USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 933 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: C 13 ASN : amide:sc= 1.06 K(o=1,f=-1.3) USER MOD Set 1.2: C 19 THR OG1 : rot 180:sc= -0.0312 USER MOD Set 2.1: C 11 SER OG : rot 179:sc= 0.746 USER MOD Set 2.2: C 21 THR OG1 : rot -70:sc= 0.85 USER MOD Set 3.1: A 13 ASN : amide:sc= -0.0178 X(o=-0.023,f=0.014) USER MOD Set 3.2: A 19 THR OG1 : rot 180:sc=-0.00508 USER MOD Set 4.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 175:sc= -0.0527 (180deg=-0.12) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0006 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 29 GLN : amide:sc= -1.4 K(o=-1.4,f=-0.13) USER MOD Single : A 35 ASN : amide:sc= -0.0435 K(o=-0.043,f=-1.9!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= -0.626 X(o=-0.63,f=-0.27) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.655 K(o=0.66,f=0) USER MOD Single : A 52 GLN : amide:sc= -2.83! K(o=-2.8!,f=-1.5) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 173:sc=-0.00705 (180deg=-0.0861) USER MOD Single : C 1 MET N :NH3+ 133:sc= 0.0122 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 7 LYS NZ :NH3+ 168:sc=-0.00927 (180deg=-0.153) USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 35 ASN : amide:sc= -0.0174 K(o=-0.017,f=-1.8!) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HD1:sc= -1.03 X(o=-1,f=-0.55) USER MOD Single : C 48 TYR OH : rot 43:sc= 0.459 USER MOD Single : C 49 GLN : amide:sc= 1.06 K(o=1.1,f=0) USER MOD Single : C 52 GLN : amide:sc= -3.19! K(o=-3.2!,f=-1.3) USER MOD Single : C 56 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.771 -7.728 -10.015 1.00 0.00 N ATOM 2 CA MET A 1 4.047 -6.753 -9.180 1.00 0.00 C ATOM 3 C MET A 1 2.704 -7.333 -8.757 1.00 0.00 C ATOM 4 O MET A 1 1.923 -7.755 -9.608 1.00 0.00 O ATOM 5 CB MET A 1 3.848 -5.436 -9.934 1.00 0.00 C ATOM 6 CG MET A 1 3.648 -4.293 -8.938 1.00 0.00 C ATOM 7 SD MET A 1 3.522 -2.649 -9.689 1.00 0.00 S ATOM 8 CE MET A 1 1.933 -2.816 -10.526 1.00 0.00 C ATOM 0 H1 MET A 1 5.687 -7.327 -10.301 1.00 0.00 H new ATOM 0 H2 MET A 1 4.929 -8.601 -9.472 1.00 0.00 H new ATOM 0 H3 MET A 1 4.208 -7.945 -10.862 1.00 0.00 H new ATOM 0 HA MET A 1 4.640 -6.546 -8.289 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.713 -5.233 -10.565 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.983 -5.511 -10.594 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.743 -4.485 -8.362 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.480 -4.293 -8.234 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.654 -1.861 -10.970 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.011 -3.571 -11.308 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.172 -3.117 -9.806 1.00 0.00 H new ATOM 20 N LEU A 2 2.429 -7.357 -7.451 1.00 0.00 N ATOM 21 CA LEU A 2 1.189 -7.911 -6.924 1.00 0.00 C ATOM 22 C LEU A 2 0.120 -6.813 -6.915 1.00 0.00 C ATOM 23 O LEU A 2 0.413 -5.686 -6.518 1.00 0.00 O ATOM 24 CB LEU A 2 1.478 -8.430 -5.505 1.00 0.00 C ATOM 25 CG LEU A 2 0.594 -9.588 -5.014 1.00 0.00 C ATOM 26 CD1 LEU A 2 0.522 -9.538 -3.491 1.00 0.00 C ATOM 27 CD2 LEU A 2 -0.822 -9.573 -5.571 1.00 0.00 C ATOM 0 H LEU A 2 3.059 -6.994 -6.736 1.00 0.00 H new ATOM 0 HA LEU A 2 0.819 -8.733 -7.537 1.00 0.00 H new ATOM 0 HB2 LEU A 2 2.519 -8.751 -5.463 1.00 0.00 H new ATOM 0 HB3 LEU A 2 1.373 -7.599 -4.808 1.00 0.00 H new ATOM 0 HG LEU A 2 1.058 -10.506 -5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -0.103 -10.355 -3.129 1.00 0.00 H new ATOM 0 HD12 LEU A 2 1.525 -9.637 -3.076 1.00 0.00 H new ATOM 0 HD13 LEU A 2 0.092 -8.586 -3.178 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -1.378 -10.423 -5.175 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.318 -8.647 -5.279 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -0.786 -9.638 -6.658 1.00 0.00 H new ATOM 39 N ILE A 3 -1.108 -7.124 -7.342 1.00 0.00 N ATOM 40 CA ILE A 3 -2.217 -6.175 -7.347 1.00 0.00 C ATOM 41 C ILE A 3 -3.354 -6.707 -6.481 1.00 0.00 C ATOM 42 O ILE A 3 -3.638 -7.901 -6.481 1.00 0.00 O ATOM 43 CB ILE A 3 -2.719 -5.911 -8.782 1.00 0.00 C ATOM 44 CG1 ILE A 3 -1.791 -4.973 -9.552 1.00 0.00 C ATOM 45 CG2 ILE A 3 -4.085 -5.215 -8.760 1.00 0.00 C ATOM 46 CD1 ILE A 3 -0.563 -5.665 -10.123 1.00 0.00 C ATOM 0 H ILE A 3 -1.358 -8.048 -7.695 1.00 0.00 H new ATOM 0 HA ILE A 3 -1.862 -5.229 -6.937 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.765 -6.889 -9.262 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -2.349 -4.511 -10.366 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.470 -4.169 -8.890 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.420 -5.038 -9.782 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -4.808 -5.848 -8.246 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -4.000 -4.263 -8.237 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.049 -4.938 -10.656 1.00 0.00 H new ATOM 0 HD12 ILE A 3 0.018 -6.103 -9.312 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.875 -6.451 -10.811 1.00 0.00 H new ATOM 58 N LEU A 4 -3.996 -5.793 -5.749 1.00 0.00 N ATOM 59 CA LEU A 4 -5.117 -6.087 -4.869 1.00 0.00 C ATOM 60 C LEU A 4 -6.241 -5.100 -5.164 1.00 0.00 C ATOM 61 O LEU A 4 -6.032 -4.052 -5.777 1.00 0.00 O ATOM 62 CB LEU A 4 -4.713 -5.918 -3.394 1.00 0.00 C ATOM 63 CG LEU A 4 -4.095 -7.129 -2.683 1.00 0.00 C ATOM 64 CD1 LEU A 4 -5.075 -8.295 -2.619 1.00 0.00 C ATOM 65 CD2 LEU A 4 -2.813 -7.604 -3.347 1.00 0.00 C ATOM 0 H LEU A 4 -3.740 -4.806 -5.756 1.00 0.00 H new ATOM 0 HA LEU A 4 -5.434 -7.116 -5.041 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -4.002 -5.094 -3.333 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.599 -5.617 -2.835 1.00 0.00 H new ATOM 0 HG LEU A 4 -3.857 -6.791 -1.674 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.606 -9.137 -2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.967 -7.991 -2.072 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.353 -8.592 -3.630 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -2.418 -8.462 -2.804 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -3.022 -7.892 -4.377 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -2.078 -6.799 -3.337 1.00 0.00 H new ATOM 77 N THR A 5 -7.442 -5.457 -4.712 1.00 0.00 N ATOM 78 CA THR A 5 -8.625 -4.623 -4.827 1.00 0.00 C ATOM 79 C THR A 5 -9.279 -4.575 -3.458 1.00 0.00 C ATOM 80 O THR A 5 -9.574 -5.611 -2.869 1.00 0.00 O ATOM 81 CB THR A 5 -9.570 -5.200 -5.881 1.00 0.00 C ATOM 82 OG1 THR A 5 -8.931 -5.188 -7.141 1.00 0.00 O ATOM 83 CG2 THR A 5 -10.860 -4.385 -5.985 1.00 0.00 C ATOM 0 H THR A 5 -7.617 -6.349 -4.249 1.00 0.00 H new ATOM 0 HA THR A 5 -8.368 -3.613 -5.147 1.00 0.00 H new ATOM 0 HB THR A 5 -9.821 -6.217 -5.582 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.535 -5.559 -7.818 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.508 -4.824 -6.744 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.373 -4.391 -5.023 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.620 -3.358 -6.262 1.00 0.00 H new ATOM 91 N ARG A 6 -9.508 -3.364 -2.952 1.00 0.00 N ATOM 92 CA ARG A 6 -10.048 -3.140 -1.618 1.00 0.00 C ATOM 93 C ARG A 6 -10.949 -1.918 -1.655 1.00 0.00 C ATOM 94 O ARG A 6 -11.024 -1.237 -2.676 1.00 0.00 O ATOM 95 CB ARG A 6 -8.900 -2.941 -0.619 1.00 0.00 C ATOM 96 CG ARG A 6 -8.019 -4.190 -0.483 1.00 0.00 C ATOM 97 CD ARG A 6 -8.782 -5.387 0.082 1.00 0.00 C ATOM 98 NE ARG A 6 -8.810 -5.382 1.546 1.00 0.00 N ATOM 99 CZ ARG A 6 -9.351 -6.363 2.276 1.00 0.00 C ATOM 100 NH1 ARG A 6 -9.921 -7.410 1.686 1.00 0.00 N ATOM 101 NH2 ARG A 6 -9.321 -6.300 3.602 1.00 0.00 N ATOM 0 H ARG A 6 -9.321 -2.503 -3.465 1.00 0.00 H new ATOM 0 HA ARG A 6 -10.630 -4.004 -1.298 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -8.286 -2.100 -0.939 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -9.312 -2.682 0.357 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -7.612 -4.451 -1.460 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -7.172 -3.964 0.165 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -9.803 -5.378 -0.300 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -8.319 -6.309 -0.268 1.00 0.00 H new ATOM 0 HE ARG A 6 -8.395 -4.589 2.035 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -9.948 -7.470 0.668 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -10.331 -8.153 2.251 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -8.885 -5.503 4.065 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -9.734 -7.049 4.158 1.00 0.00 H new ATOM 115 N LYS A 7 -11.638 -1.633 -0.551 1.00 0.00 N ATOM 116 CA LYS A 7 -12.509 -0.473 -0.454 1.00 0.00 C ATOM 117 C LYS A 7 -11.979 0.445 0.637 1.00 0.00 C ATOM 118 O LYS A 7 -11.222 0.004 1.502 1.00 0.00 O ATOM 119 CB LYS A 7 -13.948 -0.909 -0.174 1.00 0.00 C ATOM 120 CG LYS A 7 -14.371 -2.065 -1.082 1.00 0.00 C ATOM 121 CD LYS A 7 -15.898 -2.157 -1.101 1.00 0.00 C ATOM 122 CE LYS A 7 -16.364 -3.493 -1.678 1.00 0.00 C ATOM 123 NZ LYS A 7 -17.832 -3.594 -1.630 1.00 0.00 N ATOM 0 H LYS A 7 -11.605 -2.200 0.296 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.517 0.070 -1.399 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.041 -1.212 0.869 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.620 -0.064 -0.322 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.992 -1.908 -2.092 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.943 -3.001 -0.723 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -16.285 -2.041 -0.089 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -16.307 -1.339 -1.694 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -16.021 -3.590 -2.708 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.919 -4.314 -1.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -18.130 -4.508 -2.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -18.153 -3.523 -0.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -18.251 -2.822 -2.187 1.00 0.00 H new ATOM 137 N VAL A 8 -12.366 1.722 0.605 1.00 0.00 N ATOM 138 CA VAL A 8 -11.827 2.674 1.567 1.00 0.00 C ATOM 139 C VAL A 8 -12.163 2.253 2.997 1.00 0.00 C ATOM 140 O VAL A 8 -13.329 2.057 3.339 1.00 0.00 O ATOM 141 CB VAL A 8 -12.262 4.103 1.248 1.00 0.00 C ATOM 142 CG1 VAL A 8 -11.769 4.464 -0.157 1.00 0.00 C ATOM 143 CG2 VAL A 8 -13.764 4.366 1.291 1.00 0.00 C ATOM 0 H VAL A 8 -13.034 2.110 -0.061 1.00 0.00 H new ATOM 0 HA VAL A 8 -10.740 2.666 1.484 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.824 4.715 2.036 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -12.073 5.483 -0.399 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -10.682 4.392 -0.191 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -12.201 3.775 -0.882 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -13.957 5.411 1.049 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -14.266 3.726 0.565 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -14.143 4.149 2.290 1.00 0.00 H new ATOM 153 N GLY A 9 -11.122 2.116 3.821 1.00 0.00 N ATOM 154 CA GLY A 9 -11.247 1.686 5.206 1.00 0.00 C ATOM 155 C GLY A 9 -10.484 0.386 5.461 1.00 0.00 C ATOM 156 O GLY A 9 -10.243 0.033 6.615 1.00 0.00 O ATOM 0 H GLY A 9 -10.160 2.304 3.538 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.868 2.467 5.866 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.300 1.545 5.451 1.00 0.00 H new ATOM 160 N GLU A 10 -10.099 -0.330 4.398 1.00 0.00 N ATOM 161 CA GLU A 10 -9.370 -1.587 4.518 1.00 0.00 C ATOM 162 C GLU A 10 -7.857 -1.346 4.535 1.00 0.00 C ATOM 163 O GLU A 10 -7.399 -0.207 4.443 1.00 0.00 O ATOM 164 CB GLU A 10 -9.764 -2.520 3.371 1.00 0.00 C ATOM 165 CG GLU A 10 -11.256 -2.870 3.457 1.00 0.00 C ATOM 166 CD GLU A 10 -11.662 -3.956 2.467 1.00 0.00 C ATOM 167 OE1 GLU A 10 -11.491 -3.726 1.251 1.00 0.00 O ATOM 168 OE2 GLU A 10 -12.141 -5.015 2.933 1.00 0.00 O ATOM 0 H GLU A 10 -10.286 -0.051 3.435 1.00 0.00 H new ATOM 0 HA GLU A 10 -9.635 -2.059 5.464 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -9.550 -2.042 2.415 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.167 -3.431 3.413 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.490 -3.200 4.469 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.847 -1.973 3.270 1.00 0.00 H new ATOM 175 N SER A 11 -7.083 -2.431 4.654 1.00 0.00 N ATOM 176 CA SER A 11 -5.634 -2.368 4.786 1.00 0.00 C ATOM 177 C SER A 11 -4.958 -3.534 4.065 1.00 0.00 C ATOM 178 O SER A 11 -5.616 -4.485 3.642 1.00 0.00 O ATOM 179 CB SER A 11 -5.252 -2.394 6.270 1.00 0.00 C ATOM 180 OG SER A 11 -5.897 -1.354 6.973 1.00 0.00 O ATOM 0 H SER A 11 -7.453 -3.381 4.661 1.00 0.00 H new ATOM 0 HA SER A 11 -5.292 -1.440 4.328 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.526 -3.356 6.704 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.172 -2.293 6.374 1.00 0.00 H new ATOM 0 HG SER A 11 -5.641 -1.390 7.918 1.00 0.00 H new ATOM 186 N ILE A 12 -3.633 -3.441 3.932 1.00 0.00 N ATOM 187 CA ILE A 12 -2.767 -4.422 3.292 1.00 0.00 C ATOM 188 C ILE A 12 -1.542 -4.609 4.191 1.00 0.00 C ATOM 189 O ILE A 12 -1.285 -3.766 5.047 1.00 0.00 O ATOM 190 CB ILE A 12 -2.368 -3.907 1.896 1.00 0.00 C ATOM 191 CG1 ILE A 12 -3.584 -3.739 0.974 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.344 -4.827 1.226 1.00 0.00 C ATOM 193 CD1 ILE A 12 -4.294 -5.057 0.653 1.00 0.00 C ATOM 0 H ILE A 12 -3.114 -2.638 4.287 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.270 -5.380 3.162 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.915 -2.928 2.052 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.294 -3.058 1.443 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.262 -3.273 0.043 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.087 -4.431 0.243 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -0.446 -4.881 1.841 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.769 -5.825 1.115 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -5.143 -4.863 -0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.599 -5.733 0.155 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -4.647 -5.515 1.577 1.00 0.00 H new ATOM 205 N ASN A 13 -0.780 -5.689 4.020 1.00 0.00 N ATOM 206 CA ASN A 13 0.353 -5.957 4.892 1.00 0.00 C ATOM 207 C ASN A 13 1.571 -6.434 4.096 1.00 0.00 C ATOM 208 O ASN A 13 1.423 -7.039 3.033 1.00 0.00 O ATOM 209 CB ASN A 13 -0.076 -7.002 5.925 1.00 0.00 C ATOM 210 CG ASN A 13 0.936 -7.127 7.053 1.00 0.00 C ATOM 211 OD1 ASN A 13 1.959 -7.789 6.912 1.00 0.00 O ATOM 212 ND2 ASN A 13 0.652 -6.491 8.184 1.00 0.00 N ATOM 0 H ASN A 13 -0.929 -6.385 3.290 1.00 0.00 H new ATOM 0 HA ASN A 13 0.652 -5.038 5.396 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.048 -6.729 6.337 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.197 -7.969 5.436 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.295 -6.543 8.974 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.209 -5.950 8.263 1.00 0.00 H new ATOM 219 N ILE A 14 2.771 -6.155 4.615 1.00 0.00 N ATOM 220 CA ILE A 14 4.031 -6.485 3.966 1.00 0.00 C ATOM 221 C ILE A 14 5.062 -6.899 5.018 1.00 0.00 C ATOM 222 O ILE A 14 5.068 -6.383 6.136 1.00 0.00 O ATOM 223 CB ILE A 14 4.540 -5.267 3.171 1.00 0.00 C ATOM 224 CG1 ILE A 14 3.515 -4.857 2.103 1.00 0.00 C ATOM 225 CG2 ILE A 14 5.897 -5.584 2.533 1.00 0.00 C ATOM 226 CD1 ILE A 14 3.980 -3.653 1.281 1.00 0.00 C ATOM 0 H ILE A 14 2.889 -5.686 5.513 1.00 0.00 H new ATOM 0 HA ILE A 14 3.877 -7.316 3.278 1.00 0.00 H new ATOM 0 HB ILE A 14 4.669 -4.428 3.855 1.00 0.00 H new ATOM 0 HG12 ILE A 14 3.332 -5.700 1.436 1.00 0.00 H new ATOM 0 HG13 ILE A 14 2.567 -4.620 2.585 1.00 0.00 H new ATOM 0 HG21 ILE A 14 6.248 -4.717 1.974 1.00 0.00 H new ATOM 0 HG22 ILE A 14 6.618 -5.828 3.313 1.00 0.00 H new ATOM 0 HG23 ILE A 14 5.792 -6.433 1.858 1.00 0.00 H new ATOM 0 HD11 ILE A 14 3.221 -3.403 0.540 1.00 0.00 H new ATOM 0 HD12 ILE A 14 4.137 -2.800 1.942 1.00 0.00 H new ATOM 0 HD13 ILE A 14 4.914 -3.897 0.775 1.00 0.00 H new ATOM 238 N GLY A 15 5.943 -7.836 4.653 1.00 0.00 N ATOM 239 CA GLY A 15 6.996 -8.304 5.537 1.00 0.00 C ATOM 240 C GLY A 15 6.416 -8.822 6.852 1.00 0.00 C ATOM 241 O GLY A 15 5.429 -9.555 6.859 1.00 0.00 O ATOM 0 H GLY A 15 5.940 -8.285 3.737 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.561 -9.097 5.047 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.695 -7.492 5.738 1.00 0.00 H new ATOM 245 N ASP A 16 7.045 -8.429 7.964 1.00 0.00 N ATOM 246 CA ASP A 16 6.605 -8.778 9.306 1.00 0.00 C ATOM 247 C ASP A 16 6.545 -7.526 10.192 1.00 0.00 C ATOM 248 O ASP A 16 6.301 -7.615 11.393 1.00 0.00 O ATOM 249 CB ASP A 16 7.541 -9.843 9.877 1.00 0.00 C ATOM 250 CG ASP A 16 7.072 -10.367 11.232 1.00 0.00 C ATOM 251 OD1 ASP A 16 5.891 -10.776 11.323 1.00 0.00 O ATOM 252 OD2 ASP A 16 7.897 -10.357 12.174 1.00 0.00 O ATOM 0 H ASP A 16 7.886 -7.851 7.950 1.00 0.00 H new ATOM 0 HA ASP A 16 5.597 -9.191 9.273 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.613 -10.674 9.175 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.542 -9.425 9.979 1.00 0.00 H new ATOM 257 N ASP A 17 6.774 -6.351 9.594 1.00 0.00 N ATOM 258 CA ASP A 17 6.858 -5.090 10.324 1.00 0.00 C ATOM 259 C ASP A 17 6.260 -3.926 9.527 1.00 0.00 C ATOM 260 O ASP A 17 6.450 -2.772 9.912 1.00 0.00 O ATOM 261 CB ASP A 17 8.320 -4.792 10.653 1.00 0.00 C ATOM 262 CG ASP A 17 8.945 -5.865 11.540 1.00 0.00 C ATOM 263 OD1 ASP A 17 8.728 -5.800 12.771 1.00 0.00 O ATOM 264 OD2 ASP A 17 9.640 -6.742 10.981 1.00 0.00 O ATOM 0 H ASP A 17 6.906 -6.252 8.587 1.00 0.00 H new ATOM 0 HA ASP A 17 6.278 -5.193 11.241 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.889 -4.712 9.727 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.388 -3.826 11.153 1.00 0.00 H new ATOM 269 N ILE A 18 5.542 -4.196 8.429 1.00 0.00 N ATOM 270 CA ILE A 18 4.989 -3.136 7.597 1.00 0.00 C ATOM 271 C ILE A 18 3.515 -3.402 7.316 1.00 0.00 C ATOM 272 O ILE A 18 3.107 -4.539 7.083 1.00 0.00 O ATOM 273 CB ILE A 18 5.782 -3.059 6.282 1.00 0.00 C ATOM 274 CG1 ILE A 18 7.267 -2.793 6.559 1.00 0.00 C ATOM 275 CG2 ILE A 18 5.208 -1.968 5.374 1.00 0.00 C ATOM 276 CD1 ILE A 18 8.100 -2.880 5.282 1.00 0.00 C ATOM 0 H ILE A 18 5.334 -5.140 8.102 1.00 0.00 H new ATOM 0 HA ILE A 18 5.069 -2.183 8.121 1.00 0.00 H new ATOM 0 HB ILE A 18 5.693 -4.019 5.773 1.00 0.00 H new ATOM 0 HG12 ILE A 18 7.384 -1.805 7.004 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.638 -3.516 7.286 1.00 0.00 H new ATOM 0 HG21 ILE A 18 5.781 -1.927 4.448 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.166 -2.195 5.147 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.268 -1.005 5.880 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.147 -2.686 5.516 1.00 0.00 H new ATOM 0 HD12 ILE A 18 8.003 -3.877 4.852 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.745 -2.139 4.565 1.00 0.00 H new ATOM 288 N THR A 19 2.710 -2.336 7.342 1.00 0.00 N ATOM 289 CA THR A 19 1.286 -2.401 7.037 1.00 0.00 C ATOM 290 C THR A 19 0.896 -1.125 6.306 1.00 0.00 C ATOM 291 O THR A 19 1.517 -0.088 6.520 1.00 0.00 O ATOM 292 CB THR A 19 0.476 -2.561 8.331 1.00 0.00 C ATOM 293 OG1 THR A 19 1.040 -3.558 9.148 1.00 0.00 O ATOM 294 CG2 THR A 19 -0.971 -2.958 8.042 1.00 0.00 C ATOM 0 H THR A 19 3.035 -1.398 7.578 1.00 0.00 H new ATOM 0 HA THR A 19 1.073 -3.263 6.405 1.00 0.00 H new ATOM 0 HB THR A 19 0.497 -1.595 8.836 1.00 0.00 H new ATOM 0 HG1 THR A 19 0.512 -3.646 9.969 1.00 0.00 H new ATOM 0 HG21 THR A 19 -1.514 -3.062 8.981 1.00 0.00 H new ATOM 0 HG22 THR A 19 -1.445 -2.188 7.432 1.00 0.00 H new ATOM 0 HG23 THR A 19 -0.988 -3.907 7.506 1.00 0.00 H new ATOM 302 N ILE A 20 -0.123 -1.193 5.451 1.00 0.00 N ATOM 303 CA ILE A 20 -0.546 -0.077 4.610 1.00 0.00 C ATOM 304 C ILE A 20 -2.063 0.054 4.703 1.00 0.00 C ATOM 305 O ILE A 20 -2.753 -0.943 4.912 1.00 0.00 O ATOM 306 CB ILE A 20 -0.122 -0.339 3.154 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.338 -0.789 3.020 1.00 0.00 C ATOM 308 CG2 ILE A 20 -0.340 0.919 2.311 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.345 0.283 3.432 1.00 0.00 C ATOM 0 H ILE A 20 -0.684 -2.035 5.322 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.078 0.848 4.947 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.747 -1.157 2.794 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.494 -1.677 3.632 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.528 -1.077 1.986 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.037 0.724 1.282 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.395 1.194 2.333 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.256 1.736 2.716 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.357 -0.103 3.312 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.216 1.164 2.803 1.00 0.00 H new ATOM 0 HD13 ILE A 20 2.181 0.554 4.475 1.00 0.00 H new ATOM 321 N THR A 21 -2.593 1.272 4.552 1.00 0.00 N ATOM 322 CA THR A 21 -4.016 1.520 4.723 1.00 0.00 C ATOM 323 C THR A 21 -4.516 2.499 3.667 1.00 0.00 C ATOM 324 O THR A 21 -3.774 3.371 3.222 1.00 0.00 O ATOM 325 CB THR A 21 -4.259 2.090 6.124 1.00 0.00 C ATOM 326 OG1 THR A 21 -3.661 1.253 7.094 1.00 0.00 O ATOM 327 CG2 THR A 21 -5.750 2.200 6.429 1.00 0.00 C ATOM 0 H THR A 21 -2.050 2.101 4.311 1.00 0.00 H new ATOM 0 HA THR A 21 -4.562 0.584 4.607 1.00 0.00 H new ATOM 0 HB THR A 21 -3.817 3.086 6.156 1.00 0.00 H new ATOM 0 HG1 THR A 21 -3.818 1.623 7.988 1.00 0.00 H new ATOM 0 HG21 THR A 21 -5.887 2.608 7.430 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.223 2.859 5.701 1.00 0.00 H new ATOM 0 HG23 THR A 21 -6.207 1.212 6.374 1.00 0.00 H new ATOM 335 N ILE A 22 -5.786 2.348 3.274 1.00 0.00 N ATOM 336 CA ILE A 22 -6.443 3.230 2.318 1.00 0.00 C ATOM 337 C ILE A 22 -7.487 4.053 3.069 1.00 0.00 C ATOM 338 O ILE A 22 -8.613 3.606 3.282 1.00 0.00 O ATOM 339 CB ILE A 22 -7.001 2.409 1.138 1.00 0.00 C ATOM 340 CG1 ILE A 22 -7.900 3.241 0.214 1.00 0.00 C ATOM 341 CG2 ILE A 22 -7.786 1.178 1.596 1.00 0.00 C ATOM 342 CD1 ILE A 22 -7.144 4.405 -0.418 1.00 0.00 C ATOM 0 H ILE A 22 -6.388 1.600 3.618 1.00 0.00 H new ATOM 0 HA ILE A 22 -5.743 3.934 1.868 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.119 2.086 0.585 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.304 2.602 -0.571 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -8.748 3.624 0.781 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.156 0.637 0.725 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.134 0.526 2.178 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.628 1.492 2.212 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.817 4.968 -1.065 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.762 5.059 0.366 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.312 4.021 -1.008 1.00 0.00 H new ATOM 354 N LEU A 23 -7.109 5.267 3.480 1.00 0.00 N ATOM 355 CA LEU A 23 -7.972 6.109 4.297 1.00 0.00 C ATOM 356 C LEU A 23 -9.199 6.553 3.514 1.00 0.00 C ATOM 357 O LEU A 23 -10.275 6.726 4.088 1.00 0.00 O ATOM 358 CB LEU A 23 -7.201 7.336 4.795 1.00 0.00 C ATOM 359 CG LEU A 23 -5.948 6.983 5.598 1.00 0.00 C ATOM 360 CD1 LEU A 23 -5.377 8.263 6.193 1.00 0.00 C ATOM 361 CD2 LEU A 23 -6.222 5.987 6.720 1.00 0.00 C ATOM 0 H LEU A 23 -6.206 5.685 3.256 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.302 5.522 5.154 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.915 7.947 3.939 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.861 7.944 5.414 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.241 6.509 4.917 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.482 8.029 6.769 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -5.121 8.955 5.390 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.119 8.723 6.846 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.295 5.776 7.253 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.951 6.410 7.412 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.616 5.063 6.298 1.00 0.00 H new ATOM 373 N GLY A 24 -9.049 6.739 2.199 1.00 0.00 N ATOM 374 CA GLY A 24 -10.182 7.003 1.330 1.00 0.00 C ATOM 375 C GLY A 24 -9.787 7.533 -0.040 1.00 0.00 C ATOM 376 O GLY A 24 -8.619 7.504 -0.422 1.00 0.00 O ATOM 0 H GLY A 24 -8.149 6.710 1.720 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -10.755 6.084 1.204 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -10.840 7.725 1.814 1.00 0.00 H new ATOM 380 N VAL A 25 -10.790 8.017 -0.779 1.00 0.00 N ATOM 381 CA VAL A 25 -10.638 8.418 -2.170 1.00 0.00 C ATOM 382 C VAL A 25 -11.285 9.780 -2.397 1.00 0.00 C ATOM 383 O VAL A 25 -12.183 10.184 -1.662 1.00 0.00 O ATOM 384 CB VAL A 25 -11.255 7.329 -3.057 1.00 0.00 C ATOM 385 CG1 VAL A 25 -12.753 7.170 -2.798 1.00 0.00 C ATOM 386 CG2 VAL A 25 -11.045 7.620 -4.542 1.00 0.00 C ATOM 0 H VAL A 25 -11.737 8.140 -0.420 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.584 8.522 -2.429 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.743 6.403 -2.796 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.153 6.390 -3.445 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.915 6.895 -1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.261 8.111 -3.008 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -11.497 6.825 -5.136 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.511 8.572 -4.796 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.977 7.670 -4.755 1.00 0.00 H new ATOM 396 N SER A 26 -10.815 10.481 -3.430 1.00 0.00 N ATOM 397 CA SER A 26 -11.258 11.822 -3.778 1.00 0.00 C ATOM 398 C SER A 26 -11.210 11.979 -5.295 1.00 0.00 C ATOM 399 O SER A 26 -10.488 12.829 -5.819 1.00 0.00 O ATOM 400 CB SER A 26 -10.372 12.865 -3.089 1.00 0.00 C ATOM 401 OG SER A 26 -10.408 12.703 -1.684 1.00 0.00 O ATOM 0 H SER A 26 -10.099 10.119 -4.060 1.00 0.00 H new ATOM 0 HA SER A 26 -12.281 11.977 -3.436 1.00 0.00 H new ATOM 0 HB2 SER A 26 -9.346 12.770 -3.445 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.709 13.867 -3.353 1.00 0.00 H new ATOM 0 HG SER A 26 -9.835 13.377 -1.262 1.00 0.00 H new ATOM 407 N GLY A 27 -11.980 11.155 -6.009 1.00 0.00 N ATOM 408 CA GLY A 27 -11.995 11.188 -7.462 1.00 0.00 C ATOM 409 C GLY A 27 -10.691 10.617 -7.994 1.00 0.00 C ATOM 410 O GLY A 27 -10.277 9.530 -7.589 1.00 0.00 O ATOM 0 H GLY A 27 -12.600 10.457 -5.598 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.839 10.611 -7.841 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.126 12.212 -7.812 1.00 0.00 H new ATOM 414 N GLN A 28 -10.039 11.344 -8.905 1.00 0.00 N ATOM 415 CA GLN A 28 -8.763 10.935 -9.469 1.00 0.00 C ATOM 416 C GLN A 28 -7.634 11.040 -8.434 1.00 0.00 C ATOM 417 O GLN A 28 -6.466 10.852 -8.774 1.00 0.00 O ATOM 418 CB GLN A 28 -8.484 11.778 -10.719 1.00 0.00 C ATOM 419 CG GLN A 28 -7.414 11.134 -11.605 1.00 0.00 C ATOM 420 CD GLN A 28 -7.230 11.881 -12.921 1.00 0.00 C ATOM 421 OE1 GLN A 28 -8.129 12.566 -13.398 1.00 0.00 O ATOM 422 NE2 GLN A 28 -6.050 11.757 -13.519 1.00 0.00 N ATOM 0 H GLN A 28 -10.386 12.232 -9.268 1.00 0.00 H new ATOM 0 HA GLN A 28 -8.809 9.885 -9.757 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.405 11.900 -11.290 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -8.159 12.775 -10.421 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -6.466 11.110 -11.067 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -7.690 10.100 -11.812 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -5.323 11.180 -13.097 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -5.872 12.239 -14.400 1.00 0.00 H new ATOM 431 N GLN A 29 -7.962 11.339 -7.171 1.00 0.00 N ATOM 432 CA GLN A 29 -6.966 11.419 -6.111 1.00 0.00 C ATOM 433 C GLN A 29 -7.263 10.400 -5.017 1.00 0.00 C ATOM 434 O GLN A 29 -8.395 9.936 -4.875 1.00 0.00 O ATOM 435 CB GLN A 29 -6.909 12.822 -5.510 1.00 0.00 C ATOM 436 CG GLN A 29 -6.800 13.901 -6.589 1.00 0.00 C ATOM 437 CD GLN A 29 -6.552 15.281 -5.983 1.00 0.00 C ATOM 438 OE1 GLN A 29 -7.119 16.272 -6.432 1.00 0.00 O ATOM 439 NE2 GLN A 29 -5.703 15.362 -4.957 1.00 0.00 N ATOM 0 H GLN A 29 -8.916 11.529 -6.864 1.00 0.00 H new ATOM 0 HA GLN A 29 -5.996 11.194 -6.553 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.803 12.997 -4.911 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.055 12.894 -4.837 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -5.988 13.652 -7.272 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.717 13.921 -7.178 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.246 14.520 -4.605 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.511 16.265 -4.524 1.00 0.00 H new ATOM 448 N VAL A 30 -6.235 10.051 -4.237 1.00 0.00 N ATOM 449 CA VAL A 30 -6.337 9.034 -3.194 1.00 0.00 C ATOM 450 C VAL A 30 -5.568 9.447 -1.937 1.00 0.00 C ATOM 451 O VAL A 30 -4.570 10.160 -2.022 1.00 0.00 O ATOM 452 CB VAL A 30 -5.818 7.704 -3.754 1.00 0.00 C ATOM 453 CG1 VAL A 30 -5.625 6.669 -2.650 1.00 0.00 C ATOM 454 CG2 VAL A 30 -6.810 7.141 -4.772 1.00 0.00 C ATOM 0 H VAL A 30 -5.308 10.469 -4.314 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.380 8.921 -2.899 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.856 7.904 -4.227 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.256 5.739 -3.083 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.903 7.042 -1.924 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.578 6.485 -2.153 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.433 6.197 -5.164 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.773 6.974 -4.288 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -6.933 7.850 -5.591 1.00 0.00 H new ATOM 464 N ARG A 31 -6.045 8.988 -0.773 1.00 0.00 N ATOM 465 CA ARG A 31 -5.461 9.278 0.531 1.00 0.00 C ATOM 466 C ARG A 31 -5.108 7.955 1.205 1.00 0.00 C ATOM 467 O ARG A 31 -5.987 7.131 1.458 1.00 0.00 O ATOM 468 CB ARG A 31 -6.489 10.068 1.354 1.00 0.00 C ATOM 469 CG ARG A 31 -5.971 11.427 1.829 1.00 0.00 C ATOM 470 CD ARG A 31 -4.928 11.311 2.945 1.00 0.00 C ATOM 471 NE ARG A 31 -4.624 12.636 3.501 1.00 0.00 N ATOM 472 CZ ARG A 31 -5.338 13.240 4.455 1.00 0.00 C ATOM 473 NH1 ARG A 31 -6.377 12.634 5.028 1.00 0.00 N ATOM 474 NH2 ARG A 31 -5.014 14.468 4.843 1.00 0.00 N ATOM 0 H ARG A 31 -6.869 8.390 -0.717 1.00 0.00 H new ATOM 0 HA ARG A 31 -4.553 9.875 0.441 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -7.386 10.219 0.753 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.782 9.476 2.221 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.534 11.959 0.984 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -6.810 12.026 2.183 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -5.300 10.656 3.733 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.018 10.856 2.555 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.811 13.130 3.133 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.640 11.692 4.740 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.909 13.112 5.755 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.223 14.947 4.413 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.557 14.933 5.571 1.00 0.00 H new ATOM 488 N ILE A 32 -3.825 7.751 1.493 1.00 0.00 N ATOM 489 CA ILE A 32 -3.309 6.484 1.988 1.00 0.00 C ATOM 490 C ILE A 32 -2.307 6.706 3.110 1.00 0.00 C ATOM 491 O ILE A 32 -1.710 7.775 3.224 1.00 0.00 O ATOM 492 CB ILE A 32 -2.639 5.704 0.847 1.00 0.00 C ATOM 493 CG1 ILE A 32 -1.752 6.634 0.006 1.00 0.00 C ATOM 494 CG2 ILE A 32 -3.710 5.022 -0.004 1.00 0.00 C ATOM 495 CD1 ILE A 32 -0.991 5.868 -1.075 1.00 0.00 C ATOM 0 H ILE A 32 -3.109 8.470 1.387 1.00 0.00 H new ATOM 0 HA ILE A 32 -4.147 5.908 2.379 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.992 4.933 1.265 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.369 7.402 -0.459 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.043 7.146 0.656 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -3.234 4.469 -0.813 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -4.285 4.334 0.617 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.377 5.776 -0.423 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.375 6.562 -1.648 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -0.353 5.117 -0.608 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -1.701 5.378 -1.741 1.00 0.00 H new ATOM 507 N GLY A 33 -2.128 5.678 3.943 1.00 0.00 N ATOM 508 CA GLY A 33 -1.202 5.713 5.060 1.00 0.00 C ATOM 509 C GLY A 33 -0.258 4.512 5.020 1.00 0.00 C ATOM 510 O GLY A 33 -0.521 3.523 4.343 1.00 0.00 O ATOM 0 H GLY A 33 -2.629 4.794 3.854 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -0.624 6.637 5.030 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.757 5.714 5.998 1.00 0.00 H new ATOM 514 N ILE A 34 0.846 4.620 5.760 1.00 0.00 N ATOM 515 CA ILE A 34 1.871 3.597 5.847 1.00 0.00 C ATOM 516 C ILE A 34 2.201 3.423 7.323 1.00 0.00 C ATOM 517 O ILE A 34 2.262 4.399 8.069 1.00 0.00 O ATOM 518 CB ILE A 34 3.131 4.020 5.078 1.00 0.00 C ATOM 519 CG1 ILE A 34 2.901 4.148 3.566 1.00 0.00 C ATOM 520 CG2 ILE A 34 4.233 2.978 5.284 1.00 0.00 C ATOM 521 CD1 ILE A 34 2.389 5.535 3.162 1.00 0.00 C ATOM 0 H ILE A 34 1.051 5.443 6.326 1.00 0.00 H new ATOM 0 HA ILE A 34 1.515 2.665 5.407 1.00 0.00 H new ATOM 0 HB ILE A 34 3.411 4.998 5.470 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.834 3.943 3.042 1.00 0.00 H new ATOM 0 HG13 ILE A 34 2.183 3.393 3.246 1.00 0.00 H new ATOM 0 HG21 ILE A 34 5.126 3.280 4.737 1.00 0.00 H new ATOM 0 HG22 ILE A 34 4.466 2.900 6.346 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.892 2.010 4.916 1.00 0.00 H new ATOM 0 HD11 ILE A 34 2.244 5.569 2.082 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.441 5.733 3.662 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.118 6.291 3.454 1.00 0.00 H new ATOM 533 N ASN A 35 2.413 2.178 7.743 1.00 0.00 N ATOM 534 CA ASN A 35 2.642 1.847 9.136 1.00 0.00 C ATOM 535 C ASN A 35 3.837 0.908 9.245 1.00 0.00 C ATOM 536 O ASN A 35 3.705 -0.292 9.482 1.00 0.00 O ATOM 537 CB ASN A 35 1.367 1.254 9.727 1.00 0.00 C ATOM 538 CG ASN A 35 1.360 1.301 11.248 1.00 0.00 C ATOM 539 OD1 ASN A 35 2.409 1.307 11.886 1.00 0.00 O ATOM 540 ND2 ASN A 35 0.171 1.337 11.839 1.00 0.00 N ATOM 0 H ASN A 35 2.430 1.371 7.119 1.00 0.00 H new ATOM 0 HA ASN A 35 2.883 2.740 9.713 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.504 1.799 9.345 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.263 0.220 9.397 1.00 0.00 H new ATOM 0 HD21 ASN A 35 0.108 1.371 12.856 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -0.679 1.331 11.275 1.00 0.00 H new ATOM 547 N ALA A 36 5.009 1.508 9.059 1.00 0.00 N ATOM 548 CA ALA A 36 6.306 0.868 9.178 1.00 0.00 C ATOM 549 C ALA A 36 7.087 1.571 10.282 1.00 0.00 C ATOM 550 O ALA A 36 6.766 2.707 10.635 1.00 0.00 O ATOM 551 CB ALA A 36 7.024 0.989 7.832 1.00 0.00 C ATOM 0 H ALA A 36 5.079 2.495 8.811 1.00 0.00 H new ATOM 0 HA ALA A 36 6.212 -0.187 9.433 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.003 0.514 7.898 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.433 0.497 7.059 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.148 2.042 7.579 1.00 0.00 H new ATOM 557 N PRO A 37 8.114 0.925 10.840 1.00 0.00 N ATOM 558 CA PRO A 37 8.931 1.518 11.876 1.00 0.00 C ATOM 559 C PRO A 37 9.818 2.581 11.246 1.00 0.00 C ATOM 560 O PRO A 37 10.135 2.513 10.062 1.00 0.00 O ATOM 561 CB PRO A 37 9.752 0.360 12.440 1.00 0.00 C ATOM 562 CG PRO A 37 9.898 -0.577 11.243 1.00 0.00 C ATOM 563 CD PRO A 37 8.566 -0.412 10.524 1.00 0.00 C ATOM 0 HA PRO A 37 8.356 2.004 12.664 1.00 0.00 H new ATOM 0 HB2 PRO A 37 10.721 0.695 12.810 1.00 0.00 H new ATOM 0 HB3 PRO A 37 9.244 -0.126 13.273 1.00 0.00 H new ATOM 0 HG2 PRO A 37 10.738 -0.295 10.608 1.00 0.00 H new ATOM 0 HG3 PRO A 37 10.065 -1.608 11.554 1.00 0.00 H new ATOM 0 HD2 PRO A 37 8.683 -0.542 9.448 1.00 0.00 H new ATOM 0 HD3 PRO A 37 7.845 -1.158 10.858 1.00 0.00 H new ATOM 571 N LYS A 38 10.228 3.572 12.037 1.00 0.00 N ATOM 572 CA LYS A 38 11.111 4.610 11.534 1.00 0.00 C ATOM 573 C LYS A 38 12.525 4.064 11.342 1.00 0.00 C ATOM 574 O LYS A 38 13.424 4.782 10.914 1.00 0.00 O ATOM 575 CB LYS A 38 11.043 5.835 12.443 1.00 0.00 C ATOM 576 CG LYS A 38 9.581 6.285 12.463 1.00 0.00 C ATOM 577 CD LYS A 38 9.371 7.643 13.126 1.00 0.00 C ATOM 578 CE LYS A 38 10.094 8.745 12.355 1.00 0.00 C ATOM 579 NZ LYS A 38 9.796 10.073 12.924 1.00 0.00 N ATOM 0 H LYS A 38 9.964 3.673 13.017 1.00 0.00 H new ATOM 0 HA LYS A 38 10.781 4.936 10.548 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.387 5.591 13.448 1.00 0.00 H new ATOM 0 HB3 LYS A 38 11.688 6.630 12.070 1.00 0.00 H new ATOM 0 HG2 LYS A 38 9.208 6.328 11.440 1.00 0.00 H new ATOM 0 HG3 LYS A 38 8.986 5.537 12.988 1.00 0.00 H new ATOM 0 HD2 LYS A 38 8.305 7.867 13.175 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.737 7.611 14.152 1.00 0.00 H new ATOM 0 HE2 LYS A 38 11.169 8.567 12.382 1.00 0.00 H new ATOM 0 HE3 LYS A 38 9.793 8.718 11.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 10.300 10.804 12.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.772 10.250 12.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 10.106 10.103 13.916 1.00 0.00 H new ATOM 593 N ASP A 39 12.714 2.780 11.669 1.00 0.00 N ATOM 594 CA ASP A 39 13.940 2.054 11.380 1.00 0.00 C ATOM 595 C ASP A 39 14.048 1.789 9.875 1.00 0.00 C ATOM 596 O ASP A 39 15.118 1.415 9.398 1.00 0.00 O ATOM 597 CB ASP A 39 13.951 0.738 12.158 1.00 0.00 C ATOM 598 CG ASP A 39 13.988 0.988 13.663 1.00 0.00 C ATOM 599 OD1 ASP A 39 15.108 1.198 14.181 1.00 0.00 O ATOM 600 OD2 ASP A 39 12.896 0.969 14.275 1.00 0.00 O ATOM 0 H ASP A 39 12.009 2.218 12.146 1.00 0.00 H new ATOM 0 HA ASP A 39 14.797 2.653 11.688 1.00 0.00 H new ATOM 0 HB2 ASP A 39 13.065 0.155 11.905 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.817 0.145 11.864 1.00 0.00 H new ATOM 605 N VAL A 40 12.955 1.981 9.123 1.00 0.00 N ATOM 606 CA VAL A 40 12.986 1.918 7.671 1.00 0.00 C ATOM 607 C VAL A 40 12.444 3.211 7.072 1.00 0.00 C ATOM 608 O VAL A 40 11.526 3.841 7.604 1.00 0.00 O ATOM 609 CB VAL A 40 12.231 0.694 7.141 1.00 0.00 C ATOM 610 CG1 VAL A 40 12.789 -0.588 7.761 1.00 0.00 C ATOM 611 CG2 VAL A 40 10.733 0.775 7.424 1.00 0.00 C ATOM 0 H VAL A 40 12.033 2.183 9.510 1.00 0.00 H new ATOM 0 HA VAL A 40 14.025 1.807 7.360 1.00 0.00 H new ATOM 0 HB VAL A 40 12.374 0.678 6.061 1.00 0.00 H new ATOM 0 HG11 VAL A 40 12.242 -1.447 7.374 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.844 -0.686 7.507 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.679 -0.546 8.845 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.240 -0.114 7.030 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.569 0.835 8.500 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.319 1.662 6.944 1.00 0.00 H new ATOM 621 N ALA A 41 13.034 3.608 5.945 1.00 0.00 N ATOM 622 CA ALA A 41 12.689 4.840 5.261 1.00 0.00 C ATOM 623 C ALA A 41 11.323 4.710 4.601 1.00 0.00 C ATOM 624 O ALA A 41 10.955 3.634 4.133 1.00 0.00 O ATOM 625 CB ALA A 41 13.758 5.137 4.219 1.00 0.00 C ATOM 0 H ALA A 41 13.770 3.075 5.482 1.00 0.00 H new ATOM 0 HA ALA A 41 12.641 5.660 5.978 1.00 0.00 H new ATOM 0 HB1 ALA A 41 13.511 6.061 3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 41 14.725 5.245 4.710 1.00 0.00 H new ATOM 0 HB3 ALA A 41 13.805 4.317 3.502 1.00 0.00 H new ATOM 631 N VAL A 42 10.573 5.812 4.567 1.00 0.00 N ATOM 632 CA VAL A 42 9.271 5.871 3.921 1.00 0.00 C ATOM 633 C VAL A 42 9.094 7.267 3.352 1.00 0.00 C ATOM 634 O VAL A 42 9.012 8.237 4.109 1.00 0.00 O ATOM 635 CB VAL A 42 8.158 5.571 4.930 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.802 5.638 4.247 1.00 0.00 C ATOM 637 CG2 VAL A 42 8.299 4.178 5.544 1.00 0.00 C ATOM 0 H VAL A 42 10.859 6.694 4.992 1.00 0.00 H new ATOM 0 HA VAL A 42 9.214 5.126 3.127 1.00 0.00 H new ATOM 0 HB VAL A 42 8.240 6.320 5.718 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.018 5.423 4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.651 6.636 3.835 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.763 4.903 3.443 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.489 4.009 6.253 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.254 3.427 4.756 1.00 0.00 H new ATOM 0 HG23 VAL A 42 9.255 4.104 6.062 1.00 0.00 H new ATOM 647 N HIS A 43 9.040 7.374 2.019 1.00 0.00 N ATOM 648 CA HIS A 43 8.892 8.654 1.341 1.00 0.00 C ATOM 649 C HIS A 43 8.144 8.490 0.024 1.00 0.00 C ATOM 650 O HIS A 43 7.985 7.388 -0.498 1.00 0.00 O ATOM 651 CB HIS A 43 10.257 9.278 1.016 1.00 0.00 C ATOM 652 CG HIS A 43 11.190 9.460 2.180 1.00 0.00 C ATOM 653 ND1 HIS A 43 11.370 10.654 2.879 1.00 0.00 N ATOM 654 CD2 HIS A 43 11.991 8.495 2.719 1.00 0.00 C ATOM 655 CE1 HIS A 43 12.284 10.378 3.822 1.00 0.00 C ATOM 656 NE2 HIS A 43 12.675 9.093 3.753 1.00 0.00 N ATOM 0 H HIS A 43 9.098 6.575 1.388 1.00 0.00 H new ATOM 0 HA HIS A 43 8.336 9.300 2.020 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.752 8.654 0.273 1.00 0.00 H new ATOM 0 HB3 HIS A 43 10.089 10.251 0.554 1.00 0.00 H new ATOM 0 HD2 HIS A 43 12.072 7.467 2.398 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.656 11.093 4.541 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.358 8.641 4.360 1.00 0.00 H new ATOM 664 N ARG A 44 7.694 9.629 -0.496 1.00 0.00 N ATOM 665 CA ARG A 44 7.070 9.797 -1.799 1.00 0.00 C ATOM 666 C ARG A 44 8.082 9.454 -2.892 1.00 0.00 C ATOM 667 O ARG A 44 9.264 9.732 -2.732 1.00 0.00 O ATOM 668 CB ARG A 44 6.728 11.283 -1.828 1.00 0.00 C ATOM 669 CG ARG A 44 6.059 11.812 -3.089 1.00 0.00 C ATOM 670 CD ARG A 44 6.255 13.329 -3.106 1.00 0.00 C ATOM 671 NE ARG A 44 5.951 13.942 -1.807 1.00 0.00 N ATOM 672 CZ ARG A 44 6.209 15.221 -1.516 1.00 0.00 C ATOM 673 NH1 ARG A 44 6.649 16.060 -2.450 1.00 0.00 N ATOM 674 NH2 ARG A 44 6.027 15.672 -0.281 1.00 0.00 N ATOM 0 H ARG A 44 7.761 10.510 0.014 1.00 0.00 H new ATOM 0 HA ARG A 44 6.200 9.160 -1.961 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.075 11.497 -0.982 1.00 0.00 H new ATOM 0 HB3 ARG A 44 7.648 11.846 -1.671 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.499 11.358 -3.977 1.00 0.00 H new ATOM 0 HG3 ARG A 44 4.998 11.562 -3.095 1.00 0.00 H new ATOM 0 HD2 ARG A 44 7.285 13.558 -3.382 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.615 13.768 -3.872 1.00 0.00 H new ATOM 0 HE ARG A 44 5.520 13.361 -1.088 1.00 0.00 H new ATOM 0 HH11 ARG A 44 6.794 15.730 -3.404 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.841 17.033 -2.212 1.00 0.00 H new ATOM 0 HH21 ARG A 44 5.690 15.042 0.447 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.224 16.648 -0.060 1.00 0.00 H new ATOM 688 N GLU A 45 7.642 8.856 -4.002 1.00 0.00 N ATOM 689 CA GLU A 45 8.548 8.520 -5.100 1.00 0.00 C ATOM 690 C GLU A 45 9.107 9.765 -5.769 1.00 0.00 C ATOM 691 O GLU A 45 10.264 9.789 -6.179 1.00 0.00 O ATOM 692 CB GLU A 45 7.792 7.722 -6.154 1.00 0.00 C ATOM 693 CG GLU A 45 7.724 6.257 -5.754 1.00 0.00 C ATOM 694 CD GLU A 45 8.983 5.515 -6.193 1.00 0.00 C ATOM 695 OE1 GLU A 45 9.974 5.544 -5.429 1.00 0.00 O ATOM 696 OE2 GLU A 45 8.946 4.920 -7.293 1.00 0.00 O ATOM 0 H GLU A 45 6.669 8.596 -4.163 1.00 0.00 H new ATOM 0 HA GLU A 45 9.371 7.942 -4.680 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.785 8.122 -6.270 1.00 0.00 H new ATOM 0 HB3 GLU A 45 8.288 7.820 -7.120 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.607 6.176 -4.673 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.847 5.793 -6.205 1.00 0.00 H new ATOM 703 N GLU A 46 8.274 10.800 -5.878 1.00 0.00 N ATOM 704 CA GLU A 46 8.653 12.079 -6.467 1.00 0.00 C ATOM 705 C GLU A 46 9.762 12.769 -5.661 1.00 0.00 C ATOM 706 O GLU A 46 10.267 13.811 -6.075 1.00 0.00 O ATOM 707 CB GLU A 46 7.395 12.942 -6.581 1.00 0.00 C ATOM 708 CG GLU A 46 7.606 14.190 -7.440 1.00 0.00 C ATOM 709 CD GLU A 46 6.292 14.941 -7.624 1.00 0.00 C ATOM 710 OE1 GLU A 46 5.787 15.472 -6.609 1.00 0.00 O ATOM 711 OE2 GLU A 46 5.797 14.978 -8.772 1.00 0.00 O ATOM 0 H GLU A 46 7.307 10.771 -5.555 1.00 0.00 H new ATOM 0 HA GLU A 46 9.071 11.920 -7.461 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.589 12.345 -7.007 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.075 13.243 -5.583 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.342 14.842 -6.969 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.008 13.906 -8.412 1.00 0.00 H new ATOM 718 N ILE A 47 10.144 12.201 -4.512 1.00 0.00 N ATOM 719 CA ILE A 47 11.180 12.765 -3.659 1.00 0.00 C ATOM 720 C ILE A 47 12.193 11.702 -3.247 1.00 0.00 C ATOM 721 O ILE A 47 13.343 12.035 -2.988 1.00 0.00 O ATOM 722 CB ILE A 47 10.525 13.438 -2.439 1.00 0.00 C ATOM 723 CG1 ILE A 47 10.085 14.851 -2.823 1.00 0.00 C ATOM 724 CG2 ILE A 47 11.459 13.497 -1.228 1.00 0.00 C ATOM 725 CD1 ILE A 47 9.781 15.691 -1.584 1.00 0.00 C ATOM 0 H ILE A 47 9.739 11.337 -4.152 1.00 0.00 H new ATOM 0 HA ILE A 47 11.733 13.522 -4.216 1.00 0.00 H new ATOM 0 HB ILE A 47 9.665 12.834 -2.149 1.00 0.00 H new ATOM 0 HG12 ILE A 47 10.868 15.332 -3.408 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.200 14.799 -3.457 1.00 0.00 H new ATOM 0 HG21 ILE A 47 10.947 13.981 -0.397 1.00 0.00 H new ATOM 0 HG22 ILE A 47 11.744 12.485 -0.939 1.00 0.00 H new ATOM 0 HG23 ILE A 47 12.352 14.067 -1.485 1.00 0.00 H new ATOM 0 HD11 ILE A 47 9.471 16.690 -1.889 1.00 0.00 H new ATOM 0 HD12 ILE A 47 8.980 15.221 -1.013 1.00 0.00 H new ATOM 0 HD13 ILE A 47 10.675 15.762 -0.964 1.00 0.00 H new ATOM 737 N TYR A 48 11.812 10.426 -3.175 1.00 0.00 N ATOM 738 CA TYR A 48 12.742 9.408 -2.724 1.00 0.00 C ATOM 739 C TYR A 48 13.926 9.308 -3.680 1.00 0.00 C ATOM 740 O TYR A 48 15.051 9.026 -3.266 1.00 0.00 O ATOM 741 CB TYR A 48 12.035 8.060 -2.621 1.00 0.00 C ATOM 742 CG TYR A 48 12.984 6.983 -2.160 1.00 0.00 C ATOM 743 CD1 TYR A 48 13.169 6.757 -0.789 1.00 0.00 C ATOM 744 CD2 TYR A 48 13.693 6.222 -3.101 1.00 0.00 C ATOM 745 CE1 TYR A 48 14.070 5.780 -0.355 1.00 0.00 C ATOM 746 CE2 TYR A 48 14.600 5.243 -2.678 1.00 0.00 C ATOM 747 CZ TYR A 48 14.782 5.008 -1.299 1.00 0.00 C ATOM 748 OH TYR A 48 15.641 4.036 -0.875 1.00 0.00 O ATOM 0 H TYR A 48 10.883 10.084 -3.420 1.00 0.00 H new ATOM 0 HA TYR A 48 13.114 9.688 -1.738 1.00 0.00 H new ATOM 0 HB2 TYR A 48 11.200 8.136 -1.924 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.617 7.790 -3.591 1.00 0.00 H new ATOM 0 HD1 TYR A 48 12.615 7.338 -0.067 1.00 0.00 H new ATOM 0 HD2 TYR A 48 13.539 6.392 -4.156 1.00 0.00 H new ATOM 0 HE1 TYR A 48 14.221 5.616 0.702 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.158 4.670 -3.404 1.00 0.00 H new ATOM 0 HH TYR A 48 16.049 3.598 -1.651 1.00 0.00 H new ATOM 758 N GLN A 49 13.662 9.548 -4.964 1.00 0.00 N ATOM 759 CA GLN A 49 14.671 9.469 -6.000 1.00 0.00 C ATOM 760 C GLN A 49 15.613 10.672 -5.931 1.00 0.00 C ATOM 761 O GLN A 49 16.684 10.652 -6.539 1.00 0.00 O ATOM 762 CB GLN A 49 13.968 9.399 -7.355 1.00 0.00 C ATOM 763 CG GLN A 49 12.991 8.219 -7.347 1.00 0.00 C ATOM 764 CD GLN A 49 12.250 8.087 -8.670 1.00 0.00 C ATOM 765 OE1 GLN A 49 12.825 7.684 -9.678 1.00 0.00 O ATOM 766 NE2 GLN A 49 10.965 8.431 -8.675 1.00 0.00 N ATOM 0 H GLN A 49 12.736 9.803 -5.308 1.00 0.00 H new ATOM 0 HA GLN A 49 15.279 8.575 -5.858 1.00 0.00 H new ATOM 0 HB2 GLN A 49 13.434 10.329 -7.551 1.00 0.00 H new ATOM 0 HB3 GLN A 49 14.700 9.277 -8.153 1.00 0.00 H new ATOM 0 HG2 GLN A 49 13.536 7.298 -7.143 1.00 0.00 H new ATOM 0 HG3 GLN A 49 12.271 8.349 -6.539 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.522 8.761 -7.818 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.423 8.364 -9.536 1.00 0.00 H new ATOM 775 N ARG A 50 15.216 11.716 -5.198 1.00 0.00 N ATOM 776 CA ARG A 50 16.052 12.888 -4.977 1.00 0.00 C ATOM 777 C ARG A 50 16.839 12.733 -3.676 1.00 0.00 C ATOM 778 O ARG A 50 17.916 13.308 -3.538 1.00 0.00 O ATOM 779 CB ARG A 50 15.189 14.158 -4.994 1.00 0.00 C ATOM 780 CG ARG A 50 14.931 14.746 -3.604 1.00 0.00 C ATOM 781 CD ARG A 50 13.917 15.884 -3.686 1.00 0.00 C ATOM 782 NE ARG A 50 14.444 17.033 -4.432 1.00 0.00 N ATOM 783 CZ ARG A 50 13.777 18.175 -4.618 1.00 0.00 C ATOM 784 NH1 ARG A 50 12.558 18.340 -4.116 1.00 0.00 N ATOM 785 NH2 ARG A 50 14.337 19.159 -5.315 1.00 0.00 N ATOM 0 H ARG A 50 14.305 11.768 -4.743 1.00 0.00 H new ATOM 0 HA ARG A 50 16.780 12.981 -5.783 1.00 0.00 H new ATOM 0 HB2 ARG A 50 15.678 14.911 -5.612 1.00 0.00 H new ATOM 0 HB3 ARG A 50 14.233 13.931 -5.466 1.00 0.00 H new ATOM 0 HG2 ARG A 50 14.561 13.968 -2.936 1.00 0.00 H new ATOM 0 HG3 ARG A 50 15.865 15.113 -3.179 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.007 15.525 -4.167 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.643 16.199 -2.679 1.00 0.00 H new ATOM 0 HE ARG A 50 15.378 16.954 -4.834 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.121 17.589 -3.581 1.00 0.00 H new ATOM 0 HH12 ARG A 50 12.059 19.217 -4.265 1.00 0.00 H new ATOM 0 HH21 ARG A 50 15.272 19.040 -5.705 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.832 20.033 -5.460 1.00 0.00 H new ATOM 799 N ILE A 51 16.303 11.958 -2.726 1.00 0.00 N ATOM 800 CA ILE A 51 16.993 11.653 -1.477 1.00 0.00 C ATOM 801 C ILE A 51 18.160 10.718 -1.783 1.00 0.00 C ATOM 802 O ILE A 51 19.298 10.984 -1.407 1.00 0.00 O ATOM 803 CB ILE A 51 16.019 10.988 -0.492 1.00 0.00 C ATOM 804 CG1 ILE A 51 14.939 11.991 -0.074 1.00 0.00 C ATOM 805 CG2 ILE A 51 16.740 10.516 0.772 1.00 0.00 C ATOM 806 CD1 ILE A 51 13.824 11.295 0.697 1.00 0.00 C ATOM 0 H ILE A 51 15.381 11.528 -2.805 1.00 0.00 H new ATOM 0 HA ILE A 51 17.368 12.570 -1.022 1.00 0.00 H new ATOM 0 HB ILE A 51 15.578 10.129 -0.997 1.00 0.00 H new ATOM 0 HG12 ILE A 51 15.382 12.772 0.544 1.00 0.00 H new ATOM 0 HG13 ILE A 51 14.527 12.478 -0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 51 16.023 10.050 1.448 1.00 0.00 H new ATOM 0 HG22 ILE A 51 17.509 9.791 0.503 1.00 0.00 H new ATOM 0 HG23 ILE A 51 17.203 11.370 1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 51 13.068 12.026 0.984 1.00 0.00 H new ATOM 0 HD12 ILE A 51 13.369 10.531 0.067 1.00 0.00 H new ATOM 0 HD13 ILE A 51 14.236 10.829 1.592 1.00 0.00 H new ATOM 818 N GLN A 52 17.869 9.614 -2.471 1.00 0.00 N ATOM 819 CA GLN A 52 18.854 8.590 -2.786 1.00 0.00 C ATOM 820 C GLN A 52 19.813 9.048 -3.879 1.00 0.00 C ATOM 821 O GLN A 52 20.641 8.267 -4.342 1.00 0.00 O ATOM 822 CB GLN A 52 18.134 7.285 -3.147 1.00 0.00 C ATOM 823 CG GLN A 52 17.334 6.799 -1.935 1.00 0.00 C ATOM 824 CD GLN A 52 18.158 6.839 -0.653 1.00 0.00 C ATOM 825 OE1 GLN A 52 19.223 6.238 -0.555 1.00 0.00 O ATOM 826 NE2 GLN A 52 17.663 7.563 0.348 1.00 0.00 N ATOM 0 H GLN A 52 16.935 9.408 -2.826 1.00 0.00 H new ATOM 0 HA GLN A 52 19.472 8.407 -1.907 1.00 0.00 H new ATOM 0 HB2 GLN A 52 17.469 7.445 -3.996 1.00 0.00 H new ATOM 0 HB3 GLN A 52 18.858 6.527 -3.447 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.446 7.419 -1.815 1.00 0.00 H new ATOM 0 HG3 GLN A 52 16.990 5.780 -2.113 1.00 0.00 H new ATOM 0 HE21 GLN A 52 16.774 8.051 0.234 1.00 0.00 H new ATOM 0 HE22 GLN A 52 18.172 7.630 1.229 1.00 0.00 H new ATOM 835 N ALA A 53 19.710 10.313 -4.298 1.00 0.00 N ATOM 836 CA ALA A 53 20.603 10.864 -5.301 1.00 0.00 C ATOM 837 C ALA A 53 22.008 11.070 -4.722 1.00 0.00 C ATOM 838 O ALA A 53 22.972 11.201 -5.477 1.00 0.00 O ATOM 839 CB ALA A 53 20.035 12.189 -5.811 1.00 0.00 C ATOM 0 H ALA A 53 19.011 10.971 -3.952 1.00 0.00 H new ATOM 0 HA ALA A 53 20.683 10.162 -6.131 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.703 12.605 -6.565 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.053 12.018 -6.252 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.943 12.889 -4.981 1.00 0.00 H new ATOM 845 N GLY A 54 22.135 11.097 -3.389 1.00 0.00 N ATOM 846 CA GLY A 54 23.425 11.248 -2.730 1.00 0.00 C ATOM 847 C GLY A 54 23.349 12.154 -1.500 1.00 0.00 C ATOM 848 O GLY A 54 24.385 12.584 -0.996 1.00 0.00 O ATOM 0 H GLY A 54 21.347 11.015 -2.746 1.00 0.00 H new ATOM 0 HA2 GLY A 54 23.795 10.267 -2.433 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.145 11.660 -3.437 1.00 0.00 H new ATOM 852 N LEU A 55 22.139 12.440 -1.013 1.00 0.00 N ATOM 853 CA LEU A 55 21.910 13.358 0.094 1.00 0.00 C ATOM 854 C LEU A 55 20.856 12.793 1.048 1.00 0.00 C ATOM 855 O LEU A 55 20.491 11.623 0.954 1.00 0.00 O ATOM 856 CB LEU A 55 21.519 14.721 -0.487 1.00 0.00 C ATOM 857 CG LEU A 55 20.310 14.654 -1.429 1.00 0.00 C ATOM 858 CD1 LEU A 55 18.993 14.457 -0.683 1.00 0.00 C ATOM 859 CD2 LEU A 55 20.230 15.960 -2.208 1.00 0.00 C ATOM 0 H LEU A 55 21.282 12.032 -1.385 1.00 0.00 H new ATOM 0 HA LEU A 55 22.815 13.485 0.687 1.00 0.00 H new ATOM 0 HB2 LEU A 55 21.296 15.407 0.331 1.00 0.00 H new ATOM 0 HB3 LEU A 55 22.370 15.135 -1.028 1.00 0.00 H new ATOM 0 HG LEU A 55 20.451 13.796 -2.086 1.00 0.00 H new ATOM 0 HD11 LEU A 55 18.172 14.417 -1.399 1.00 0.00 H new ATOM 0 HD12 LEU A 55 19.030 13.524 -0.120 1.00 0.00 H new ATOM 0 HD13 LEU A 55 18.836 15.289 0.003 1.00 0.00 H new ATOM 0 HD21 LEU A 55 19.375 15.929 -2.883 1.00 0.00 H new ATOM 0 HD22 LEU A 55 20.114 16.792 -1.513 1.00 0.00 H new ATOM 0 HD23 LEU A 55 21.144 16.095 -2.786 1.00 0.00 H new ATOM 871 N THR A 56 20.358 13.622 1.969 1.00 0.00 N ATOM 872 CA THR A 56 19.295 13.227 2.882 1.00 0.00 C ATOM 873 C THR A 56 18.297 14.369 3.066 1.00 0.00 C ATOM 874 O THR A 56 18.571 15.509 2.690 1.00 0.00 O ATOM 875 CB THR A 56 19.883 12.794 4.230 1.00 0.00 C ATOM 876 OG1 THR A 56 20.665 13.833 4.780 1.00 0.00 O ATOM 877 CG2 THR A 56 20.762 11.557 4.058 1.00 0.00 C ATOM 0 H THR A 56 20.682 14.580 2.098 1.00 0.00 H new ATOM 0 HA THR A 56 18.764 12.378 2.452 1.00 0.00 H new ATOM 0 HB THR A 56 19.054 12.563 4.899 1.00 0.00 H new ATOM 0 HG1 THR A 56 21.033 13.545 5.641 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.171 11.264 5.025 1.00 0.00 H new ATOM 0 HG22 THR A 56 20.165 10.740 3.654 1.00 0.00 H new ATOM 0 HG23 THR A 56 21.579 11.783 3.372 1.00 0.00 H new ATOM 885 N ALA A 57 17.139 14.057 3.651 1.00 0.00 N ATOM 886 CA ALA A 57 16.084 15.023 3.932 1.00 0.00 C ATOM 887 C ALA A 57 16.614 16.189 4.770 1.00 0.00 C ATOM 888 O ALA A 57 17.564 16.018 5.534 1.00 0.00 O ATOM 889 CB ALA A 57 14.983 14.297 4.702 1.00 0.00 C ATOM 0 H ALA A 57 16.907 13.109 3.947 1.00 0.00 H new ATOM 0 HA ALA A 57 15.704 15.433 2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 57 14.177 14.995 4.928 1.00 0.00 H new ATOM 0 HB2 ALA A 57 14.595 13.478 4.097 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.390 13.900 5.632 1.00 0.00 H new ATOM 895 N PRO A 58 16.012 17.380 4.637 1.00 0.00 N ATOM 896 CA PRO A 58 16.307 18.540 5.463 1.00 0.00 C ATOM 897 C PRO A 58 16.332 18.242 6.955 1.00 0.00 C ATOM 898 O PRO A 58 17.079 18.886 7.689 1.00 0.00 O ATOM 899 CB PRO A 58 15.162 19.499 5.195 1.00 0.00 C ATOM 900 CG PRO A 58 14.774 19.198 3.748 1.00 0.00 C ATOM 901 CD PRO A 58 14.991 17.689 3.655 1.00 0.00 C ATOM 0 HA PRO A 58 17.298 18.921 5.215 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.329 19.330 5.877 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.470 20.537 5.320 1.00 0.00 H new ATOM 0 HG2 PRO A 58 13.740 19.473 3.539 1.00 0.00 H new ATOM 0 HG3 PRO A 58 15.398 19.742 3.039 1.00 0.00 H new ATOM 0 HD2 PRO A 58 14.069 17.147 3.865 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.310 17.400 2.654 1.00 0.00 H new ATOM 909 N ASP A 59 15.518 17.277 7.392 1.00 0.00 N ATOM 910 CA ASP A 59 15.474 16.781 8.760 1.00 0.00 C ATOM 911 C ASP A 59 15.074 17.818 9.817 1.00 0.00 C ATOM 912 O ASP A 59 14.853 17.457 10.971 1.00 0.00 O ATOM 913 CB ASP A 59 16.842 16.173 9.049 1.00 0.00 C ATOM 914 CG ASP A 59 16.890 15.458 10.395 1.00 0.00 C ATOM 915 OD1 ASP A 59 16.226 14.403 10.512 1.00 0.00 O ATOM 916 OD2 ASP A 59 17.588 15.971 11.295 1.00 0.00 O ATOM 0 H ASP A 59 14.852 16.808 6.779 1.00 0.00 H new ATOM 0 HA ASP A 59 14.676 16.042 8.833 1.00 0.00 H new ATOM 0 HB2 ASP A 59 17.098 15.468 8.258 1.00 0.00 H new ATOM 0 HB3 ASP A 59 17.597 16.959 9.032 1.00 0.00 H new ATOM 1635 N MET C 1 1.731 7.131 12.566 1.00 0.00 N ATOM 1636 CA MET C 1 1.505 6.592 11.210 1.00 0.00 C ATOM 1637 C MET C 1 1.716 7.689 10.175 1.00 0.00 C ATOM 1638 O MET C 1 1.227 8.797 10.368 1.00 0.00 O ATOM 1639 CB MET C 1 0.095 6.008 11.095 1.00 0.00 C ATOM 1640 CG MET C 1 0.005 5.068 9.892 1.00 0.00 C ATOM 1641 SD MET C 1 -1.546 4.141 9.761 1.00 0.00 S ATOM 1642 CE MET C 1 -2.701 5.497 9.468 1.00 0.00 C ATOM 0 H1 MET C 1 0.955 6.834 13.192 1.00 0.00 H new ATOM 0 H2 MET C 1 2.633 6.770 12.937 1.00 0.00 H new ATOM 0 H3 MET C 1 1.764 8.170 12.526 1.00 0.00 H new ATOM 0 HA MET C 1 2.221 5.792 11.024 1.00 0.00 H new ATOM 0 HB2 MET C 1 -0.157 5.467 12.007 1.00 0.00 H new ATOM 0 HB3 MET C 1 -0.632 6.813 10.991 1.00 0.00 H new ATOM 0 HG2 MET C 1 0.140 5.653 8.982 1.00 0.00 H new ATOM 0 HG3 MET C 1 0.832 4.359 9.941 1.00 0.00 H new ATOM 0 HE1 MET C 1 -3.687 5.092 9.240 1.00 0.00 H new ATOM 0 HE2 MET C 1 -2.762 6.122 10.359 1.00 0.00 H new ATOM 0 HE3 MET C 1 -2.352 6.097 8.628 1.00 0.00 H new ATOM 1654 N LEU C 2 2.437 7.389 9.088 1.00 0.00 N ATOM 1655 CA LEU C 2 2.726 8.359 8.039 1.00 0.00 C ATOM 1656 C LEU C 2 1.602 8.319 6.996 1.00 0.00 C ATOM 1657 O LEU C 2 1.205 7.242 6.563 1.00 0.00 O ATOM 1658 CB LEU C 2 4.082 7.978 7.421 1.00 0.00 C ATOM 1659 CG LEU C 2 4.862 9.115 6.730 1.00 0.00 C ATOM 1660 CD1 LEU C 2 5.806 8.511 5.697 1.00 0.00 C ATOM 1661 CD2 LEU C 2 3.995 10.162 6.042 1.00 0.00 C ATOM 0 H LEU C 2 2.834 6.465 8.916 1.00 0.00 H new ATOM 0 HA LEU C 2 2.779 9.375 8.431 1.00 0.00 H new ATOM 0 HB2 LEU C 2 4.711 7.560 8.207 1.00 0.00 H new ATOM 0 HB3 LEU C 2 3.915 7.185 6.692 1.00 0.00 H new ATOM 0 HG LEU C 2 5.394 9.636 7.526 1.00 0.00 H new ATOM 0 HD11 LEU C 2 6.362 9.308 5.203 1.00 0.00 H new ATOM 0 HD12 LEU C 2 6.503 7.835 6.192 1.00 0.00 H new ATOM 0 HD13 LEU C 2 5.229 7.958 4.956 1.00 0.00 H new ATOM 0 HD21 LEU C 2 4.632 10.919 5.586 1.00 0.00 H new ATOM 0 HD22 LEU C 2 3.390 9.684 5.271 1.00 0.00 H new ATOM 0 HD23 LEU C 2 3.341 10.633 6.776 1.00 0.00 H new ATOM 1673 N ILE C 3 1.089 9.483 6.595 1.00 0.00 N ATOM 1674 CA ILE C 3 0.053 9.595 5.571 1.00 0.00 C ATOM 1675 C ILE C 3 0.575 10.433 4.418 1.00 0.00 C ATOM 1676 O ILE C 3 1.380 11.339 4.618 1.00 0.00 O ATOM 1677 CB ILE C 3 -1.227 10.231 6.139 1.00 0.00 C ATOM 1678 CG1 ILE C 3 -2.029 9.243 6.990 1.00 0.00 C ATOM 1679 CG2 ILE C 3 -2.173 10.683 5.022 1.00 0.00 C ATOM 1680 CD1 ILE C 3 -1.472 9.078 8.396 1.00 0.00 C ATOM 0 H ILE C 3 1.385 10.382 6.976 1.00 0.00 H new ATOM 0 HA ILE C 3 -0.196 8.593 5.221 1.00 0.00 H new ATOM 0 HB ILE C 3 -0.885 11.075 6.738 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -3.063 9.582 7.053 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -2.042 8.272 6.494 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -3.067 11.128 5.460 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -1.671 11.420 4.396 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -2.456 9.823 4.415 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -2.084 8.365 8.949 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -0.447 8.710 8.341 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -1.485 10.040 8.908 1.00 0.00 H new ATOM 1692 N LEU C 4 0.105 10.120 3.211 1.00 0.00 N ATOM 1693 CA LEU C 4 0.414 10.869 2.003 1.00 0.00 C ATOM 1694 C LEU C 4 -0.810 10.854 1.096 1.00 0.00 C ATOM 1695 O LEU C 4 -1.757 10.100 1.322 1.00 0.00 O ATOM 1696 CB LEU C 4 1.623 10.251 1.284 1.00 0.00 C ATOM 1697 CG LEU C 4 2.938 10.425 2.051 1.00 0.00 C ATOM 1698 CD1 LEU C 4 4.070 9.731 1.296 1.00 0.00 C ATOM 1699 CD2 LEU C 4 3.326 11.897 2.178 1.00 0.00 C ATOM 0 H LEU C 4 -0.512 9.324 3.047 1.00 0.00 H new ATOM 0 HA LEU C 4 0.668 11.897 2.261 1.00 0.00 H new ATOM 0 HB2 LEU C 4 1.440 9.188 1.128 1.00 0.00 H new ATOM 0 HB3 LEU C 4 1.722 10.706 0.298 1.00 0.00 H new ATOM 0 HG LEU C 4 2.789 9.995 3.042 1.00 0.00 H new ATOM 0 HD11 LEU C 4 5.004 9.857 1.844 1.00 0.00 H new ATOM 0 HD12 LEU C 4 3.846 8.669 1.200 1.00 0.00 H new ATOM 0 HD13 LEU C 4 4.170 10.172 0.304 1.00 0.00 H new ATOM 0 HD21 LEU C 4 4.264 11.980 2.728 1.00 0.00 H new ATOM 0 HD22 LEU C 4 3.449 12.328 1.184 1.00 0.00 H new ATOM 0 HD23 LEU C 4 2.543 12.435 2.713 1.00 0.00 H new ATOM 1711 N THR C 5 -0.789 11.693 0.061 1.00 0.00 N ATOM 1712 CA THR C 5 -1.880 11.814 -0.888 1.00 0.00 C ATOM 1713 C THR C 5 -1.288 11.682 -2.284 1.00 0.00 C ATOM 1714 O THR C 5 -0.222 12.220 -2.563 1.00 0.00 O ATOM 1715 CB THR C 5 -2.578 13.156 -0.680 1.00 0.00 C ATOM 1716 OG1 THR C 5 -3.081 13.211 0.638 1.00 0.00 O ATOM 1717 CG2 THR C 5 -3.747 13.369 -1.640 1.00 0.00 C ATOM 0 H THR C 5 -0.003 12.312 -0.139 1.00 0.00 H new ATOM 0 HA THR C 5 -2.631 11.036 -0.749 1.00 0.00 H new ATOM 0 HB THR C 5 -1.839 13.935 -0.868 1.00 0.00 H new ATOM 0 HG1 THR C 5 -3.530 14.070 0.781 1.00 0.00 H new ATOM 0 HG21 THR C 5 -4.205 14.339 -1.446 1.00 0.00 H new ATOM 0 HG22 THR C 5 -3.384 13.338 -2.667 1.00 0.00 H new ATOM 0 HG23 THR C 5 -4.487 12.582 -1.492 1.00 0.00 H new ATOM 1725 N ARG C 6 -1.984 10.962 -3.162 1.00 0.00 N ATOM 1726 CA ARG C 6 -1.481 10.645 -4.492 1.00 0.00 C ATOM 1727 C ARG C 6 -2.602 10.764 -5.510 1.00 0.00 C ATOM 1728 O ARG C 6 -3.760 10.976 -5.151 1.00 0.00 O ATOM 1729 CB ARG C 6 -0.917 9.218 -4.492 1.00 0.00 C ATOM 1730 CG ARG C 6 0.429 9.099 -3.766 1.00 0.00 C ATOM 1731 CD ARG C 6 1.609 9.361 -4.705 1.00 0.00 C ATOM 1732 NE ARG C 6 1.544 10.676 -5.351 1.00 0.00 N ATOM 1733 CZ ARG C 6 1.981 11.821 -4.827 1.00 0.00 C ATOM 1734 NH1 ARG C 6 2.523 11.868 -3.611 1.00 0.00 N ATOM 1735 NH2 ARG C 6 1.869 12.942 -5.534 1.00 0.00 N ATOM 0 H ARG C 6 -2.911 10.584 -2.969 1.00 0.00 H new ATOM 0 HA ARG C 6 -0.690 11.346 -4.760 1.00 0.00 H new ATOM 0 HB2 ARG C 6 -1.637 8.550 -4.020 1.00 0.00 H new ATOM 0 HB3 ARG C 6 -0.798 8.882 -5.522 1.00 0.00 H new ATOM 0 HG2 ARG C 6 0.459 9.808 -2.939 1.00 0.00 H new ATOM 0 HG3 ARG C 6 0.522 8.102 -3.335 1.00 0.00 H new ATOM 0 HD2 ARG C 6 2.539 9.284 -4.142 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.636 8.586 -5.471 1.00 0.00 H new ATOM 0 HE ARG C 6 1.129 10.718 -6.282 1.00 0.00 H new ATOM 0 HH11 ARG C 6 2.611 11.015 -3.059 1.00 0.00 H new ATOM 0 HH12 ARG C 6 2.850 12.757 -3.232 1.00 0.00 H new ATOM 0 HH21 ARG C 6 1.453 12.918 -6.465 1.00 0.00 H new ATOM 0 HH22 ARG C 6 2.199 13.825 -5.145 1.00 0.00 H new ATOM 1749 N LYS C 7 -2.251 10.622 -6.786 1.00 0.00 N ATOM 1750 CA LYS C 7 -3.205 10.653 -7.877 1.00 0.00 C ATOM 1751 C LYS C 7 -3.092 9.332 -8.630 1.00 0.00 C ATOM 1752 O LYS C 7 -2.057 8.669 -8.549 1.00 0.00 O ATOM 1753 CB LYS C 7 -2.904 11.822 -8.822 1.00 0.00 C ATOM 1754 CG LYS C 7 -2.343 13.091 -8.169 1.00 0.00 C ATOM 1755 CD LYS C 7 -3.394 13.852 -7.364 1.00 0.00 C ATOM 1756 CE LYS C 7 -2.753 15.051 -6.657 1.00 0.00 C ATOM 1757 NZ LYS C 7 -2.246 16.046 -7.625 1.00 0.00 N ATOM 0 H LYS C 7 -1.287 10.481 -7.088 1.00 0.00 H new ATOM 0 HA LYS C 7 -4.214 10.789 -7.488 1.00 0.00 H new ATOM 0 HB2 LYS C 7 -2.193 11.480 -9.574 1.00 0.00 H new ATOM 0 HB3 LYS C 7 -3.823 12.084 -9.347 1.00 0.00 H new ATOM 0 HG2 LYS C 7 -1.514 12.822 -7.514 1.00 0.00 H new ATOM 0 HG3 LYS C 7 -1.939 13.745 -8.942 1.00 0.00 H new ATOM 0 HD2 LYS C 7 -4.191 14.193 -8.024 1.00 0.00 H new ATOM 0 HD3 LYS C 7 -3.851 13.189 -6.629 1.00 0.00 H new ATOM 0 HE2 LYS C 7 -3.485 15.521 -6.001 1.00 0.00 H new ATOM 0 HE3 LYS C 7 -1.934 14.707 -6.026 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 -2.006 16.926 -7.125 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 -1.397 15.672 -8.095 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 -2.978 16.241 -8.338 1.00 0.00 H new ATOM 1771 N VAL C 8 -4.142 8.949 -9.355 1.00 0.00 N ATOM 1772 CA VAL C 8 -4.140 7.725 -10.142 1.00 0.00 C ATOM 1773 C VAL C 8 -2.954 7.746 -11.102 1.00 0.00 C ATOM 1774 O VAL C 8 -2.897 8.587 -11.997 1.00 0.00 O ATOM 1775 CB VAL C 8 -5.461 7.617 -10.903 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -5.406 6.430 -11.859 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -6.612 7.431 -9.915 1.00 0.00 C ATOM 0 H VAL C 8 -5.012 9.478 -9.411 1.00 0.00 H new ATOM 0 HA VAL C 8 -4.042 6.855 -9.492 1.00 0.00 H new ATOM 0 HB VAL C 8 -5.623 8.531 -11.474 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -6.349 6.355 -12.401 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -4.591 6.572 -12.568 1.00 0.00 H new ATOM 0 HG13 VAL C 8 -5.239 5.514 -11.292 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -7.552 7.354 -10.462 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -6.453 6.520 -9.338 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -6.654 8.286 -9.240 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.007 6.821 -10.914 1.00 0.00 N ATOM 1788 CA GLY C 9 -0.842 6.709 -11.781 1.00 0.00 C ATOM 1789 C GLY C 9 0.455 7.107 -11.080 1.00 0.00 C ATOM 1790 O GLY C 9 1.480 7.251 -11.746 1.00 0.00 O ATOM 0 H GLY C 9 -2.031 6.135 -10.159 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -0.757 5.683 -12.138 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -0.985 7.340 -12.658 1.00 0.00 H new ATOM 1794 N GLU C 10 0.424 7.289 -9.755 1.00 0.00 N ATOM 1795 CA GLU C 10 1.605 7.683 -8.991 1.00 0.00 C ATOM 1796 C GLU C 10 1.947 6.632 -7.938 1.00 0.00 C ATOM 1797 O GLU C 10 1.215 5.655 -7.769 1.00 0.00 O ATOM 1798 CB GLU C 10 1.379 9.062 -8.364 1.00 0.00 C ATOM 1799 CG GLU C 10 1.119 10.107 -9.453 1.00 0.00 C ATOM 1800 CD GLU C 10 1.013 11.515 -8.872 1.00 0.00 C ATOM 1801 OE1 GLU C 10 0.592 11.623 -7.700 1.00 0.00 O ATOM 1802 OE2 GLU C 10 1.354 12.472 -9.605 1.00 0.00 O ATOM 0 H GLU C 10 -0.416 7.168 -9.189 1.00 0.00 H new ATOM 0 HA GLU C 10 2.460 7.751 -9.664 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.532 9.023 -7.679 1.00 0.00 H new ATOM 0 HB3 GLU C 10 2.251 9.349 -7.776 1.00 0.00 H new ATOM 0 HG2 GLU C 10 1.925 10.076 -10.187 1.00 0.00 H new ATOM 0 HG3 GLU C 10 0.198 9.861 -9.981 1.00 0.00 H new ATOM 1809 N SER C 11 3.061 6.822 -7.226 1.00 0.00 N ATOM 1810 CA SER C 11 3.606 5.793 -6.350 1.00 0.00 C ATOM 1811 C SER C 11 4.278 6.369 -5.104 1.00 0.00 C ATOM 1812 O SER C 11 4.518 7.573 -5.014 1.00 0.00 O ATOM 1813 CB SER C 11 4.636 4.996 -7.157 1.00 0.00 C ATOM 1814 OG SER C 11 4.030 4.343 -8.251 1.00 0.00 O ATOM 0 H SER C 11 3.603 7.686 -7.243 1.00 0.00 H new ATOM 0 HA SER C 11 2.785 5.167 -6.002 1.00 0.00 H new ATOM 0 HB2 SER C 11 5.417 5.665 -7.517 1.00 0.00 H new ATOM 0 HB3 SER C 11 5.118 4.261 -6.512 1.00 0.00 H new ATOM 0 HG SER C 11 4.711 3.856 -8.760 1.00 0.00 H new ATOM 1820 N ILE C 12 4.578 5.485 -4.144 1.00 0.00 N ATOM 1821 CA ILE C 12 5.254 5.780 -2.882 1.00 0.00 C ATOM 1822 C ILE C 12 6.335 4.714 -2.669 1.00 0.00 C ATOM 1823 O ILE C 12 6.333 3.698 -3.359 1.00 0.00 O ATOM 1824 CB ILE C 12 4.245 5.779 -1.722 1.00 0.00 C ATOM 1825 CG1 ILE C 12 3.088 6.765 -1.946 1.00 0.00 C ATOM 1826 CG2 ILE C 12 4.925 6.121 -0.394 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.539 8.227 -1.951 1.00 0.00 C ATOM 0 H ILE C 12 4.343 4.497 -4.235 1.00 0.00 H new ATOM 0 HA ILE C 12 5.710 6.770 -2.915 1.00 0.00 H new ATOM 0 HB ILE C 12 3.839 4.768 -1.684 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.603 6.537 -2.895 1.00 0.00 H new ATOM 0 HG13 ILE C 12 2.341 6.624 -1.164 1.00 0.00 H new ATOM 0 HG21 ILE C 12 4.185 6.112 0.406 1.00 0.00 H new ATOM 0 HG22 ILE C 12 5.699 5.384 -0.181 1.00 0.00 H new ATOM 0 HG23 ILE C 12 5.376 7.111 -0.460 1.00 0.00 H new ATOM 0 HD11 ILE C 12 2.676 8.873 -2.114 1.00 0.00 H new ATOM 0 HD12 ILE C 12 3.998 8.469 -0.993 1.00 0.00 H new ATOM 0 HD13 ILE C 12 4.264 8.381 -2.750 1.00 0.00 H new ATOM 1839 N ASN C 13 7.254 4.927 -1.726 1.00 0.00 N ATOM 1840 CA ASN C 13 8.397 4.052 -1.544 1.00 0.00 C ATOM 1841 C ASN C 13 8.627 3.731 -0.066 1.00 0.00 C ATOM 1842 O ASN C 13 8.359 4.559 0.807 1.00 0.00 O ATOM 1843 CB ASN C 13 9.612 4.742 -2.164 1.00 0.00 C ATOM 1844 CG ASN C 13 10.741 3.766 -2.468 1.00 0.00 C ATOM 1845 OD1 ASN C 13 11.324 3.169 -1.570 1.00 0.00 O ATOM 1846 ND2 ASN C 13 11.052 3.599 -3.747 1.00 0.00 N ATOM 0 H ASN C 13 7.221 5.710 -1.073 1.00 0.00 H new ATOM 0 HA ASN C 13 8.219 3.096 -2.036 1.00 0.00 H new ATOM 0 HB2 ASN C 13 9.311 5.244 -3.084 1.00 0.00 H new ATOM 0 HB3 ASN C 13 9.975 5.513 -1.484 1.00 0.00 H new ATOM 0 HD21 ASN C 13 11.799 2.956 -4.011 1.00 0.00 H new ATOM 0 HD22 ASN C 13 10.544 4.113 -4.467 1.00 0.00 H new ATOM 1853 N ILE C 14 9.128 2.522 0.199 1.00 0.00 N ATOM 1854 CA ILE C 14 9.423 2.036 1.544 1.00 0.00 C ATOM 1855 C ILE C 14 10.734 1.253 1.542 1.00 0.00 C ATOM 1856 O ILE C 14 11.060 0.559 0.577 1.00 0.00 O ATOM 1857 CB ILE C 14 8.276 1.139 2.038 1.00 0.00 C ATOM 1858 CG1 ILE C 14 6.954 1.918 2.048 1.00 0.00 C ATOM 1859 CG2 ILE C 14 8.594 0.603 3.443 1.00 0.00 C ATOM 1860 CD1 ILE C 14 5.769 1.062 2.499 1.00 0.00 C ATOM 0 H ILE C 14 9.343 1.843 -0.531 1.00 0.00 H new ATOM 0 HA ILE C 14 9.523 2.889 2.216 1.00 0.00 H new ATOM 0 HB ILE C 14 8.172 0.295 1.356 1.00 0.00 H new ATOM 0 HG12 ILE C 14 7.049 2.778 2.711 1.00 0.00 H new ATOM 0 HG13 ILE C 14 6.758 2.306 1.048 1.00 0.00 H new ATOM 0 HG21 ILE C 14 7.776 -0.031 3.784 1.00 0.00 H new ATOM 0 HG22 ILE C 14 9.515 0.021 3.411 1.00 0.00 H new ATOM 0 HG23 ILE C 14 8.717 1.439 4.132 1.00 0.00 H new ATOM 0 HD11 ILE C 14 4.860 1.664 2.487 1.00 0.00 H new ATOM 0 HD12 ILE C 14 5.653 0.216 1.822 1.00 0.00 H new ATOM 0 HD13 ILE C 14 5.948 0.696 3.510 1.00 0.00 H new ATOM 1872 N GLY C 15 11.489 1.365 2.639 1.00 0.00 N ATOM 1873 CA GLY C 15 12.740 0.646 2.802 1.00 0.00 C ATOM 1874 C GLY C 15 13.698 0.967 1.663 1.00 0.00 C ATOM 1875 O GLY C 15 13.844 2.123 1.263 1.00 0.00 O ATOM 0 H GLY C 15 11.244 1.957 3.433 1.00 0.00 H new ATOM 0 HA2 GLY C 15 13.197 0.913 3.755 1.00 0.00 H new ATOM 0 HA3 GLY C 15 12.548 -0.427 2.831 1.00 0.00 H new ATOM 1879 N ASP C 16 14.347 -0.073 1.142 1.00 0.00 N ATOM 1880 CA ASP C 16 15.287 0.025 0.036 1.00 0.00 C ATOM 1881 C ASP C 16 14.938 -1.017 -1.030 1.00 0.00 C ATOM 1882 O ASP C 16 15.693 -1.212 -1.984 1.00 0.00 O ATOM 1883 CB ASP C 16 16.714 -0.174 0.553 1.00 0.00 C ATOM 1884 CG ASP C 16 17.112 0.891 1.574 1.00 0.00 C ATOM 1885 OD1 ASP C 16 16.834 0.669 2.776 1.00 0.00 O ATOM 1886 OD2 ASP C 16 17.690 1.914 1.148 1.00 0.00 O ATOM 0 H ASP C 16 14.229 -1.026 1.487 1.00 0.00 H new ATOM 0 HA ASP C 16 15.222 1.014 -0.417 1.00 0.00 H new ATOM 0 HB2 ASP C 16 16.799 -1.161 1.008 1.00 0.00 H new ATOM 0 HB3 ASP C 16 17.409 -0.148 -0.286 1.00 0.00 H new ATOM 1891 N ASP C 17 13.792 -1.691 -0.871 1.00 0.00 N ATOM 1892 CA ASP C 17 13.399 -2.802 -1.724 1.00 0.00 C ATOM 1893 C ASP C 17 11.887 -2.869 -1.950 1.00 0.00 C ATOM 1894 O ASP C 17 11.400 -3.862 -2.490 1.00 0.00 O ATOM 1895 CB ASP C 17 13.890 -4.105 -1.084 1.00 0.00 C ATOM 1896 CG ASP C 17 13.128 -4.458 0.195 1.00 0.00 C ATOM 1897 OD1 ASP C 17 13.171 -3.642 1.143 1.00 0.00 O ATOM 1898 OD2 ASP C 17 12.509 -5.545 0.211 1.00 0.00 O ATOM 0 H ASP C 17 13.113 -1.474 -0.141 1.00 0.00 H new ATOM 0 HA ASP C 17 13.854 -2.653 -2.703 1.00 0.00 H new ATOM 0 HB2 ASP C 17 13.785 -4.919 -1.801 1.00 0.00 H new ATOM 0 HB3 ASP C 17 14.952 -4.016 -0.856 1.00 0.00 H new ATOM 1903 N ILE C 18 11.135 -1.839 -1.551 1.00 0.00 N ATOM 1904 CA ILE C 18 9.681 -1.871 -1.663 1.00 0.00 C ATOM 1905 C ILE C 18 9.148 -0.568 -2.248 1.00 0.00 C ATOM 1906 O ILE C 18 9.643 0.516 -1.939 1.00 0.00 O ATOM 1907 CB ILE C 18 9.072 -2.117 -0.273 1.00 0.00 C ATOM 1908 CG1 ILE C 18 9.575 -3.446 0.297 1.00 0.00 C ATOM 1909 CG2 ILE C 18 7.542 -2.123 -0.337 1.00 0.00 C ATOM 1910 CD1 ILE C 18 9.318 -3.533 1.800 1.00 0.00 C ATOM 0 H ILE C 18 11.510 -0.979 -1.150 1.00 0.00 H new ATOM 0 HA ILE C 18 9.398 -2.680 -2.337 1.00 0.00 H new ATOM 0 HB ILE C 18 9.385 -1.304 0.382 1.00 0.00 H new ATOM 0 HG12 ILE C 18 9.077 -4.274 -0.209 1.00 0.00 H new ATOM 0 HG13 ILE C 18 10.642 -3.548 0.101 1.00 0.00 H new ATOM 0 HG21 ILE C 18 7.137 -2.299 0.659 1.00 0.00 H new ATOM 0 HG22 ILE C 18 7.190 -1.160 -0.707 1.00 0.00 H new ATOM 0 HG23 ILE C 18 7.209 -2.914 -1.009 1.00 0.00 H new ATOM 0 HD11 ILE C 18 9.685 -4.487 2.177 1.00 0.00 H new ATOM 0 HD12 ILE C 18 9.837 -2.719 2.306 1.00 0.00 H new ATOM 0 HD13 ILE C 18 8.248 -3.455 1.991 1.00 0.00 H new ATOM 1922 N THR C 19 8.129 -0.685 -3.102 1.00 0.00 N ATOM 1923 CA THR C 19 7.471 0.458 -3.721 1.00 0.00 C ATOM 1924 C THR C 19 5.989 0.135 -3.869 1.00 0.00 C ATOM 1925 O THR C 19 5.632 -1.033 -4.001 1.00 0.00 O ATOM 1926 CB THR C 19 8.112 0.752 -5.083 1.00 0.00 C ATOM 1927 OG1 THR C 19 9.521 0.695 -4.994 1.00 0.00 O ATOM 1928 CG2 THR C 19 7.738 2.141 -5.595 1.00 0.00 C ATOM 0 H THR C 19 7.737 -1.584 -3.383 1.00 0.00 H new ATOM 0 HA THR C 19 7.585 1.348 -3.102 1.00 0.00 H new ATOM 0 HB THR C 19 7.738 -0.006 -5.772 1.00 0.00 H new ATOM 0 HG1 THR C 19 9.912 0.884 -5.872 1.00 0.00 H new ATOM 0 HG21 THR C 19 8.211 2.312 -6.562 1.00 0.00 H new ATOM 0 HG22 THR C 19 6.656 2.209 -5.704 1.00 0.00 H new ATOM 0 HG23 THR C 19 8.080 2.895 -4.885 1.00 0.00 H new ATOM 1936 N ILE C 20 5.127 1.156 -3.853 1.00 0.00 N ATOM 1937 CA ILE C 20 3.674 0.974 -3.857 1.00 0.00 C ATOM 1938 C ILE C 20 3.060 1.909 -4.891 1.00 0.00 C ATOM 1939 O ILE C 20 3.610 2.979 -5.145 1.00 0.00 O ATOM 1940 CB ILE C 20 3.117 1.279 -2.456 1.00 0.00 C ATOM 1941 CG1 ILE C 20 3.910 0.585 -1.338 1.00 0.00 C ATOM 1942 CG2 ILE C 20 1.648 0.865 -2.379 1.00 0.00 C ATOM 1943 CD1 ILE C 20 3.779 -0.939 -1.349 1.00 0.00 C ATOM 0 H ILE C 20 5.418 2.133 -3.837 1.00 0.00 H new ATOM 0 HA ILE C 20 3.424 -0.055 -4.115 1.00 0.00 H new ATOM 0 HB ILE C 20 3.214 2.354 -2.301 1.00 0.00 H new ATOM 0 HG12 ILE C 20 4.963 0.851 -1.432 1.00 0.00 H new ATOM 0 HG13 ILE C 20 3.570 0.964 -0.374 1.00 0.00 H new ATOM 0 HG21 ILE C 20 1.260 1.084 -1.384 1.00 0.00 H new ATOM 0 HG22 ILE C 20 1.074 1.419 -3.122 1.00 0.00 H new ATOM 0 HG23 ILE C 20 1.560 -0.204 -2.576 1.00 0.00 H new ATOM 0 HD11 ILE C 20 4.365 -1.360 -0.532 1.00 0.00 H new ATOM 0 HD12 ILE C 20 2.732 -1.215 -1.224 1.00 0.00 H new ATOM 0 HD13 ILE C 20 4.146 -1.329 -2.298 1.00 0.00 H new ATOM 1955 N THR C 21 1.924 1.526 -5.497 1.00 0.00 N ATOM 1956 CA THR C 21 1.326 2.300 -6.581 1.00 0.00 C ATOM 1957 C THR C 21 -0.198 2.300 -6.495 1.00 0.00 C ATOM 1958 O THR C 21 -0.800 1.359 -5.981 1.00 0.00 O ATOM 1959 CB THR C 21 1.767 1.690 -7.917 1.00 0.00 C ATOM 1960 OG1 THR C 21 3.176 1.620 -7.975 1.00 0.00 O ATOM 1961 CG2 THR C 21 1.292 2.508 -9.116 1.00 0.00 C ATOM 0 H THR C 21 1.406 0.683 -5.249 1.00 0.00 H new ATOM 0 HA THR C 21 1.662 3.334 -6.500 1.00 0.00 H new ATOM 0 HB THR C 21 1.319 0.698 -7.968 1.00 0.00 H new ATOM 0 HG1 THR C 21 3.545 2.524 -8.056 1.00 0.00 H new ATOM 0 HG21 THR C 21 1.630 2.034 -10.037 1.00 0.00 H new ATOM 0 HG22 THR C 21 0.203 2.559 -9.113 1.00 0.00 H new ATOM 0 HG23 THR C 21 1.703 3.516 -9.055 1.00 0.00 H new ATOM 1969 N ILE C 22 -0.824 3.370 -7.001 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.273 3.505 -7.096 1.00 0.00 C ATOM 1971 C ILE C 22 -2.663 3.413 -8.572 1.00 0.00 C ATOM 1972 O ILE C 22 -2.540 4.380 -9.325 1.00 0.00 O ATOM 1973 CB ILE C 22 -2.739 4.804 -6.416 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -4.211 5.117 -6.709 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -1.894 6.016 -6.816 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -5.123 4.010 -6.189 1.00 0.00 C ATOM 0 H ILE C 22 -0.321 4.181 -7.362 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.780 2.700 -6.563 1.00 0.00 H new ATOM 0 HB ILE C 22 -2.613 4.623 -5.348 1.00 0.00 H new ATOM 0 HG12 ILE C 22 -4.484 6.065 -6.245 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -4.354 5.235 -7.783 1.00 0.00 H new ATOM 0 HG21 ILE C 22 -2.268 6.904 -6.307 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.855 5.845 -6.533 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -1.956 6.163 -7.894 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -6.161 4.259 -6.411 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -4.864 3.068 -6.673 1.00 0.00 H new ATOM 0 HD13 ILE C 22 -4.996 3.911 -5.111 1.00 0.00 H new ATOM 1988 N LEU C 23 -3.134 2.236 -8.988 1.00 0.00 N ATOM 1989 CA LEU C 23 -3.434 1.966 -10.387 1.00 0.00 C ATOM 1990 C LEU C 23 -4.713 2.671 -10.837 1.00 0.00 C ATOM 1991 O LEU C 23 -4.871 2.968 -12.019 1.00 0.00 O ATOM 1992 CB LEU C 23 -3.593 0.460 -10.588 1.00 0.00 C ATOM 1993 CG LEU C 23 -2.420 -0.343 -10.021 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -2.668 -1.817 -10.308 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -1.084 0.063 -10.630 1.00 0.00 C ATOM 0 H LEU C 23 -3.316 1.449 -8.365 1.00 0.00 H new ATOM 0 HA LEU C 23 -2.608 2.347 -10.988 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -4.516 0.130 -10.112 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -3.690 0.249 -11.653 1.00 0.00 H new ATOM 0 HG LEU C 23 -2.362 -0.145 -8.951 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -1.843 -2.409 -9.912 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -3.598 -2.129 -9.833 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -2.741 -1.971 -11.385 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -0.287 -0.538 -10.192 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -1.111 -0.100 -11.707 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -0.897 1.117 -10.427 1.00 0.00 H new ATOM 2007 N GLY C 24 -5.622 2.935 -9.896 1.00 0.00 N ATOM 2008 CA GLY C 24 -6.861 3.633 -10.198 1.00 0.00 C ATOM 2009 C GLY C 24 -7.913 3.445 -9.115 1.00 0.00 C ATOM 2010 O GLY C 24 -7.631 2.912 -8.043 1.00 0.00 O ATOM 0 H GLY C 24 -5.517 2.672 -8.916 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -6.655 4.696 -10.320 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -7.254 3.274 -11.149 1.00 0.00 H new ATOM 2014 N VAL C 25 -9.135 3.892 -9.407 1.00 0.00 N ATOM 2015 CA VAL C 25 -10.245 3.851 -8.466 1.00 0.00 C ATOM 2016 C VAL C 25 -11.490 3.288 -9.146 1.00 0.00 C ATOM 2017 O VAL C 25 -11.574 3.243 -10.373 1.00 0.00 O ATOM 2018 CB VAL C 25 -10.516 5.258 -7.912 1.00 0.00 C ATOM 2019 CG1 VAL C 25 -9.276 5.825 -7.219 1.00 0.00 C ATOM 2020 CG2 VAL C 25 -10.936 6.217 -9.021 1.00 0.00 C ATOM 0 H VAL C 25 -9.380 4.295 -10.311 1.00 0.00 H new ATOM 0 HA VAL C 25 -9.984 3.197 -7.634 1.00 0.00 H new ATOM 0 HB VAL C 25 -11.326 5.163 -7.189 1.00 0.00 H new ATOM 0 HG11 VAL C 25 -9.497 6.822 -6.837 1.00 0.00 H new ATOM 0 HG12 VAL C 25 -8.991 5.174 -6.392 1.00 0.00 H new ATOM 0 HG13 VAL C 25 -8.455 5.884 -7.933 1.00 0.00 H new ATOM 0 HG21 VAL C 25 -11.121 7.204 -8.598 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -10.142 6.284 -9.764 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -11.846 5.849 -9.495 1.00 0.00 H new ATOM 2030 N SER C 26 -12.461 2.857 -8.334 1.00 0.00 N ATOM 2031 CA SER C 26 -13.685 2.223 -8.798 1.00 0.00 C ATOM 2032 C SER C 26 -14.819 2.555 -7.835 1.00 0.00 C ATOM 2033 O SER C 26 -15.482 1.661 -7.308 1.00 0.00 O ATOM 2034 CB SER C 26 -13.470 0.710 -8.894 1.00 0.00 C ATOM 2035 OG SER C 26 -12.557 0.405 -9.927 1.00 0.00 O ATOM 0 H SER C 26 -12.411 2.944 -7.319 1.00 0.00 H new ATOM 0 HA SER C 26 -13.950 2.596 -9.787 1.00 0.00 H new ATOM 0 HB2 SER C 26 -13.094 0.329 -7.944 1.00 0.00 H new ATOM 0 HB3 SER C 26 -14.421 0.213 -9.083 1.00 0.00 H new ATOM 0 HG SER C 26 -12.429 -0.565 -9.974 1.00 0.00 H new ATOM 2041 N GLY C 27 -15.051 3.851 -7.600 1.00 0.00 N ATOM 2042 CA GLY C 27 -16.077 4.284 -6.666 1.00 0.00 C ATOM 2043 C GLY C 27 -15.598 4.057 -5.235 1.00 0.00 C ATOM 2044 O GLY C 27 -14.505 4.489 -4.870 1.00 0.00 O ATOM 0 H GLY C 27 -14.539 4.612 -8.047 1.00 0.00 H new ATOM 0 HA2 GLY C 27 -16.302 5.339 -6.821 1.00 0.00 H new ATOM 0 HA3 GLY C 27 -17.000 3.732 -6.843 1.00 0.00 H new ATOM 2048 N GLN C 28 -16.409 3.375 -4.423 1.00 0.00 N ATOM 2049 CA GLN C 28 -16.033 3.019 -3.066 1.00 0.00 C ATOM 2050 C GLN C 28 -14.880 2.011 -3.077 1.00 0.00 C ATOM 2051 O GLN C 28 -14.242 1.785 -2.049 1.00 0.00 O ATOM 2052 CB GLN C 28 -17.260 2.432 -2.360 1.00 0.00 C ATOM 2053 CG GLN C 28 -17.046 2.331 -0.848 1.00 0.00 C ATOM 2054 CD GLN C 28 -18.258 1.714 -0.161 1.00 0.00 C ATOM 2055 OE1 GLN C 28 -18.151 0.677 0.485 1.00 0.00 O ATOM 2056 NE2 GLN C 28 -19.424 2.345 -0.294 1.00 0.00 N ATOM 0 H GLN C 28 -17.340 3.058 -4.693 1.00 0.00 H new ATOM 0 HA GLN C 28 -15.692 3.905 -2.531 1.00 0.00 H new ATOM 0 HB2 GLN C 28 -18.131 3.055 -2.564 1.00 0.00 H new ATOM 0 HB3 GLN C 28 -17.475 1.443 -2.764 1.00 0.00 H new ATOM 0 HG2 GLN C 28 -16.162 1.728 -0.643 1.00 0.00 H new ATOM 0 HG3 GLN C 28 -16.858 3.323 -0.437 1.00 0.00 H new ATOM 0 HE21 GLN C 28 -19.479 3.206 -0.838 1.00 0.00 H new ATOM 0 HE22 GLN C 28 -20.262 1.967 0.149 1.00 0.00 H new ATOM 2065 N GLN C 29 -14.604 1.402 -4.240 1.00 0.00 N ATOM 2066 CA GLN C 29 -13.528 0.438 -4.383 1.00 0.00 C ATOM 2067 C GLN C 29 -12.285 1.132 -4.930 1.00 0.00 C ATOM 2068 O GLN C 29 -12.354 2.236 -5.472 1.00 0.00 O ATOM 2069 CB GLN C 29 -13.935 -0.685 -5.339 1.00 0.00 C ATOM 2070 CG GLN C 29 -15.213 -1.409 -4.924 1.00 0.00 C ATOM 2071 CD GLN C 29 -15.467 -2.589 -5.850 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -16.101 -2.454 -6.892 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -14.972 -3.760 -5.467 1.00 0.00 N ATOM 0 H GLN C 29 -15.125 1.571 -5.100 1.00 0.00 H new ATOM 0 HA GLN C 29 -13.315 0.011 -3.403 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -14.071 -0.269 -6.337 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -13.122 -1.408 -5.403 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -15.126 -1.756 -3.894 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -16.058 -0.721 -4.958 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -14.450 -3.832 -4.594 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -15.114 -4.588 -6.046 1.00 0.00 H new ATOM 2082 N VAL C 30 -11.137 0.468 -4.784 1.00 0.00 N ATOM 2083 CA VAL C 30 -9.839 0.991 -5.188 1.00 0.00 C ATOM 2084 C VAL C 30 -8.984 -0.139 -5.751 1.00 0.00 C ATOM 2085 O VAL C 30 -9.146 -1.296 -5.364 1.00 0.00 O ATOM 2086 CB VAL C 30 -9.155 1.627 -3.969 1.00 0.00 C ATOM 2087 CG1 VAL C 30 -7.742 2.102 -4.312 1.00 0.00 C ATOM 2088 CG2 VAL C 30 -9.947 2.835 -3.466 1.00 0.00 C ATOM 0 H VAL C 30 -11.087 -0.465 -4.374 1.00 0.00 H new ATOM 0 HA VAL C 30 -9.966 1.748 -5.962 1.00 0.00 H new ATOM 0 HB VAL C 30 -9.111 0.859 -3.197 1.00 0.00 H new ATOM 0 HG11 VAL C 30 -7.284 2.548 -3.429 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -7.143 1.253 -4.643 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -7.791 2.844 -5.109 1.00 0.00 H new ATOM 0 HG21 VAL C 30 -9.442 3.267 -2.602 1.00 0.00 H new ATOM 0 HG22 VAL C 30 -10.015 3.581 -4.258 1.00 0.00 H new ATOM 0 HG23 VAL C 30 -10.950 2.519 -3.179 1.00 0.00 H new ATOM 2098 N ARG C 31 -8.072 0.204 -6.666 1.00 0.00 N ATOM 2099 CA ARG C 31 -7.165 -0.735 -7.310 1.00 0.00 C ATOM 2100 C ARG C 31 -5.738 -0.256 -7.080 1.00 0.00 C ATOM 2101 O ARG C 31 -5.351 0.819 -7.538 1.00 0.00 O ATOM 2102 CB ARG C 31 -7.496 -0.810 -8.805 1.00 0.00 C ATOM 2103 CG ARG C 31 -8.012 -2.191 -9.213 1.00 0.00 C ATOM 2104 CD ARG C 31 -6.883 -3.227 -9.257 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.374 -4.509 -9.770 1.00 0.00 N ATOM 2106 CZ ARG C 31 -7.583 -4.774 -11.063 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -7.345 -3.863 -11.999 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.035 -5.969 -11.433 1.00 0.00 N ATOM 0 H ARG C 31 -7.946 1.165 -6.983 1.00 0.00 H new ATOM 0 HA ARG C 31 -7.273 -1.735 -6.891 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -8.246 -0.057 -9.048 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.605 -0.571 -9.385 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -8.777 -2.516 -8.508 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -8.486 -2.128 -10.192 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -6.073 -2.863 -9.890 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -6.470 -3.364 -8.258 1.00 0.00 H new ATOM 0 HE ARG C 31 -7.569 -5.248 -9.095 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -6.996 -2.941 -11.736 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -7.511 -4.085 -12.981 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -8.222 -6.684 -10.730 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -8.194 -6.171 -12.420 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.959 -1.065 -6.364 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.607 -0.724 -5.941 1.00 0.00 C ATOM 2124 C ILE C 32 -2.682 -1.918 -6.114 1.00 0.00 C ATOM 2125 O ILE C 32 -3.140 -3.054 -6.245 1.00 0.00 O ATOM 2126 CB ILE C 32 -3.607 -0.279 -4.469 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -4.461 -1.226 -3.615 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -4.093 1.165 -4.358 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -4.324 -0.907 -2.128 1.00 0.00 C ATOM 0 H ILE C 32 -5.257 -1.991 -6.058 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.248 0.096 -6.563 1.00 0.00 H new ATOM 0 HB ILE C 32 -2.587 -0.324 -4.086 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -5.507 -1.144 -3.912 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -4.158 -2.257 -3.797 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -4.089 1.471 -3.312 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.431 1.817 -4.929 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -5.106 1.240 -4.754 1.00 0.00 H new ATOM 0 HD11 ILE C 32 -4.941 -1.595 -1.550 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -3.282 -1.014 -1.827 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -4.651 0.116 -1.944 1.00 0.00 H new ATOM 2141 N GLY C 33 -1.374 -1.656 -6.115 1.00 0.00 N ATOM 2142 CA GLY C 33 -0.380 -2.700 -6.286 1.00 0.00 C ATOM 2143 C GLY C 33 0.813 -2.482 -5.371 1.00 0.00 C ATOM 2144 O GLY C 33 0.975 -1.418 -4.776 1.00 0.00 O ATOM 0 H GLY C 33 -0.983 -0.721 -5.998 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -0.829 -3.671 -6.076 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.046 -2.721 -7.323 1.00 0.00 H new ATOM 2148 N ILE C 34 1.646 -3.517 -5.272 1.00 0.00 N ATOM 2149 CA ILE C 34 2.820 -3.538 -4.420 1.00 0.00 C ATOM 2150 C ILE C 34 3.975 -4.074 -5.259 1.00 0.00 C ATOM 2151 O ILE C 34 3.795 -4.995 -6.055 1.00 0.00 O ATOM 2152 CB ILE C 34 2.595 -4.454 -3.205 1.00 0.00 C ATOM 2153 CG1 ILE C 34 1.484 -3.956 -2.273 1.00 0.00 C ATOM 2154 CG2 ILE C 34 3.887 -4.541 -2.386 1.00 0.00 C ATOM 2155 CD1 ILE C 34 0.099 -4.457 -2.692 1.00 0.00 C ATOM 0 H ILE C 34 1.515 -4.382 -5.797 1.00 0.00 H new ATOM 0 HA ILE C 34 3.033 -2.536 -4.047 1.00 0.00 H new ATOM 0 HB ILE C 34 2.297 -5.425 -3.601 1.00 0.00 H new ATOM 0 HG12 ILE C 34 1.693 -4.285 -1.255 1.00 0.00 H new ATOM 0 HG13 ILE C 34 1.485 -2.866 -2.262 1.00 0.00 H new ATOM 0 HG21 ILE C 34 3.729 -5.190 -1.525 1.00 0.00 H new ATOM 0 HG22 ILE C 34 4.684 -4.950 -3.007 1.00 0.00 H new ATOM 0 HG23 ILE C 34 4.168 -3.545 -2.043 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -0.651 -4.076 -1.999 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -0.126 -4.106 -3.699 1.00 0.00 H new ATOM 0 HD13 ILE C 34 0.086 -5.547 -2.677 1.00 0.00 H new ATOM 2167 N ASN C 35 5.162 -3.497 -5.078 1.00 0.00 N ATOM 2168 CA ASN C 35 6.331 -3.840 -5.857 1.00 0.00 C ATOM 2169 C ASN C 35 7.487 -4.160 -4.916 1.00 0.00 C ATOM 2170 O ASN C 35 8.416 -3.377 -4.731 1.00 0.00 O ATOM 2171 CB ASN C 35 6.642 -2.708 -6.830 1.00 0.00 C ATOM 2172 CG ASN C 35 7.522 -3.176 -7.984 1.00 0.00 C ATOM 2173 OD1 ASN C 35 8.350 -4.067 -7.829 1.00 0.00 O ATOM 2174 ND2 ASN C 35 7.342 -2.568 -9.154 1.00 0.00 N ATOM 0 H ASN C 35 5.332 -2.774 -4.379 1.00 0.00 H new ATOM 0 HA ASN C 35 6.153 -4.732 -6.457 1.00 0.00 H new ATOM 0 HB2 ASN C 35 5.710 -2.303 -7.225 1.00 0.00 H new ATOM 0 HB3 ASN C 35 7.141 -1.899 -6.298 1.00 0.00 H new ATOM 0 HD21 ASN C 35 7.903 -2.839 -9.961 1.00 0.00 H new ATOM 0 HD22 ASN C 35 6.643 -1.831 -9.243 1.00 0.00 H new ATOM 2181 N ALA C 36 7.384 -5.351 -4.331 1.00 0.00 N ATOM 2182 CA ALA C 36 8.362 -5.937 -3.434 1.00 0.00 C ATOM 2183 C ALA C 36 8.725 -7.323 -3.965 1.00 0.00 C ATOM 2184 O ALA C 36 7.968 -7.897 -4.745 1.00 0.00 O ATOM 2185 CB ALA C 36 7.735 -6.031 -2.046 1.00 0.00 C ATOM 0 H ALA C 36 6.577 -5.957 -4.480 1.00 0.00 H new ATOM 0 HA ALA C 36 9.268 -5.333 -3.374 1.00 0.00 H new ATOM 0 HB1 ALA C 36 8.452 -6.469 -1.352 1.00 0.00 H new ATOM 0 HB2 ALA C 36 7.460 -5.034 -1.702 1.00 0.00 H new ATOM 0 HB3 ALA C 36 6.844 -6.657 -2.091 1.00 0.00 H new ATOM 2191 N PRO C 37 9.869 -7.877 -3.551 1.00 0.00 N ATOM 2192 CA PRO C 37 10.296 -9.200 -3.960 1.00 0.00 C ATOM 2193 C PRO C 37 9.520 -10.240 -3.163 1.00 0.00 C ATOM 2194 O PRO C 37 9.069 -9.960 -2.053 1.00 0.00 O ATOM 2195 CB PRO C 37 11.781 -9.242 -3.609 1.00 0.00 C ATOM 2196 CG PRO C 37 11.869 -8.345 -2.377 1.00 0.00 C ATOM 2197 CD PRO C 37 10.836 -7.266 -2.661 1.00 0.00 C ATOM 0 HA PRO C 37 10.124 -9.407 -5.016 1.00 0.00 H new ATOM 0 HB2 PRO C 37 12.116 -10.257 -3.394 1.00 0.00 H new ATOM 0 HB3 PRO C 37 12.399 -8.868 -4.425 1.00 0.00 H new ATOM 0 HG2 PRO C 37 11.639 -8.892 -1.463 1.00 0.00 H new ATOM 0 HG3 PRO C 37 12.867 -7.925 -2.255 1.00 0.00 H new ATOM 0 HD2 PRO C 37 10.361 -6.926 -1.741 1.00 0.00 H new ATOM 0 HD3 PRO C 37 11.298 -6.393 -3.123 1.00 0.00 H new ATOM 2205 N LYS C 38 9.364 -11.447 -3.708 1.00 0.00 N ATOM 2206 CA LYS C 38 8.709 -12.527 -2.981 1.00 0.00 C ATOM 2207 C LYS C 38 9.584 -13.021 -1.834 1.00 0.00 C ATOM 2208 O LYS C 38 9.199 -13.925 -1.097 1.00 0.00 O ATOM 2209 CB LYS C 38 8.301 -13.645 -3.942 1.00 0.00 C ATOM 2210 CG LYS C 38 7.153 -13.107 -4.791 1.00 0.00 C ATOM 2211 CD LYS C 38 6.455 -14.205 -5.595 1.00 0.00 C ATOM 2212 CE LYS C 38 7.377 -14.737 -6.691 1.00 0.00 C ATOM 2213 NZ LYS C 38 6.724 -15.815 -7.459 1.00 0.00 N ATOM 0 H LYS C 38 9.681 -11.697 -4.645 1.00 0.00 H new ATOM 0 HA LYS C 38 7.794 -12.147 -2.527 1.00 0.00 H new ATOM 0 HB2 LYS C 38 9.141 -13.938 -4.571 1.00 0.00 H new ATOM 0 HB3 LYS C 38 7.990 -14.533 -3.391 1.00 0.00 H new ATOM 0 HG2 LYS C 38 6.426 -12.617 -4.144 1.00 0.00 H new ATOM 0 HG3 LYS C 38 7.535 -12.348 -5.474 1.00 0.00 H new ATOM 0 HD2 LYS C 38 6.162 -15.019 -4.932 1.00 0.00 H new ATOM 0 HD3 LYS C 38 5.541 -13.812 -6.040 1.00 0.00 H new ATOM 0 HE2 LYS C 38 7.655 -13.925 -7.363 1.00 0.00 H new ATOM 0 HE3 LYS C 38 8.299 -15.111 -6.245 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 7.372 -16.158 -8.196 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 6.481 -16.599 -6.820 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 5.857 -15.449 -7.903 1.00 0.00 H new ATOM 2227 N ASP C 39 10.769 -12.419 -1.683 1.00 0.00 N ATOM 2228 CA ASP C 39 11.628 -12.641 -0.533 1.00 0.00 C ATOM 2229 C ASP C 39 10.980 -12.048 0.720 1.00 0.00 C ATOM 2230 O ASP C 39 11.415 -12.347 1.833 1.00 0.00 O ATOM 2231 CB ASP C 39 13.003 -12.023 -0.782 1.00 0.00 C ATOM 2232 CG ASP C 39 13.744 -12.759 -1.898 1.00 0.00 C ATOM 2233 OD1 ASP C 39 14.254 -13.865 -1.621 1.00 0.00 O ATOM 2234 OD2 ASP C 39 13.793 -12.207 -3.021 1.00 0.00 O ATOM 0 H ASP C 39 11.153 -11.763 -2.363 1.00 0.00 H new ATOM 0 HA ASP C 39 11.758 -13.712 -0.379 1.00 0.00 H new ATOM 0 HB2 ASP C 39 12.890 -10.972 -1.048 1.00 0.00 H new ATOM 0 HB3 ASP C 39 13.592 -12.058 0.134 1.00 0.00 H new ATOM 2239 N VAL C 40 9.943 -11.217 0.553 1.00 0.00 N ATOM 2240 CA VAL C 40 9.145 -10.721 1.664 1.00 0.00 C ATOM 2241 C VAL C 40 7.663 -10.960 1.387 1.00 0.00 C ATOM 2242 O VAL C 40 7.204 -10.875 0.247 1.00 0.00 O ATOM 2243 CB VAL C 40 9.437 -9.241 1.932 1.00 0.00 C ATOM 2244 CG1 VAL C 40 10.935 -9.013 2.134 1.00 0.00 C ATOM 2245 CG2 VAL C 40 8.948 -8.334 0.804 1.00 0.00 C ATOM 0 H VAL C 40 9.640 -10.874 -0.359 1.00 0.00 H new ATOM 0 HA VAL C 40 9.416 -11.270 2.566 1.00 0.00 H new ATOM 0 HB VAL C 40 8.892 -8.982 2.840 1.00 0.00 H new ATOM 0 HG11 VAL C 40 11.120 -7.956 2.323 1.00 0.00 H new ATOM 0 HG12 VAL C 40 11.281 -9.599 2.985 1.00 0.00 H new ATOM 0 HG13 VAL C 40 11.474 -9.321 1.238 1.00 0.00 H new ATOM 0 HG21 VAL C 40 9.180 -7.297 1.045 1.00 0.00 H new ATOM 0 HG22 VAL C 40 9.444 -8.610 -0.126 1.00 0.00 H new ATOM 0 HG23 VAL C 40 7.870 -8.447 0.688 1.00 0.00 H new ATOM 2255 N ALA C 41 6.912 -11.263 2.442 1.00 0.00 N ATOM 2256 CA ALA C 41 5.495 -11.574 2.344 1.00 0.00 C ATOM 2257 C ALA C 41 4.689 -10.332 1.969 1.00 0.00 C ATOM 2258 O ALA C 41 5.013 -9.230 2.407 1.00 0.00 O ATOM 2259 CB ALA C 41 5.023 -12.120 3.690 1.00 0.00 C ATOM 0 H ALA C 41 7.275 -11.299 3.394 1.00 0.00 H new ATOM 0 HA ALA C 41 5.342 -12.318 1.562 1.00 0.00 H new ATOM 0 HB1 ALA C 41 3.961 -12.359 3.634 1.00 0.00 H new ATOM 0 HB2 ALA C 41 5.585 -13.021 3.934 1.00 0.00 H new ATOM 0 HB3 ALA C 41 5.186 -11.370 4.464 1.00 0.00 H new ATOM 2265 N VAL C 42 3.644 -10.518 1.159 1.00 0.00 N ATOM 2266 CA VAL C 42 2.723 -9.454 0.781 1.00 0.00 C ATOM 2267 C VAL C 42 1.339 -10.067 0.607 1.00 0.00 C ATOM 2268 O VAL C 42 1.146 -10.891 -0.287 1.00 0.00 O ATOM 2269 CB VAL C 42 3.168 -8.793 -0.528 1.00 0.00 C ATOM 2270 CG1 VAL C 42 2.181 -7.705 -0.942 1.00 0.00 C ATOM 2271 CG2 VAL C 42 4.543 -8.143 -0.403 1.00 0.00 C ATOM 0 H VAL C 42 3.415 -11.422 0.745 1.00 0.00 H new ATOM 0 HA VAL C 42 2.708 -8.688 1.556 1.00 0.00 H new ATOM 0 HB VAL C 42 3.208 -9.587 -1.274 1.00 0.00 H new ATOM 0 HG11 VAL C 42 2.514 -7.247 -1.874 1.00 0.00 H new ATOM 0 HG12 VAL C 42 1.194 -8.145 -1.086 1.00 0.00 H new ATOM 0 HG13 VAL C 42 2.129 -6.945 -0.162 1.00 0.00 H new ATOM 0 HG21 VAL C 42 4.818 -7.687 -1.354 1.00 0.00 H new ATOM 0 HG22 VAL C 42 4.514 -7.377 0.372 1.00 0.00 H new ATOM 0 HG23 VAL C 42 5.281 -8.900 -0.137 1.00 0.00 H new ATOM 2281 N HIS C 43 0.390 -9.665 1.461 1.00 0.00 N ATOM 2282 CA HIS C 43 -0.974 -10.181 1.439 1.00 0.00 C ATOM 2283 C HIS C 43 -1.968 -9.132 1.929 1.00 0.00 C ATOM 2284 O HIS C 43 -1.585 -8.117 2.510 1.00 0.00 O ATOM 2285 CB HIS C 43 -1.102 -11.402 2.365 1.00 0.00 C ATOM 2286 CG HIS C 43 -0.109 -12.503 2.129 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -0.376 -13.681 1.429 1.00 0.00 N ATOM 2288 CD2 HIS C 43 1.183 -12.520 2.566 1.00 0.00 C ATOM 2289 CE1 HIS C 43 0.768 -14.385 1.467 1.00 0.00 C ATOM 2290 NE2 HIS C 43 1.718 -13.713 2.138 1.00 0.00 N ATOM 0 H HIS C 43 0.553 -8.969 2.188 1.00 0.00 H new ATOM 0 HA HIS C 43 -1.195 -10.453 0.407 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -1.005 -11.065 3.397 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -2.106 -11.813 2.257 1.00 0.00 H new ATOM 0 HD2 HIS C 43 1.685 -11.751 3.134 1.00 0.00 H new ATOM 0 HE1 HIS C 43 0.905 -15.358 1.019 1.00 0.00 H new ATOM 0 HE2 HIS C 43 2.673 -14.033 2.302 1.00 0.00 H new ATOM 2298 N ARG C 44 -3.255 -9.390 1.683 1.00 0.00 N ATOM 2299 CA ARG C 44 -4.364 -8.599 2.207 1.00 0.00 C ATOM 2300 C ARG C 44 -4.440 -8.755 3.725 1.00 0.00 C ATOM 2301 O ARG C 44 -4.047 -9.790 4.259 1.00 0.00 O ATOM 2302 CB ARG C 44 -5.657 -9.091 1.535 1.00 0.00 C ATOM 2303 CG ARG C 44 -5.912 -10.550 1.923 1.00 0.00 C ATOM 2304 CD ARG C 44 -6.763 -11.299 0.897 1.00 0.00 C ATOM 2305 NE ARG C 44 -8.188 -10.996 1.035 1.00 0.00 N ATOM 2306 CZ ARG C 44 -9.075 -11.138 0.047 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -8.697 -11.597 -1.141 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -10.352 -10.823 0.234 1.00 0.00 N ATOM 0 H ARG C 44 -3.558 -10.171 1.102 1.00 0.00 H new ATOM 0 HA ARG C 44 -4.221 -7.540 1.990 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -6.498 -8.470 1.842 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -5.573 -9.001 0.452 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -4.957 -11.062 2.038 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -6.410 -10.581 2.892 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -6.433 -11.036 -0.108 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -6.608 -12.372 1.013 1.00 0.00 H new ATOM 0 HE ARG C 44 -8.523 -10.657 1.937 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -7.721 -11.845 -1.305 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -9.383 -11.702 -1.889 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -10.663 -10.469 1.139 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -11.022 -10.935 -0.527 1.00 0.00 H new ATOM 2322 N GLU C 45 -4.947 -7.746 4.437 1.00 0.00 N ATOM 2323 CA GLU C 45 -5.074 -7.833 5.888 1.00 0.00 C ATOM 2324 C GLU C 45 -6.097 -8.896 6.295 1.00 0.00 C ATOM 2325 O GLU C 45 -6.051 -9.416 7.407 1.00 0.00 O ATOM 2326 CB GLU C 45 -5.423 -6.456 6.468 1.00 0.00 C ATOM 2327 CG GLU C 45 -6.839 -5.983 6.119 1.00 0.00 C ATOM 2328 CD GLU C 45 -7.918 -6.593 7.018 1.00 0.00 C ATOM 2329 OE1 GLU C 45 -7.729 -6.564 8.254 1.00 0.00 O ATOM 2330 OE2 GLU C 45 -8.927 -7.082 6.463 1.00 0.00 O ATOM 0 H GLU C 45 -5.273 -6.868 4.034 1.00 0.00 H new ATOM 0 HA GLU C 45 -4.115 -8.144 6.303 1.00 0.00 H new ATOM 0 HB2 GLU C 45 -5.318 -6.491 7.552 1.00 0.00 H new ATOM 0 HB3 GLU C 45 -4.704 -5.724 6.101 1.00 0.00 H new ATOM 0 HG2 GLU C 45 -6.882 -4.897 6.197 1.00 0.00 H new ATOM 0 HG3 GLU C 45 -7.054 -6.237 5.081 1.00 0.00 H new ATOM 2337 N GLU C 46 -7.024 -9.211 5.387 1.00 0.00 N ATOM 2338 CA GLU C 46 -8.095 -10.169 5.625 1.00 0.00 C ATOM 2339 C GLU C 46 -7.582 -11.612 5.646 1.00 0.00 C ATOM 2340 O GLU C 46 -8.326 -12.522 6.006 1.00 0.00 O ATOM 2341 CB GLU C 46 -9.135 -9.966 4.524 1.00 0.00 C ATOM 2342 CG GLU C 46 -10.436 -10.726 4.766 1.00 0.00 C ATOM 2343 CD GLU C 46 -11.483 -10.346 3.720 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -11.083 -9.767 2.682 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -12.674 -10.637 3.966 1.00 0.00 O ATOM 0 H GLU C 46 -7.048 -8.799 4.454 1.00 0.00 H new ATOM 0 HA GLU C 46 -8.535 -9.998 6.607 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -9.356 -8.902 4.436 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -8.710 -10.283 3.571 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -10.249 -11.799 4.728 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -10.813 -10.503 5.764 1.00 0.00 H new ATOM 2352 N ILE C 47 -6.323 -11.832 5.260 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.738 -13.165 5.197 1.00 0.00 C ATOM 2354 C ILE C 47 -4.358 -13.181 5.851 1.00 0.00 C ATOM 2355 O ILE C 47 -3.907 -14.240 6.284 1.00 0.00 O ATOM 2356 CB ILE C 47 -5.688 -13.626 3.729 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -7.053 -14.198 3.323 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -4.577 -14.641 3.457 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -6.971 -14.998 2.019 1.00 0.00 C ATOM 0 H ILE C 47 -5.683 -11.087 4.983 1.00 0.00 H new ATOM 0 HA ILE C 47 -6.358 -13.866 5.756 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.456 -12.751 3.122 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -7.429 -14.840 4.120 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.768 -13.383 3.205 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -4.594 -14.926 2.405 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -3.611 -14.196 3.696 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -4.732 -15.525 4.075 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.958 -15.385 1.767 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -6.620 -14.350 1.216 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.276 -15.829 2.145 1.00 0.00 H new ATOM 2371 N TYR C 48 -3.667 -12.042 5.943 1.00 0.00 N ATOM 2372 CA TYR C 48 -2.345 -12.059 6.541 1.00 0.00 C ATOM 2373 C TYR C 48 -2.432 -12.505 7.999 1.00 0.00 C ATOM 2374 O TYR C 48 -1.535 -13.164 8.513 1.00 0.00 O ATOM 2375 CB TYR C 48 -1.700 -10.680 6.448 1.00 0.00 C ATOM 2376 CG TYR C 48 -0.322 -10.691 7.065 1.00 0.00 C ATOM 2377 CD1 TYR C 48 0.790 -11.052 6.286 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.165 -10.362 8.418 1.00 0.00 C ATOM 2379 CE1 TYR C 48 2.066 -11.089 6.864 1.00 0.00 C ATOM 2380 CE2 TYR C 48 1.105 -10.404 9.005 1.00 0.00 C ATOM 2381 CZ TYR C 48 2.227 -10.751 8.222 1.00 0.00 C ATOM 2382 OH TYR C 48 3.468 -10.766 8.786 1.00 0.00 O ATOM 0 H TYR C 48 -3.992 -11.130 5.622 1.00 0.00 H new ATOM 0 HA TYR C 48 -1.725 -12.769 5.993 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -1.634 -10.374 5.404 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -2.325 -9.946 6.956 1.00 0.00 H new ATOM 0 HD1 TYR C 48 0.662 -11.301 5.243 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -1.024 -10.076 9.008 1.00 0.00 H new ATOM 0 HE1 TYR C 48 2.922 -11.375 6.271 1.00 0.00 H new ATOM 0 HE2 TYR C 48 1.226 -10.172 10.053 1.00 0.00 H new ATOM 0 HH TYR C 48 4.112 -10.359 8.170 1.00 0.00 H new ATOM 2392 N GLN C 49 -3.529 -12.136 8.662 1.00 0.00 N ATOM 2393 CA GLN C 49 -3.734 -12.442 10.065 1.00 0.00 C ATOM 2394 C GLN C 49 -4.081 -13.918 10.263 1.00 0.00 C ATOM 2395 O GLN C 49 -4.044 -14.415 11.388 1.00 0.00 O ATOM 2396 CB GLN C 49 -4.833 -11.532 10.611 1.00 0.00 C ATOM 2397 CG GLN C 49 -4.449 -10.073 10.349 1.00 0.00 C ATOM 2398 CD GLN C 49 -5.474 -9.100 10.924 1.00 0.00 C ATOM 2399 OE1 GLN C 49 -5.571 -8.923 12.135 1.00 0.00 O ATOM 2400 NE2 GLN C 49 -6.250 -8.460 10.053 1.00 0.00 N ATOM 0 H GLN C 49 -4.296 -11.617 8.235 1.00 0.00 H new ATOM 0 HA GLN C 49 -2.811 -12.260 10.616 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -5.785 -11.762 10.132 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -4.965 -11.700 11.680 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -3.472 -9.871 10.787 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -4.357 -9.910 9.275 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -6.143 -8.631 9.053 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -6.952 -7.799 10.385 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.423 -14.619 9.174 1.00 0.00 N ATOM 2410 CA ARG C 50 -4.696 -16.050 9.224 1.00 0.00 C ATOM 2411 C ARG C 50 -3.424 -16.833 8.905 1.00 0.00 C ATOM 2412 O ARG C 50 -3.266 -17.955 9.376 1.00 0.00 O ATOM 2413 CB ARG C 50 -5.863 -16.392 8.289 1.00 0.00 C ATOM 2414 CG ARG C 50 -5.436 -17.013 6.957 1.00 0.00 C ATOM 2415 CD ARG C 50 -6.632 -17.149 6.016 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.626 -18.096 6.534 1.00 0.00 N ATOM 2417 CZ ARG C 50 -8.756 -18.415 5.898 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -9.048 -17.874 4.719 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -9.604 -19.282 6.448 1.00 0.00 N ATOM 0 H ARG C 50 -4.516 -14.209 8.245 1.00 0.00 H new ATOM 0 HA ARG C 50 -5.002 -16.340 10.229 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -6.534 -17.082 8.801 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.432 -15.484 8.088 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -4.669 -16.394 6.491 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -4.992 -17.993 7.133 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -7.097 -16.173 5.876 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -6.288 -17.482 5.037 1.00 0.00 H new ATOM 0 HE ARG C 50 -7.443 -18.538 7.435 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.406 -17.207 4.291 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -9.914 -18.126 4.243 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -9.390 -19.701 7.353 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -10.468 -19.527 5.964 1.00 0.00 H new ATOM 2433 N ILE C 51 -2.521 -16.250 8.108 1.00 0.00 N ATOM 2434 CA ILE C 51 -1.222 -16.844 7.808 1.00 0.00 C ATOM 2435 C ILE C 51 -0.367 -16.821 9.068 1.00 0.00 C ATOM 2436 O ILE C 51 0.207 -17.833 9.460 1.00 0.00 O ATOM 2437 CB ILE C 51 -0.545 -16.035 6.695 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -1.338 -16.173 5.396 1.00 0.00 C ATOM 2439 CG2 ILE C 51 0.890 -16.510 6.448 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -0.846 -15.171 4.358 1.00 0.00 C ATOM 0 H ILE C 51 -2.675 -15.350 7.654 1.00 0.00 H new ATOM 0 HA ILE C 51 -1.345 -17.875 7.475 1.00 0.00 H new ATOM 0 HB ILE C 51 -0.519 -14.993 7.015 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -1.237 -17.186 5.008 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -2.398 -16.011 5.592 1.00 0.00 H new ATOM 0 HG21 ILE C 51 1.339 -15.914 5.653 1.00 0.00 H new ATOM 0 HG22 ILE C 51 1.474 -16.395 7.361 1.00 0.00 H new ATOM 0 HG23 ILE C 51 0.880 -17.559 6.154 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -1.423 -15.285 3.440 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -0.971 -14.159 4.742 1.00 0.00 H new ATOM 0 HD13 ILE C 51 0.208 -15.352 4.149 1.00 0.00 H new ATOM 2452 N GLN C 52 -0.290 -15.656 9.707 1.00 0.00 N ATOM 2453 CA GLN C 52 0.530 -15.469 10.893 1.00 0.00 C ATOM 2454 C GLN C 52 -0.115 -16.112 12.119 1.00 0.00 C ATOM 2455 O GLN C 52 0.392 -15.968 13.231 1.00 0.00 O ATOM 2456 CB GLN C 52 0.803 -13.976 11.081 1.00 0.00 C ATOM 2457 CG GLN C 52 1.605 -13.447 9.892 1.00 0.00 C ATOM 2458 CD GLN C 52 2.829 -14.305 9.596 1.00 0.00 C ATOM 2459 OE1 GLN C 52 3.768 -14.367 10.385 1.00 0.00 O ATOM 2460 NE2 GLN C 52 2.822 -14.975 8.448 1.00 0.00 N ATOM 0 H GLN C 52 -0.795 -14.819 9.415 1.00 0.00 H new ATOM 0 HA GLN C 52 1.487 -15.974 10.763 1.00 0.00 H new ATOM 0 HB2 GLN C 52 -0.138 -13.432 11.169 1.00 0.00 H new ATOM 0 HB3 GLN C 52 1.354 -13.811 12.007 1.00 0.00 H new ATOM 0 HG2 GLN C 52 0.965 -13.414 9.010 1.00 0.00 H new ATOM 0 HG3 GLN C 52 1.921 -12.424 10.095 1.00 0.00 H new ATOM 0 HE21 GLN C 52 2.024 -14.899 7.818 1.00 0.00 H new ATOM 0 HE22 GLN C 52 3.615 -15.566 8.197 1.00 0.00 H new ATOM 2469 N ALA C 53 -1.230 -16.823 11.930 1.00 0.00 N ATOM 2470 CA ALA C 53 -1.890 -17.512 13.019 1.00 0.00 C ATOM 2471 C ALA C 53 -1.102 -18.752 13.448 1.00 0.00 C ATOM 2472 O ALA C 53 -1.328 -19.266 14.542 1.00 0.00 O ATOM 2473 CB ALA C 53 -3.300 -17.907 12.593 1.00 0.00 C ATOM 0 H ALA C 53 -1.689 -16.931 11.025 1.00 0.00 H new ATOM 0 HA ALA C 53 -1.942 -16.837 13.873 1.00 0.00 H new ATOM 0 HB1 ALA C 53 -3.796 -18.426 13.413 1.00 0.00 H new ATOM 0 HB2 ALA C 53 -3.866 -17.012 12.334 1.00 0.00 H new ATOM 0 HB3 ALA C 53 -3.247 -18.566 11.726 1.00 0.00 H new ATOM 2479 N GLY C 54 -0.183 -19.232 12.599 1.00 0.00 N ATOM 2480 CA GLY C 54 0.636 -20.398 12.909 1.00 0.00 C ATOM 2481 C GLY C 54 0.697 -21.381 11.740 1.00 0.00 C ATOM 2482 O GLY C 54 1.069 -22.538 11.927 1.00 0.00 O ATOM 0 H GLY C 54 0.008 -18.822 11.685 1.00 0.00 H new ATOM 0 HA2 GLY C 54 1.645 -20.075 13.164 1.00 0.00 H new ATOM 0 HA3 GLY C 54 0.231 -20.903 13.786 1.00 0.00 H new ATOM 2486 N LEU C 55 0.335 -20.932 10.535 1.00 0.00 N ATOM 2487 CA LEU C 55 0.227 -21.778 9.357 1.00 0.00 C ATOM 2488 C LEU C 55 0.780 -21.063 8.126 1.00 0.00 C ATOM 2489 O LEU C 55 1.362 -19.984 8.236 1.00 0.00 O ATOM 2490 CB LEU C 55 -1.239 -22.198 9.194 1.00 0.00 C ATOM 2491 CG LEU C 55 -2.206 -21.008 9.095 1.00 0.00 C ATOM 2492 CD1 LEU C 55 -2.211 -20.387 7.698 1.00 0.00 C ATOM 2493 CD2 LEU C 55 -3.617 -21.502 9.403 1.00 0.00 C ATOM 0 H LEU C 55 0.107 -19.954 10.354 1.00 0.00 H new ATOM 0 HA LEU C 55 0.830 -22.678 9.476 1.00 0.00 H new ATOM 0 HB2 LEU C 55 -1.336 -22.811 8.298 1.00 0.00 H new ATOM 0 HB3 LEU C 55 -1.527 -22.822 10.040 1.00 0.00 H new ATOM 0 HG LEU C 55 -1.879 -20.249 9.805 1.00 0.00 H new ATOM 0 HD11 LEU C 55 -2.909 -19.550 7.675 1.00 0.00 H new ATOM 0 HD12 LEU C 55 -1.210 -20.032 7.454 1.00 0.00 H new ATOM 0 HD13 LEU C 55 -2.518 -21.136 6.968 1.00 0.00 H new ATOM 0 HD21 LEU C 55 -4.317 -20.669 9.337 1.00 0.00 H new ATOM 0 HD22 LEU C 55 -3.899 -22.270 8.683 1.00 0.00 H new ATOM 0 HD23 LEU C 55 -3.645 -21.920 10.409 1.00 0.00 H new ATOM 2505 N THR C 56 0.602 -21.656 6.943 1.00 0.00 N ATOM 2506 CA THR C 56 1.076 -21.071 5.695 1.00 0.00 C ATOM 2507 C THR C 56 0.049 -21.269 4.582 1.00 0.00 C ATOM 2508 O THR C 56 -0.956 -21.955 4.770 1.00 0.00 O ATOM 2509 CB THR C 56 2.424 -21.692 5.309 1.00 0.00 C ATOM 2510 OG1 THR C 56 2.294 -23.091 5.173 1.00 0.00 O ATOM 2511 CG2 THR C 56 3.482 -21.399 6.376 1.00 0.00 C ATOM 0 H THR C 56 0.127 -22.551 6.828 1.00 0.00 H new ATOM 0 HA THR C 56 1.212 -19.999 5.837 1.00 0.00 H new ATOM 0 HB THR C 56 2.735 -21.253 4.361 1.00 0.00 H new ATOM 0 HG1 THR C 56 3.160 -23.477 4.925 1.00 0.00 H new ATOM 0 HG21 THR C 56 4.430 -21.849 6.081 1.00 0.00 H new ATOM 0 HG22 THR C 56 3.608 -20.321 6.477 1.00 0.00 H new ATOM 0 HG23 THR C 56 3.162 -21.818 7.330 1.00 0.00 H new ATOM 2519 N ALA C 57 0.304 -20.667 3.416 1.00 0.00 N ATOM 2520 CA ALA C 57 -0.593 -20.732 2.274 1.00 0.00 C ATOM 2521 C ALA C 57 -0.877 -22.183 1.864 1.00 0.00 C ATOM 2522 O ALA C 57 -0.058 -23.069 2.118 1.00 0.00 O ATOM 2523 CB ALA C 57 0.050 -19.976 1.114 1.00 0.00 C ATOM 0 H ALA C 57 1.147 -20.119 3.244 1.00 0.00 H new ATOM 0 HA ALA C 57 -1.547 -20.278 2.544 1.00 0.00 H new ATOM 0 HB1 ALA C 57 -0.608 -20.013 0.246 1.00 0.00 H new ATOM 0 HB2 ALA C 57 0.212 -18.937 1.402 1.00 0.00 H new ATOM 0 HB3 ALA C 57 1.006 -20.437 0.864 1.00 0.00 H new