET A 1 -0.761 10.907 -13.661 1.00 0.00 C ATOM 7 SD MET A 1 0.245 9.589 -14.405 1.00 0.00 S ATOM 8 CE MET A 1 0.898 8.761 -12.925 1.00 0.00 C ATOM 0 H1 MET A 1 -0.551 14.167 -15.361 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.676 15.217 -14.643 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.475 14.480 -13.694 1.00 0.00 H new ATOM 0 HA MET A 1 -2.919 13.280 -14.862 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.138 11.305 -15.244 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.590 12.109 -15.418 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.143 11.480 -12.970 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.562 10.457 -13.074 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.535 7.929 -13.225 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.481 9.471 -12.338 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.070 8.386 -12.323 1.00 0.00 H new ATOM 20 N GLN A 2 -3.276 12.257 -12.344 1.00 0.00 N ATOM 21 CA GLN A 2 -3.619 12.073 -10.925 1.00 0.00 C ATOM 22 C GLN A 2 -3.383 10.630 -10.494 1.00 0.00 C ATOM 23 O GLN A 2 -3.351 9.731 -11.331 1.00 0.00 O ATOM 24 CB GLN A 2 -5.074 12.501 -10.648 1.00 0.00 C ATOM 25 CG GLN A 2 -6.103 11.511 -11.206 1.00 0.00 C ATOM 26 CD GLN A 2 -7.504 12.121 -11.224 1.00 0.00 C ATOM 27 OE1 GLN A 2 -7.956 12.674 -12.218 1.00 0.00 O ATOM 28 NE2 GLN A 2 -8.241 12.056 -10.136 1.00 0.00 N ATOM 0 H GLN A 2 -3.682 11.549 -12.956 1.00 0.00 H new ATOM 0 HA GLN A 2 -2.964 12.714 -10.334 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -5.220 12.601 -9.572 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -5.248 13.484 -11.086 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -5.818 11.218 -12.216 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -6.106 10.605 -10.600 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -7.877 11.598 -9.300 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -9.176 12.463 -10.128 1.00 0.00 H new ATOM 37 N ILE A 3 -3.292 10.410 -9.190 1.00 0.00 N ATOM 38 CA ILE A 3 -3.278 9.096 -8.530 1.00 0.00 C ATOM 39 C ILE A 3 -4.036 9.173 -7.195 1.00 0.00 C ATOM 40 O ILE A 3 -4.299 10.264 -6.688 1.00 0.00 O ATOM 41 CB ILE A 3 -1.837 8.553 -8.347 1.00 0.00 C ATOM 42 CG1 ILE A 3 -0.933 9.435 -7.457 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.142 8.339 -9.701 1.00 0.00 C ATOM 44 CD1 ILE A 3 -0.734 8.868 -6.052 1.00 0.00 C ATOM 0 H ILE A 3 -3.222 11.178 -8.522 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.790 8.383 -9.176 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.969 7.601 -7.832 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.039 9.548 -7.937 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.369 10.431 -7.381 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.134 7.958 -9.536 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.710 7.620 -10.292 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.089 9.287 -10.236 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.090 9.535 -5.479 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.700 8.780 -5.555 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.270 7.884 -6.119 1.00 0.00 H new ATOM 56 N PHE A 4 -4.389 8.030 -6.614 1.00 0.00 N ATOM 57 CA PHE A 4 -5.124 7.919 -5.351 1.00 0.00 C ATOM 58 C PHE A 4 -4.335 7.051 -4.360 1.00 0.00 C ATOM 59 O PHE A 4 -3.626 6.131 -4.776 1.00 0.00 O ATOM 60 CB PHE A 4 -6.527 7.334 -5.592 1.00 0.00 C ATOM 61 CG PHE A 4 -7.477 8.110 -6.497 1.00 0.00 C ATOM 62 CD1 PHE A 4 -7.240 8.185 -7.883 1.00 0.00 C ATOM 63 CD2 PHE A 4 -8.657 8.670 -5.973 1.00 0.00 C ATOM 64 CE1 PHE A 4 -8.168 8.804 -8.743 1.00 0.00 C ATOM 65 CE2 PHE A 4 -9.585 9.296 -6.826 1.00 0.00 C ATOM 66 CZ PHE A 4 -9.344 9.359 -8.210 1.00 0.00 C ATOM 0 H PHE A 4 -4.165 7.122 -7.021 1.00 0.00 H new ATOM 0 HA PHE A 4 -5.243 8.915 -4.924 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -6.405 6.336 -6.012 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -7.011 7.215 -4.623 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -6.334 7.762 -8.292 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -8.851 8.619 -4.912 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -7.977 8.852 -9.805 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -10.485 9.729 -6.416 1.00 0.00 H new ATOM 0 HZ PHE A 4 -10.062 9.833 -8.863 1.00 0.00 H new ATOM 76 N VAL A 5 -4.454 7.324 -3.055 1.00 0.00 N ATOM 77 CA VAL A 5 -3.655 6.663 -2.003 1.00 0.00 C ATOM 78 C VAL A 5 -4.499 6.332 -0.773 1.00 0.00 C ATOM 79 O VAL A 5 -5.108 7.218 -0.183 1.00 0.00 O ATOM 80 CB VAL A 5 -2.427 7.494 -1.570 1.00 0.00 C ATOM 81 CG1 VAL A 5 -1.310 6.528 -1.176 1.00 0.00 C ATOM 82 CG2 VAL A 5 -1.844 8.410 -2.645 1.00 0.00 C ATOM 0 H VAL A 5 -5.111 8.014 -2.691 1.00 0.00 H new ATOM 0 HA VAL A 5 -3.296 5.737 -2.452 1.00 0.00 H new ATOM 0 HB VAL A 5 -2.781 8.131 -0.759 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -0.432 7.094 -0.866 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -1.646 5.900 -0.351 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -1.054 5.900 -2.029 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -0.987 8.948 -2.239 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -1.526 7.812 -3.499 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -2.603 9.125 -2.965 1.00 0.00 H new ATOM 92 N LYS A 6 -4.544 5.062 -0.372 1.00 0.00 N ATOM 93 CA LYS A 6 -5.460 4.520 0.646 1.00 0.00 C ATOM 94 C LYS A 6 -4.724 4.002 1.893 1.00 0.00 C ATOM 95 O LYS A 6 -3.893 3.104 1.792 1.00 0.00 O ATOM 96 CB LYS A 6 -6.302 3.450 -0.063 1.00 0.00 C ATOM 97 CG LYS A 6 -7.727 3.335 0.472 1.00 0.00 C ATOM 98 CD LYS A 6 -7.834 2.743 1.877 1.00 0.00 C ATOM 99 CE LYS A 6 -9.243 2.151 2.032 1.00 0.00 C ATOM 100 NZ LYS A 6 -9.360 0.816 1.386 1.00 0.00 N ATOM 0 H LYS A 6 -3.923 4.351 -0.758 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.107 5.300 1.047 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -6.341 3.678 -1.128 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -5.806 2.484 0.038 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.181 4.326 0.474 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.309 2.719 -0.213 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -7.078 1.972 2.025 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.658 3.512 2.630 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.485 2.064 3.091 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.973 2.832 1.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -10.362 0.542 1.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.962 0.859 0.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -8.838 0.112 1.946 1.00 0.00 H new ATOM 114 N THR A 7 -4.948 4.605 3.061 1.00 0.00 N ATOM 115 CA THR A 7 -4.245 4.221 4.311 1.00 0.00 C ATOM 116 C THR A 7 -4.790 2.928 4.949 1.00 0.00 C ATOM 117 O THR A 7 -5.852 2.425 4.565 1.00 0.00 O ATOM 118 CB THR A 7 -4.198 5.396 5.305 1.00 0.00 C ATOM 119 OG1 THR A 7 -3.336 5.107 6.382 1.00 0.00 O ATOM 120 CG2 THR A 7 -5.565 5.745 5.873 1.00 0.00 C ATOM 0 H THR A 7 -5.614 5.368 3.180 1.00 0.00 H new ATOM 0 HA THR A 7 -3.218 3.985 4.031 1.00 0.00 H new ATOM 0 HB THR A 7 -3.831 6.250 4.736 1.00 0.00 H new ATOM 0 HG1 THR A 7 -3.319 5.867 7.001 1.00 0.00 H new ATOM 0 HG21 THR A 7 -5.468 6.580 6.567 1.00 0.00 H new ATOM 0 HG22 THR A 7 -6.236 6.024 5.061 1.00 0.00 H new ATOM 0 HG23 THR A 7 -5.972 4.881 6.399 1.00 0.00 H new ATOM 128 N LEU A 8 -4.089 2.393 5.957 1.00 0.00 N ATOM 129 CA LEU A 8 -4.497 1.231 6.761 1.00 0.00 C ATOM 130 C LEU A 8 -5.813 1.465 7.529 1.00 0.00 C ATOM 131 O LEU A 8 -6.642 0.559 7.619 1.00 0.00 O ATOM 132 CB LEU A 8 -3.376 0.853 7.748 1.00 0.00 C ATOM 133 CG LEU A 8 -2.084 0.294 7.120 1.00 0.00 C ATOM 134 CD1 LEU A 8 -1.071 0.009 8.230 1.00 0.00 C ATOM 135 CD2 LEU A 8 -2.315 -1.016 6.360 1.00 0.00 C ATOM 0 H LEU A 8 -3.187 2.771 6.247 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.675 0.412 6.064 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -3.120 1.737 8.332 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.767 0.113 8.446 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.723 1.044 6.416 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.154 -0.387 7.793 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.849 0.932 8.765 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -1.487 -0.722 8.924 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.372 -1.364 5.939 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.707 -1.769 7.044 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.031 -0.849 5.556 1.00 0.00 H new ATOM 147 N THR A 9 -6.023 2.678 8.059 1.00 0.00 N ATOM 148 CA THR A 9 -7.259 3.094 8.759 1.00 0.00 C ATOM 149 C THR A 9 -8.496 3.024 7.850 1.00 0.00 C ATOM 150 O THR A 9 -9.576 2.634 8.300 1.00 0.00 O ATOM 151 CB THR A 9 -7.109 4.523 9.316 1.00 0.00 C ATOM 152 OG1 THR A 9 -5.941 4.620 10.109 1.00 0.00 O ATOM 153 CG2 THR A 9 -8.291 4.966 10.179 1.00 0.00 C ATOM 0 H THR A 9 -5.324 3.420 8.015 1.00 0.00 H new ATOM 0 HA THR A 9 -7.408 2.393 9.580 1.00 0.00 H new ATOM 0 HB THR A 9 -7.058 5.174 8.443 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.856 5.533 10.456 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.119 5.981 10.538 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.205 4.941 9.585 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.393 4.293 11.030 1.00 0.00 H new ATOM 161 N GLY A 10 -8.336 3.369 6.566 1.00 0.00 N ATOM 162 CA GLY A 10 -9.330 3.170 5.505 1.00 0.00 C ATOM 163 C GLY A 10 -9.692 4.419 4.686 1.00 0.00 C ATOM 164 O GLY A 10 -10.611 4.368 3.867 1.00 0.00 O ATOM 0 H GLY A 10 -7.481 3.810 6.226 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -8.957 2.406 4.822 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.241 2.777 5.956 1.00 0.00 H new ATOM 168 N LYS A 11 -8.986 5.538 4.891 1.00 0.00 N ATOM 169 CA LYS A 11 -9.162 6.816 4.184 1.00 0.00 C ATOM 170 C LYS A 11 -8.504 6.771 2.804 1.00 0.00 C ATOM 171 O LYS A 11 -7.356 6.344 2.688 1.00 0.00 O ATOM 172 CB LYS A 11 -8.564 7.932 5.066 1.00 0.00 C ATOM 173 CG LYS A 11 -8.533 9.337 4.440 1.00 0.00 C ATOM 174 CD LYS A 11 -9.905 9.878 4.016 1.00 0.00 C ATOM 175 CE LYS A 11 -9.760 11.347 3.593 1.00 0.00 C ATOM 176 NZ LYS A 11 -11.061 11.932 3.180 1.00 0.00 N ATOM 0 H LYS A 11 -8.241 5.581 5.587 1.00 0.00 H new ATOM 0 HA LYS A 11 -10.220 7.014 4.015 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -9.134 7.981 5.994 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.545 7.651 5.333 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -8.089 10.029 5.155 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.879 9.318 3.568 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.303 9.287 3.191 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -10.613 9.793 4.840 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -9.348 11.925 4.420 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -9.050 11.420 2.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -10.923 12.924 2.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -11.442 11.396 2.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -11.730 11.886 3.975 1.00 0.00 H new ATOM 190 N THR A 12 -9.210 7.259 1.787 1.00 0.00 N ATOM 191 CA THR A 12 -8.735 7.392 0.399 1.00 0.00 C ATOM 192 C THR A 12 -8.406 8.851 0.082 1.00 0.00 C ATOM 193 O THR A 12 -9.278 9.722 0.111 1.00 0.00 O ATOM 194 CB THR A 12 -9.768 6.872 -0.617 1.00 0.00 C ATOM 195 OG1 THR A 12 -10.317 5.636 -0.206 1.00 0.00 O ATOM 196 CG2 THR A 12 -9.117 6.644 -1.982 1.00 0.00 C ATOM 0 H THR A 12 -10.168 7.588 1.905 1.00 0.00 H new ATOM 0 HA THR A 12 -7.835 6.783 0.312 1.00 0.00 H new ATOM 0 HB THR A 12 -10.550 7.629 -0.681 1.00 0.00 H new ATOM 0 HG1 THR A 12 -10.971 5.332 -0.870 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.865 6.277 -2.685 1.00 0.00 H new ATOM 0 HG22 THR A 12 -8.704 7.583 -2.350 1.00 0.00 H new ATOM 0 HG23 THR A 12 -8.318 5.909 -1.886 1.00 0.00 H new ATOM 204 N ILE A 13 -7.136 9.120 -0.206 1.00 0.00 N ATOM 205 CA ILE A 13 -6.598 10.401 -0.689 1.00 0.00 C ATOM 206 C ILE A 13 -6.574 10.417 -2.226 1.00 0.00 C ATOM 207 O ILE A 13 -6.501 9.362 -2.859 1.00 0.00 O ATOM 208 CB ILE A 13 -5.169 10.630 -0.121 1.00 0.00 C ATOM 209 CG1 ILE A 13 -5.018 10.270 1.378 1.00 0.00 C ATOM 210 CG2 ILE A 13 -4.696 12.082 -0.327 1.00 0.00 C ATOM 211 CD1 ILE A 13 -5.923 11.078 2.316 1.00 0.00 C ATOM 0 H ILE A 13 -6.408 8.413 -0.105 1.00 0.00 H new ATOM 0 HA ILE A 13 -7.242 11.209 -0.342 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.542 9.945 -0.692 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -5.234 9.210 1.508 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -3.980 10.423 1.673 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.693 12.200 0.084 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.681 12.312 -1.392 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.379 12.763 0.182 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -5.754 10.763 3.346 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -5.693 12.139 2.219 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.966 10.907 2.051 1.00 0.00 H new ATOM 223 N THR A 14 -6.555 11.608 -2.827 1.00 0.00 N ATOM 224 CA THR A 14 -6.322 11.850 -4.265 1.00 0.00 C ATOM 225 C THR A 14 -5.244 12.928 -4.414 1.00 0.00 C ATOM 226 O THR A 14 -5.287 13.937 -3.709 1.00 0.00 O ATOM 227 CB THR A 14 -7.602 12.327 -4.975 1.00 0.00 C ATOM 228 OG1 THR A 14 -8.733 11.571 -4.587 1.00 0.00 O ATOM 229 CG2 THR A 14 -7.471 12.197 -6.494 1.00 0.00 C ATOM 0 H THR A 14 -6.708 12.473 -2.308 1.00 0.00 H new ATOM 0 HA THR A 14 -6.007 10.912 -4.723 1.00 0.00 H new ATOM 0 HB THR A 14 -7.734 13.370 -4.686 1.00 0.00 H new ATOM 0 HG1 THR A 14 -8.778 10.751 -5.122 1.00 0.00 H new ATOM 0 HG21 THR A 14 -8.390 12.541 -6.969 1.00 0.00 H new ATOM 0 HG22 THR A 14 -6.634 12.804 -6.840 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.296 11.154 -6.756 1.00 0.00 H new ATOM 237 N LEU A 15 -4.276 12.731 -5.311 1.00 0.00 N ATOM 238 CA LEU A 15 -3.117 13.609 -5.538 1.00 0.00 C ATOM 239 C LEU A 15 -2.914 13.893 -7.040 1.00 0.00 C ATOM 240 O LEU A 15 -3.401 13.151 -7.893 1.00 0.00 O ATOM 241 CB LEU A 15 -1.851 12.930 -4.978 1.00 0.00 C ATOM 242 CG LEU A 15 -1.891 12.494 -3.502 1.00 0.00 C ATOM 243 CD1 LEU A 15 -0.651 11.659 -3.226 1.00 0.00 C ATOM 244 CD2 LEU A 15 -1.907 13.662 -2.518 1.00 0.00 C ATOM 0 H LEU A 15 -4.275 11.920 -5.929 1.00 0.00 H new ATOM 0 HA LEU A 15 -3.300 14.556 -5.031 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.640 12.050 -5.586 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.013 13.615 -5.107 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.817 11.938 -3.354 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.654 11.336 -2.185 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.649 10.785 -3.877 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.240 12.257 -3.418 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.935 13.278 -1.498 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -1.009 14.265 -2.654 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.788 14.278 -2.698 1.00 0.00 H new ATOM 256 N GLU A 16 -2.132 14.923 -7.373 1.00 0.00 N ATOM 257 CA GLU A 16 -1.867 15.387 -8.747 1.00 0.00 C ATOM 258 C GLU A 16 -0.362 15.323 -9.076 1.00 0.00 C ATOM 259 O GLU A 16 0.410 16.183 -8.647 1.00 0.00 O ATOM 260 CB GLU A 16 -2.457 16.799 -8.916 1.00 0.00 C ATOM 261 CG GLU A 16 -2.414 17.291 -10.369 1.00 0.00 C ATOM 262 CD GLU A 16 -2.979 18.720 -10.483 1.00 0.00 C ATOM 263 OE1 GLU A 16 -4.214 18.882 -10.645 1.00 0.00 O ATOM 264 OE2 GLU A 16 -2.192 19.697 -10.417 1.00 0.00 O ATOM 0 H GLU A 16 -1.646 15.481 -6.671 1.00 0.00 H new ATOM 0 HA GLU A 16 -2.354 14.726 -9.464 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.490 16.801 -8.567 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.906 17.496 -8.285 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.387 17.272 -10.733 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.990 16.616 -11.003 1.00 0.00 H new ATOM 271 N VAL A 17 0.061 14.283 -9.804 1.00 0.00 N ATOM 272 CA VAL A 17 1.466 13.972 -10.164 1.00 0.00 C ATOM 273 C VAL A 17 1.628 13.684 -11.665 1.00 0.00 C ATOM 274 O VAL A 17 0.651 13.646 -12.408 1.00 0.00 O ATOM 275 CB VAL A 17 1.991 12.770 -9.342 1.00 0.00 C ATOM 276 CG1 VAL A 17 2.108 13.099 -7.848 1.00 0.00 C ATOM 277 CG2 VAL A 17 1.132 11.512 -9.526 1.00 0.00 C ATOM 0 H VAL A 17 -0.593 13.596 -10.181 1.00 0.00 H new ATOM 0 HA VAL A 17 2.056 14.857 -9.926 1.00 0.00 H new ATOM 0 HB VAL A 17 2.987 12.563 -9.733 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.480 12.226 -7.311 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.799 13.931 -7.712 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.128 13.374 -7.458 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.544 10.699 -8.928 1.00 0.00 H new ATOM 0 HG22 VAL A 17 0.111 11.718 -9.204 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.130 11.224 -10.577 1.00 0.00 H new ATOM 287 N GLU A 18 2.851 13.444 -12.134 1.00 0.00 N ATOM 288 CA GLU A 18 3.174 12.940 -13.475 1.00 0.00 C ATOM 289 C GLU A 18 3.795 11.537 -13.382 1.00 0.00 C ATOM 290 O GLU A 18 4.291 11.130 -12.330 1.00 0.00 O ATOM 291 CB GLU A 18 4.159 13.901 -14.169 1.00 0.00 C ATOM 292 CG GLU A 18 3.520 15.216 -14.634 1.00 0.00 C ATOM 293 CD GLU A 18 2.619 15.011 -15.868 1.00 0.00 C ATOM 294 OE1 GLU A 18 3.121 15.114 -17.014 1.00 0.00 O ATOM 295 OE2 GLU A 18 1.405 14.744 -15.701 1.00 0.00 O ATOM 0 H GLU A 18 3.684 13.601 -11.567 1.00 0.00 H new ATOM 0 HA GLU A 18 2.256 12.880 -14.059 1.00 0.00 H new ATOM 0 HB2 GLU A 18 4.975 14.128 -13.483 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.598 13.397 -15.030 1.00 0.00 H new ATOM 0 HG2 GLU A 18 2.931 15.641 -13.821 1.00 0.00 H new ATOM 0 HG3 GLU A 18 4.303 15.936 -14.871 1.00 0.00 H new ATOM 302 N SER A 19 3.867 10.821 -14.508 1.00 0.00 N ATOM 303 CA SER A 19 4.567 9.529 -14.630 1.00 0.00 C ATOM 304 C SER A 19 6.058 9.606 -14.254 1.00 0.00 C ATOM 305 O SER A 19 6.669 8.587 -13.927 1.00 0.00 O ATOM 306 CB SER A 19 4.460 9.010 -16.071 1.00 0.00 C ATOM 307 OG SER A 19 3.110 8.986 -16.509 1.00 0.00 O ATOM 0 H SER A 19 3.433 11.125 -15.380 1.00 0.00 H new ATOM 0 HA SER A 19 4.080 8.853 -13.927 1.00 0.00 H new ATOM 0 HB2 SER A 19 5.049 9.644 -16.733 1.00 0.00 H new ATOM 0 HB3 SER A 19 4.883 8.007 -16.131 1.00 0.00 H new ATOM 0 HG SER A 19 2.515 9.115 -15.741 1.00 0.00 H new ATOM 313 N SER A 20 6.632 10.815 -14.272 1.00 0.00 N ATOM 314 CA SER A 20 8.055 11.099 -14.047 1.00 0.00 C ATOM 315 C SER A 20 8.352 11.657 -12.648 1.00 0.00 C ATOM 316 O SER A 20 9.525 11.847 -12.315 1.00 0.00 O ATOM 317 CB SER A 20 8.569 12.076 -15.112 1.00 0.00 C ATOM 318 OG SER A 20 8.362 11.555 -16.419 1.00 0.00 O ATOM 0 H SER A 20 6.092 11.661 -14.452 1.00 0.00 H new ATOM 0 HA SER A 20 8.576 10.145 -14.122 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.056 13.033 -15.012 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.631 12.266 -14.955 1.00 0.00 H new ATOM 0 HG SER A 20 8.695 12.194 -17.083 1.00 0.00 H new ATOM 324 N ASP A 21 7.335 11.921 -11.813 1.00 0.00 N ATOM 325 CA ASP A 21 7.571 12.239 -10.397 1.00 0.00 C ATOM 326 C ASP A 21 8.141 11.015 -9.651 1.00 0.00 C ATOM 327 O ASP A 21 7.983 9.876 -10.102 1.00 0.00 O ATOM 328 CB ASP A 21 6.288 12.746 -9.719 1.00 0.00 C ATOM 329 CG ASP A 21 6.003 14.221 -10.034 1.00 0.00 C ATOM 330 OD1 ASP A 21 6.890 15.077 -9.806 1.00 0.00 O ATOM 331 OD2 ASP A 21 4.875 14.530 -10.481 1.00 0.00 O ATOM 0 H ASP A 21 6.353 11.921 -12.089 1.00 0.00 H new ATOM 0 HA ASP A 21 8.308 13.040 -10.352 1.00 0.00 H new ATOM 0 HB2 ASP A 21 5.444 12.138 -10.045 1.00 0.00 H new ATOM 0 HB3 ASP A 21 6.376 12.618 -8.640 1.00 0.00 H new ATOM 336 N THR A 22 8.806 11.228 -8.510 1.00 0.00 N ATOM 337 CA THR A 22 9.387 10.137 -7.707 1.00 0.00 C ATOM 338 C THR A 22 8.425 9.599 -6.646 1.00 0.00 C ATOM 339 O THR A 22 7.485 10.277 -6.230 1.00 0.00 O ATOM 340 CB THR A 22 10.715 10.534 -7.043 1.00 0.00 C ATOM 341 OG1 THR A 22 10.550 11.615 -6.151 1.00 0.00 O ATOM 342 CG2 THR A 22 11.774 10.934 -8.069 1.00 0.00 C ATOM 0 H THR A 22 8.958 12.156 -8.115 1.00 0.00 H new ATOM 0 HA THR A 22 9.583 9.339 -8.423 1.00 0.00 H new ATOM 0 HB THR A 22 11.046 9.649 -6.500 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.414 11.840 -5.746 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.695 11.206 -7.554 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.967 10.096 -8.738 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.416 11.786 -8.648 1.00 0.00 H new ATOM 350 N ILE A 23 8.685 8.392 -6.138 1.00 0.00 N ATOM 351 CA ILE A 23 7.979 7.821 -4.978 1.00 0.00 C ATOM 352 C ILE A 23 8.138 8.730 -3.745 1.00 0.00 C ATOM 353 O ILE A 23 7.159 9.011 -3.057 1.00 0.00 O ATOM 354 CB ILE A 23 8.473 6.377 -4.733 1.00 0.00 C ATOM 355 CG1 ILE A 23 8.079 5.409 -5.874 1.00 0.00 C ATOM 356 CG2 ILE A 23 8.008 5.803 -3.385 1.00 0.00 C ATOM 357 CD1 ILE A 23 6.582 5.112 -6.025 1.00 0.00 C ATOM 0 H ILE A 23 9.399 7.773 -6.522 1.00 0.00 H new ATOM 0 HA ILE A 23 6.909 7.769 -5.182 1.00 0.00 H new ATOM 0 HB ILE A 23 9.560 6.457 -4.709 1.00 0.00 H new ATOM 0 HG12 ILE A 23 8.443 5.823 -6.815 1.00 0.00 H new ATOM 0 HG13 ILE A 23 8.601 4.465 -5.718 1.00 0.00 H new ATOM 0 HG21 ILE A 23 8.387 4.787 -3.272 1.00 0.00 H new ATOM 0 HG22 ILE A 23 8.388 6.424 -2.574 1.00 0.00 H new ATOM 0 HG23 ILE A 23 6.919 5.790 -3.352 1.00 0.00 H new ATOM 0 HD11 ILE A 23 6.430 4.423 -6.856 1.00 0.00 H new ATOM 0 HD12 ILE A 23 6.206 4.662 -5.106 1.00 0.00 H new ATOM 0 HD13 ILE A 23 6.045 6.040 -6.220 1.00 0.00 H new ATOM 369 N ASP A 24 9.339 9.270 -3.508 1.00 0.00 N ATOM 370 CA ASP A 24 9.598 10.300 -2.488 1.00 0.00 C ATOM 371 C ASP A 24 8.705 11.546 -2.641 1.00 0.00 C ATOM 372 O ASP A 24 8.196 12.082 -1.654 1.00 0.00 O ATOM 373 CB ASP A 24 11.066 10.724 -2.573 1.00 0.00 C ATOM 374 CG ASP A 24 11.451 11.691 -1.441 1.00 0.00 C ATOM 375 OD1 ASP A 24 11.543 11.247 -0.272 1.00 0.00 O ATOM 376 OD2 ASP A 24 11.679 12.893 -1.719 1.00 0.00 O ATOM 0 H ASP A 24 10.175 9.001 -4.027 1.00 0.00 H new ATOM 0 HA ASP A 24 9.365 9.858 -1.519 1.00 0.00 H new ATOM 0 HB2 ASP A 24 11.702 9.840 -2.527 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.251 11.200 -3.536 1.00 0.00 H new ATOM 381 N ASN A 25 8.483 11.990 -3.883 1.00 0.00 N ATOM 382 CA ASN A 25 7.590 13.104 -4.192 1.00 0.00 C ATOM 383 C ASN A 25 6.149 12.761 -3.822 1.00 0.00 C ATOM 384 O ASN A 25 5.502 13.566 -3.159 1.00 0.00 O ATOM 385 CB ASN A 25 7.687 13.519 -5.668 1.00 0.00 C ATOM 386 CG ASN A 25 8.609 14.710 -5.850 1.00 0.00 C ATOM 387 OD1 ASN A 25 8.189 15.833 -6.094 1.00 0.00 O ATOM 388 ND2 ASN A 25 9.893 14.501 -5.698 1.00 0.00 N ATOM 0 H ASN A 25 8.924 11.580 -4.707 1.00 0.00 H new ATOM 0 HA ASN A 25 7.910 13.955 -3.591 1.00 0.00 H new ATOM 0 HB2 ASN A 25 8.053 12.680 -6.260 1.00 0.00 H new ATOM 0 HB3 ASN A 25 6.694 13.765 -6.044 1.00 0.00 H new ATOM 0 HD21 ASN A 25 10.550 15.277 -5.783 1.00 0.00 H new ATOM 0 HD22 ASN A 25 10.236 13.562 -5.495 1.00 0.00 H new ATOM 395 N VAL A 26 5.653 11.576 -4.198 1.00 0.00 N ATOM 396 CA VAL A 26 4.292 11.136 -3.856 1.00 0.00 C ATOM 397 C VAL A 26 4.069 11.225 -2.353 1.00 0.00 C ATOM 398 O VAL A 26 3.137 11.905 -1.936 1.00 0.00 O ATOM 399 CB VAL A 26 3.978 9.719 -4.353 1.00 0.00 C ATOM 400 CG1 VAL A 26 2.563 9.286 -3.949 1.00 0.00 C ATOM 401 CG2 VAL A 26 4.087 9.626 -5.877 1.00 0.00 C ATOM 0 H VAL A 26 6.180 10.896 -4.746 1.00 0.00 H new ATOM 0 HA VAL A 26 3.607 11.811 -4.370 1.00 0.00 H new ATOM 0 HB VAL A 26 4.712 9.060 -3.890 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.372 8.278 -4.316 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.475 9.299 -2.863 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.835 9.973 -4.380 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.859 8.609 -6.197 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.380 10.318 -6.335 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.100 9.884 -6.186 1.00 0.00 H new ATOM 411 N LYS A 27 4.950 10.635 -1.531 1.00 0.00 N ATOM 412 CA LYS A 27 4.882 10.735 -0.058 1.00 0.00 C ATOM 413 C LYS A 27 4.691 12.177 0.418 1.00 0.00 C ATOM 414 O LYS A 27 3.820 12.474 1.234 1.00 0.00 O ATOM 415 CB LYS A 27 6.154 10.153 0.569 1.00 0.00 C ATOM 416 CG LYS A 27 6.349 8.669 0.278 1.00 0.00 C ATOM 417 CD LYS A 27 7.712 8.220 0.796 1.00 0.00 C ATOM 418 CE LYS A 27 7.881 6.729 0.517 1.00 0.00 C ATOM 419 NZ LYS A 27 8.909 6.140 1.416 1.00 0.00 N ATOM 0 H LYS A 27 5.733 10.073 -1.866 1.00 0.00 H new ATOM 0 HA LYS A 27 4.012 10.162 0.262 1.00 0.00 H new ATOM 0 HB2 LYS A 27 7.018 10.705 0.198 1.00 0.00 H new ATOM 0 HB3 LYS A 27 6.119 10.302 1.648 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.559 8.088 0.754 1.00 0.00 H new ATOM 0 HG3 LYS A 27 6.278 8.486 -0.794 1.00 0.00 H new ATOM 0 HD2 LYS A 27 8.506 8.787 0.309 1.00 0.00 H new ATOM 0 HD3 LYS A 27 7.791 8.415 1.866 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.929 6.217 0.660 1.00 0.00 H new ATOM 0 HE3 LYS A 27 8.171 6.579 -0.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 9.194 5.208 1.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 9.739 6.766 1.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 8.514 6.034 2.372 1.00 0.00 H new ATOM 433 N SER A 28 5.488 13.079 -0.147 1.00 0.00 N ATOM 434 CA SER A 28 5.498 14.521 0.132 1.00 0.00 C ATOM 435 C SER A 28 4.199 15.243 -0.279 1.00 0.00 C ATOM 436 O SER A 28 3.926 16.342 0.209 1.00 0.00 O ATOM 437 CB SER A 28 6.717 15.152 -0.560 1.00 0.00 C ATOM 438 OG SER A 28 7.042 16.403 0.022 1.00 0.00 O ATOM 0 H SER A 28 6.181 12.816 -0.848 1.00 0.00 H new ATOM 0 HA SER A 28 5.565 14.644 1.213 1.00 0.00 H new ATOM 0 HB2 SER A 28 7.571 14.479 -0.484 1.00 0.00 H new ATOM 0 HB3 SER A 28 6.509 15.284 -1.622 1.00 0.00 H new ATOM 0 HG SER A 28 7.821 16.783 -0.434 1.00 0.00 H new ATOM 444 N LYS A 29 3.345 14.632 -1.117 1.00 0.00 N ATOM 445 CA LYS A 29 2.072 15.210 -1.577 1.00 0.00 C ATOM 446 C LYS A 29 0.929 14.853 -0.625 1.00 0.00 C ATOM 447 O LYS A 29 0.078 15.701 -0.380 1.00 0.00 O ATOM 448 CB LYS A 29 1.776 14.774 -3.021 1.00 0.00 C ATOM 449 CG LYS A 29 2.836 15.212 -4.041 1.00 0.00 C ATOM 450 CD LYS A 29 2.607 16.594 -4.667 1.00 0.00 C ATOM 451 CE LYS A 29 1.538 16.521 -5.761 1.00 0.00 C ATOM 452 NZ LYS A 29 1.469 17.775 -6.554 1.00 0.00 N ATOM 0 H LYS A 29 3.524 13.704 -1.501 1.00 0.00 H new ATOM 0 HA LYS A 29 2.161 16.296 -1.572 1.00 0.00 H new ATOM 0 HB2 LYS A 29 1.687 13.688 -3.050 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.810 15.181 -3.321 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.811 15.209 -3.553 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.877 14.471 -4.839 1.00 0.00 H new ATOM 0 HD2 LYS A 29 2.299 17.301 -3.897 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.541 16.968 -5.088 1.00 0.00 H new ATOM 0 HE2 LYS A 29 1.754 15.684 -6.424 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.567 16.325 -5.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.082 17.569 -7.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.854 18.459 -6.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.423 18.177 -6.652 1.00 0.00 H new ATOM 466 N ILE A 30 0.942 13.667 0.002 1.00 0.00 N ATOM 467 CA ILE A 30 0.015 13.318 1.103 1.00 0.00 C ATOM 468 C ILE A 30 0.110 14.347 2.246 1.00 0.00 C ATOM 469 O ILE A 30 -0.896 14.697 2.869 1.00 0.00 O ATOM 470 CB ILE A 30 0.272 11.889 1.647 1.00 0.00 C ATOM 471 CG1 ILE A 30 -0.165 10.786 0.661 1.00 0.00 C ATOM 472 CG2 ILE A 30 -0.504 11.650 2.953 1.00 0.00 C ATOM 473 CD1 ILE A 30 0.970 10.316 -0.239 1.00 0.00 C ATOM 0 H ILE A 30 1.593 12.919 -0.236 1.00 0.00 H new ATOM 0 HA ILE A 30 -0.994 13.339 0.690 1.00 0.00 H new ATOM 0 HB ILE A 30 1.349 11.831 1.806 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.553 9.936 1.222 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.982 11.160 0.043 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.307 10.641 3.314 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -0.184 12.373 3.704 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.572 11.767 2.768 1.00 0.00 H new ATOM 0 HD11 ILE A 30 0.604 9.540 -0.911 1.00 0.00 H new ATOM 0 HD12 ILE A 30 1.342 11.157 -0.824 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.777 9.914 0.373 1.00 0.00 H new ATOM 485 N GLN A 31 1.312 14.869 2.508 1.00 0.00 N ATOM 486 CA GLN A 31 1.553 15.884 3.543 1.00 0.00 C ATOM 487 C GLN A 31 0.791 17.204 3.280 1.00 0.00 C ATOM 488 O GLN A 31 0.568 17.989 4.201 1.00 0.00 O ATOM 489 CB GLN A 31 3.068 16.099 3.705 1.00 0.00 C ATOM 490 CG GLN A 31 3.434 16.951 4.928 1.00 0.00 C ATOM 491 CD GLN A 31 4.936 16.969 5.199 1.00 0.00 C ATOM 492 OE1 GLN A 31 5.752 17.365 4.377 1.00 0.00 O ATOM 493 NE2 GLN A 31 5.354 16.559 6.376 1.00 0.00 N ATOM 0 H GLN A 31 2.155 14.597 2.003 1.00 0.00 H new ATOM 0 HA GLN A 31 1.151 15.513 4.486 1.00 0.00 H new ATOM 0 HB2 GLN A 31 3.559 15.129 3.787 1.00 0.00 H new ATOM 0 HB3 GLN A 31 3.458 16.579 2.807 1.00 0.00 H new ATOM 0 HG2 GLN A 31 3.084 17.972 4.774 1.00 0.00 H new ATOM 0 HG3 GLN A 31 2.914 16.565 5.805 1.00 0.00 H new ATOM 0 HE21 GLN A 31 4.683 16.227 7.068 1.00 0.00 H new ATOM 0 HE22 GLN A 31 6.350 16.573 6.597 1.00 0.00 H new ATOM 502 N ASP A 32 0.317 17.427 2.053 1.00 0.00 N ATOM 503 CA ASP A 32 -0.547 18.564 1.694 1.00 0.00 C ATOM 504 C ASP A 32 -2.033 18.333 2.045 1.00 0.00 C ATOM 505 O ASP A 32 -2.792 19.291 2.210 1.00 0.00 O ATOM 506 CB ASP A 32 -0.399 18.832 0.191 1.00 0.00 C ATOM 507 CG ASP A 32 -0.973 20.197 -0.221 1.00 0.00 C ATOM 508 OD1 ASP A 32 -0.418 21.241 0.201 1.00 0.00 O ATOM 509 OD2 ASP A 32 -1.961 20.233 -0.994 1.00 0.00 O ATOM 0 H ASP A 32 0.524 16.815 1.264 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.225 19.425 2.280 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.656 18.788 -0.081 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.906 18.045 -0.367 1.00 0.00 H new ATOM 514 N LYS A 33 -2.451 17.063 2.165 1.00 0.00 N ATOM 515 CA LYS A 33 -3.852 16.621 2.308 1.00 0.00 C ATOM 516 C LYS A 33 -4.212 16.265 3.756 1.00 0.00 C ATOM 517 O LYS A 33 -5.283 16.635 4.234 1.00 0.00 O ATOM 518 CB LYS A 33 -4.146 15.426 1.374 1.00 0.00 C ATOM 519 CG LYS A 33 -3.448 15.446 0.003 1.00 0.00 C ATOM 520 CD LYS A 33 -3.714 16.677 -0.871 1.00 0.00 C ATOM 521 CE LYS A 33 -4.980 16.510 -1.715 1.00 0.00 C ATOM 522 NZ LYS A 33 -5.347 17.773 -2.408 1.00 0.00 N ATOM 0 H LYS A 33 -1.796 16.281 2.165 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.478 17.465 2.018 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.860 14.510 1.890 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.222 15.377 1.209 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.373 15.365 0.164 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.755 14.559 -0.551 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.813 17.558 -0.237 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.860 16.849 -1.526 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.825 15.722 -2.452 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.804 16.192 -1.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.209 17.623 -2.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.519 18.518 -1.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.570 18.063 -3.036 1.00 0.00 H new ATOM 536 N GLU A 34 -3.316 15.560 4.452 1.00 0.00 N ATOM 537 CA GLU A 34 -3.505 15.059 5.829 1.00 0.00 C ATOM 538 C GLU A 34 -2.340 15.401 6.771 1.00 0.00 C ATOM 539 O GLU A 34 -2.522 15.440 7.990 1.00 0.00 O ATOM 540 CB GLU A 34 -3.687 13.533 5.808 1.00 0.00 C ATOM 541 CG GLU A 34 -4.954 13.057 5.086 1.00 0.00 C ATOM 542 CD GLU A 34 -6.279 13.510 5.741 1.00 0.00 C ATOM 543 OE1 GLU A 34 -6.339 13.685 6.983 1.00 0.00 O ATOM 544 OE2 GLU A 34 -7.291 13.657 5.013 1.00 0.00 O ATOM 0 H GLU A 34 -2.406 15.310 4.065 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.394 15.558 6.214 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -2.819 13.082 5.328 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.709 13.168 6.835 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.929 13.421 4.059 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.942 11.968 5.039 1.00 0.00 H new ATOM 551 N GLY A 35 -1.148 15.671 6.224 1.00 0.00 N ATOM 552 CA GLY A 35 0.026 16.113 6.991 1.00 0.00 C ATOM 553 C GLY A 35 1.026 15.006 7.347 1.00 0.00 C ATOM 554 O GLY A 35 1.962 15.251 8.110 1.00 0.00 O ATOM 0 H GLY A 35 -0.968 15.588 5.223 1.00 0.00 H new ATOM 0 HA2 GLY A 35 0.546 16.881 6.418 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.317 16.581 7.913 1.00 0.00 H new ATOM 558 N ILE A 36 0.849 13.794 6.805 1.00 0.00 N ATOM 559 CA ILE A 36 1.689 12.620 7.090 1.00 0.00 C ATOM 560 C ILE A 36 3.143 12.872 6.653 1.00 0.00 C ATOM 561 O ILE A 36 3.377 13.155 5.474 1.00 0.00 O ATOM 562 CB ILE A 36 1.141 11.351 6.399 1.00 0.00 C ATOM 563 CG1 ILE A 36 -0.355 11.077 6.678 1.00 0.00 C ATOM 564 CG2 ILE A 36 1.992 10.127 6.790 1.00 0.00 C ATOM 565 CD1 ILE A 36 -0.756 11.021 8.159 1.00 0.00 C ATOM 0 H ILE A 36 0.101 13.596 6.141 1.00 0.00 H new ATOM 0 HA ILE A 36 1.667 12.456 8.167 1.00 0.00 H new ATOM 0 HB ILE A 36 1.215 11.534 5.327 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -0.945 11.853 6.190 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -0.625 10.130 6.211 1.00 0.00 H new ATOM 0 HG21 ILE A 36 1.598 9.238 6.298 1.00 0.00 H new ATOM 0 HG22 ILE A 36 3.024 10.287 6.478 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.957 9.990 7.871 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -1.825 10.824 8.239 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -0.202 10.225 8.656 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.526 11.975 8.634 1.00 0.00 H new ATOM 577 N PRO A 37 4.133 12.757 7.557 1.00 0.00 N ATOM 578 CA PRO A 37 5.530 13.029 7.243 1.00 0.00 C ATOM 579 C PRO A 37 6.094 11.987 6.261 1.00 0.00 C ATOM 580 O PRO A 37 6.014 10.788 6.548 1.00 0.00 O ATOM 581 CB PRO A 37 6.270 13.014 8.581 1.00 0.00 C ATOM 582 CG PRO A 37 5.397 12.133 9.469 1.00 0.00 C ATOM 583 CD PRO A 37 3.991 12.337 8.943 1.00 0.00 C ATOM 0 HA PRO A 37 5.649 13.991 6.745 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.276 12.606 8.478 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.374 14.018 8.992 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.696 11.087 9.406 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.475 12.425 10.516 1.00 0.00 H new ATOM 0 HD2 PRO A 37 3.412 11.416 9.013 1.00 0.00 H new ATOM 0 HD3 PRO A 37 3.463 13.091 9.526 1.00 0.00 H new ATOM 591 N PRO A 38 6.698 12.400 5.129 1.00 0.00 N ATOM 592 CA PRO A 38 7.236 11.481 4.122 1.00 0.00 C ATOM 593 C PRO A 38 8.389 10.566 4.584 1.00 0.00 C ATOM 594 O PRO A 38 8.821 9.718 3.803 1.00 0.00 O ATOM 595 CB PRO A 38 7.624 12.355 2.921 1.00 0.00 C ATOM 596 CG PRO A 38 7.772 13.760 3.486 1.00 0.00 C ATOM 597 CD PRO A 38 6.773 13.773 4.637 1.00 0.00 C ATOM 0 HA PRO A 38 6.468 10.749 3.874 1.00 0.00 H new ATOM 0 HB2 PRO A 38 8.554 12.012 2.468 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.860 12.321 2.145 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.788 13.951 3.831 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.540 14.521 2.741 1.00 0.00 H new ATOM 0 HD2 PRO A 38 7.097 14.452 5.426 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.796 14.119 4.300 1.00 0.00 H new ATOM 605 N ASP A 39 8.872 10.670 5.829 1.00 0.00 N ATOM 606 CA ASP A 39 9.834 9.711 6.385 1.00 0.00 C ATOM 607 C ASP A 39 9.134 8.474 6.980 1.00 0.00 C ATOM 608 O ASP A 39 9.640 7.357 6.851 1.00 0.00 O ATOM 609 CB ASP A 39 10.705 10.407 7.442 1.00 0.00 C ATOM 610 CG ASP A 39 11.928 9.548 7.807 1.00 0.00 C ATOM 611 OD1 ASP A 39 11.800 8.611 8.631 1.00 0.00 O ATOM 612 OD2 ASP A 39 13.027 9.800 7.256 1.00 0.00 O ATOM 0 H ASP A 39 8.609 11.415 6.474 1.00 0.00 H new ATOM 0 HA ASP A 39 10.468 9.356 5.573 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.036 11.374 7.065 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.112 10.600 8.336 1.00 0.00 H new ATOM 617 N GLN A 40 7.960 8.645 7.606 1.00 0.00 N ATOM 618 CA GLN A 40 7.252 7.558 8.286 1.00 0.00 C ATOM 619 C GLN A 40 6.569 6.598 7.310 1.00 0.00 C ATOM 620 O GLN A 40 6.453 5.405 7.594 1.00 0.00 O ATOM 621 CB GLN A 40 6.198 8.157 9.230 1.00 0.00 C ATOM 622 CG GLN A 40 6.730 8.605 10.602 1.00 0.00 C ATOM 623 CD GLN A 40 7.999 9.453 10.604 1.00 0.00 C ATOM 624 OE1 GLN A 40 9.106 8.958 10.448 1.00 0.00 O ATOM 625 NE2 GLN A 40 7.880 10.744 10.832 1.00 0.00 N ATOM 0 H GLN A 40 7.477 9.542 7.653 1.00 0.00 H new ATOM 0 HA GLN A 40 7.992 6.983 8.842 1.00 0.00 H new ATOM 0 HB2 GLN A 40 5.738 9.014 8.739 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.411 7.419 9.386 1.00 0.00 H new ATOM 0 HG2 GLN A 40 5.944 9.169 11.104 1.00 0.00 H new ATOM 0 HG3 GLN A 40 6.916 7.714 11.202 1.00 0.00 H new ATOM 0 HE21 GLN A 40 6.956 11.156 10.962 1.00 0.00 H new ATOM 0 HE22 GLN A 40 8.712 11.332 10.879 1.00 0.00 H new ATOM 634 N GLN A 41 6.079 7.125 6.189 1.00 0.00 N ATOM 635 CA GLN A 41 5.255 6.388 5.231 1.00 0.00 C ATOM 636 C GLN A 41 6.050 5.697 4.101 1.00 0.00 C ATOM 637 O GLN A 41 7.138 6.131 3.707 1.00 0.00 O ATOM 638 CB GLN A 41 4.150 7.305 4.679 1.00 0.00 C ATOM 639 CG GLN A 41 4.698 8.547 3.963 1.00 0.00 C ATOM 640 CD GLN A 41 3.641 9.242 3.118 1.00 0.00 C ATOM 641 OE1 GLN A 41 3.081 8.676 2.192 1.00 0.00 O ATOM 642 NE2 GLN A 41 3.366 10.504 3.348 1.00 0.00 N ATOM 0 H GLN A 41 6.246 8.093 5.916 1.00 0.00 H new ATOM 0 HA GLN A 41 4.801 5.564 5.781 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.529 6.738 3.986 1.00 0.00 H new ATOM 0 HB3 GLN A 41 3.505 7.621 5.499 1.00 0.00 H new ATOM 0 HG2 GLN A 41 5.087 9.247 4.702 1.00 0.00 H new ATOM 0 HG3 GLN A 41 5.535 8.257 3.327 1.00 0.00 H new ATOM 0 HE21 GLN A 41 3.824 10.994 4.117 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.695 10.995 2.758 1.00 0.00 H new ATOM 651 N ARG A 42 5.456 4.646 3.525 1.00 0.00 N ATOM 652 CA ARG A 42 5.849 3.922 2.302 1.00 0.00 C ATOM 653 C ARG A 42 4.615 3.735 1.408 1.00 0.00 C ATOM 654 O ARG A 42 3.491 3.813 1.905 1.00 0.00 O ATOM 655 CB ARG A 42 6.499 2.550 2.604 1.00 0.00 C ATOM 656 CG ARG A 42 7.422 2.453 3.835 1.00 0.00 C ATOM 657 CD ARG A 42 6.680 1.901 5.063 1.00 0.00 C ATOM 658 NE ARG A 42 7.580 1.753 6.222 1.00 0.00 N ATOM 659 CZ ARG A 42 7.641 0.740 7.072 1.00 0.00 C ATOM 660 NH1 ARG A 42 6.821 -0.272 7.034 1.00 0.00 N ATOM 661 NH2 ARG A 42 8.556 0.722 7.998 1.00 0.00 N ATOM 0 H ARG A 42 4.614 4.242 3.935 1.00 0.00 H new ATOM 0 HA ARG A 42 6.602 4.521 1.790 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.700 1.819 2.725 1.00 0.00 H new ATOM 0 HB3 ARG A 42 7.075 2.251 1.728 1.00 0.00 H new ATOM 0 HG2 ARG A 42 8.270 1.809 3.603 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.824 3.439 4.066 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.859 2.569 5.323 1.00 0.00 H new ATOM 0 HD3 ARG A 42 6.240 0.934 4.818 1.00 0.00 H new ATOM 0 HE ARG A 42 8.231 2.520 6.388 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.089 -0.309 6.325 1.00 0.00 H new ATOM 0 HH12 ARG A 42 6.912 -1.028 7.713 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.226 1.488 8.068 1.00 0.00 H new ATOM 0 HH22 ARG A 42 8.603 -0.058 8.653 1.00 0.00 H new ATOM 675 N LEU A 43 4.813 3.448 0.121 1.00 0.00 N ATOM 676 CA LEU A 43 3.734 3.131 -0.826 1.00 0.00 C ATOM 677 C LEU A 43 3.740 1.631 -1.172 1.00 0.00 C ATOM 678 O LEU A 43 4.795 0.992 -1.156 1.00 0.00 O ATOM 679 CB LEU A 43 3.844 4.014 -2.090 1.00 0.00 C ATOM 680 CG LEU A 43 3.486 5.514 -1.970 1.00 0.00 C ATOM 681 CD1 LEU A 43 2.160 5.769 -1.260 1.00 0.00 C ATOM 682 CD2 LEU A 43 4.527 6.363 -1.248 1.00 0.00 C ATOM 0 H LEU A 43 5.740 3.428 -0.303 1.00 0.00 H new ATOM 0 HA LEU A 43 2.777 3.353 -0.355 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.869 3.945 -2.456 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.202 3.579 -2.856 1.00 0.00 H new ATOM 0 HG LEU A 43 3.431 5.813 -3.017 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.973 6.842 -1.212 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.353 5.285 -1.811 1.00 0.00 H new ATOM 0 HD13 LEU A 43 2.204 5.363 -0.249 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.190 7.399 -1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.660 5.990 -0.233 1.00 0.00 H new ATOM 0 HD23 LEU A 43 5.475 6.308 -1.782 1.00 0.00 H new ATOM 694 N ILE A 44 2.568 1.076 -1.497 1.00 0.00 N ATOM 695 CA ILE A 44 2.341 -0.351 -1.797 1.00 0.00 C ATOM 696 C ILE A 44 1.532 -0.482 -3.103 1.00 0.00 C ATOM 697 O ILE A 44 0.390 -0.016 -3.172 1.00 0.00 O ATOM 698 CB ILE A 44 1.642 -1.076 -0.610 1.00 0.00 C ATOM 699 CG1 ILE A 44 2.288 -0.849 0.778 1.00 0.00 C ATOM 700 CG2 ILE A 44 1.539 -2.592 -0.849 1.00 0.00 C ATOM 701 CD1 ILE A 44 3.577 -1.643 1.018 1.00 0.00 C ATOM 0 H ILE A 44 1.713 1.628 -1.562 1.00 0.00 H new ATOM 0 HA ILE A 44 3.305 -0.840 -1.937 1.00 0.00 H new ATOM 0 HB ILE A 44 0.655 -0.615 -0.584 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.504 0.213 0.895 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.564 -1.114 1.549 1.00 0.00 H new ATOM 0 HG21 ILE A 44 1.045 -3.062 0.002 1.00 0.00 H new ATOM 0 HG22 ILE A 44 0.960 -2.779 -1.753 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.539 -3.011 -0.965 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.960 -1.423 2.014 1.00 0.00 H new ATOM 0 HD12 ILE A 44 3.368 -2.710 0.937 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.321 -1.362 0.273 1.00 0.00 H new ATOM 713 N PHE A 45 2.112 -1.100 -4.141 1.00 0.00 N ATOM 714 CA PHE A 45 1.422 -1.480 -5.392 1.00 0.00 C ATOM 715 C PHE A 45 1.860 -2.878 -5.862 1.00 0.00 C ATOM 716 O PHE A 45 3.019 -3.255 -5.690 1.00 0.00 O ATOM 717 CB PHE A 45 1.651 -0.416 -6.489 1.00 0.00 C ATOM 718 CG PHE A 45 0.866 -0.587 -7.790 1.00 0.00 C ATOM 719 CD1 PHE A 45 -0.465 -1.063 -7.793 1.00 0.00 C ATOM 720 CD2 PHE A 45 1.438 -0.172 -9.011 1.00 0.00 C ATOM 721 CE1 PHE A 45 -1.198 -1.130 -8.991 1.00 0.00 C ATOM 722 CE2 PHE A 45 0.697 -0.216 -10.203 1.00 0.00 C ATOM 723 CZ PHE A 45 -0.619 -0.701 -10.197 1.00 0.00 C ATOM 0 H PHE A 45 3.099 -1.358 -4.139 1.00 0.00 H new ATOM 0 HA PHE A 45 0.352 -1.524 -5.191 1.00 0.00 H new ATOM 0 HB2 PHE A 45 1.407 0.561 -6.071 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.713 -0.402 -6.733 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.923 -1.378 -6.867 1.00 0.00 H new ATOM 0 HD2 PHE A 45 2.458 0.184 -9.029 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.208 -1.512 -8.984 1.00 0.00 H new ATOM 0 HE2 PHE A 45 1.141 0.124 -11.127 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.185 -0.744 -11.116 1.00 0.00 H new ATOM 733 N ALA A 46 0.936 -3.664 -6.428 1.00 0.00 N ATOM 734 CA ALA A 46 1.105 -5.089 -6.758 1.00 0.00 C ATOM 735 C ALA A 46 1.691 -5.928 -5.588 1.00 0.00 C ATOM 736 O ALA A 46 2.439 -6.888 -5.791 1.00 0.00 O ATOM 737 CB ALA A 46 1.882 -5.197 -8.080 1.00 0.00 C ATOM 0 H ALA A 46 0.012 -3.313 -6.680 1.00 0.00 H new ATOM 0 HA ALA A 46 0.126 -5.545 -6.907 1.00 0.00 H new ATOM 0 HB1 ALA A 46 2.016 -6.247 -8.339 1.00 0.00 H new ATOM 0 HB2 ALA A 46 1.324 -4.696 -8.872 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.858 -4.724 -7.968 1.00 0.00 H new ATOM 743 N GLY A 47 1.377 -5.528 -4.351 1.00 0.00 N ATOM 744 CA GLY A 47 1.883 -6.073 -3.087 1.00 0.00 C ATOM 745 C GLY A 47 3.335 -5.703 -2.737 1.00 0.00 C ATOM 746 O GLY A 47 3.793 -6.022 -1.640 1.00 0.00 O ATOM 0 H GLY A 47 0.719 -4.764 -4.196 1.00 0.00 H new ATOM 0 HA2 GLY A 47 1.235 -5.731 -2.280 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.802 -7.159 -3.122 1.00 0.00 H new ATOM 750 N LYS A 48 4.069 -5.021 -3.625 1.00 0.00 N ATOM 751 CA LYS A 48 5.465 -4.597 -3.435 1.00 0.00 C ATOM 752 C LYS A 48 5.539 -3.243 -2.721 1.00 0.00 C ATOM 753 O LYS A 48 4.826 -2.307 -3.081 1.00 0.00 O ATOM 754 CB LYS A 48 6.152 -4.537 -4.814 1.00 0.00 C ATOM 755 CG LYS A 48 7.652 -4.189 -4.781 1.00 0.00 C ATOM 756 CD LYS A 48 8.512 -5.261 -4.095 1.00 0.00 C ATOM 757 CE LYS A 48 9.990 -4.852 -4.134 1.00 0.00 C ATOM 758 NZ LYS A 48 10.862 -5.891 -3.525 1.00 0.00 N ATOM 0 H LYS A 48 3.694 -4.738 -4.530 1.00 0.00 H new ATOM 0 HA LYS A 48 5.982 -5.318 -2.801 1.00 0.00 H new ATOM 0 HB2 LYS A 48 6.029 -5.502 -5.306 1.00 0.00 H new ATOM 0 HB3 LYS A 48 5.637 -3.798 -5.428 1.00 0.00 H new ATOM 0 HG2 LYS A 48 8.007 -4.047 -5.802 1.00 0.00 H new ATOM 0 HG3 LYS A 48 7.786 -3.240 -4.262 1.00 0.00 H new ATOM 0 HD2 LYS A 48 8.189 -5.392 -3.062 1.00 0.00 H new ATOM 0 HD3 LYS A 48 8.378 -6.221 -4.594 1.00 0.00 H new ATOM 0 HE2 LYS A 48 10.294 -4.681 -5.167 1.00 0.00 H new ATOM 0 HE3 LYS A 48 10.121 -3.909 -3.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 11.854 -5.581 -3.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 10.588 -6.036 -2.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 10.755 -6.784 -4.048 1.00 0.00 H new ATOM 772 N GLN A 49 6.427 -3.133 -1.731 1.00 0.00 N ATOM 773 CA GLN A 49 6.788 -1.865 -1.089 1.00 0.00 C ATOM 774 C GLN A 49 7.717 -1.052 -2.001 1.00 0.00 C ATOM 775 O GLN A 49 8.857 -1.446 -2.261 1.00 0.00 O ATOM 776 CB GLN A 49 7.382 -2.128 0.304 1.00 0.00 C ATOM 777 CG GLN A 49 7.522 -0.825 1.107 1.00 0.00 C ATOM 778 CD GLN A 49 7.938 -1.093 2.551 1.00 0.00 C ATOM 779 OE1 GLN A 49 7.120 -1.168 3.458 1.00 0.00 O ATOM 780 NE2 GLN A 49 9.216 -1.239 2.827 1.00 0.00 N ATOM 0 H GLN A 49 6.925 -3.936 -1.345 1.00 0.00 H new ATOM 0 HA GLN A 49 5.895 -1.259 -0.938 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.745 -2.826 0.847 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.359 -2.601 0.202 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.260 -0.181 0.629 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.574 -0.287 1.095 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.909 -1.179 2.081 1.00 0.00 H new ATOM 0 HE22 GLN A 49 9.514 -1.412 3.787 1.00 0.00 H new ATOM 789 N LEU A 50 7.192 0.046 -2.546 1.00 0.00 N ATOM 790 CA LEU A 50 7.827 0.857 -3.588 1.00 0.00 C ATOM 791 C LEU A 50 9.017 1.660 -3.026 1.00 0.00 C ATOM 792 O LEU A 50 8.928 2.238 -1.939 1.00 0.00 O ATOM 793 CB LEU A 50 6.771 1.770 -4.244 1.00 0.00 C ATOM 794 CG LEU A 50 5.447 1.081 -4.650 1.00 0.00 C ATOM 795 CD1 LEU A 50 4.570 2.056 -5.436 1.00 0.00 C ATOM 796 CD2 LEU A 50 5.637 -0.174 -5.498 1.00 0.00 C ATOM 0 H LEU A 50 6.281 0.409 -2.265 1.00 0.00 H new ATOM 0 HA LEU A 50 8.235 0.198 -4.354 1.00 0.00 H new ATOM 0 HB2 LEU A 50 6.540 2.581 -3.554 1.00 0.00 H new ATOM 0 HB3 LEU A 50 7.211 2.223 -5.133 1.00 0.00 H new ATOM 0 HG LEU A 50 4.976 0.779 -3.715 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.640 1.563 -5.718 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.347 2.925 -4.817 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.097 2.377 -6.334 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.663 -0.599 -5.742 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.161 0.085 -6.418 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.223 -0.905 -4.940 1.00 0.00 H new ATOM 808 N GLU A 51 10.138 1.686 -3.750 1.00 0.00 N ATOM 809 CA GLU A 51 11.391 2.315 -3.303 1.00 0.00 C ATOM 810 C GLU A 51 11.406 3.820 -3.629 1.00 0.00 C ATOM 811 O GLU A 51 10.963 4.260 -4.686 1.00 0.00 O ATOM 812 CB GLU A 51 12.565 1.550 -3.928 1.00 0.00 C ATOM 813 CG GLU A 51 13.964 2.074 -3.587 1.00 0.00 C ATOM 814 CD GLU A 51 15.057 1.138 -4.147 1.00 0.00 C ATOM 815 OE1 GLU A 51 15.001 0.773 -5.349 1.00 0.00 O ATOM 816 OE2 GLU A 51 15.983 0.758 -3.388 1.00 0.00 O ATOM 0 H GLU A 51 10.206 1.266 -4.677 1.00 0.00 H new ATOM 0 HA GLU A 51 11.481 2.255 -2.218 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.502 0.508 -3.614 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.447 1.565 -5.012 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.092 3.075 -3.999 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.071 2.158 -2.506 1.00 0.00 H new ATOM 823 N ASP A 52 11.942 4.625 -2.714 1.00 0.00 N ATOM 824 CA ASP A 52 11.854 6.097 -2.720 1.00 0.00 C ATOM 825 C ASP A 52 12.484 6.802 -3.934 1.00 0.00 C ATOM 826 O ASP A 52 11.942 7.802 -4.413 1.00 0.00 O ATOM 827 CB ASP A 52 12.417 6.653 -1.406 1.00 0.00 C ATOM 828 CG ASP A 52 13.949 6.551 -1.298 1.00 0.00 C ATOM 829 OD1 ASP A 52 14.466 5.430 -1.079 1.00 0.00 O ATOM 830 OD2 ASP A 52 14.639 7.591 -1.425 1.00 0.00 O ATOM 0 H ASP A 52 12.469 4.266 -1.918 1.00 0.00 H new ATOM 0 HA ASP A 52 10.792 6.323 -2.811 1.00 0.00 H new ATOM 0 HB2 ASP A 52 12.123 7.698 -1.308 1.00 0.00 H new ATOM 0 HB3 ASP A 52 11.966 6.116 -0.572 1.00 0.00 H new ATOM 835 N GLY A 53 13.590 6.267 -4.460 1.00 0.00 N ATOM 836 CA GLY A 53 14.309 6.824 -5.612 1.00 0.00 C ATOM 837 C GLY A 53 13.696 6.476 -6.975 1.00 0.00 C ATOM 838 O GLY A 53 14.201 6.927 -8.006 1.00 0.00 O ATOM 0 H GLY A 53 14.019 5.419 -4.091 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.346 7.909 -5.511 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.338 6.466 -5.589 1.00 0.00 H new ATOM 842 N ARG A 54 12.629 5.663 -7.001 1.00 0.00 N ATOM 843 CA ARG A 54 11.908 5.255 -8.221 1.00 0.00 C ATOM 844 C ARG A 54 10.945 6.342 -8.684 1.00 0.00 C ATOM 845 O ARG A 54 10.656 7.279 -7.940 1.00 0.00 O ATOM 846 CB ARG A 54 11.102 3.976 -7.947 1.00 0.00 C ATOM 847 CG ARG A 54 11.928 2.832 -7.362 1.00 0.00 C ATOM 848 CD ARG A 54 12.911 2.238 -8.358 1.00 0.00 C ATOM 849 NE ARG A 54 13.563 1.063 -7.768 1.00 0.00 N ATOM 850 CZ ARG A 54 13.326 -0.211 -7.990 1.00 0.00 C ATOM 851 NH1 ARG A 54 12.525 -0.650 -8.922 1.00 0.00 N ATOM 852 NH2 ARG A 54 13.924 -1.074 -7.223 1.00 0.00 N ATOM 0 H ARG A 54 12.232 5.259 -6.153 1.00 0.00 H new ATOM 0 HA ARG A 54 12.649 5.080 -9.001 1.00 0.00 H new ATOM 0 HB2 ARG A 54 10.289 4.212 -7.260 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.645 3.641 -8.878 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.476 3.195 -6.492 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.256 2.048 -7.012 1.00 0.00 H new ATOM 0 HD2 ARG A 54 12.391 1.956 -9.273 1.00 0.00 H new ATOM 0 HD3 ARG A 54 13.659 2.981 -8.633 1.00 0.00 H new ATOM 0 HE ARG A 54 14.301 1.262 -7.093 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.040 0.010 -9.530 1.00 0.00 H new ATOM 0 HH12 ARG A 54 12.384 -1.653 -9.043 1.00 0.00 H new ATOM 0 HH21 ARG A 54 14.549 -0.752 -6.484 1.00 0.00 H new ATOM 0 HH22 ARG A 54 13.768 -2.073 -7.361 1.00 0.00 H new ATOM 866 N THR A 55 10.382 6.167 -9.876 1.00 0.00 N ATOM 867 CA THR A 55 9.276 6.978 -10.407 1.00 0.00 C ATOM 868 C THR A 55 7.957 6.207 -10.405 1.00 0.00 C ATOM 869 O THR A 55 7.924 4.998 -10.168 1.00 0.00 O ATOM 870 CB THR A 55 9.575 7.483 -11.830 1.00 0.00 C ATOM 871 OG1 THR A 55 9.734 6.384 -12.704 1.00 0.00 O ATOM 872 CG2 THR A 55 10.834 8.347 -11.892 1.00 0.00 C ATOM 0 H THR A 55 10.687 5.439 -10.522 1.00 0.00 H new ATOM 0 HA THR A 55 9.178 7.837 -9.744 1.00 0.00 H new ATOM 0 HB THR A 55 8.729 8.099 -12.133 1.00 0.00 H new ATOM 0 HG1 THR A 55 9.922 6.710 -13.609 1.00 0.00 H new ATOM 0 HG21 THR A 55 10.999 8.677 -12.918 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.711 9.217 -11.247 1.00 0.00 H new ATOM 0 HG23 THR A 55 11.692 7.765 -11.556 1.00 0.00 H new ATOM 880 N LEU A 56 6.854 6.899 -10.697 1.00 0.00 N ATOM 881 CA LEU A 56 5.551 6.279 -10.954 1.00 0.00 C ATOM 882 C LEU A 56 5.641 5.286 -12.137 1.00 0.00 C ATOM 883 O LEU A 56 5.222 4.130 -12.024 1.00 0.00 O ATOM 884 CB LEU A 56 4.516 7.403 -11.192 1.00 0.00 C ATOM 885 CG LEU A 56 4.015 8.182 -9.955 1.00 0.00 C ATOM 886 CD1 LEU A 56 3.706 7.300 -8.745 1.00 0.00 C ATOM 887 CD2 LEU A 56 4.979 9.263 -9.481 1.00 0.00 C ATOM 0 H LEU A 56 6.839 7.917 -10.763 1.00 0.00 H new ATOM 0 HA LEU A 56 5.230 5.691 -10.094 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.952 8.120 -11.888 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.650 6.964 -11.687 1.00 0.00 H new ATOM 0 HG LEU A 56 3.095 8.635 -10.323 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.360 7.923 -7.920 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.930 6.581 -9.007 1.00 0.00 H new ATOM 0 HD13 LEU A 56 4.607 6.766 -8.444 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.561 9.767 -8.610 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.933 8.808 -9.214 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.134 9.988 -10.280 1.00 0.00 H new ATOM 899 N SER A 57 6.250 5.705 -13.251 1.00 0.00 N ATOM 900 CA SER A 57 6.430 4.888 -14.462 1.00 0.00 C ATOM 901 C SER A 57 7.196 3.578 -14.213 1.00 0.00 C ATOM 902 O SER A 57 6.905 2.565 -14.853 1.00 0.00 O ATOM 903 CB SER A 57 7.147 5.721 -15.532 1.00 0.00 C ATOM 904 OG SER A 57 7.185 5.059 -16.788 1.00 0.00 O ATOM 0 H SER A 57 6.641 6.643 -13.341 1.00 0.00 H new ATOM 0 HA SER A 57 5.435 4.598 -14.801 1.00 0.00 H new ATOM 0 HB2 SER A 57 6.641 6.680 -15.643 1.00 0.00 H new ATOM 0 HB3 SER A 57 8.164 5.934 -15.204 1.00 0.00 H new ATOM 0 HG SER A 57 7.648 5.624 -17.441 1.00 0.00 H new ATOM 910 N ASP A 58 8.110 3.548 -13.235 1.00 0.00 N ATOM 911 CA ASP A 58 8.900 2.366 -12.859 1.00 0.00 C ATOM 912 C ASP A 58 8.044 1.143 -12.500 1.00 0.00 C ATOM 913 O ASP A 58 8.378 0.012 -12.864 1.00 0.00 O ATOM 914 CB ASP A 58 9.785 2.709 -11.658 1.00 0.00 C ATOM 915 CG ASP A 58 11.004 1.777 -11.587 1.00 0.00 C ATOM 916 OD1 ASP A 58 12.003 2.039 -12.299 1.00 0.00 O ATOM 917 OD2 ASP A 58 10.982 0.792 -10.811 1.00 0.00 O ATOM 0 H ASP A 58 8.327 4.367 -12.667 1.00 0.00 H new ATOM 0 HA ASP A 58 9.493 2.101 -13.734 1.00 0.00 H new ATOM 0 HB2 ASP A 58 10.118 3.744 -11.731 1.00 0.00 H new ATOM 0 HB3 ASP A 58 9.205 2.625 -10.739 1.00 0.00 H new ATOM 922 N TYR A 59 6.915 1.385 -11.824 1.00 0.00 N ATOM 923 CA TYR A 59 5.956 0.359 -11.405 1.00 0.00 C ATOM 924 C TYR A 59 4.710 0.321 -12.306 1.00 0.00 C ATOM 925 O TYR A 59 3.711 -0.306 -11.950 1.00 0.00 O ATOM 926 CB TYR A 59 5.616 0.562 -9.922 1.00 0.00 C ATOM 927 CG TYR A 59 6.811 0.406 -9.003 1.00 0.00 C ATOM 928 CD1 TYR A 59 7.327 -0.875 -8.723 1.00 0.00 C ATOM 929 CD2 TYR A 59 7.394 1.542 -8.413 1.00 0.00 C ATOM 930 CE1 TYR A 59 8.407 -1.024 -7.830 1.00 0.00 C ATOM 931 CE2 TYR A 59 8.484 1.401 -7.534 1.00 0.00 C ATOM 932 CZ TYR A 59 8.982 0.115 -7.225 1.00 0.00 C ATOM 933 OH TYR A 59 9.991 -0.026 -6.321 1.00 0.00 O ATOM 0 H TYR A 59 6.637 2.326 -11.546 1.00 0.00 H new ATOM 0 HA TYR A 59 6.415 -0.623 -11.520 1.00 0.00 H new ATOM 0 HB2 TYR A 59 5.191 1.557 -9.787 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.848 -0.155 -9.632 1.00 0.00 H new ATOM 0 HD1 TYR A 59 6.894 -1.745 -9.194 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.004 2.524 -8.635 1.00 0.00 H new ATOM 0 HE1 TYR A 59 8.794 -2.008 -7.609 1.00 0.00 H new ATOM 0 HE2 TYR A 59 8.940 2.276 -7.095 1.00 0.00 H new ATOM 0 HH TYR A 59 10.837 -0.171 -6.795 1.00 0.00 H new ATOM 943 N ASN A 60 4.761 0.983 -13.473 1.00 0.00 N ATOM 944 CA ASN A 60 3.653 1.080 -14.437 1.00 0.00 C ATOM 945 C ASN A 60 2.430 1.817 -13.843 1.00 0.00 C ATOM 946 O ASN A 60 1.302 1.632 -14.303 1.00 0.00 O ATOM 947 CB ASN A 60 3.378 -0.327 -15.023 1.00 0.00 C ATOM 948 CG ASN A 60 2.661 -0.315 -16.363 1.00 0.00 C ATOM 949 OD1 ASN A 60 1.564 -0.833 -16.520 1.00 0.00 O ATOM 950 ND2 ASN A 60 3.270 0.236 -17.390 1.00 0.00 N ATOM 0 H ASN A 60 5.597 1.479 -13.781 1.00 0.00 H new ATOM 0 HA ASN A 60 3.928 1.715 -15.279 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.326 -0.853 -15.136 1.00 0.00 H new ATOM 0 HB3 ASN A 60 2.781 -0.895 -14.309 1.00 0.00 H new ATOM 0 HD21 ASN A 60 2.827 0.229 -18.309 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.185 0.670 -17.268 1.00 0.00 H new ATOM 957 N ILE A 61 2.648 2.678 -12.840 1.00 0.00 N ATOM 958 CA ILE A 61 1.630 3.583 -12.294 1.00 0.00 C ATOM 959 C ILE A 61 1.223 4.564 -13.402 1.00 0.00 C ATOM 960 O ILE A 61 2.079 5.213 -14.010 1.00 0.00 O ATOM 961 CB ILE A 61 2.155 4.395 -11.095 1.00 0.00 C ATOM 962 CG1 ILE A 61 2.734 3.535 -9.955 1.00 0.00 C ATOM 963 CG2 ILE A 61 1.054 5.377 -10.633 1.00 0.00 C ATOM 964 CD1 ILE A 61 1.713 3.077 -8.926 1.00 0.00 C ATOM 0 H ILE A 61 3.553 2.766 -12.378 1.00 0.00 H new ATOM 0 HA ILE A 61 0.789 2.982 -11.949 1.00 0.00 H new ATOM 0 HB ILE A 61 3.020 4.970 -11.427 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.213 2.657 -10.388 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.512 4.105 -9.447 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.416 5.957 -9.784 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.801 6.051 -11.451 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.167 4.816 -10.337 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.209 2.478 -8.162 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.250 3.947 -8.461 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.947 2.477 -9.416 1.00 0.00 H new ATOM 976 N GLN A 62 -0.077 4.685 -13.651 1.00 0.00 N ATOM 977 CA GLN A 62 -0.679 5.563 -14.662 1.00 0.00 C ATOM 978 C GLN A 62 -1.778 6.443 -14.040 1.00 0.00 C ATOM 979 O GLN A 62 -1.977 6.432 -12.822 1.00 0.00 O ATOM 980 CB GLN A 62 -1.157 4.685 -15.838 1.00 0.00 C ATOM 981 CG GLN A 62 0.059 4.201 -16.647 1.00 0.00 C ATOM 982 CD GLN A 62 -0.198 2.929 -17.443 1.00 0.00 C ATOM 983 OE1 GLN A 62 -0.635 2.940 -18.589 1.00 0.00 O ATOM 984 NE2 GLN A 62 0.114 1.787 -16.869 1.00 0.00 N ATOM 0 H GLN A 62 -0.775 4.152 -13.133 1.00 0.00 H new ATOM 0 HA GLN A 62 0.051 6.271 -15.055 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -1.720 3.831 -15.462 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -1.831 5.253 -16.479 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.365 4.991 -17.332 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.892 4.030 -15.965 1.00 0.00 H new ATOM 0 HE21 GLN A 62 0.477 1.778 -15.916 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -0.008 0.911 -17.377 1.00 0.00 H new ATOM 993 N LYS A 63 -2.458 7.269 -14.849 1.00 0.00 N ATOM 994 CA LYS A 63 -3.506 8.159 -14.324 1.00 0.00 C ATOM 995 C LYS A 63 -4.623 7.376 -13.621 1.00 0.00 C ATOM 996 O LYS A 63 -5.026 6.289 -14.034 1.00 0.00 O ATOM 997 CB LYS A 63 -4.024 9.173 -15.368 1.00 0.00 C ATOM 998 CG LYS A 63 -5.266 8.776 -16.186 1.00 0.00 C ATOM 999 CD LYS A 63 -5.110 7.534 -17.059 1.00 0.00 C ATOM 1000 CE LYS A 63 -4.206 7.848 -18.253 1.00 0.00 C ATOM 1001 NZ LYS A 63 -4.112 6.702 -19.196 1.00 0.00 N ATOM 0 H LYS A 63 -2.305 7.340 -15.855 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.036 8.773 -13.555 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -4.246 10.106 -14.850 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -3.213 9.381 -16.066 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.095 8.613 -15.498 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.542 9.615 -16.825 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -4.685 6.719 -16.474 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.087 7.200 -17.409 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -4.591 8.721 -18.780 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -3.209 8.106 -17.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -3.491 6.956 -19.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -3.720 5.876 -18.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -5.059 6.471 -19.558 1.00 0.00 H new ATOM 1015 N GLU A 64 -5.126 7.971 -12.552 1.00 0.00 N ATOM 1016 CA GLU A 64 -6.181 7.466 -11.671 1.00 0.00 C ATOM 1017 C GLU A 64 -5.891 6.099 -11.011 1.00 0.00 C ATOM 1018 O GLU A 64 -6.817 5.442 -10.527 1.00 0.00 O ATOM 1019 CB GLU A 64 -7.560 7.504 -12.367 1.00 0.00 C ATOM 1020 CG GLU A 64 -7.920 8.846 -13.018 1.00 0.00 C ATOM 1021 CD GLU A 64 -9.322 8.790 -13.655 1.00 0.00 C ATOM 1022 OE1 GLU A 64 -10.327 9.053 -12.951 1.00 0.00 O ATOM 1023 OE2 GLU A 64 -9.432 8.485 -14.868 1.00 0.00 O ATOM 0 H GLU A 64 -4.788 8.885 -12.251 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.202 8.159 -10.830 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.586 6.728 -13.132 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.327 7.255 -11.634 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.888 9.638 -12.270 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.180 9.096 -13.779 1.00 0.00 H new ATOM 1030 N SER A 65 -4.624 5.659 -10.950 1.00 0.00 N ATOM 1031 CA SER A 65 -4.244 4.438 -10.219 1.00 0.00 C ATOM 1032 C SER A 65 -4.587 4.555 -8.726 1.00 0.00 C ATOM 1033 O SER A 65 -4.454 5.626 -8.131 1.00 0.00 O ATOM 1034 CB SER A 65 -2.748 4.129 -10.378 1.00 0.00 C ATOM 1035 OG SER A 65 -2.437 3.652 -11.681 1.00 0.00 O ATOM 0 H SER A 65 -3.841 6.133 -11.400 1.00 0.00 H new ATOM 0 HA SER A 65 -4.818 3.619 -10.652 1.00 0.00 H new ATOM 0 HB2 SER A 65 -2.168 5.029 -10.174 1.00 0.00 H new ATOM 0 HB3 SER A 65 -2.451 3.385 -9.639 1.00 0.00 H new ATOM 0 HG SER A 65 -1.669 3.045 -11.633 1.00 0.00 H new ATOM 1041 N THR A 66 -5.006 3.447 -8.112 1.00 0.00 N ATOM 1042 CA THR A 66 -5.536 3.366 -6.735 1.00 0.00 C ATOM 1043 C THR A 66 -4.599 2.572 -5.825 1.00 0.00 C ATOM 1044 O THR A 66 -4.725 1.353 -5.675 1.00 0.00 O ATOM 1045 CB THR A 66 -6.969 2.796 -6.712 1.00 0.00 C ATOM 1046 OG1 THR A 66 -7.068 1.600 -7.462 1.00 0.00 O ATOM 1047 CG2 THR A 66 -7.984 3.777 -7.304 1.00 0.00 C ATOM 0 H THR A 66 -4.988 2.538 -8.575 1.00 0.00 H new ATOM 0 HA THR A 66 -5.588 4.382 -6.343 1.00 0.00 H new ATOM 0 HB THR A 66 -7.190 2.610 -5.661 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.333 1.000 -7.219 1.00 0.00 H new ATOM 0 HG21 THR A 66 -8.980 3.336 -7.268 1.00 0.00 H new ATOM 0 HG22 THR A 66 -7.976 4.702 -6.727 1.00 0.00 H new ATOM 0 HG23 THR A 66 -7.720 3.993 -8.339 1.00 0.00 H new ATOM 1055 N LEU A 67 -3.614 3.263 -5.249 1.00 0.00 N ATOM 1056 CA LEU A 67 -2.542 2.681 -4.436 1.00 0.00 C ATOM 1057 C LEU A 67 -2.871 2.752 -2.937 1.00 0.00 C ATOM 1058 O LEU A 67 -3.887 3.319 -2.536 1.00 0.00 O ATOM 1059 CB LEU A 67 -1.202 3.384 -4.763 1.00 0.00 C ATOM 1060 CG LEU A 67 -0.722 3.343 -6.231 1.00 0.00 C ATOM 1061 CD1 LEU A 67 -1.132 2.062 -6.958 1.00 0.00 C ATOM 1062 CD2 LEU A 67 -1.191 4.548 -7.049 1.00 0.00 C ATOM 0 H LEU A 67 -3.537 4.276 -5.338 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.448 1.624 -4.683 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.287 4.429 -4.465 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.426 2.937 -4.141 1.00 0.00 H new ATOM 0 HG LEU A 67 0.365 3.372 -6.157 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.766 2.093 -7.984 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.704 1.200 -6.446 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -2.219 1.978 -6.963 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.821 4.460 -8.071 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.281 4.579 -7.059 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.806 5.464 -6.601 1.00 0.00 H new ATOM 1074 N HIS A 68 -2.001 2.193 -2.098 1.00 0.00 N ATOM 1075 CA HIS A 68 -2.085 2.296 -0.639 1.00 0.00 C ATOM 1076 C HIS A 68 -0.807 2.892 -0.038 1.00 0.00 C ATOM 1077 O HIS A 68 0.283 2.697 -0.584 1.00 0.00 O ATOM 1078 CB HIS A 68 -2.345 0.907 -0.036 1.00 0.00 C ATOM 1079 CG HIS A 68 -3.773 0.417 -0.132 1.00 0.00 C ATOM 1080 ND1 HIS A 68 -4.488 0.170 -1.283 1.00 0.00 N ATOM 1081 CD2 HIS A 68 -4.574 0.087 0.929 1.00 0.00 C ATOM 1082 CE1 HIS A 68 -5.698 -0.290 -0.924 1.00 0.00 C ATOM 1083 NE2 HIS A 68 -5.801 -0.353 0.415 1.00 0.00 N ATOM 0 H HIS A 68 -1.202 1.645 -2.417 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.910 2.966 -0.397 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -1.697 0.186 -0.534 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.054 0.925 1.014 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -4.308 0.154 1.974 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -6.479 -0.570 -1.615 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -6.612 -0.661 0.951 1.00 0.00 H new ATOM 1091 N LEU A 69 -0.935 3.576 1.107 1.00 0.00 N ATOM 1092 CA LEU A 69 0.187 4.012 1.931 1.00 0.00 C ATOM 1093 C LEU A 69 0.171 3.271 3.272 1.00 0.00 C ATOM 1094 O LEU A 69 -0.886 2.952 3.823 1.00 0.00 O ATOM 1095 CB LEU A 69 0.234 5.538 2.117 1.00 0.00 C ATOM 1096 CG LEU A 69 -0.843 6.152 3.038 1.00 0.00 C ATOM 1097 CD1 LEU A 69 -0.306 7.456 3.609 1.00 0.00 C ATOM 1098 CD2 LEU A 69 -2.143 6.471 2.293 1.00 0.00 C ATOM 0 H LEU A 69 -1.842 3.844 1.489 1.00 0.00 H new ATOM 0 HA LEU A 69 1.105 3.755 1.402 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.214 5.804 2.513 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.150 6.004 1.135 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.064 5.419 3.814 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.055 7.903 4.262 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.601 7.257 4.180 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.078 8.144 2.794 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.865 6.900 2.988 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.939 7.185 1.495 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.551 5.555 1.865 1.00 0.00 H new ATOM 1110 N VAL A 70 1.362 2.998 3.789 1.00 0.00 N ATOM 1111 CA VAL A 70 1.612 2.308 5.055 1.00 0.00 C ATOM 1112 C VAL A 70 2.644 3.076 5.867 1.00 0.00 C ATOM 1113 O VAL A 70 3.539 3.683 5.289 1.00 0.00 O ATOM 1114 CB VAL A 70 2.044 0.866 4.784 1.00 0.00 C ATOM 1115 CG1 VAL A 70 0.889 0.090 4.139 1.00 0.00 C ATOM 1116 CG2 VAL A 70 3.289 0.762 3.901 1.00 0.00 C ATOM 0 H VAL A 70 2.225 3.264 3.315 1.00 0.00 H new ATOM 0 HA VAL A 70 0.696 2.269 5.645 1.00 0.00 H new ATOM 0 HB VAL A 70 2.305 0.432 5.749 1.00 0.00 H new ATOM 0 HG11 VAL A 70 1.202 -0.936 3.948 1.00 0.00 H new ATOM 0 HG12 VAL A 70 0.031 0.089 4.812 1.00 0.00 H new ATOM 0 HG13 VAL A 70 0.612 0.566 3.198 1.00 0.00 H new ATOM 0 HG21 VAL A 70 3.540 -0.288 3.749 1.00 0.00 H new ATOM 0 HG22 VAL A 70 3.092 1.232 2.937 1.00 0.00 H new ATOM 0 HG23 VAL A 70 4.123 1.268 4.387 1.00 0.00 H new ATOM 1126 N LEU A 71 2.538 3.071 7.194 1.00 0.00 N ATOM 1127 CA LEU A 71 3.402 3.854 8.087 1.00 0.00 C ATOM 1128 C LEU A 71 4.230 2.949 9.018 1.00 0.00 C ATOM 1129 O LEU A 71 3.728 1.932 9.501 1.00 0.00 O ATOM 1130 CB LEU A 71 2.530 4.831 8.899 1.00 0.00 C ATOM 1131 CG LEU A 71 2.127 6.134 8.179 1.00 0.00 C ATOM 1132 CD1 LEU A 71 1.062 5.947 7.095 1.00 0.00 C ATOM 1133 CD2 LEU A 71 1.564 7.103 9.218 1.00 0.00 C ATOM 0 H LEU A 71 1.841 2.516 7.690 1.00 0.00 H new ATOM 0 HA LEU A 71 4.114 4.416 7.482 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.621 4.311 9.202 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.066 5.094 9.811 1.00 0.00 H new ATOM 0 HG LEU A 71 3.026 6.507 7.688 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.835 6.910 6.638 1.00 0.00 H new ATOM 0 HD12 LEU A 71 1.435 5.262 6.333 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.157 5.535 7.541 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.273 8.032 8.729 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.693 6.657 9.697 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.325 7.312 9.970 1.00 0.00 H new ATOM 1145 N ARG A 72 5.464 3.365 9.357 1.00 0.00 N ATOM 1146 CA ARG A 72 6.337 2.703 10.355 1.00 0.00 C ATOM 1147 C ARG A 72 5.715 2.605 11.759 1.00 0.00 C ATOM 1148 O ARG A 72 6.106 1.738 12.541 1.00 0.00 O ATOM 1149 CB ARG A 72 7.729 3.382 10.394 1.00 0.00 C ATOM 1150 CG ARG A 72 7.725 4.812 10.970 1.00 0.00 C ATOM 1151 CD ARG A 72 9.108 5.366 11.351 1.00 0.00 C ATOM 1152 NE ARG A 72 9.925 5.845 10.215 1.00 0.00 N ATOM 1153 CZ ARG A 72 10.880 5.201 9.568 1.00 0.00 C ATOM 1154 NH1 ARG A 72 11.123 3.933 9.753 1.00 0.00 N ATOM 1155 NH2 ARG A 72 11.639 5.831 8.725 1.00 0.00 N ATOM 0 H ARG A 72 5.895 4.189 8.938 1.00 0.00 H new ATOM 0 HA ARG A 72 6.456 1.672 10.023 1.00 0.00 H new ATOM 0 HB2 ARG A 72 8.404 2.766 10.989 1.00 0.00 H new ATOM 0 HB3 ARG A 72 8.133 3.412 9.382 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.272 5.481 10.238 1.00 0.00 H new ATOM 0 HG3 ARG A 72 7.088 4.829 11.854 1.00 0.00 H new ATOM 0 HD2 ARG A 72 8.972 6.188 12.053 1.00 0.00 H new ATOM 0 HD3 ARG A 72 9.663 4.588 11.875 1.00 0.00 H new ATOM 0 HE ARG A 72 9.726 6.791 9.890 1.00 0.00 H new ATOM 0 HH11 ARG A 72 10.565 3.399 10.419 1.00 0.00 H new ATOM 0 HH12 ARG A 72 11.871 3.476 9.231 1.00 0.00 H new ATOM 0 HH21 ARG A 72 11.500 6.828 8.559 1.00 0.00 H new ATOM 0 HH22 ARG A 72 12.375 5.329 8.228 1.00 0.00 H new ATOM 1366 N PRO B 328 -11.151 -17.070 10.096 1.00 0.00 N ATOM 1367 CA PRO B 328 -10.347 -15.867 9.878 1.00 0.00 C ATOM 1368 C PRO B 328 -10.824 -15.021 8.694 1.00 0.00 C ATOM 1369 O PRO B 328 -10.656 -13.806 8.700 1.00 0.00 O ATOM 1370 CB PRO B 328 -8.923 -16.375 9.649 1.00 0.00 C ATOM 1371 CG PRO B 328 -9.123 -17.775 9.075 1.00 0.00 C ATOM 1372 CD PRO B 328 -10.376 -18.263 9.792 1.00 0.00 C ATOM 0 HA PRO B 328 -10.425 -15.200 10.736 1.00 0.00 H new ATOM 0 HB2 PRO B 328 -8.376 -15.734 8.958 1.00 0.00 H new ATOM 0 HB3 PRO B 328 -8.354 -16.401 10.578 1.00 0.00 H new ATOM 0 HG2 PRO B 328 -9.260 -17.752 7.994 1.00 0.00 H new ATOM 0 HG3 PRO B 328 -8.267 -18.419 9.275 1.00 0.00 H new ATOM 0 HD2 PRO B 328 -10.944 -18.948 9.163 1.00 0.00 H new ATOM 0 HD3 PRO B 328 -10.119 -18.805 10.702 1.00 0.00 H new ATOM 1380 N GLU B 329 -11.461 -15.642 7.700 1.00 0.00 N ATOM 1381 CA GLU B 329 -12.032 -15.018 6.517 1.00 0.00 C ATOM 1382 C GLU B 329 -13.017 -13.885 6.859 1.00 0.00 C ATOM 1383 O GLU B 329 -12.978 -12.810 6.260 1.00 0.00 O ATOM 1384 CB GLU B 329 -12.703 -16.166 5.759 1.00 0.00 C ATOM 1385 CG GLU B 329 -13.497 -15.726 4.543 1.00 0.00 C ATOM 1386 CD GLU B 329 -12.601 -15.265 3.373 1.00 0.00 C ATOM 1387 OE1 GLU B 329 -12.097 -16.133 2.620 1.00 0.00 O ATOM 1388 OE2 GLU B 329 -12.403 -14.040 3.188 1.00 0.00 O ATOM 0 H GLU B 329 -11.597 -16.653 7.705 1.00 0.00 H new ATOM 0 HA GLU B 329 -11.269 -14.524 5.915 1.00 0.00 H new ATOM 0 HB2 GLU B 329 -11.937 -16.875 5.443 1.00 0.00 H new ATOM 0 HB3 GLU B 329 -13.367 -16.698 6.440 1.00 0.00 H new ATOM 0 HG2 GLU B 329 -14.126 -16.551 4.209 1.00 0.00 H new ATOM 0 HG3 GLU B 329 -14.163 -14.911 4.826 1.00 0.00 H new ATOM 1395 N GLU B 330 -13.894 -14.119 7.839 1.00 0.00 N ATOM 1396 CA GLU B 330 -14.892 -13.136 8.289 1.00 0.00 C ATOM 1397 C GLU B 330 -14.433 -12.343 9.523 1.00 0.00 C ATOM 1398 O GLU B 330 -14.834 -11.191 9.703 1.00 0.00 O ATOM 1399 CB GLU B 330 -16.257 -13.809 8.496 1.00 0.00 C ATOM 1400 CG GLU B 330 -16.292 -14.898 9.579 1.00 0.00 C ATOM 1401 CD GLU B 330 -17.697 -15.528 9.648 1.00 0.00 C ATOM 1402 OE1 GLU B 330 -18.606 -14.926 10.271 1.00 0.00 O ATOM 1403 OE2 GLU B 330 -17.909 -16.618 9.063 1.00 0.00 O ATOM 0 H GLU B 330 -13.934 -15.002 8.348 1.00 0.00 H new ATOM 0 HA GLU B 330 -15.003 -12.396 7.497 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -16.988 -13.041 8.751 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -16.574 -14.249 7.551 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -15.551 -15.666 9.358 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -16.029 -14.469 10.546 1.00 0.00 H new ATOM 1410 N ARG B 331 -13.537 -12.918 10.338 1.00 0.00 N ATOM 1411 CA ARG B 331 -12.915 -12.249 11.494 1.00 0.00 C ATOM 1412 C ARG B 331 -11.973 -11.109 11.083 1.00 0.00 C ATOM 1413 O ARG B 331 -11.978 -10.049 11.708 1.00 0.00 O ATOM 1414 CB ARG B 331 -12.201 -13.281 12.373 1.00 0.00 C ATOM 1415 CG ARG B 331 -11.779 -12.640 13.700 1.00 0.00 C ATOM 1416 CD ARG B 331 -11.285 -13.672 14.709 1.00 0.00 C ATOM 1417 NE ARG B 331 -10.033 -14.320 14.279 1.00 0.00 N ATOM 1418 CZ ARG B 331 -9.851 -15.584 13.948 1.00 0.00 C ATOM 1419 NH1 ARG B 331 -10.820 -16.450 13.860 1.00 0.00 N ATOM 1420 NH2 ARG B 331 -8.654 -16.023 13.699 1.00 0.00 N ATOM 0 H ARG B 331 -13.217 -13.878 10.212 1.00 0.00 H new ATOM 0 HA ARG B 331 -13.712 -11.783 12.074 1.00 0.00 H new ATOM 0 HB2 ARG B 331 -12.861 -14.128 12.563 1.00 0.00 H new ATOM 0 HB3 ARG B 331 -11.325 -13.670 11.853 1.00 0.00 H new ATOM 0 HG2 ARG B 331 -10.991 -11.910 13.514 1.00 0.00 H new ATOM 0 HG3 ARG B 331 -12.624 -12.096 14.123 1.00 0.00 H new ATOM 0 HD2 ARG B 331 -11.129 -13.188 15.673 1.00 0.00 H new ATOM 0 HD3 ARG B 331 -12.053 -14.431 14.854 1.00 0.00 H new ATOM 0 HE ARG B 331 -9.210 -13.720 14.232 1.00 0.00 H new ATOM 0 HH11 ARG B 331 -11.780 -16.163 14.052 1.00 0.00 H new ATOM 0 HH12 ARG B 331 -10.619 -17.415 13.599 1.00 0.00 H new ATOM 0 HH21 ARG B 331 -7.856 -15.391 13.760 1.00 0.00 H new ATOM 0 HH22 ARG B 331 -8.512 -17.000 13.443 1.00 0.00 H new ATOM 1434 N TYR B 332 -11.190 -11.319 10.024 1.00 0.00 N ATOM 1435 CA TYR B 332 -10.191 -10.385 9.487 1.00 0.00 C ATOM 1436 C TYR B 332 -10.609 -9.780 8.134 1.00 0.00 C ATOM 1437 O TYR B 332 -9.752 -9.296 7.400 1.00 0.00 O ATOM 1438 CB TYR B 332 -8.823 -11.084 9.359 1.00 0.00 C ATOM 1439 CG TYR B 332 -8.255 -11.795 10.574 1.00 0.00 C ATOM 1440 CD1 TYR B 332 -8.400 -11.265 11.874 1.00 0.00 C ATOM 1441 CD2 TYR B 332 -7.498 -12.967 10.381 1.00 0.00 C ATOM 1442 CE1 TYR B 332 -7.822 -11.926 12.977 1.00 0.00 C ATOM 1443 CE2 TYR B 332 -6.909 -13.622 11.476 1.00 0.00 C ATOM 1444 CZ TYR B 332 -7.082 -13.112 12.778 1.00 0.00 C ATOM 1445 OH TYR B 332 -6.570 -13.794 13.839 1.00 0.00 O ATOM 0 H TYR B 332 -11.235 -12.186 9.489 1.00 0.00 H new ATOM 0 HA TYR B 332 -10.115 -9.559 10.194 1.00 0.00 H new ATOM 0 HB2 TYR B 332 -8.898 -11.814 8.553 1.00 0.00 H new ATOM 0 HB3 TYR B 332 -8.097 -10.335 9.044 1.00 0.00 H new ATOM 0 HD1 TYR B 332 -8.955 -10.351 12.024 1.00 0.00 H new ATOM 0 HD2 TYR B 332 -7.369 -13.365 9.385 1.00 0.00 H new ATOM 0 HE1 TYR B 332 -7.945 -11.526 13.973 1.00 0.00 H new ATOM 0 HE2 TYR B 332 -6.324 -14.516 11.320 1.00 0.00 H new ATOM 0 HH TYR B 332 -6.091 -14.586 13.518 1.00 0.00 H new ATOM 1455 N GLU B 333 -11.898 -9.808 7.773 1.00 0.00 N ATOM 1456 CA GLU B 333 -12.423 -9.423 6.450 1.00 0.00 C ATOM 1457 C GLU B 333 -11.809 -8.126 5.894 1.00 0.00 C ATOM 1458 O GLU B 333 -11.201 -8.141 4.826 1.00 0.00 O ATOM 1459 CB GLU B 333 -13.958 -9.341 6.519 1.00 0.00 C ATOM 1460 CG GLU B 333 -14.592 -9.045 5.154 1.00 0.00 C ATOM 1461 CD GLU B 333 -16.130 -9.085 5.239 1.00 0.00 C ATOM 1462 OE1 GLU B 333 -16.753 -8.043 5.560 1.00 0.00 O ATOM 1463 OE2 GLU B 333 -16.729 -10.155 4.971 1.00 0.00 O ATOM 0 H GLU B 333 -12.632 -10.109 8.414 1.00 0.00 H new ATOM 0 HA GLU B 333 -12.127 -10.197 5.742 1.00 0.00 H new ATOM 0 HB2 GLU B 333 -14.352 -10.282 6.903 1.00 0.00 H new ATOM 0 HB3 GLU B 333 -14.246 -8.563 7.226 1.00 0.00 H new ATOM 0 HG2 GLU B 333 -14.269 -8.065 4.804 1.00 0.00 H new ATOM 0 HG3 GLU B 333 -14.246 -9.775 4.422 1.00 0.00 H new ATOM 1470 N HIS B 334 -11.904 -7.019 6.636 1.00 0.00 N ATOM 1471 CA HIS B 334 -11.256 -5.741 6.315 1.00 0.00 C ATOM 1472 C HIS B 334 -9.772 -5.896 5.947 1.00 0.00 C ATOM 1473 O HIS B 334 -9.332 -5.472 4.879 1.00 0.00 O ATOM 1474 CB HIS B 334 -11.388 -4.805 7.527 1.00 0.00 C ATOM 1475 CG HIS B 334 -12.733 -4.129 7.629 1.00 0.00 C ATOM 1476 ND1 HIS B 334 -13.707 -4.388 8.570 1.00 0.00 N ATOM 1477 CD2 HIS B 334 -13.204 -3.141 6.805 1.00 0.00 C ATOM 1478 CE1 HIS B 334 -14.749 -3.576 8.319 1.00 0.00 C ATOM 1479 NE2 HIS B 334 -14.487 -2.798 7.253 1.00 0.00 N ATOM 0 H HIS B 334 -12.447 -6.984 7.499 1.00 0.00 H new ATOM 0 HA HIS B 334 -11.756 -5.328 5.439 1.00 0.00 H new ATOM 0 HB2 HIS B 334 -11.209 -5.377 8.437 1.00 0.00 H new ATOM 0 HB3 HIS B 334 -10.611 -4.042 7.472 1.00 0.00 H new ATOM 0 HD2 HIS B 334 -12.683 -2.706 5.965 1.00 0.00 H new ATOM 0 HE1 HIS B 334 -15.665 -3.552 8.891 1.00 0.00 H new ATOM 0 HE2 HIS B 334 -15.104 -2.094 6.848 1.00 0.00 H new ATOM 1487 N GLN B 335 -9.004 -6.515 6.840 1.00 0.00 N ATOM 1488 CA GLN B 335 -7.558 -6.711 6.745 1.00 0.00 C ATOM 1489 C GLN B 335 -7.184 -7.562 5.515 1.00 0.00 C ATOM 1490 O GLN B 335 -6.251 -7.234 4.781 1.00 0.00 O ATOM 1491 CB GLN B 335 -7.063 -7.385 8.039 1.00 0.00 C ATOM 1492 CG GLN B 335 -7.619 -6.831 9.365 1.00 0.00 C ATOM 1493 CD GLN B 335 -7.247 -5.375 9.639 1.00 0.00 C ATOM 1494 OE1 GLN B 335 -7.864 -4.439 9.149 1.00 0.00 O ATOM 1495 NE2 GLN B 335 -6.247 -5.135 10.456 1.00 0.00 N ATOM 0 H GLN B 335 -9.393 -6.915 7.694 1.00 0.00 H new ATOM 0 HA GLN B 335 -7.076 -5.741 6.624 1.00 0.00 H new ATOM 0 HB2 GLN B 335 -7.307 -8.446 7.985 1.00 0.00 H new ATOM 0 HB3 GLN B 335 -5.976 -7.309 8.068 1.00 0.00 H new ATOM 0 HG2 GLN B 335 -8.705 -6.922 9.357 1.00 0.00 H new ATOM 0 HG3 GLN B 335 -7.254 -7.448 10.186 1.00 0.00 H new ATOM 0 HE21 GLN B 335 -5.728 -5.910 10.868 1.00 0.00 H new ATOM 0 HE22 GLN B 335 -5.989 -4.173 10.678 1.00 0.00 H new ATOM 1504 N LEU B 336 -7.953 -8.626 5.253 1.00 0.00 N ATOM 1505 CA LEU B 336 -7.856 -9.467 4.059 1.00 0.00 C ATOM 1506 C LEU B 336 -8.108 -8.666 2.777 1.00 0.00 C ATOM 1507 O LEU B 336 -7.301 -8.741 1.851 1.00 0.00 O ATOM 1508 CB LEU B 336 -8.848 -10.639 4.170 1.00 0.00 C ATOM 1509 CG LEU B 336 -8.440 -11.712 5.191 1.00 0.00 C ATOM 1510 CD1 LEU B 336 -9.633 -12.583 5.550 1.00 0.00 C ATOM 1511 CD2 LEU B 336 -7.361 -12.630 4.617 1.00 0.00 C ATOM 0 H LEU B 336 -8.686 -8.934 5.892 1.00 0.00 H new ATOM 0 HA LEU B 336 -6.840 -9.857 3.999 1.00 0.00 H new ATOM 0 HB2 LEU B 336 -9.828 -10.247 4.443 1.00 0.00 H new ATOM 0 HB3 LEU B 336 -8.953 -11.106 3.191 1.00 0.00 H new ATOM 0 HG LEU B 336 -8.063 -11.192 6.071 1.00 0.00 H new ATOM 0 HD11 LEU B 336 -9.327 -13.338 6.274 1.00 0.00 H new ATOM 0 HD12 LEU B 336 -10.419 -11.963 5.982 1.00 0.00 H new ATOM 0 HD13 LEU B 336 -10.009 -13.073 4.652 1.00 0.00 H new ATOM 0 HD21 LEU B 336 -7.089 -13.381 5.359 1.00 0.00 H new ATOM 0 HD22 LEU B 336 -7.742 -13.124 3.723 1.00 0.00 H new ATOM 0 HD23 LEU B 336 -6.481 -12.040 4.359 1.00 0.00 H new ATOM 1523 N ARG B 337 -9.190 -7.876 2.712 1.00 0.00 N ATOM 1524 CA ARG B 337 -9.516 -7.029 1.550 1.00 0.00 C ATOM 1525 C ARG B 337 -8.462 -5.950 1.287 1.00 0.00 C ATOM 1526 O ARG B 337 -8.166 -5.688 0.123 1.00 0.00 O ATOM 1527 CB ARG B 337 -10.917 -6.406 1.700 1.00 0.00 C ATOM 1528 CG ARG B 337 -12.046 -7.231 1.055 1.00 0.00 C ATOM 1529 CD ARG B 337 -12.392 -8.546 1.763 1.00 0.00 C ATOM 1530 NE ARG B 337 -11.496 -9.666 1.414 1.00 0.00 N ATOM 1531 CZ ARG B 337 -11.597 -10.917 1.826 1.00 0.00 C ATOM 1532 NH1 ARG B 337 -12.480 -11.309 2.696 1.00 0.00 N ATOM 1533 NH2 ARG B 337 -10.796 -11.823 1.356 1.00 0.00 N ATOM 0 H ARG B 337 -9.870 -7.805 3.469 1.00 0.00 H new ATOM 0 HA ARG B 337 -9.516 -7.683 0.678 1.00 0.00 H new ATOM 0 HB2 ARG B 337 -11.135 -6.280 2.761 1.00 0.00 H new ATOM 0 HB3 ARG B 337 -10.910 -5.411 1.255 1.00 0.00 H new ATOM 0 HG2 ARG B 337 -12.944 -6.614 1.013 1.00 0.00 H new ATOM 0 HG3 ARG B 337 -11.765 -7.456 0.026 1.00 0.00 H new ATOM 0 HD2 ARG B 337 -12.357 -8.387 2.841 1.00 0.00 H new ATOM 0 HD3 ARG B 337 -13.417 -8.822 1.515 1.00 0.00 H new ATOM 0 HE ARG B 337 -10.718 -9.452 0.790 1.00 0.00 H new ATOM 0 HH11 ARG B 337 -13.137 -10.638 3.094 1.00 0.00 H new ATOM 0 HH12 ARG B 337 -12.516 -12.288 2.981 1.00 0.00 H new ATOM 0 HH21 ARG B 337 -10.087 -11.570 0.668 1.00 0.00 H new ATOM 0 HH22 ARG B 337 -10.875 -12.789 1.675 1.00 0.00 H new ATOM 1547 N GLN B 338 -7.857 -5.376 2.330 1.00 0.00 N ATOM 1548 CA GLN B 338 -6.701 -4.470 2.191 1.00 0.00 C ATOM 1549 C GLN B 338 -5.545 -5.179 1.460 1.00 0.00 C ATOM 1550 O GLN B 338 -5.076 -4.689 0.434 1.00 0.00 O ATOM 1551 CB GLN B 338 -6.240 -3.909 3.553 1.00 0.00 C ATOM 1552 CG GLN B 338 -7.263 -2.981 4.233 1.00 0.00 C ATOM 1553 CD GLN B 338 -7.180 -1.527 3.771 1.00 0.00 C ATOM 1554 OE1 GLN B 338 -8.001 -1.038 3.007 1.00 0.00 O ATOM 1555 NE2 GLN B 338 -6.213 -0.771 4.247 1.00 0.00 N ATOM 0 H GLN B 338 -8.150 -5.522 3.296 1.00 0.00 H new ATOM 0 HA GLN B 338 -7.019 -3.618 1.589 1.00 0.00 H new ATOM 0 HB2 GLN B 338 -6.022 -4.742 4.221 1.00 0.00 H new ATOM 0 HB3 GLN B 338 -5.308 -3.362 3.411 1.00 0.00 H new ATOM 0 HG2 GLN B 338 -8.267 -3.358 4.038 1.00 0.00 H new ATOM 0 HG3 GLN B 338 -7.113 -3.019 5.312 1.00 0.00 H new ATOM 0 HE21 GLN B 338 -5.523 -1.167 4.885 1.00 0.00 H new ATOM 0 HE22 GLN B 338 -6.154 0.211 3.978 1.00 0.00 H new ATOM 1564 N LEU B 339 -5.117 -6.357 1.937 1.00 0.00 N ATOM 1565 CA LEU B 339 -4.086 -7.177 1.279 1.00 0.00 C ATOM 1566 C LEU B 339 -4.462 -7.536 -0.169 1.00 0.00 C ATOM 1567 O LEU B 339 -3.666 -7.319 -1.084 1.00 0.00 O ATOM 1568 CB LEU B 339 -3.805 -8.449 2.105 1.00 0.00 C ATOM 1569 CG LEU B 339 -3.157 -8.205 3.479 1.00 0.00 C ATOM 1570 CD1 LEU B 339 -3.162 -9.506 4.277 1.00 0.00 C ATOM 1571 CD2 LEU B 339 -1.712 -7.717 3.359 1.00 0.00 C ATOM 0 H LEU B 339 -5.478 -6.771 2.796 1.00 0.00 H new ATOM 0 HA LEU B 339 -3.176 -6.579 1.230 1.00 0.00 H new ATOM 0 HB2 LEU B 339 -4.744 -8.982 2.253 1.00 0.00 H new ATOM 0 HB3 LEU B 339 -3.155 -9.104 1.525 1.00 0.00 H new ATOM 0 HG LEU B 339 -3.738 -7.431 3.981 1.00 0.00 H new ATOM 0 HD11 LEU B 339 -2.704 -9.337 5.251 1.00 0.00 H new ATOM 0 HD12 LEU B 339 -4.189 -9.845 4.413 1.00 0.00 H new ATOM 0 HD13 LEU B 339 -2.597 -10.266 3.737 1.00 0.00 H new ATOM 0 HD21 LEU B 339 -1.298 -7.559 4.355 1.00 0.00 H new ATOM 0 HD22 LEU B 339 -1.118 -8.465 2.833 1.00 0.00 H new ATOM 0 HD23 LEU B 339 -1.690 -6.779 2.804 1.00 0.00 H new ATOM 1583 N ASN B 340 -5.677 -8.046 -0.395 1.00 0.00 N ATOM 1584 CA ASN B 340 -6.205 -8.362 -1.729 1.00 0.00 C ATOM 1585 C ASN B 340 -6.072 -7.176 -2.699 1.00 0.00 C ATOM 1586 O ASN B 340 -5.459 -7.314 -3.757 1.00 0.00 O ATOM 1587 CB ASN B 340 -7.679 -8.800 -1.651 1.00 0.00 C ATOM 1588 CG ASN B 340 -8.009 -10.067 -0.878 1.00 0.00 C ATOM 1589 OD1 ASN B 340 -9.060 -10.184 -0.258 1.00 0.00 O ATOM 1590 ND2 ASN B 340 -7.191 -11.089 -0.938 1.00 0.00 N ATOM 0 H ASN B 340 -6.334 -8.255 0.357 1.00 0.00 H new ATOM 0 HA ASN B 340 -5.604 -9.186 -2.114 1.00 0.00 H new ATOM 0 HB2 ASN B 340 -8.247 -7.982 -1.208 1.00 0.00 H new ATOM 0 HB3 ASN B 340 -8.044 -8.927 -2.670 1.00 0.00 H new ATOM 0 HD21 ASN B 340 -7.433 -11.964 -0.473 1.00 0.00 H new ATOM 0 HD22 ASN B 340 -6.312 -11.009 -1.450 1.00 0.00 H new ATOM 1597 N ASP B 341 -6.633 -6.016 -2.348 1.00 0.00 N ATOM 1598 CA ASP B 341 -6.670 -4.830 -3.211 1.00 0.00 C ATOM 1599 C ASP B 341 -5.285 -4.187 -3.429 1.00 0.00 C ATOM 1600 O ASP B 341 -5.031 -3.623 -4.496 1.00 0.00 O ATOM 1601 CB ASP B 341 -7.673 -3.815 -2.645 1.00 0.00 C ATOM 1602 CG ASP B 341 -8.051 -2.750 -3.689 1.00 0.00 C ATOM 1603 OD1 ASP B 341 -8.676 -3.107 -4.717 1.00 0.00 O ATOM 1604 OD2 ASP B 341 -7.759 -1.550 -3.473 1.00 0.00 O ATOM 0 H ASP B 341 -7.081 -5.871 -1.443 1.00 0.00 H new ATOM 0 HA ASP B 341 -6.997 -5.157 -4.198 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -8.571 -4.336 -2.314 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -7.245 -3.330 -1.768 1.00 0.00 H new ATOM 1609 N MET B 342 -4.359 -4.322 -2.467 1.00 0.00 N ATOM 1610 CA MET B 342 -2.947 -3.950 -2.645 1.00 0.00 C ATOM 1611 C MET B 342 -2.214 -4.871 -3.632 1.00 0.00 C ATOM 1612 O MET B 342 -1.246 -4.433 -4.257 1.00 0.00 O ATOM 1613 CB MET B 342 -2.209 -3.945 -1.296 1.00 0.00 C ATOM 1614 CG MET B 342 -2.581 -2.699 -0.486 1.00 0.00 C ATOM 1615 SD MET B 342 -1.599 -2.388 1.010 1.00 0.00 S ATOM 1616 CE MET B 342 -2.022 -3.836 2.004 1.00 0.00 C ATOM 0 H MET B 342 -4.569 -4.694 -1.541 1.00 0.00 H new ATOM 0 HA MET B 342 -2.944 -2.945 -3.066 1.00 0.00 H new ATOM 0 HB2 MET B 342 -2.464 -4.842 -0.732 1.00 0.00 H new ATOM 0 HB3 MET B 342 -1.132 -3.969 -1.464 1.00 0.00 H new ATOM 0 HG2 MET B 342 -2.496 -1.829 -1.138 1.00 0.00 H new ATOM 0 HG3 MET B 342 -3.629 -2.779 -0.197 1.00 0.00 H new ATOM 0 HE1 MET B 342 -1.736 -3.661 3.041 1.00 0.00 H new ATOM 0 HE2 MET B 342 -3.096 -4.014 1.948 1.00 0.00 H new ATOM 0 HE3 MET B 342 -1.489 -4.707 1.623 1.00 0.00 H new ATOM 1626 N GLY B 343 -2.682 -6.114 -3.806 1.00 0.00 N ATOM 1627 CA GLY B 343 -2.216 -7.046 -4.837 1.00 0.00 C ATOM 1628 C GLY B 343 -2.179 -8.536 -4.464 1.00 0.00 C ATOM 1629 O GLY B 343 -1.705 -9.330 -5.280 1.00 0.00 O ATOM 0 H GLY B 343 -3.415 -6.508 -3.217 1.00 0.00 H new ATOM 0 HA2 GLY B 343 -2.856 -6.931 -5.712 1.00 0.00 H new ATOM 0 HA3 GLY B 343 -1.211 -6.746 -5.136 1.00 0.00 H new ATOM 1633 N PHE B 344 -2.638 -8.952 -3.276 1.00 0.00 N ATOM 1634 CA PHE B 344 -2.474 -10.330 -2.787 1.00 0.00 C ATOM 1635 C PHE B 344 -3.782 -11.117 -2.901 1.00 0.00 C ATOM 1636 O PHE B 344 -4.521 -11.269 -1.928 1.00 0.00 O ATOM 1637 CB PHE B 344 -1.930 -10.342 -1.351 1.00 0.00 C ATOM 1638 CG PHE B 344 -0.550 -9.745 -1.166 1.00 0.00 C ATOM 1639 CD1 PHE B 344 0.594 -10.503 -1.484 1.00 0.00 C ATOM 1640 CD2 PHE B 344 -0.403 -8.453 -0.631 1.00 0.00 C ATOM 1641 CE1 PHE B 344 1.878 -9.974 -1.259 1.00 0.00 C ATOM 1642 CE2 PHE B 344 0.878 -7.926 -0.405 1.00 0.00 C ATOM 1643 CZ PHE B 344 2.020 -8.689 -0.709 1.00 0.00 C ATOM 0 H PHE B 344 -3.134 -8.343 -2.625 1.00 0.00 H new ATOM 0 HA PHE B 344 -1.740 -10.828 -3.421 1.00 0.00 H new ATOM 0 HB2 PHE B 344 -2.628 -9.800 -0.713 1.00 0.00 H new ATOM 0 HB3 PHE B 344 -1.910 -11.373 -0.998 1.00 0.00 H new ATOM 0 HD1 PHE B 344 0.485 -11.493 -1.902 1.00 0.00 H new ATOM 0 HD2 PHE B 344 -1.277 -7.865 -0.394 1.00 0.00 H new ATOM 0 HE1 PHE B 344 2.753 -10.555 -1.509 1.00 0.00 H new ATOM 0 HE2 PHE B 344 0.987 -6.932 0.003 1.00 0.00 H new ATOM 0 HZ PHE B 344 3.005 -8.288 -0.520 1.00 0.00 H new ATOM 1653 N PHE B 345 -4.093 -11.620 -4.095 1.00 0.00 N ATOM 1654 CA PHE B 345 -5.304 -12.412 -4.359 1.00 0.00 C ATOM 1655 C PHE B 345 -5.320 -13.802 -3.680 1.00 0.00 C ATOM 1656 O PHE B 345 -6.376 -14.431 -3.591 1.00 0.00 O ATOM 1657 CB PHE B 345 -5.508 -12.521 -5.879 1.00 0.00 C ATOM 1658 CG PHE B 345 -4.313 -13.051 -6.654 1.00 0.00 C ATOM 1659 CD1 PHE B 345 -4.085 -14.437 -6.749 1.00 0.00 C ATOM 1660 CD2 PHE B 345 -3.419 -12.154 -7.273 1.00 0.00 C ATOM 1661 CE1 PHE B 345 -2.968 -14.923 -7.453 1.00 0.00 C ATOM 1662 CE2 PHE B 345 -2.302 -12.641 -7.976 1.00 0.00 C ATOM 1663 CZ PHE B 345 -2.075 -14.025 -8.065 1.00 0.00 C ATOM 0 H PHE B 345 -3.507 -11.490 -4.920 1.00 0.00 H new ATOM 0 HA PHE B 345 -6.141 -11.882 -3.904 1.00 0.00 H new ATOM 0 HB2 PHE B 345 -6.362 -13.171 -6.070 1.00 0.00 H new ATOM 0 HB3 PHE B 345 -5.765 -11.535 -6.267 1.00 0.00 H new ATOM 0 HD1 PHE B 345 -4.769 -15.129 -6.280 1.00 0.00 H new ATOM 0 HD2 PHE B 345 -3.592 -11.090 -7.207 1.00 0.00 H new ATOM 0 HE1 PHE B 345 -2.796 -15.987 -7.524 1.00 0.00 H new ATOM 0 HE2 PHE B 345 -1.618 -11.951 -8.448 1.00 0.00 H new ATOM 0 HZ PHE B 345 -1.216 -14.399 -8.603 1.00 0.00 H new ATOM 1673 N ASP B 346 -4.181 -14.283 -3.167 1.00 0.00 N ATOM 1674 CA ASP B 346 -4.060 -15.535 -2.405 1.00 0.00 C ATOM 1675 C ASP B 346 -4.640 -15.412 -0.979 1.00 0.00 C ATOM 1676 O ASP B 346 -3.915 -15.229 0.002 1.00 0.00 O ATOM 1677 CB ASP B 346 -2.594 -15.995 -2.355 1.00 0.00 C ATOM 1678 CG ASP B 346 -2.025 -16.431 -3.712 1.00 0.00 C ATOM 1679 OD1 ASP B 346 -2.709 -17.163 -4.465 1.00 0.00 O ATOM 1680 OD2 ASP B 346 -0.846 -16.102 -3.986 1.00 0.00 O ATOM 0 H ASP B 346 -3.290 -13.798 -3.273 1.00 0.00 H new ATOM 0 HA ASP B 346 -4.651 -16.288 -2.927 1.00 0.00 H new ATOM 0 HB2 ASP B 346 -1.983 -15.182 -1.962 1.00 0.00 H new ATOM 0 HB3 ASP B 346 -2.509 -16.826 -1.654 1.00 0.00 H new ATOM 1685 N PHE B 347 -5.961 -15.554 -0.856 1.00 0.00 N ATOM 1686 CA PHE B 347 -6.704 -15.543 0.412 1.00 0.00 C ATOM 1687 C PHE B 347 -6.099 -16.465 1.485 1.00 0.00 C ATOM 1688 O PHE B 347 -5.869 -16.040 2.616 1.00 0.00 O ATOM 1689 CB PHE B 347 -8.179 -15.886 0.142 1.00 0.00 C ATOM 1690 CG PHE B 347 -8.444 -17.212 -0.558 1.00 0.00 C ATOM 1691 CD1 PHE B 347 -8.410 -17.295 -1.965 1.00 0.00 C ATOM 1692 CD2 PHE B 347 -8.730 -18.367 0.196 1.00 0.00 C ATOM 1693 CE1 PHE B 347 -8.633 -18.525 -2.609 1.00 0.00 C ATOM 1694 CE2 PHE B 347 -8.952 -19.599 -0.447 1.00 0.00 C ATOM 1695 CZ PHE B 347 -8.900 -19.678 -1.850 1.00 0.00 C ATOM 0 H PHE B 347 -6.568 -15.685 -1.665 1.00 0.00 H new ATOM 0 HA PHE B 347 -6.631 -14.537 0.825 1.00 0.00 H new ATOM 0 HB2 PHE B 347 -8.710 -15.889 1.094 1.00 0.00 H new ATOM 0 HB3 PHE B 347 -8.611 -15.088 -0.461 1.00 0.00 H new ATOM 0 HD1 PHE B 347 -8.212 -16.410 -2.551 1.00 0.00 H new ATOM 0 HD2 PHE B 347 -8.779 -18.307 1.273 1.00 0.00 H new ATOM 0 HE1 PHE B 347 -8.599 -18.584 -3.687 1.00 0.00 H new ATOM 0 HE2 PHE B 347 -9.162 -20.483 0.137 1.00 0.00 H new ATOM 0 HZ PHE B 347 -9.065 -20.624 -2.344 1.00 0.00 H new ATOM 1705 N ASP B 348 -5.797 -17.714 1.127 1.00 0.00 N ATOM 1706 CA ASP B 348 -5.198 -18.725 2.011 1.00 0.00 C ATOM 1707 C ASP B 348 -3.828 -18.304 2.582 1.00 0.00 C ATOM 1708 O ASP B 348 -3.572 -18.472 3.779 1.00 0.00 O ATOM 1709 CB ASP B 348 -5.093 -20.047 1.238 1.00 0.00 C ATOM 1710 CG ASP B 348 -4.578 -21.193 2.125 1.00 0.00 C ATOM 1711 OD1 ASP B 348 -5.354 -21.701 2.970 1.00 0.00 O ATOM 1712 OD2 ASP B 348 -3.403 -21.601 1.966 1.00 0.00 O ATOM 0 H ASP B 348 -5.967 -18.065 0.184 1.00 0.00 H new ATOM 0 HA ASP B 348 -5.847 -18.842 2.879 1.00 0.00 H new ATOM 0 HB2 ASP B 348 -6.071 -20.311 0.836 1.00 0.00 H new ATOM 0 HB3 ASP B 348 -4.424 -19.918 0.388 1.00 0.00 H new ATOM 1717 N ARG B 349 -2.961 -17.701 1.754 1.00 0.00 N ATOM 1718 CA ARG B 349 -1.678 -17.119 2.192 1.00 0.00 C ATOM 1719 C ARG B 349 -1.902 -15.920 3.115 1.00 0.00 C ATOM 1720 O ARG B 349 -1.279 -15.838 4.173 1.00 0.00 O ATOM 1721 CB ARG B 349 -0.801 -16.734 0.987 1.00 0.00 C ATOM 1722 CG ARG B 349 -0.321 -17.960 0.193 1.00 0.00 C ATOM 1723 CD ARG B 349 0.596 -17.552 -0.970 1.00 0.00 C ATOM 1724 NE ARG B 349 1.203 -18.735 -1.613 1.00 0.00 N ATOM 1725 CZ ARG B 349 1.422 -18.963 -2.898 1.00 0.00 C ATOM 1726 NH1 ARG B 349 1.032 -18.163 -3.850 1.00 0.00 N ATOM 1727 NH2 ARG B 349 2.061 -20.038 -3.263 1.00 0.00 N ATOM 0 H ARG B 349 -3.130 -17.602 0.753 1.00 0.00 H new ATOM 0 HA ARG B 349 -1.146 -17.882 2.760 1.00 0.00 H new ATOM 0 HB2 ARG B 349 -1.365 -16.076 0.327 1.00 0.00 H new ATOM 0 HB3 ARG B 349 0.064 -16.170 1.336 1.00 0.00 H new ATOM 0 HG2 ARG B 349 0.213 -18.639 0.858 1.00 0.00 H new ATOM 0 HG3 ARG B 349 -1.182 -18.504 -0.195 1.00 0.00 H new ATOM 0 HD2 ARG B 349 0.024 -16.988 -1.707 1.00 0.00 H new ATOM 0 HD3 ARG B 349 1.381 -16.892 -0.603 1.00 0.00 H new ATOM 0 HE ARG B 349 1.494 -19.479 -0.979 1.00 0.00 H new ATOM 0 HH11 ARG B 349 0.528 -17.306 -3.622 1.00 0.00 H new ATOM 0 HH12 ARG B 349 1.231 -18.394 -4.823 1.00 0.00 H new ATOM 0 HH21 ARG B 349 2.390 -20.699 -2.560 1.00 0.00 H new ATOM 0 HH22 ARG B 349 2.232 -20.218 -4.252 1.00 0.00 H new ATOM 1741 N ASN B 350 -2.820 -15.017 2.764 1.00 0.00 N ATOM 1742 CA ASN B 350 -3.154 -13.853 3.592 1.00 0.00 C ATOM 1743 C ASN B 350 -3.665 -14.272 4.979 1.00 0.00 C ATOM 1744 O ASN B 350 -3.229 -13.713 5.983 1.00 0.00 O ATOM 1745 CB ASN B 350 -4.184 -12.958 2.888 1.00 0.00 C ATOM 1746 CG ASN B 350 -3.717 -12.363 1.574 1.00 0.00 C ATOM 1747 OD1 ASN B 350 -2.564 -12.431 1.183 1.00 0.00 O ATOM 1748 ND2 ASN B 350 -4.618 -11.730 0.864 1.00 0.00 N ATOM 0 H ASN B 350 -3.354 -15.071 1.897 1.00 0.00 H new ATOM 0 HA ASN B 350 -2.237 -13.282 3.734 1.00 0.00 H new ATOM 0 HB2 ASN B 350 -5.087 -13.541 2.706 1.00 0.00 H new ATOM 0 HB3 ASN B 350 -4.459 -12.146 3.561 1.00 0.00 H new ATOM 0 HD21 ASN B 350 -4.356 -11.292 -0.019 1.00 0.00 H new ATOM 0 HD22 ASN B 350 -5.581 -11.675 1.194 1.00 0.00 H new ATOM 1755 N VAL B 351 -4.527 -15.291 5.055 1.00 0.00 N ATOM 1756 CA VAL B 351 -4.952 -15.928 6.311 1.00 0.00 C ATOM 1757 C VAL B 351 -3.753 -16.434 7.115 1.00 0.00 C ATOM 1758 O VAL B 351 -3.630 -16.087 8.289 1.00 0.00 O ATOM 1759 CB VAL B 351 -5.973 -17.053 6.034 1.00 0.00 C ATOM 1760 CG1 VAL B 351 -6.173 -17.988 7.233 1.00 0.00 C ATOM 1761 CG2 VAL B 351 -7.337 -16.447 5.689 1.00 0.00 C ATOM 0 H VAL B 351 -4.959 -15.706 4.230 1.00 0.00 H new ATOM 0 HA VAL B 351 -5.448 -15.174 6.922 1.00 0.00 H new ATOM 0 HB VAL B 351 -5.568 -17.633 5.205 1.00 0.00 H new ATOM 0 HG11 VAL B 351 -6.901 -18.757 6.977 1.00 0.00 H new ATOM 0 HG12 VAL B 351 -5.224 -18.458 7.490 1.00 0.00 H new ATOM 0 HG13 VAL B 351 -6.536 -17.414 8.085 1.00 0.00 H new ATOM 0 HG21 VAL B 351 -8.052 -17.247 5.495 1.00 0.00 H new ATOM 0 HG22 VAL B 351 -7.688 -15.841 6.525 1.00 0.00 H new ATOM 0 HG23 VAL B 351 -7.243 -15.821 4.802 1.00 0.00 H new ATOM 1771 N ALA B 352 -2.850 -17.220 6.515 1.00 0.00 N ATOM 1772 CA ALA B 352 -1.696 -17.782 7.218 1.00 0.00 C ATOM 1773 C ALA B 352 -0.762 -16.693 7.785 1.00 0.00 C ATOM 1774 O ALA B 352 -0.209 -16.850 8.878 1.00 0.00 O ATOM 1775 CB ALA B 352 -0.968 -18.733 6.260 1.00 0.00 C ATOM 0 H ALA B 352 -2.901 -17.482 5.531 1.00 0.00 H new ATOM 0 HA ALA B 352 -2.041 -18.338 8.090 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -0.103 -19.164 6.763 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -1.645 -19.531 5.955 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -0.638 -18.181 5.380 1.00 0.00 H new ATOM 1781 N ALA B 353 -0.624 -15.574 7.069 1.00 0.00 N ATOM 1782 CA ALA B 353 0.114 -14.384 7.486 1.00 0.00 C ATOM 1783 C ALA B 353 -0.599 -13.588 8.602 1.00 0.00 C ATOM 1784 O ALA B 353 0.029 -13.206 9.589 1.00 0.00 O ATOM 1785 CB ALA B 353 0.341 -13.526 6.237 1.00 0.00 C ATOM 0 H ALA B 353 -1.042 -15.471 6.144 1.00 0.00 H new ATOM 0 HA ALA B 353 1.064 -14.687 7.925 1.00 0.00 H new ATOM 0 HB1 ALA B 353 0.891 -12.625 6.509 1.00 0.00 H new ATOM 0 HB2 ALA B 353 0.915 -14.094 5.505 1.00 0.00 H new ATOM 0 HB3 ALA B 353 -0.621 -13.247 5.807 1.00 0.00 H new ATOM 1791 N LEU B 354 -1.910 -13.345 8.485 1.00 0.00 N ATOM 1792 CA LEU B 354 -2.702 -12.614 9.485 1.00 0.00 C ATOM 1793 C LEU B 354 -2.811 -13.378 10.811 1.00 0.00 C ATOM 1794 O LEU B 354 -2.716 -12.749 11.866 1.00 0.00 O ATOM 1795 CB LEU B 354 -4.094 -12.284 8.921 1.00 0.00 C ATOM 1796 CG LEU B 354 -4.082 -11.165 7.860 1.00 0.00 C ATOM 1797 CD1 LEU B 354 -5.413 -11.177 7.119 1.00 0.00 C ATOM 1798 CD2 LEU B 354 -3.911 -9.769 8.465 1.00 0.00 C ATOM 0 H LEU B 354 -2.459 -13.654 7.683 1.00 0.00 H new ATOM 0 HA LEU B 354 -2.180 -11.682 9.703 1.00 0.00 H new ATOM 0 HB2 LEU B 354 -4.521 -13.185 8.481 1.00 0.00 H new ATOM 0 HB3 LEU B 354 -4.748 -11.988 9.741 1.00 0.00 H new ATOM 0 HG LEU B 354 -3.235 -11.361 7.203 1.00 0.00 H new ATOM 0 HD11 LEU B 354 -5.417 -10.390 6.365 1.00 0.00 H new ATOM 0 HD12 LEU B 354 -5.551 -12.144 6.635 1.00 0.00 H new ATOM 0 HD13 LEU B 354 -6.225 -11.006 7.826 1.00 0.00 H new ATOM 0 HD21 LEU B 354 -3.910 -9.025 7.669 1.00 0.00 H new ATOM 0 HD22 LEU B 354 -4.734 -9.566 9.150 1.00 0.00 H new ATOM 0 HD23 LEU B 354 -2.967 -9.721 9.007 1.00 0.00 H new ATOM 1810 N ARG B 355 -2.930 -14.715 10.776 1.00 0.00 N ATOM 1811 CA ARG B 355 -2.929 -15.596 11.961 1.00 0.00 C ATOM 1812 C ARG B 355 -1.735 -15.324 12.885 1.00 0.00 C ATOM 1813 O ARG B 355 -1.927 -15.022 14.064 1.00 0.00 O ATOM 1814 CB ARG B 355 -2.946 -17.080 11.540 1.00 0.00 C ATOM 1815 CG ARG B 355 -4.334 -17.625 11.167 1.00 0.00 C ATOM 1816 CD ARG B 355 -4.185 -19.088 10.721 1.00 0.00 C ATOM 1817 NE ARG B 355 -5.481 -19.724 10.409 1.00 0.00 N ATOM 1818 CZ ARG B 355 -5.857 -20.962 10.695 1.00 0.00 C ATOM 1819 NH1 ARG B 355 -5.110 -21.788 11.365 1.00 0.00 N ATOM 1820 NH2 ARG B 355 -7.019 -21.410 10.323 1.00 0.00 N ATOM 0 H ARG B 355 -3.032 -15.229 9.901 1.00 0.00 H new ATOM 0 HA ARG B 355 -3.837 -15.373 12.521 1.00 0.00 H new ATOM 0 HB2 ARG B 355 -2.279 -17.210 10.688 1.00 0.00 H new ATOM 0 HB3 ARG B 355 -2.542 -17.680 12.356 1.00 0.00 H new ATOM 0 HG2 ARG B 355 -5.009 -17.557 12.020 1.00 0.00 H new ATOM 0 HG3 ARG B 355 -4.772 -17.029 10.366 1.00 0.00 H new ATOM 0 HD2 ARG B 355 -3.543 -19.132 9.842 1.00 0.00 H new ATOM 0 HD3 ARG B 355 -3.687 -19.654 11.508 1.00 0.00 H new ATOM 0 HE ARG B 355 -6.163 -19.145 9.918 1.00 0.00 H new ATOM 0 HH11 ARG B 355 -4.191 -21.492 11.695 1.00 0.00 H new ATOM 0 HH12 ARG B 355 -5.443 -22.732 11.561 1.00 0.00 H new ATOM 0 HH21 ARG B 355 -7.656 -20.806 9.803 1.00 0.00 H new ATOM 0 HH22 ARG B 355 -7.294 -22.365 10.551 1.00 0.00 H new ATOM 1834 N ARG B 356 -0.506 -15.420 12.356 1.00 0.00 N ATOM 1835 CA ARG B 356 0.749 -15.195 13.104 1.00 0.00 C ATOM 1836 C ARG B 356 1.010 -13.721 13.431 1.00 0.00 C ATOM 1837 O ARG B 356 1.537 -13.411 14.499 1.00 0.00 O ATOM 1838 CB ARG B 356 1.931 -15.843 12.365 1.00 0.00 C ATOM 1839 CG ARG B 356 2.287 -15.206 11.012 1.00 0.00 C ATOM 1840 CD ARG B 356 3.241 -16.085 10.200 1.00 0.00 C ATOM 1841 NE ARG B 356 2.532 -17.254 9.646 1.00 0.00 N ATOM 1842 CZ ARG B 356 3.035 -18.203 8.884 1.00 0.00 C ATOM 1843 NH1 ARG B 356 4.288 -18.239 8.555 1.00 0.00 N ATOM 1844 NH2 ARG B 356 2.265 -19.135 8.407 1.00 0.00 N ATOM 0 H ARG B 356 -0.349 -15.661 11.377 1.00 0.00 H new ATOM 0 HA ARG B 356 0.636 -15.681 14.073 1.00 0.00 H new ATOM 0 HB2 ARG B 356 2.809 -15.801 13.010 1.00 0.00 H new ATOM 0 HB3 ARG B 356 1.704 -16.897 12.204 1.00 0.00 H new ATOM 0 HG2 ARG B 356 1.375 -15.036 10.440 1.00 0.00 H new ATOM 0 HG3 ARG B 356 2.745 -14.231 11.179 1.00 0.00 H new ATOM 0 HD2 ARG B 356 3.679 -15.502 9.390 1.00 0.00 H new ATOM 0 HD3 ARG B 356 4.063 -16.419 10.833 1.00 0.00 H new ATOM 0 HE ARG B 356 1.542 -17.336 9.879 1.00 0.00 H new ATOM 0 HH11 ARG B 356 4.924 -17.515 8.889 1.00 0.00 H new ATOM 0 HH12 ARG B 356 4.638 -18.992 7.962 1.00 0.00 H new ATOM 0 HH21 ARG B 356 1.268 -19.133 8.623 1.00 0.00 H new ATOM 0 HH22 ARG B 356 2.658 -19.869 7.817 1.00 0.00 H new ATOM 1858 N SER B 357 0.603 -12.820 12.537 1.00 0.00 N ATOM 1859 CA SER B 357 0.665 -11.362 12.725 1.00 0.00 C ATOM 1860 C SER B 357 -0.220 -10.859 13.883 1.00 0.00 C ATOM 1861 O SER B 357 0.148 -9.918 14.591 1.00 0.00 O ATOM 1862 CB SER B 357 0.260 -10.667 11.419 1.00 0.00 C ATOM 1863 OG SER B 357 0.387 -9.267 11.540 1.00 0.00 O ATOM 0 H SER B 357 0.209 -13.087 11.635 1.00 0.00 H new ATOM 0 HA SER B 357 1.693 -11.115 12.991 1.00 0.00 H new ATOM 0 HB2 SER B 357 0.886 -11.025 10.601 1.00 0.00 H new ATOM 0 HB3 SER B 357 -0.769 -10.924 11.168 1.00 0.00 H new ATOM 0 HG SER B 357 -0.131 -8.829 10.833 1.00 0.00 H new ATOM 1869 N GLY B 358 -1.384 -11.487 14.096 1.00 0.00 N ATOM 1870 CA GLY B 358 -2.422 -11.049 15.041 1.00 0.00 C ATOM 1871 C GLY B 358 -3.519 -10.191 14.392 1.00 0.00 C ATOM 1872 O GLY B 358 -4.214 -9.444 15.084 1.00 0.00 O ATOM 0 H GLY B 358 -1.638 -12.341 13.600 1.00 0.00 H new ATOM 0 HA2 GLY B 358 -2.880 -11.926 15.497 1.00 0.00 H new ATOM 0 HA3 GLY B 358 -1.954 -10.480 15.844 1.00 0.00 H new ATOM 1876 N GLY B 359 -3.651 -10.257 13.061 1.00 0.00 N ATOM 1877 CA GLY B 359 -4.607 -9.497 12.248 1.00 0.00 C ATOM 1878 C GLY B 359 -4.070 -8.165 11.703 1.00 0.00 C ATOM 1879 O GLY B 359 -4.781 -7.477 10.974 1.00 0.00 O ATOM 0 H GLY B 359 -3.066 -10.872 12.495 1.00 0.00 H new ATOM 0 HA2 GLY B 359 -4.922 -10.117 11.409 1.00 0.00 H new ATOM 0 HA3 GLY B 359 -5.495 -9.297 12.848 1.00 0.00 H new ATOM 1883 N SER B 360 -2.836 -7.774 12.035 1.00 0.00 N ATOM 1884 CA SER B 360 -2.194 -6.546 11.536 1.00 0.00 C ATOM 1885 C SER B 360 -1.776 -6.679 10.063 1.00 0.00 C ATOM 1886 O SER B 360 -0.930 -7.512 9.727 1.00 0.00 O ATOM 1887 CB SER B 360 -0.981 -6.190 12.405 1.00 0.00 C ATOM 1888 OG SER B 360 -1.405 -5.708 13.673 1.00 0.00 O ATOM 0 H SER B 360 -2.242 -8.309 12.669 1.00 0.00 H new ATOM 0 HA SER B 360 -2.927 -5.741 11.598 1.00 0.00 H new ATOM 0 HB2 SER B 360 -0.349 -7.068 12.535 1.00 0.00 H new ATOM 0 HB3 SER B 360 -0.377 -5.433 11.905 1.00 0.00 H new ATOM 0 HG SER B 360 -0.621 -5.486 14.218 1.00 0.00 H new ATOM 1894 N VAL B 361 -2.353 -5.847 9.186 1.00 0.00 N ATOM 1895 CA VAL B 361 -2.136 -5.834 7.721 1.00 0.00 C ATOM 1896 C VAL B 361 -0.651 -5.791 7.360 1.00 0.00 C ATOM 1897 O VAL B 361 -0.150 -6.706 6.719 1.00 0.00 O ATOM 1898 CB VAL B 361 -2.863 -4.648 7.050 1.00 0.00 C ATOM 1899 CG1 VAL B 361 -2.675 -4.619 5.527 1.00 0.00 C ATOM 1900 CG2 VAL B 361 -4.368 -4.664 7.314 1.00 0.00 C ATOM 0 H VAL B 361 -3.014 -5.130 9.485 1.00 0.00 H new ATOM 0 HA VAL B 361 -2.555 -6.767 7.344 1.00 0.00 H new ATOM 0 HB VAL B 361 -2.407 -3.765 7.498 1.00 0.00 H new ATOM 0 HG11 VAL B 361 -3.208 -3.764 5.111 1.00 0.00 H new ATOM 0 HG12 VAL B 361 -1.614 -4.534 5.293 1.00 0.00 H new ATOM 0 HG13 VAL B 361 -3.069 -5.538 5.094 1.00 0.00 H new ATOM 0 HG21 VAL B 361 -4.833 -3.810 6.821 1.00 0.00 H new ATOM 0 HG22 VAL B 361 -4.796 -5.587 6.922 1.00 0.00 H new ATOM 0 HG23 VAL B 361 -4.550 -4.607 8.387 1.00 0.00 H new ATOM 1910 N GLN B 362 0.065 -4.738 7.767 1.00 0.00 N ATOM 1911 CA GLN B 362 1.492 -4.541 7.465 1.00 0.00 C ATOM 1912 C GLN B 362 2.390 -5.668 8.010 1.00 0.00 C ATOM 1913 O GLN B 362 3.364 -6.049 7.358 1.00 0.00 O ATOM 1914 CB GLN B 362 1.938 -3.176 8.018 1.00 0.00 C ATOM 1915 CG GLN B 362 1.936 -2.078 6.953 1.00 0.00 C ATOM 1916 CD GLN B 362 3.123 -2.167 5.992 1.00 0.00 C ATOM 1917 OE1 GLN B 362 2.933 -2.623 4.771 1.00 0.00 O flip ATOM 1918 NE2 GLN B 362 4.236 -1.763 6.300 1.00 0.00 N flip ATOM 0 H GLN B 362 -0.335 -3.984 8.325 1.00 0.00 H new ATOM 0 HA GLN B 362 1.606 -4.567 6.381 1.00 0.00 H new ATOM 0 HB2 GLN B 362 1.277 -2.886 8.834 1.00 0.00 H new ATOM 0 HB3 GLN B 362 2.940 -3.268 8.437 1.00 0.00 H new ATOM 0 HG2 GLN B 362 1.009 -2.137 6.382 1.00 0.00 H new ATOM 0 HG3 GLN B 362 1.947 -1.105 7.444 1.00 0.00 H new ATOM 0 HE21 GLN B 362 4.407 -1.405 7.240 1.00 0.00 H new ATOM 0 HE22 GLN B 362 4.993 -1.784 5.617 1.00 0.00 H new ATOM 1927 N GLY B 363 2.046 -6.242 9.168 1.00 0.00 N ATOM 1928 CA GLY B 363 2.731 -7.409 9.737 1.00 0.00 C ATOM 1929 C GLY B 363 2.564 -8.666 8.876 1.00 0.00 C ATOM 1930 O GLY B 363 3.535 -9.378 8.620 1.00 0.00 O ATOM 0 H GLY B 363 1.274 -5.905 9.744 1.00 0.00 H new ATOM 0 HA2 GLY B 363 3.792 -7.186 9.846 1.00 0.00 H new ATOM 0 HA3 GLY B 363 2.342 -7.603 10.737 1.00 0.00 H new ATOM 1934 N ALA B 364 1.352 -8.908 8.366 1.00 0.00 N ATOM 1935 CA ALA B 364 1.083 -9.954 7.380 1.00 0.00 C ATOM 1936 C ALA B 364 1.785 -9.680 6.034 1.00 0.00 C ATOM 1937 O ALA B 364 2.337 -10.596 5.425 1.00 0.00 O ATOM 1938 CB ALA B 364 -0.436 -10.091 7.221 1.00 0.00 C ATOM 0 H ALA B 364 0.523 -8.376 8.631 1.00 0.00 H new ATOM 0 HA ALA B 364 1.496 -10.898 7.735 1.00 0.00 H new ATOM 0 HB1 ALA B 364 -0.657 -10.868 6.489 1.00 0.00 H new ATOM 0 HB2 ALA B 364 -0.879 -10.360 8.180 1.00 0.00 H new ATOM 0 HB3 ALA B 364 -0.853 -9.143 6.882 1.00 0.00 H new ATOM 1944 N LEU B 365 1.818 -8.422 5.583 1.00 0.00 N ATOM 1945 CA LEU B 365 2.499 -7.960 4.371 1.00 0.00 C ATOM 1946 C LEU B 365 4.000 -8.286 4.390 1.00 0.00 C ATOM 1947 O LEU B 365 4.528 -8.815 3.414 1.00 0.00 O ATOM 1948 CB LEU B 365 2.217 -6.449 4.199 1.00 0.00 C ATOM 1949 CG LEU B 365 1.809 -6.073 2.771 1.00 0.00 C ATOM 1950 CD1 LEU B 365 1.186 -4.683 2.713 1.00 0.00 C ATOM 1951 CD2 LEU B 365 2.997 -6.067 1.820 1.00 0.00 C ATOM 0 H LEU B 365 1.348 -7.663 6.077 1.00 0.00 H new ATOM 0 HA LEU B 365 2.107 -8.494 3.505 1.00 0.00 H new ATOM 0 HB2 LEU B 365 1.425 -6.153 4.887 1.00 0.00 H new ATOM 0 HB3 LEU B 365 3.108 -5.885 4.476 1.00 0.00 H new ATOM 0 HG LEU B 365 1.087 -6.831 2.467 1.00 0.00 H new ATOM 0 HD11 LEU B 365 0.909 -4.451 1.685 1.00 0.00 H new ATOM 0 HD12 LEU B 365 0.297 -4.656 3.343 1.00 0.00 H new ATOM 0 HD13 LEU B 365 1.906 -3.946 3.070 1.00 0.00 H new ATOM 0 HD21 LEU B 365 2.661 -5.795 0.819 1.00 0.00 H new ATOM 0 HD22 LEU B 365 3.735 -5.342 2.164 1.00 0.00 H new ATOM 0 HD23 LEU B 365 3.447 -7.059 1.794 1.00 0.00 H new ATOM 1963 N ASP B 366 4.679 -8.047 5.515 1.00 0.00 N ATOM 1964 CA ASP B 366 6.072 -8.459 5.728 1.00 0.00 C ATOM 1965 C ASP B 366 6.269 -9.982 5.582 1.00 0.00 C ATOM 1966 O ASP B 366 7.196 -10.416 4.894 1.00 0.00 O ATOM 1967 CB ASP B 366 6.548 -7.959 7.099 1.00 0.00 C ATOM 1968 CG ASP B 366 8.036 -8.272 7.329 1.00 0.00 C ATOM 1969 OD1 ASP B 366 8.896 -7.603 6.708 1.00 0.00 O ATOM 1970 OD2 ASP B 366 8.350 -9.178 8.137 1.00 0.00 O ATOM 0 H ASP B 366 4.274 -7.557 6.313 1.00 0.00 H new ATOM 0 HA ASP B 366 6.682 -8.004 4.948 1.00 0.00 H new ATOM 0 HB2 ASP B 366 6.386 -6.883 7.171 1.00 0.00 H new ATOM 0 HB3 ASP B 366 5.952 -8.424 7.884 1.00 0.00 H new ATOM 1975 N SER B 367 5.383 -10.803 6.162 1.00 0.00 N ATOM 1976 CA SER B 367 5.415 -12.270 6.021 1.00 0.00 C ATOM 1977 C SER B 367 5.211 -12.721 4.569 1.00 0.00 C ATOM 1978 O SER B 367 5.934 -13.594 4.089 1.00 0.00 O ATOM 1979 CB SER B 367 4.355 -12.939 6.909 1.00 0.00 C ATOM 1980 OG SER B 367 4.581 -12.674 8.284 1.00 0.00 O ATOM 0 H SER B 367 4.617 -10.468 6.747 1.00 0.00 H new ATOM 0 HA SER B 367 6.409 -12.583 6.342 1.00 0.00 H new ATOM 0 HB2 SER B 367 3.365 -12.581 6.627 1.00 0.00 H new ATOM 0 HB3 SER B 367 4.365 -14.016 6.739 1.00 0.00 H new ATOM 0 HG SER B 367 3.888 -13.113 8.820 1.00 0.00 H new ATOM 1986 N LEU B 368 4.259 -12.114 3.854 1.00 0.00 N ATOM 1987 CA LEU B 368 3.974 -12.373 2.437 1.00 0.00 C ATOM 1988 C LEU B 368 5.156 -11.999 1.523 1.00 0.00 C ATOM 1989 O LEU B 368 5.491 -12.761 0.615 1.00 0.00 O ATOM 1990 CB LEU B 368 2.699 -11.611 2.027 1.00 0.00 C ATOM 1991 CG LEU B 368 1.406 -12.174 2.648 1.00 0.00 C ATOM 1992 CD1 LEU B 368 0.283 -11.143 2.565 1.00 0.00 C ATOM 1993 CD2 LEU B 368 0.943 -13.447 1.937 1.00 0.00 C ATOM 0 H LEU B 368 3.645 -11.406 4.257 1.00 0.00 H new ATOM 0 HA LEU B 368 3.817 -13.444 2.313 1.00 0.00 H new ATOM 0 HB2 LEU B 368 2.804 -10.565 2.317 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.608 -11.633 0.941 1.00 0.00 H new ATOM 0 HG LEU B 368 1.631 -12.409 3.688 1.00 0.00 H new ATOM 0 HD11 LEU B 368 -0.623 -11.556 3.008 1.00 0.00 H new ATOM 0 HD12 LEU B 368 0.574 -10.243 3.107 1.00 0.00 H new ATOM 0 HD13 LEU B 368 0.095 -10.893 1.521 1.00 0.00 H new ATOM 0 HD21 LEU B 368 0.029 -13.813 2.404 1.00 0.00 H new ATOM 0 HD22 LEU B 368 0.751 -13.228 0.887 1.00 0.00 H new ATOM 0 HD23 LEU B 368 1.719 -14.209 2.013 1.00 0.00 H new ATOM 2005 N LEU B 369 5.822 -10.866 1.780 1.00 0.00 N ATOM 2006 CA LEU B 369 7.027 -10.425 1.062 1.00 0.00 C ATOM 2007 C LEU B 369 8.221 -11.368 1.294 1.00 0.00 C ATOM 2008 O LEU B 369 8.954 -11.682 0.354 1.00 0.00 O ATOM 2009 CB LEU B 369 7.383 -8.986 1.487 1.00 0.00 C ATOM 2010 CG LEU B 369 6.488 -7.904 0.850 1.00 0.00 C ATOM 2011 CD1 LEU B 369 6.694 -6.568 1.565 1.00 0.00 C ATOM 2012 CD2 LEU B 369 6.826 -7.695 -0.629 1.00 0.00 C ATOM 0 H LEU B 369 5.532 -10.215 2.510 1.00 0.00 H new ATOM 0 HA LEU B 369 6.809 -10.449 -0.006 1.00 0.00 H new ATOM 0 HB2 LEU B 369 7.311 -8.910 2.572 1.00 0.00 H new ATOM 0 HB3 LEU B 369 8.421 -8.786 1.222 1.00 0.00 H new ATOM 0 HG LEU B 369 5.457 -8.244 0.944 1.00 0.00 H new ATOM 0 HD11 LEU B 369 6.058 -5.809 1.109 1.00 0.00 H new ATOM 0 HD12 LEU B 369 6.433 -6.675 2.618 1.00 0.00 H new ATOM 0 HD13 LEU B 369 7.738 -6.266 1.479 1.00 0.00 H new ATOM 0 HD21 LEU B 369 6.176 -6.926 -1.046 1.00 0.00 H new ATOM 0 HD22 LEU B 369 7.866 -7.382 -0.724 1.00 0.00 H new ATOM 0 HD23 LEU B 369 6.677 -8.629 -1.172 1.00 0.00 H new ATOM 2024 N ASN B 370 8.406 -11.843 2.529 1.00 0.00 N ATOM 2025 CA ASN B 370 9.432 -12.829 2.892 1.00 0.00 C ATOM 2026 C ASN B 370 9.103 -14.270 2.440 1.00 0.00 C ATOM 2027 O ASN B 370 9.995 -15.122 2.421 1.00 0.00 O ATOM 2028 CB ASN B 370 9.653 -12.767 4.414 1.00 0.00 C ATOM 2029 CG ASN B 370 10.566 -11.616 4.807 1.00 0.00 C ATOM 2030 OD1 ASN B 370 11.783 -11.741 4.841 1.00 0.00 O ATOM 2031 ND2 ASN B 370 10.021 -10.463 5.112 1.00 0.00 N ATOM 0 H ASN B 370 7.836 -11.548 3.322 1.00 0.00 H new ATOM 0 HA ASN B 370 10.345 -12.567 2.358 1.00 0.00 H new ATOM 0 HB2 ASN B 370 8.692 -12.656 4.916 1.00 0.00 H new ATOM 0 HB3 ASN B 370 10.085 -13.707 4.757 1.00 0.00 H new ATOM 0 HD21 ASN B 370 10.611 -9.674 5.376 1.00 0.00 H new ATOM 0 HD22 ASN B 370 9.007 -10.355 5.085 1.00 0.00 H new ATOM 2038 N GLY B 371 7.848 -14.562 2.075 1.00 0.00 N ATOM 2039 CA GLY B 371 7.374 -15.912 1.740 1.00 0.00 C ATOM 2040 C GLY B 371 7.281 -16.852 2.953 1.00 0.00 C ATOM 2041 O GLY B 371 7.388 -18.070 2.809 1.00 0.00 O ATOM 0 H GLY B 371 7.119 -13.853 2.003 1.00 0.00 H new ATOM 0 HA2 GLY B 371 6.392 -15.837 1.273 1.00 0.00 H new ATOM 0 HA3 GLY B 371 8.045 -16.351 1.002 1.00 0.00 H new ATOM 2045 N ASP B 372 7.124 -16.288 4.154 1.00 0.00 N ATOM 2046 CA ASP B 372 7.139 -16.986 5.448 1.00 0.00 C ATOM 2047 C ASP B 372 5.935 -17.932 5.669 1.00 0.00 C ATOM 2048 O ASP B 372 6.037 -18.884 6.448 1.00 0.00 O ATOM 2049 CB ASP B 372 7.196 -15.916 6.550 1.00 0.00 C ATOM 2050 CG ASP B 372 7.328 -16.509 7.962 1.00 0.00 C ATOM 2051 OD1 ASP B 372 8.412 -17.045 8.296 1.00 0.00 O ATOM 2052 OD2 ASP B 372 6.354 -16.413 8.749 1.00 0.00 O ATOM 0 H ASP B 372 6.976 -15.284 4.258 1.00 0.00 H new ATOM 0 HA ASP B 372 8.013 -17.637 5.472 1.00 0.00 H new ATOM 0 HB2 ASP B 372 8.040 -15.253 6.361 1.00 0.00 H new ATOM 0 HB3 ASP B 372 6.294 -15.305 6.502 1.00 0.00 H new ATOM 2057 N VAL B 373 4.808 -17.675 4.986 1.00 0.00 N ATOM 2058 CA VAL B 373 3.507 -18.381 5.079 1.00 0.00 C ATOM 2059 C VAL B 373 3.607 -19.911 5.126 1.00 0.00 C ATOM 2060 O VAL B 373 3.221 -20.470 6.179 1.00 0.00 O ATOM 2061 CB VAL B 373 2.511 -17.910 4.002 1.00 0.00 C ATOM 2062 CG1 VAL B 373 1.884 -16.581 4.430 1.00 0.00 C ATOM 2063 CG2 VAL B 373 3.123 -17.724 2.605 1.00 0.00 C ATOM 2064 OXT VAL B 373 4.049 -20.543 4.139 1.00 0.00 O ATOM 0 H VAL B 373 4.773 -16.917 4.305 1.00 0.00 H new ATOM 0 HA VAL B 373 3.113 -18.093 6.054 1.00 0.00 H new ATOM 0 HB VAL B 373 1.771 -18.706 3.921 1.00 0.00 H new ATOM 0 HG11 VAL B 373 1.180 -16.249 3.667 1.00 0.00 H new ATOM 0 HG12 VAL B 373 1.359 -16.714 5.376 1.00 0.00 H new ATOM 0 HG13 VAL B 373 2.667 -15.832 4.552 1.00 0.00 H new ATOM 0 HG21 VAL B 373 2.351 -17.391 1.911 1.00 0.00 H new ATOM 0 HG22 VAL B 373 3.915 -16.977 2.651 1.00 0.00 H new ATOM 0 HG23 VAL B 373 3.537 -18.671 2.260 1.00 0.00 H new