USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 926 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 MET CE :methyl 161:sc= -1.33 (180deg=-2.33!) USER MOD Set 1.2: A 113 MET CE :methyl 154:sc= -0.885 (180deg=-2.34!) USER MOD Single : A 3 ASN : amide:sc= -0.169 K(o=-0.17,f=-2.6!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 CYS SG : rot -177:sc= 1.25 USER MOD Single : A 17 SER OG : rot -98:sc= 1.21 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -0.119 K(o=-0.12,f=-2.3!) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -2.22 K(o=-2.2,f=-4.1!) USER MOD Single : A 45 SER OG : rot 180:sc= -0.0175 USER MOD Single : A 46 THR OG1 : rot -106:sc= 1.23 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.204 USER MOD Single : A 59 GLN : amide:sc= -7.11! C(o=-7.1!,f=-8.3!) USER MOD Single : A 65 CYS SG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= -0.223 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 60:sc= 1.3 USER MOD Single : A 88 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.125) USER MOD Single : A 97 ASN : amide:sc= -0.484 K(o=-0.48,f=-3.7!) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 64:sc= 0.198 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.186 USER MOD Single : A 108 ASN : amide:sc= -0.276 X(o=-0.28,f=-0.0044) USER MOD Single : A 110 TYR OH : rot 165:sc= -2.91! USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.0563 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 2.328 -0.252 -0.201 1.00 13.00 N ATOM 2 CA GLY A 2 2.440 0.600 -1.370 1.00 45.03 C ATOM 3 C GLY A 2 3.731 1.394 -1.388 1.00 34.22 C ATOM 4 O GLY A 2 4.801 0.845 -1.653 1.00 23.24 O ATOM 0 HA2 GLY A 2 2.382 -0.013 -2.269 1.00 45.03 H new ATOM 0 HA3 GLY A 2 1.594 1.287 -1.397 1.00 45.03 H new ATOM 8 N ASN A 3 3.633 2.689 -1.105 1.00 51.23 N ATOM 9 CA ASN A 3 4.803 3.559 -1.092 1.00 63.24 C ATOM 10 C ASN A 3 5.585 3.439 -2.397 1.00 71.01 C ATOM 11 O ASN A 3 6.760 3.066 -2.397 1.00 2.13 O ATOM 12 CB ASN A 3 5.708 3.214 0.092 1.00 40.24 C ATOM 13 CG ASN A 3 6.720 4.305 0.383 1.00 24.54 C ATOM 14 OD1 ASN A 3 7.036 5.121 -0.483 1.00 31.44 O ATOM 15 ND2 ASN A 3 7.233 4.324 1.608 1.00 53.43 N ATOM 0 H ASN A 3 2.756 3.159 -0.882 1.00 51.23 H new ATOM 0 HA ASN A 3 4.458 4.588 -0.989 1.00 63.24 H new ATOM 0 HB2 ASN A 3 5.095 3.045 0.977 1.00 40.24 H new ATOM 0 HB3 ASN A 3 6.233 2.281 -0.115 1.00 40.24 H new ATOM 0 HD21 ASN A 3 7.918 5.035 1.863 1.00 53.43 H new ATOM 0 HD22 ASN A 3 6.942 3.627 2.294 1.00 53.43 H new ATOM 22 N LEU A 4 4.927 3.758 -3.506 1.00 34.41 N ATOM 23 CA LEU A 4 5.560 3.686 -4.819 1.00 34.42 C ATOM 24 C LEU A 4 6.206 2.321 -5.038 1.00 22.30 C ATOM 25 O LEU A 4 7.297 2.222 -5.599 1.00 2.30 O ATOM 26 CB LEU A 4 6.612 4.788 -4.960 1.00 25.41 C ATOM 27 CG LEU A 4 6.696 5.464 -6.329 1.00 32.34 C ATOM 28 CD1 LEU A 4 7.858 6.445 -6.370 1.00 21.23 C ATOM 29 CD2 LEU A 4 6.835 4.423 -7.430 1.00 31.50 C ATOM 0 H LEU A 4 3.956 4.069 -3.523 1.00 34.41 H new ATOM 0 HA LEU A 4 4.788 3.828 -5.576 1.00 34.42 H new ATOM 0 HB2 LEU A 4 6.410 5.553 -4.211 1.00 25.41 H new ATOM 0 HB3 LEU A 4 7.588 4.363 -4.726 1.00 25.41 H new ATOM 0 HG LEU A 4 5.773 6.019 -6.496 1.00 32.34 H new ATOM 0 HD11 LEU A 4 7.902 6.916 -7.352 1.00 21.23 H new ATOM 0 HD12 LEU A 4 7.716 7.210 -5.606 1.00 21.23 H new ATOM 0 HD13 LEU A 4 8.790 5.913 -6.181 1.00 21.23 H new ATOM 0 HD21 LEU A 4 6.893 4.922 -8.397 1.00 31.50 H new ATOM 0 HD22 LEU A 4 7.741 3.840 -7.267 1.00 31.50 H new ATOM 0 HD23 LEU A 4 5.970 3.760 -7.415 1.00 31.50 H new ATOM 41 N LYS A 5 5.523 1.272 -4.594 1.00 4.01 N ATOM 42 CA LYS A 5 6.026 -0.088 -4.744 1.00 54.45 C ATOM 43 C LYS A 5 6.419 -0.366 -6.193 1.00 15.33 C ATOM 44 O LYS A 5 5.584 -0.302 -7.095 1.00 61.30 O ATOM 45 CB LYS A 5 4.971 -1.099 -4.288 1.00 61.35 C ATOM 46 CG LYS A 5 5.510 -2.510 -4.128 1.00 5.02 C ATOM 47 CD LYS A 5 5.392 -2.992 -2.691 1.00 62.25 C ATOM 48 CE LYS A 5 6.519 -3.947 -2.331 1.00 33.25 C ATOM 49 NZ LYS A 5 7.671 -3.237 -1.708 1.00 65.35 N ATOM 0 H LYS A 5 4.619 1.338 -4.127 1.00 4.01 H new ATOM 0 HA LYS A 5 6.913 -0.191 -4.118 1.00 54.45 H new ATOM 0 HB2 LYS A 5 4.551 -0.770 -3.338 1.00 61.35 H new ATOM 0 HB3 LYS A 5 4.155 -1.111 -5.010 1.00 61.35 H new ATOM 0 HG2 LYS A 5 4.964 -3.186 -4.786 1.00 5.02 H new ATOM 0 HG3 LYS A 5 6.555 -2.539 -4.438 1.00 5.02 H new ATOM 0 HD2 LYS A 5 5.409 -2.136 -2.016 1.00 62.25 H new ATOM 0 HD3 LYS A 5 4.433 -3.490 -2.550 1.00 62.25 H new ATOM 0 HE2 LYS A 5 6.146 -4.706 -1.644 1.00 33.25 H new ATOM 0 HE3 LYS A 5 6.855 -4.467 -3.228 1.00 33.25 H new ATOM 0 HZ1 LYS A 5 8.418 -3.923 -1.477 1.00 65.35 H new ATOM 0 HZ2 LYS A 5 8.044 -2.530 -2.373 1.00 65.35 H new ATOM 0 HZ3 LYS A 5 7.357 -2.762 -0.838 1.00 65.35 H new ATOM 63 N SER A 6 7.693 -0.676 -6.406 1.00 40.43 N ATOM 64 CA SER A 6 8.196 -0.962 -7.745 1.00 44.10 C ATOM 65 C SER A 6 7.433 -2.124 -8.375 1.00 70.45 C ATOM 66 O SER A 6 7.396 -2.266 -9.598 1.00 35.11 O ATOM 67 CB SER A 6 9.690 -1.286 -7.694 1.00 63.10 C ATOM 68 OG SER A 6 9.923 -2.518 -7.034 1.00 51.32 O ATOM 0 H SER A 6 8.396 -0.736 -5.669 1.00 40.43 H new ATOM 0 HA SER A 6 8.045 -0.075 -8.360 1.00 44.10 H new ATOM 0 HB2 SER A 6 10.090 -1.331 -8.707 1.00 63.10 H new ATOM 0 HB3 SER A 6 10.221 -0.487 -7.177 1.00 63.10 H new ATOM 0 HG SER A 6 10.885 -2.703 -7.016 1.00 51.32 H new ATOM 74 N ARG A 7 6.828 -2.952 -7.531 1.00 1.41 N ATOM 75 CA ARG A 7 6.068 -4.103 -8.004 1.00 4.42 C ATOM 76 C ARG A 7 4.770 -3.659 -8.674 1.00 15.32 C ATOM 77 O ARG A 7 4.570 -3.880 -9.869 1.00 3.44 O ATOM 78 CB ARG A 7 5.756 -5.048 -6.842 1.00 34.42 C ATOM 79 CG ARG A 7 5.369 -6.450 -7.283 1.00 43.24 C ATOM 80 CD ARG A 7 4.109 -6.927 -6.579 1.00 1.54 C ATOM 81 NE ARG A 7 4.120 -8.371 -6.356 1.00 72.14 N ATOM 82 CZ ARG A 7 3.327 -8.987 -5.488 1.00 32.54 C ATOM 83 NH1 ARG A 7 2.463 -8.289 -4.763 1.00 44.01 N ATOM 84 NH2 ARG A 7 3.397 -10.304 -5.340 1.00 64.13 N ATOM 0 H ARG A 7 6.849 -2.848 -6.517 1.00 1.41 H new ATOM 0 HA ARG A 7 6.676 -4.630 -8.739 1.00 4.42 H new ATOM 0 HB2 ARG A 7 6.628 -5.109 -6.191 1.00 34.42 H new ATOM 0 HB3 ARG A 7 4.944 -4.626 -6.250 1.00 34.42 H new ATOM 0 HG2 ARG A 7 5.212 -6.463 -8.362 1.00 43.24 H new ATOM 0 HG3 ARG A 7 6.188 -7.138 -7.072 1.00 43.24 H new ATOM 0 HD2 ARG A 7 4.011 -6.413 -5.623 1.00 1.54 H new ATOM 0 HD3 ARG A 7 3.237 -6.659 -7.175 1.00 1.54 H new ATOM 0 HE ARG A 7 4.773 -8.937 -6.897 1.00 72.14 H new ATOM 0 HH11 ARG A 7 2.407 -7.276 -4.872 1.00 44.01 H new ATOM 0 HH12 ARG A 7 1.855 -8.765 -4.097 1.00 44.01 H new ATOM 0 HH21 ARG A 7 4.061 -10.845 -5.894 1.00 64.13 H new ATOM 0 HH22 ARG A 7 2.787 -10.775 -4.672 1.00 64.13 H new ATOM 98 N ASP A 8 3.892 -3.034 -7.897 1.00 61.34 N ATOM 99 CA ASP A 8 2.615 -2.558 -8.415 1.00 51.12 C ATOM 100 C ASP A 8 2.819 -1.402 -9.389 1.00 31.34 C ATOM 101 O ASP A 8 1.972 -1.138 -10.241 1.00 44.11 O ATOM 102 CB ASP A 8 1.706 -2.119 -7.266 1.00 32.25 C ATOM 103 CG ASP A 8 0.643 -3.150 -6.943 1.00 31.34 C ATOM 104 OD1 ASP A 8 0.959 -4.126 -6.230 1.00 52.22 O ATOM 105 OD2 ASP A 8 -0.506 -2.980 -7.401 1.00 0.41 O ATOM 0 H ASP A 8 4.042 -2.845 -6.906 1.00 61.34 H new ATOM 0 HA ASP A 8 2.140 -3.380 -8.950 1.00 51.12 H new ATOM 0 HB2 ASP A 8 2.311 -1.935 -6.378 1.00 32.25 H new ATOM 0 HB3 ASP A 8 1.226 -1.176 -7.526 1.00 32.25 H new ATOM 110 N TRP A 9 3.948 -0.715 -9.254 1.00 53.42 N ATOM 111 CA TRP A 9 4.264 0.414 -10.121 1.00 44.33 C ATOM 112 C TRP A 9 4.559 -0.056 -11.542 1.00 33.11 C ATOM 113 O TRP A 9 3.851 0.297 -12.484 1.00 64.13 O ATOM 114 CB TRP A 9 5.460 1.191 -9.569 1.00 33.05 C ATOM 115 CG TRP A 9 5.952 2.262 -10.494 1.00 5.13 C ATOM 116 CD1 TRP A 9 7.219 2.406 -10.980 1.00 63.35 C ATOM 117 CD2 TRP A 9 5.184 3.340 -11.041 1.00 21.44 C ATOM 118 NE1 TRP A 9 7.286 3.510 -11.798 1.00 33.14 N ATOM 119 CE2 TRP A 9 6.050 4.100 -11.851 1.00 75.14 C ATOM 120 CE3 TRP A 9 3.849 3.737 -10.925 1.00 70.52 C ATOM 121 CZ2 TRP A 9 5.625 5.231 -12.541 1.00 22.24 C ATOM 122 CZ3 TRP A 9 3.427 4.862 -11.611 1.00 33.32 C ATOM 123 CH2 TRP A 9 4.312 5.597 -12.410 1.00 74.12 C ATOM 0 H TRP A 9 4.660 -0.920 -8.553 1.00 53.42 H new ATOM 0 HA TRP A 9 3.395 1.072 -10.149 1.00 44.33 H new ATOM 0 HB2 TRP A 9 5.182 1.643 -8.617 1.00 33.05 H new ATOM 0 HB3 TRP A 9 6.274 0.495 -9.366 1.00 33.05 H new ATOM 0 HD1 TRP A 9 8.047 1.750 -10.756 1.00 63.35 H new ATOM 0 HE1 TRP A 9 8.120 3.837 -12.286 1.00 33.14 H new ATOM 0 HE3 TRP A 9 3.160 3.176 -10.311 1.00 70.52 H new ATOM 0 HZ2 TRP A 9 6.306 5.799 -13.157 1.00 22.24 H new ATOM 0 HZ3 TRP A 9 2.398 5.179 -11.529 1.00 33.32 H new ATOM 0 HH2 TRP A 9 3.951 6.470 -12.933 1.00 74.12 H new ATOM 134 N LYS A 10 5.610 -0.855 -11.689 1.00 35.40 N ATOM 135 CA LYS A 10 6.000 -1.376 -12.993 1.00 44.34 C ATOM 136 C LYS A 10 4.929 -2.308 -13.550 1.00 1.21 C ATOM 137 O LYS A 10 4.826 -2.497 -14.761 1.00 5.41 O ATOM 138 CB LYS A 10 7.334 -2.119 -12.891 1.00 41.43 C ATOM 139 CG LYS A 10 8.492 -1.234 -12.463 1.00 23.23 C ATOM 140 CD LYS A 10 9.826 -1.944 -12.623 1.00 10.44 C ATOM 141 CE LYS A 10 10.850 -1.059 -13.314 1.00 64.43 C ATOM 142 NZ LYS A 10 11.801 -1.851 -14.141 1.00 63.30 N ATOM 0 H LYS A 10 6.208 -1.156 -10.919 1.00 35.40 H new ATOM 0 HA LYS A 10 6.112 -0.532 -13.674 1.00 44.34 H new ATOM 0 HB2 LYS A 10 7.231 -2.938 -12.179 1.00 41.43 H new ATOM 0 HB3 LYS A 10 7.567 -2.565 -13.858 1.00 41.43 H new ATOM 0 HG2 LYS A 10 8.492 -0.320 -13.057 1.00 23.23 H new ATOM 0 HG3 LYS A 10 8.359 -0.938 -11.423 1.00 23.23 H new ATOM 0 HD2 LYS A 10 10.201 -2.240 -11.643 1.00 10.44 H new ATOM 0 HD3 LYS A 10 9.686 -2.858 -13.200 1.00 10.44 H new ATOM 0 HE2 LYS A 10 10.336 -0.334 -13.946 1.00 64.43 H new ATOM 0 HE3 LYS A 10 11.404 -0.493 -12.566 1.00 64.43 H new ATOM 0 HZ1 LYS A 10 12.483 -1.210 -14.595 1.00 63.30 H new ATOM 0 HZ2 LYS A 10 12.310 -2.525 -13.535 1.00 63.30 H new ATOM 0 HZ3 LYS A 10 11.275 -2.372 -14.872 1.00 63.30 H new ATOM 156 N MET A 11 4.133 -2.886 -12.656 1.00 43.30 N ATOM 157 CA MET A 11 3.066 -3.796 -13.060 1.00 60.33 C ATOM 158 C MET A 11 1.915 -3.032 -13.708 1.00 35.22 C ATOM 159 O MET A 11 1.618 -3.222 -14.887 1.00 31.33 O ATOM 160 CB MET A 11 2.556 -4.584 -11.852 1.00 21.12 C ATOM 161 CG MET A 11 1.405 -5.521 -12.180 1.00 23.12 C ATOM 162 SD MET A 11 0.968 -6.595 -10.799 1.00 44.51 S ATOM 163 CE MET A 11 1.859 -8.086 -11.235 1.00 71.30 C ATOM 0 H MET A 11 4.206 -2.741 -11.649 1.00 43.30 H new ATOM 0 HA MET A 11 3.473 -4.492 -13.793 1.00 60.33 H new ATOM 0 HB2 MET A 11 3.378 -5.164 -11.434 1.00 21.12 H new ATOM 0 HB3 MET A 11 2.235 -3.884 -11.081 1.00 21.12 H new ATOM 0 HG2 MET A 11 0.534 -4.933 -12.468 1.00 23.12 H new ATOM 0 HG3 MET A 11 1.674 -6.134 -13.040 1.00 23.12 H new ATOM 0 HE1 MET A 11 1.688 -8.848 -10.474 1.00 71.30 H new ATOM 0 HE2 MET A 11 1.507 -8.451 -12.200 1.00 71.30 H new ATOM 0 HE3 MET A 11 2.925 -7.868 -11.297 1.00 71.30 H new ATOM 173 N ALA A 12 1.271 -2.170 -12.928 1.00 60.33 N ATOM 174 CA ALA A 12 0.155 -1.377 -13.427 1.00 62.12 C ATOM 175 C ALA A 12 0.538 -0.626 -14.698 1.00 34.31 C ATOM 176 O ALA A 12 -0.238 -0.564 -15.651 1.00 44.32 O ATOM 177 CB ALA A 12 -0.319 -0.402 -12.359 1.00 0.13 C ATOM 0 H ALA A 12 1.503 -2.003 -11.949 1.00 60.33 H new ATOM 0 HA ALA A 12 -0.661 -2.058 -13.671 1.00 62.12 H new ATOM 0 HB1 ALA A 12 -1.153 0.184 -12.746 1.00 0.13 H new ATOM 0 HB2 ALA A 12 -0.642 -0.956 -11.478 1.00 0.13 H new ATOM 0 HB3 ALA A 12 0.498 0.266 -12.087 1.00 0.13 H new ATOM 183 N ILE A 13 1.739 -0.058 -14.704 1.00 63.41 N ATOM 184 CA ILE A 13 2.225 0.688 -15.859 1.00 31.34 C ATOM 185 C ILE A 13 2.429 -0.229 -17.059 1.00 71.42 C ATOM 186 O ILE A 13 2.163 0.152 -18.198 1.00 61.25 O ATOM 187 CB ILE A 13 3.550 1.409 -15.545 1.00 42.44 C ATOM 188 CG1 ILE A 13 3.331 2.486 -14.480 1.00 1.11 C ATOM 189 CG2 ILE A 13 4.132 2.020 -16.811 1.00 5.32 C ATOM 190 CD1 ILE A 13 2.436 3.616 -14.938 1.00 3.04 C ATOM 0 H ILE A 13 2.393 -0.100 -13.923 1.00 63.41 H new ATOM 0 HA ILE A 13 1.464 1.431 -16.099 1.00 31.34 H new ATOM 0 HB ILE A 13 4.260 0.679 -15.156 1.00 42.44 H new ATOM 0 HG12 ILE A 13 2.896 2.025 -13.593 1.00 1.11 H new ATOM 0 HG13 ILE A 13 4.297 2.895 -14.185 1.00 1.11 H new ATOM 0 HG21 ILE A 13 5.068 2.526 -16.574 1.00 5.32 H new ATOM 0 HG22 ILE A 13 4.320 1.233 -17.542 1.00 5.32 H new ATOM 0 HG23 ILE A 13 3.426 2.739 -17.226 1.00 5.32 H new ATOM 0 HD11 ILE A 13 2.325 4.342 -14.132 1.00 3.04 H new ATOM 0 HD12 ILE A 13 2.880 4.103 -15.807 1.00 3.04 H new ATOM 0 HD13 ILE A 13 1.457 3.219 -15.206 1.00 3.04 H new ATOM 202 N LYS A 14 2.904 -1.442 -16.796 1.00 22.32 N ATOM 203 CA LYS A 14 3.142 -2.417 -17.854 1.00 34.22 C ATOM 204 C LYS A 14 1.831 -2.848 -18.502 1.00 5.55 C ATOM 205 O LYS A 14 1.801 -3.226 -19.673 1.00 25.35 O ATOM 206 CB LYS A 14 3.872 -3.640 -17.293 1.00 51.24 C ATOM 207 CG LYS A 14 5.385 -3.548 -17.402 1.00 24.00 C ATOM 208 CD LYS A 14 5.862 -3.857 -18.811 1.00 12.14 C ATOM 209 CE LYS A 14 7.378 -3.951 -18.878 1.00 33.22 C ATOM 210 NZ LYS A 14 7.847 -4.428 -20.208 1.00 13.41 N ATOM 0 H LYS A 14 3.132 -1.773 -15.859 1.00 22.32 H new ATOM 0 HA LYS A 14 3.765 -1.946 -18.614 1.00 34.22 H new ATOM 0 HB2 LYS A 14 3.599 -3.767 -16.246 1.00 51.24 H new ATOM 0 HB3 LYS A 14 3.531 -4.530 -17.822 1.00 51.24 H new ATOM 0 HG2 LYS A 14 5.711 -2.548 -17.118 1.00 24.00 H new ATOM 0 HG3 LYS A 14 5.844 -4.244 -16.700 1.00 24.00 H new ATOM 0 HD2 LYS A 14 5.423 -4.796 -19.147 1.00 12.14 H new ATOM 0 HD3 LYS A 14 5.514 -3.081 -19.492 1.00 12.14 H new ATOM 0 HE2 LYS A 14 7.812 -2.973 -18.670 1.00 33.22 H new ATOM 0 HE3 LYS A 14 7.734 -4.629 -18.103 1.00 33.22 H new ATOM 0 HZ1 LYS A 14 8.886 -4.478 -20.212 1.00 13.41 H new ATOM 0 HZ2 LYS A 14 7.454 -5.372 -20.397 1.00 13.41 H new ATOM 0 HZ3 LYS A 14 7.529 -3.767 -20.946 1.00 13.41 H new ATOM 224 N ARG A 15 0.748 -2.788 -17.733 1.00 24.44 N ATOM 225 CA ARG A 15 -0.567 -3.171 -18.233 1.00 12.32 C ATOM 226 C ARG A 15 -1.129 -2.100 -19.163 1.00 41.15 C ATOM 227 O ARG A 15 -1.525 -2.390 -20.293 1.00 74.04 O ATOM 228 CB ARG A 15 -1.530 -3.407 -17.069 1.00 24.51 C ATOM 229 CG ARG A 15 -1.193 -4.633 -16.237 1.00 34.23 C ATOM 230 CD ARG A 15 -1.392 -5.915 -17.029 1.00 53.01 C ATOM 231 NE ARG A 15 -1.028 -7.099 -16.255 1.00 1.33 N ATOM 232 CZ ARG A 15 0.224 -7.504 -16.076 1.00 34.41 C ATOM 233 NH1 ARG A 15 1.227 -6.824 -16.612 1.00 71.43 N ATOM 234 NH2 ARG A 15 0.475 -8.591 -15.357 1.00 52.43 N ATOM 0 H ARG A 15 0.756 -2.478 -16.761 1.00 24.44 H new ATOM 0 HA ARG A 15 -0.457 -4.097 -18.798 1.00 12.32 H new ATOM 0 HB2 ARG A 15 -1.528 -2.529 -16.423 1.00 24.51 H new ATOM 0 HB3 ARG A 15 -2.542 -3.512 -17.461 1.00 24.51 H new ATOM 0 HG2 ARG A 15 -0.159 -4.571 -15.897 1.00 34.23 H new ATOM 0 HG3 ARG A 15 -1.821 -4.653 -15.346 1.00 34.23 H new ATOM 0 HD2 ARG A 15 -2.434 -5.991 -17.339 1.00 53.01 H new ATOM 0 HD3 ARG A 15 -0.791 -5.877 -17.937 1.00 53.01 H new ATOM 0 HE ARG A 15 -1.777 -7.645 -15.828 1.00 1.33 H new ATOM 0 HH11 ARG A 15 1.038 -5.987 -17.164 1.00 71.43 H new ATOM 0 HH12 ARG A 15 2.188 -7.137 -16.473 1.00 71.43 H new ATOM 0 HH21 ARG A 15 -0.294 -9.116 -14.941 1.00 52.43 H new ATOM 0 HH22 ARG A 15 1.437 -8.901 -15.220 1.00 52.43 H new ATOM 248 N CYS A 16 -1.161 -0.863 -18.682 1.00 33.30 N ATOM 249 CA CYS A 16 -1.675 0.252 -19.470 1.00 34.34 C ATOM 250 C CYS A 16 -0.808 0.494 -20.701 1.00 15.23 C ATOM 251 O CYS A 16 -1.266 1.059 -21.693 1.00 71.41 O ATOM 252 CB CYS A 16 -1.737 1.520 -18.618 1.00 20.43 C ATOM 253 SG CYS A 16 -0.121 2.243 -18.251 1.00 74.45 S ATOM 0 H CYS A 16 -0.837 -0.606 -17.750 1.00 33.30 H new ATOM 0 HA CYS A 16 -2.681 -0.004 -19.802 1.00 34.34 H new ATOM 0 HB2 CYS A 16 -2.346 2.262 -19.134 1.00 20.43 H new ATOM 0 HB3 CYS A 16 -2.242 1.290 -17.680 1.00 20.43 H new ATOM 0 HG CYS A 16 -0.274 3.277 -17.477 1.00 74.45 H new ATOM 259 N SER A 17 0.448 0.063 -20.628 1.00 11.43 N ATOM 260 CA SER A 17 1.381 0.236 -21.734 1.00 43.14 C ATOM 261 C SER A 17 0.820 -0.365 -23.018 1.00 41.24 C ATOM 262 O SER A 17 1.175 0.054 -24.120 1.00 2.53 O ATOM 263 CB SER A 17 2.727 -0.410 -21.400 1.00 40.20 C ATOM 264 OG SER A 17 2.752 -1.770 -21.798 1.00 4.32 O ATOM 0 H SER A 17 0.842 -0.409 -19.814 1.00 11.43 H new ATOM 0 HA SER A 17 1.528 1.305 -21.888 1.00 43.14 H new ATOM 0 HB2 SER A 17 3.529 0.133 -21.900 1.00 40.20 H new ATOM 0 HB3 SER A 17 2.913 -0.338 -20.328 1.00 40.20 H new ATOM 0 HG SER A 17 2.559 -2.341 -21.025 1.00 4.32 H new ATOM 270 N ASN A 18 -0.060 -1.351 -22.868 1.00 73.41 N ATOM 271 CA ASN A 18 -0.671 -2.012 -24.016 1.00 21.45 C ATOM 272 C ASN A 18 -2.031 -1.399 -24.335 1.00 51.21 C ATOM 273 O ASN A 18 -2.911 -2.065 -24.879 1.00 3.32 O ATOM 274 CB ASN A 18 -0.825 -3.510 -23.745 1.00 33.13 C ATOM 275 CG ASN A 18 -0.205 -4.361 -24.837 1.00 32.33 C ATOM 276 OD1 ASN A 18 -0.879 -4.760 -25.786 1.00 35.45 O ATOM 277 ND2 ASN A 18 1.086 -4.643 -24.706 1.00 61.41 N ATOM 0 H ASN A 18 -0.365 -1.709 -21.963 1.00 73.41 H new ATOM 0 HA ASN A 18 -0.017 -1.871 -24.877 1.00 21.45 H new ATOM 0 HB2 ASN A 18 -0.360 -3.754 -22.790 1.00 33.13 H new ATOM 0 HB3 ASN A 18 -1.884 -3.753 -23.655 1.00 33.13 H new ATOM 0 HD21 ASN A 18 1.558 -5.212 -25.409 1.00 61.41 H new ATOM 0 HD22 ASN A 18 1.606 -4.291 -23.902 1.00 61.41 H new ATOM 284 N VAL A 19 -2.195 -0.125 -23.994 1.00 63.21 N ATOM 285 CA VAL A 19 -3.446 0.579 -24.246 1.00 22.24 C ATOM 286 C VAL A 19 -3.221 1.803 -25.125 1.00 63.24 C ATOM 287 O VAL A 19 -2.154 2.417 -25.092 1.00 31.43 O ATOM 288 CB VAL A 19 -4.116 1.021 -22.931 1.00 70.11 C ATOM 289 CG1 VAL A 19 -5.505 1.579 -23.201 1.00 11.31 C ATOM 290 CG2 VAL A 19 -4.180 -0.139 -21.950 1.00 34.24 C ATOM 0 H VAL A 19 -1.477 0.441 -23.542 1.00 63.21 H new ATOM 0 HA VAL A 19 -4.103 -0.120 -24.763 1.00 22.24 H new ATOM 0 HB VAL A 19 -3.513 1.812 -22.484 1.00 70.11 H new ATOM 0 HG11 VAL A 19 -5.963 1.886 -22.261 1.00 11.31 H new ATOM 0 HG12 VAL A 19 -5.429 2.440 -23.865 1.00 11.31 H new ATOM 0 HG13 VAL A 19 -6.120 0.812 -23.671 1.00 11.31 H new ATOM 0 HG21 VAL A 19 -4.656 0.191 -21.027 1.00 34.24 H new ATOM 0 HG22 VAL A 19 -4.759 -0.953 -22.386 1.00 34.24 H new ATOM 0 HG23 VAL A 19 -3.170 -0.488 -21.733 1.00 34.24 H new ATOM 300 N ALA A 20 -4.233 2.155 -25.912 1.00 74.22 N ATOM 301 CA ALA A 20 -4.146 3.309 -26.799 1.00 20.14 C ATOM 302 C ALA A 20 -4.547 4.589 -26.075 1.00 61.31 C ATOM 303 O ALA A 20 -5.057 4.548 -24.955 1.00 61.21 O ATOM 304 CB ALA A 20 -5.021 3.098 -28.025 1.00 50.14 C ATOM 0 H ALA A 20 -5.122 1.657 -25.953 1.00 74.22 H new ATOM 0 HA ALA A 20 -3.109 3.413 -27.119 1.00 20.14 H new ATOM 0 HB1 ALA A 20 -4.947 3.967 -28.679 1.00 50.14 H new ATOM 0 HB2 ALA A 20 -4.687 2.210 -28.562 1.00 50.14 H new ATOM 0 HB3 ALA A 20 -6.057 2.965 -27.714 1.00 50.14 H new ATOM 310 N VAL A 21 -4.312 5.727 -26.721 1.00 32.31 N ATOM 311 CA VAL A 21 -4.649 7.021 -26.138 1.00 53.42 C ATOM 312 C VAL A 21 -6.150 7.277 -26.201 1.00 20.43 C ATOM 313 O VAL A 21 -6.709 7.966 -25.348 1.00 51.12 O ATOM 314 CB VAL A 21 -3.912 8.168 -26.855 1.00 11.43 C ATOM 315 CG1 VAL A 21 -4.162 8.108 -28.354 1.00 40.42 C ATOM 316 CG2 VAL A 21 -4.343 9.513 -26.288 1.00 53.02 C ATOM 0 H VAL A 21 -3.890 5.779 -27.648 1.00 32.31 H new ATOM 0 HA VAL A 21 -4.332 6.992 -25.095 1.00 53.42 H new ATOM 0 HB VAL A 21 -2.842 8.053 -26.684 1.00 11.43 H new ATOM 0 HG11 VAL A 21 -3.634 8.926 -28.844 1.00 40.42 H new ATOM 0 HG12 VAL A 21 -3.801 7.157 -28.745 1.00 40.42 H new ATOM 0 HG13 VAL A 21 -5.231 8.198 -28.549 1.00 40.42 H new ATOM 0 HG21 VAL A 21 -3.813 10.313 -26.805 1.00 53.02 H new ATOM 0 HG22 VAL A 21 -5.417 9.640 -26.428 1.00 53.02 H new ATOM 0 HG23 VAL A 21 -4.109 9.551 -25.224 1.00 53.02 H new ATOM 326 N GLY A 22 -6.799 6.718 -27.218 1.00 10.43 N ATOM 327 CA GLY A 22 -8.231 6.897 -27.373 1.00 31.13 C ATOM 328 C GLY A 22 -8.787 6.126 -28.554 1.00 31.35 C ATOM 329 O GLY A 22 -8.089 5.309 -29.155 1.00 42.34 O ATOM 0 H GLY A 22 -6.359 6.144 -27.937 1.00 10.43 H new ATOM 0 HA2 GLY A 22 -8.735 6.574 -26.462 1.00 31.13 H new ATOM 0 HA3 GLY A 22 -8.450 7.957 -27.500 1.00 31.13 H new ATOM 333 N VAL A 23 -10.048 6.384 -28.886 1.00 11.13 N ATOM 334 CA VAL A 23 -10.698 5.708 -30.003 1.00 34.21 C ATOM 335 C VAL A 23 -10.522 6.492 -31.298 1.00 2.23 C ATOM 336 O VAL A 23 -10.496 5.918 -32.385 1.00 22.22 O ATOM 337 CB VAL A 23 -12.202 5.505 -29.737 1.00 42.22 C ATOM 338 CG1 VAL A 23 -12.892 6.845 -29.528 1.00 51.11 C ATOM 339 CG2 VAL A 23 -12.846 4.737 -30.882 1.00 61.54 C ATOM 0 H VAL A 23 -10.640 7.056 -28.398 1.00 11.13 H new ATOM 0 HA VAL A 23 -10.220 4.734 -30.105 1.00 34.21 H new ATOM 0 HB VAL A 23 -12.317 4.918 -28.826 1.00 42.22 H new ATOM 0 HG11 VAL A 23 -13.954 6.682 -29.341 1.00 51.11 H new ATOM 0 HG12 VAL A 23 -12.447 7.354 -28.673 1.00 51.11 H new ATOM 0 HG13 VAL A 23 -12.770 7.460 -30.420 1.00 51.11 H new ATOM 0 HG21 VAL A 23 -13.908 4.602 -30.678 1.00 61.54 H new ATOM 0 HG22 VAL A 23 -12.723 5.296 -31.810 1.00 61.54 H new ATOM 0 HG23 VAL A 23 -12.369 3.762 -30.980 1.00 61.54 H new ATOM 349 N GLY A 24 -10.402 7.811 -31.172 1.00 53.44 N ATOM 350 CA GLY A 24 -10.230 8.654 -32.341 1.00 3.31 C ATOM 351 C GLY A 24 -9.389 9.881 -32.052 1.00 54.24 C ATOM 352 O GLY A 24 -8.552 9.870 -31.151 1.00 22.34 O ATOM 0 H GLY A 24 -10.421 8.310 -30.282 1.00 53.44 H new ATOM 0 HA2 GLY A 24 -9.761 8.075 -33.137 1.00 3.31 H new ATOM 0 HA3 GLY A 24 -11.208 8.966 -32.707 1.00 3.31 H new ATOM 356 N GLY A 25 -9.610 10.943 -32.821 1.00 52.14 N ATOM 357 CA GLY A 25 -8.856 12.168 -32.629 1.00 34.04 C ATOM 358 C GLY A 25 -7.428 12.054 -33.124 1.00 64.13 C ATOM 359 O GLY A 25 -7.160 12.224 -34.314 1.00 40.32 O ATOM 0 H GLY A 25 -10.298 10.977 -33.573 1.00 52.14 H new ATOM 0 HA2 GLY A 25 -9.355 12.984 -33.153 1.00 34.04 H new ATOM 0 HA3 GLY A 25 -8.851 12.425 -31.570 1.00 34.04 H new ATOM 363 N LYS A 26 -6.507 11.768 -32.210 1.00 43.24 N ATOM 364 CA LYS A 26 -5.098 11.633 -32.559 1.00 55.51 C ATOM 365 C LYS A 26 -4.635 10.188 -32.399 1.00 62.14 C ATOM 366 O LYS A 26 -5.069 9.484 -31.489 1.00 33.34 O ATOM 367 CB LYS A 26 -4.243 12.553 -31.685 1.00 31.13 C ATOM 368 CG LYS A 26 -4.299 12.211 -30.205 1.00 42.35 C ATOM 369 CD LYS A 26 -3.952 13.412 -29.342 1.00 3.33 C ATOM 370 CE LYS A 26 -2.803 13.104 -28.395 1.00 74.14 C ATOM 371 NZ LYS A 26 -2.383 14.306 -27.623 1.00 52.11 N ATOM 0 H LYS A 26 -6.712 11.625 -31.221 1.00 43.24 H new ATOM 0 HA LYS A 26 -4.979 11.922 -33.603 1.00 55.51 H new ATOM 0 HB2 LYS A 26 -3.208 12.502 -32.022 1.00 31.13 H new ATOM 0 HB3 LYS A 26 -4.573 13.582 -31.824 1.00 31.13 H new ATOM 0 HG2 LYS A 26 -5.297 11.855 -29.950 1.00 42.35 H new ATOM 0 HG3 LYS A 26 -3.606 11.397 -29.992 1.00 42.35 H new ATOM 0 HD2 LYS A 26 -3.684 14.254 -29.980 1.00 3.33 H new ATOM 0 HD3 LYS A 26 -4.828 13.714 -28.767 1.00 3.33 H new ATOM 0 HE2 LYS A 26 -3.103 12.316 -27.705 1.00 74.14 H new ATOM 0 HE3 LYS A 26 -1.955 12.724 -28.965 1.00 74.14 H new ATOM 0 HZ1 LYS A 26 -1.598 14.055 -26.989 1.00 52.11 H new ATOM 0 HZ2 LYS A 26 -2.073 15.050 -28.280 1.00 52.11 H new ATOM 0 HZ3 LYS A 26 -3.185 14.654 -27.060 1.00 52.11 H new ATOM 385 N SER A 27 -3.749 9.753 -33.291 1.00 23.00 N ATOM 386 CA SER A 27 -3.229 8.391 -33.250 1.00 22.13 C ATOM 387 C SER A 27 -2.002 8.306 -32.347 1.00 24.13 C ATOM 388 O SER A 27 -0.981 8.942 -32.605 1.00 71.43 O ATOM 389 CB SER A 27 -2.872 7.916 -34.660 1.00 64.32 C ATOM 390 OG SER A 27 -2.609 6.524 -34.678 1.00 32.52 O ATOM 0 H SER A 27 -3.377 10.324 -34.050 1.00 23.00 H new ATOM 0 HA SER A 27 -4.005 7.744 -32.842 1.00 22.13 H new ATOM 0 HB2 SER A 27 -3.691 8.143 -35.342 1.00 64.32 H new ATOM 0 HB3 SER A 27 -1.998 8.459 -35.020 1.00 64.32 H new ATOM 0 HG SER A 27 -2.385 6.245 -35.590 1.00 32.52 H new ATOM 396 N LYS A 28 -2.111 7.515 -31.285 1.00 13.34 N ATOM 397 CA LYS A 28 -1.012 7.342 -30.342 1.00 1.42 C ATOM 398 C LYS A 28 -1.348 6.276 -29.304 1.00 42.12 C ATOM 399 O LYS A 28 -2.464 5.755 -29.272 1.00 31.50 O ATOM 400 CB LYS A 28 -0.700 8.668 -29.645 1.00 32.42 C ATOM 401 CG LYS A 28 0.766 9.059 -29.710 1.00 15.11 C ATOM 402 CD LYS A 28 0.973 10.309 -30.548 1.00 74.32 C ATOM 403 CE LYS A 28 2.361 10.895 -30.341 1.00 13.14 C ATOM 404 NZ LYS A 28 2.314 12.367 -30.118 1.00 31.21 N ATOM 0 H LYS A 28 -2.950 6.983 -31.055 1.00 13.34 H new ATOM 0 HA LYS A 28 -0.134 7.016 -30.900 1.00 1.42 H new ATOM 0 HB2 LYS A 28 -1.298 9.457 -30.100 1.00 32.42 H new ATOM 0 HB3 LYS A 28 -1.003 8.600 -28.600 1.00 32.42 H new ATOM 0 HG2 LYS A 28 1.143 9.229 -28.702 1.00 15.11 H new ATOM 0 HG3 LYS A 28 1.344 8.237 -30.132 1.00 15.11 H new ATOM 0 HD2 LYS A 28 0.832 10.069 -31.602 1.00 74.32 H new ATOM 0 HD3 LYS A 28 0.220 11.053 -30.286 1.00 74.32 H new ATOM 0 HE2 LYS A 28 2.835 10.413 -29.486 1.00 13.14 H new ATOM 0 HE3 LYS A 28 2.980 10.679 -31.212 1.00 13.14 H new ATOM 0 HZ1 LYS A 28 3.280 12.728 -29.981 1.00 31.21 H new ATOM 0 HZ2 LYS A 28 1.885 12.830 -30.945 1.00 31.21 H new ATOM 0 HZ3 LYS A 28 1.745 12.572 -29.272 1.00 31.21 H new ATOM 418 N LYS A 29 -0.376 5.956 -28.456 1.00 3.52 N ATOM 419 CA LYS A 29 -0.570 4.954 -27.414 1.00 72.40 C ATOM 420 C LYS A 29 -0.152 5.498 -26.052 1.00 65.45 C ATOM 421 O LYS A 29 0.835 6.225 -25.939 1.00 71.23 O ATOM 422 CB LYS A 29 0.232 3.692 -27.739 1.00 34.33 C ATOM 423 CG LYS A 29 1.733 3.923 -27.801 1.00 4.11 C ATOM 424 CD LYS A 29 2.408 2.942 -28.744 1.00 52.12 C ATOM 425 CE LYS A 29 3.852 2.685 -28.340 1.00 71.32 C ATOM 426 NZ LYS A 29 4.042 1.309 -27.804 1.00 3.40 N ATOM 0 H LYS A 29 0.554 6.376 -28.470 1.00 3.52 H new ATOM 0 HA LYS A 29 -1.630 4.705 -27.376 1.00 72.40 H new ATOM 0 HB2 LYS A 29 0.021 2.933 -26.985 1.00 34.33 H new ATOM 0 HB3 LYS A 29 -0.106 3.294 -28.696 1.00 34.33 H new ATOM 0 HG2 LYS A 29 1.932 4.943 -28.131 1.00 4.11 H new ATOM 0 HG3 LYS A 29 2.159 3.822 -26.803 1.00 4.11 H new ATOM 0 HD2 LYS A 29 1.857 2.001 -28.748 1.00 52.12 H new ATOM 0 HD3 LYS A 29 2.378 3.333 -29.761 1.00 52.12 H new ATOM 0 HE2 LYS A 29 4.502 2.832 -29.203 1.00 71.32 H new ATOM 0 HE3 LYS A 29 4.153 3.413 -27.587 1.00 71.32 H new ATOM 0 HZ1 LYS A 29 5.039 1.174 -27.540 1.00 3.40 H new ATOM 0 HZ2 LYS A 29 3.441 1.177 -26.966 1.00 3.40 H new ATOM 0 HZ3 LYS A 29 3.779 0.614 -28.531 1.00 3.40 H new ATOM 440 N PHE A 30 -0.909 5.142 -25.019 1.00 41.22 N ATOM 441 CA PHE A 30 -0.617 5.594 -23.665 1.00 64.42 C ATOM 442 C PHE A 30 0.616 4.888 -23.109 1.00 34.12 C ATOM 443 O PHE A 30 0.542 3.742 -22.666 1.00 52.45 O ATOM 444 CB PHE A 30 -1.818 5.342 -22.750 1.00 63.35 C ATOM 445 CG PHE A 30 -2.489 6.603 -22.283 1.00 41.41 C ATOM 446 CD1 PHE A 30 -3.827 6.835 -22.562 1.00 35.23 C ATOM 447 CD2 PHE A 30 -1.782 7.555 -21.566 1.00 4.53 C ATOM 448 CE1 PHE A 30 -4.447 7.993 -22.132 1.00 11.01 C ATOM 449 CE2 PHE A 30 -2.399 8.715 -21.133 1.00 53.45 C ATOM 450 CZ PHE A 30 -3.732 8.935 -21.418 1.00 1.51 C ATOM 0 H PHE A 30 -1.730 4.541 -25.095 1.00 41.22 H new ATOM 0 HA PHE A 30 -0.415 6.664 -23.703 1.00 64.42 H new ATOM 0 HB2 PHE A 30 -2.546 4.727 -23.279 1.00 63.35 H new ATOM 0 HB3 PHE A 30 -1.490 4.771 -21.881 1.00 63.35 H new ATOM 0 HD1 PHE A 30 -4.391 6.103 -23.121 1.00 35.23 H new ATOM 0 HD2 PHE A 30 -0.738 7.390 -21.343 1.00 4.53 H new ATOM 0 HE1 PHE A 30 -5.490 8.161 -22.354 1.00 11.01 H new ATOM 0 HE2 PHE A 30 -1.838 9.448 -20.572 1.00 53.45 H new ATOM 0 HZ PHE A 30 -4.215 9.841 -21.083 1.00 1.51 H new ATOM 460 N GLY A 31 1.750 5.580 -23.137 1.00 54.03 N ATOM 461 CA GLY A 31 2.984 5.004 -22.635 1.00 13.23 C ATOM 462 C GLY A 31 3.319 5.481 -21.235 1.00 50.34 C ATOM 463 O GLY A 31 2.492 6.102 -20.570 1.00 44.32 O ATOM 0 H GLY A 31 1.837 6.530 -23.498 1.00 54.03 H new ATOM 0 HA2 GLY A 31 2.900 3.917 -22.635 1.00 13.23 H new ATOM 0 HA3 GLY A 31 3.802 5.261 -23.308 1.00 13.23 H new ATOM 467 N GLU A 32 4.535 5.187 -20.787 1.00 74.31 N ATOM 468 CA GLU A 32 4.976 5.589 -19.456 1.00 15.14 C ATOM 469 C GLU A 32 5.011 7.109 -19.331 1.00 21.44 C ATOM 470 O GLU A 32 4.620 7.667 -18.306 1.00 21.04 O ATOM 471 CB GLU A 32 6.361 5.009 -19.157 1.00 24.53 C ATOM 472 CG GLU A 32 7.412 5.383 -20.188 1.00 35.13 C ATOM 473 CD GLU A 32 8.736 4.681 -19.950 1.00 71.41 C ATOM 474 OE1 GLU A 32 8.827 3.471 -20.247 1.00 23.52 O ATOM 475 OE2 GLU A 32 9.679 5.341 -19.469 1.00 35.41 O ATOM 0 H GLU A 32 5.232 4.672 -21.325 1.00 74.31 H new ATOM 0 HA GLU A 32 4.262 5.199 -18.731 1.00 15.14 H new ATOM 0 HB2 GLU A 32 6.687 5.355 -18.176 1.00 24.53 H new ATOM 0 HB3 GLU A 32 6.287 3.923 -19.103 1.00 24.53 H new ATOM 0 HG2 GLU A 32 7.045 5.132 -21.183 1.00 35.13 H new ATOM 0 HG3 GLU A 32 7.568 6.462 -20.168 1.00 35.13 H new ATOM 482 N GLY A 33 5.484 7.773 -20.380 1.00 45.30 N ATOM 483 CA GLY A 33 5.561 9.223 -20.368 1.00 33.23 C ATOM 484 C GLY A 33 4.207 9.874 -20.174 1.00 23.10 C ATOM 485 O GLY A 33 4.058 10.779 -19.355 1.00 20.34 O ATOM 0 H GLY A 33 5.816 7.333 -21.239 1.00 45.30 H new ATOM 0 HA2 GLY A 33 6.231 9.541 -19.570 1.00 33.23 H new ATOM 0 HA3 GLY A 33 5.996 9.568 -21.306 1.00 33.23 H new ATOM 489 N ASN A 34 3.216 9.414 -20.932 1.00 62.15 N ATOM 490 CA ASN A 34 1.868 9.962 -20.842 1.00 12.21 C ATOM 491 C ASN A 34 1.282 9.736 -19.452 1.00 21.23 C ATOM 492 O ASN A 34 0.844 10.678 -18.791 1.00 23.44 O ATOM 493 CB ASN A 34 0.963 9.321 -21.898 1.00 62.53 C ATOM 494 CG ASN A 34 1.377 9.685 -23.311 1.00 70.51 C ATOM 495 OD1 ASN A 34 2.488 10.167 -23.539 1.00 2.21 O ATOM 496 ND2 ASN A 34 0.485 9.457 -24.266 1.00 2.24 N ATOM 0 H ASN A 34 3.322 8.664 -21.615 1.00 62.15 H new ATOM 0 HA ASN A 34 1.926 11.035 -21.024 1.00 12.21 H new ATOM 0 HB2 ASN A 34 0.986 8.237 -21.783 1.00 62.53 H new ATOM 0 HB3 ASN A 34 -0.067 9.637 -21.731 1.00 62.53 H new ATOM 0 HD21 ASN A 34 0.707 9.682 -25.236 1.00 2.24 H new ATOM 0 HD22 ASN A 34 -0.423 9.056 -24.031 1.00 2.24 H new ATOM 503 N PHE A 35 1.278 8.482 -19.013 1.00 23.22 N ATOM 504 CA PHE A 35 0.746 8.132 -17.701 1.00 25.13 C ATOM 505 C PHE A 35 1.472 8.897 -16.598 1.00 33.34 C ATOM 506 O PHE A 35 0.855 9.358 -15.637 1.00 65.25 O ATOM 507 CB PHE A 35 0.871 6.627 -17.460 1.00 74.14 C ATOM 508 CG PHE A 35 -0.451 5.919 -17.380 1.00 44.13 C ATOM 509 CD1 PHE A 35 -1.442 6.166 -18.318 1.00 72.24 C ATOM 510 CD2 PHE A 35 -0.705 5.010 -16.368 1.00 12.03 C ATOM 511 CE1 PHE A 35 -2.660 5.517 -18.248 1.00 32.11 C ATOM 512 CE2 PHE A 35 -1.922 4.357 -16.292 1.00 70.45 C ATOM 513 CZ PHE A 35 -2.900 4.613 -17.233 1.00 15.32 C ATOM 0 H PHE A 35 1.637 7.691 -19.547 1.00 23.22 H new ATOM 0 HA PHE A 35 -0.308 8.409 -17.679 1.00 25.13 H new ATOM 0 HB2 PHE A 35 1.461 6.187 -18.263 1.00 74.14 H new ATOM 0 HB3 PHE A 35 1.420 6.460 -16.533 1.00 74.14 H new ATOM 0 HD1 PHE A 35 -1.260 6.874 -19.113 1.00 72.24 H new ATOM 0 HD2 PHE A 35 0.056 4.808 -15.629 1.00 12.03 H new ATOM 0 HE1 PHE A 35 -3.423 5.717 -18.986 1.00 32.11 H new ATOM 0 HE2 PHE A 35 -2.107 3.648 -15.498 1.00 70.45 H new ATOM 0 HZ PHE A 35 -3.852 4.106 -17.175 1.00 15.32 H new ATOM 523 N ARG A 36 2.787 9.026 -16.743 1.00 64.43 N ATOM 524 CA ARG A 36 3.598 9.733 -15.759 1.00 61.10 C ATOM 525 C ARG A 36 3.133 11.178 -15.608 1.00 20.31 C ATOM 526 O ARG A 36 3.075 11.709 -14.498 1.00 41.23 O ATOM 527 CB ARG A 36 5.073 9.700 -16.165 1.00 23.41 C ATOM 528 CG ARG A 36 6.000 10.341 -15.144 1.00 62.13 C ATOM 529 CD ARG A 36 6.645 11.603 -15.693 1.00 71.14 C ATOM 530 NE ARG A 36 7.823 11.995 -14.923 1.00 40.45 N ATOM 531 CZ ARG A 36 8.468 13.144 -15.099 1.00 11.35 C ATOM 532 NH1 ARG A 36 8.049 14.009 -16.012 1.00 53.04 N ATOM 533 NH2 ARG A 36 9.531 13.429 -14.359 1.00 55.10 N ATOM 0 H ARG A 36 3.313 8.650 -17.532 1.00 64.43 H new ATOM 0 HA ARG A 36 3.481 9.230 -14.799 1.00 61.10 H new ATOM 0 HB2 ARG A 36 5.376 8.664 -16.318 1.00 23.41 H new ATOM 0 HB3 ARG A 36 5.190 10.211 -17.121 1.00 23.41 H new ATOM 0 HG2 ARG A 36 5.438 10.581 -14.241 1.00 62.13 H new ATOM 0 HG3 ARG A 36 6.775 9.630 -14.858 1.00 62.13 H new ATOM 0 HD2 ARG A 36 6.929 11.442 -16.733 1.00 71.14 H new ATOM 0 HD3 ARG A 36 5.918 12.415 -15.683 1.00 71.14 H new ATOM 0 HE ARG A 36 8.170 11.352 -14.211 1.00 40.45 H new ATOM 0 HH11 ARG A 36 7.230 13.793 -16.581 1.00 53.04 H new ATOM 0 HH12 ARG A 36 8.545 14.890 -16.145 1.00 53.04 H new ATOM 0 HH21 ARG A 36 9.854 12.766 -13.654 1.00 55.10 H new ATOM 0 HH22 ARG A 36 10.025 14.311 -14.495 1.00 55.10 H new ATOM 547 N TRP A 37 2.804 11.809 -16.730 1.00 15.23 N ATOM 548 CA TRP A 37 2.344 13.193 -16.721 1.00 2.10 C ATOM 549 C TRP A 37 0.993 13.314 -16.024 1.00 33.40 C ATOM 550 O TRP A 37 0.745 14.275 -15.297 1.00 4.41 O ATOM 551 CB TRP A 37 2.243 13.726 -18.152 1.00 75.50 C ATOM 552 CG TRP A 37 1.447 14.992 -18.258 1.00 30.12 C ATOM 553 CD1 TRP A 37 1.934 16.268 -18.267 1.00 70.31 C ATOM 554 CD2 TRP A 37 0.024 15.102 -18.369 1.00 44.13 C ATOM 555 NE1 TRP A 37 0.899 17.165 -18.377 1.00 4.21 N ATOM 556 CE2 TRP A 37 -0.282 16.475 -18.443 1.00 23.24 C ATOM 557 CE3 TRP A 37 -1.020 14.176 -18.417 1.00 13.33 C ATOM 558 CZ2 TRP A 37 -1.591 16.940 -18.559 1.00 74.43 C ATOM 559 CZ3 TRP A 37 -2.317 14.638 -18.531 1.00 43.32 C ATOM 560 CH2 TRP A 37 -2.593 16.011 -18.603 1.00 13.11 C ATOM 0 H TRP A 37 2.847 11.385 -17.657 1.00 15.23 H new ATOM 0 HA TRP A 37 3.071 13.788 -16.168 1.00 2.10 H new ATOM 0 HB2 TRP A 37 3.247 13.903 -18.538 1.00 75.50 H new ATOM 0 HB3 TRP A 37 1.787 12.964 -18.785 1.00 75.50 H new ATOM 0 HD1 TRP A 37 2.979 16.533 -18.198 1.00 70.31 H new ATOM 0 HE1 TRP A 37 0.995 18.180 -18.405 1.00 4.21 H new ATOM 0 HE3 TRP A 37 -0.817 13.116 -18.366 1.00 13.33 H new ATOM 0 HZ2 TRP A 37 -1.806 17.997 -18.612 1.00 74.43 H new ATOM 0 HZ3 TRP A 37 -3.132 13.930 -18.565 1.00 43.32 H new ATOM 0 HH2 TRP A 37 -3.617 16.341 -18.695 1.00 13.11 H new ATOM 571 N ALA A 38 0.126 12.334 -16.250 1.00 10.54 N ATOM 572 CA ALA A 38 -1.199 12.330 -15.641 1.00 3.10 C ATOM 573 C ALA A 38 -1.117 12.013 -14.151 1.00 44.25 C ATOM 574 O ALA A 38 -1.526 12.817 -13.313 1.00 1.22 O ATOM 575 CB ALA A 38 -2.101 11.329 -16.347 1.00 1.23 C ATOM 0 H ALA A 38 0.317 11.532 -16.851 1.00 10.54 H new ATOM 0 HA ALA A 38 -1.626 13.327 -15.751 1.00 3.10 H new ATOM 0 HB1 ALA A 38 -3.087 11.337 -15.882 1.00 1.23 H new ATOM 0 HB2 ALA A 38 -2.194 11.601 -17.398 1.00 1.23 H new ATOM 0 HB3 ALA A 38 -1.670 10.331 -16.267 1.00 1.23 H new ATOM 581 N ILE A 39 -0.589 10.838 -13.829 1.00 53.14 N ATOM 582 CA ILE A 39 -0.454 10.415 -12.441 1.00 71.34 C ATOM 583 C ILE A 39 0.241 11.486 -11.607 1.00 21.31 C ATOM 584 O ILE A 39 -0.073 11.672 -10.431 1.00 35.35 O ATOM 585 CB ILE A 39 0.337 9.098 -12.327 1.00 70.52 C ATOM 586 CG1 ILE A 39 0.388 8.634 -10.871 1.00 33.13 C ATOM 587 CG2 ILE A 39 1.743 9.275 -12.883 1.00 2.25 C ATOM 588 CD1 ILE A 39 -0.317 7.318 -10.631 1.00 5.44 C ATOM 0 H ILE A 39 -0.247 10.161 -14.511 1.00 53.14 H new ATOM 0 HA ILE A 39 -1.463 10.257 -12.059 1.00 71.34 H new ATOM 0 HB ILE A 39 -0.171 8.333 -12.915 1.00 70.52 H new ATOM 0 HG12 ILE A 39 1.430 8.540 -10.564 1.00 33.13 H new ATOM 0 HG13 ILE A 39 -0.063 9.399 -10.238 1.00 33.13 H new ATOM 0 HG21 ILE A 39 2.290 8.336 -12.796 1.00 2.25 H new ATOM 0 HG22 ILE A 39 1.686 9.565 -13.932 1.00 2.25 H new ATOM 0 HG23 ILE A 39 2.262 10.051 -12.320 1.00 2.25 H new ATOM 0 HD11 ILE A 39 -0.240 7.051 -9.577 1.00 5.44 H new ATOM 0 HD12 ILE A 39 -1.368 7.413 -10.906 1.00 5.44 H new ATOM 0 HD13 ILE A 39 0.148 6.540 -11.237 1.00 5.44 H new ATOM 600 N ARG A 40 1.185 12.190 -12.223 1.00 14.25 N ATOM 601 CA ARG A 40 1.924 13.243 -11.537 1.00 44.11 C ATOM 602 C ARG A 40 1.021 14.439 -11.247 1.00 74.53 C ATOM 603 O ARG A 40 0.805 14.799 -10.090 1.00 51.32 O ATOM 604 CB ARG A 40 3.122 13.686 -12.378 1.00 50.43 C ATOM 605 CG ARG A 40 3.981 14.744 -11.705 1.00 22.01 C ATOM 606 CD ARG A 40 4.863 15.468 -12.710 1.00 52.40 C ATOM 607 NE ARG A 40 4.128 16.494 -13.444 1.00 22.10 N ATOM 608 CZ ARG A 40 4.580 17.073 -14.552 1.00 33.51 C ATOM 609 NH1 ARG A 40 5.759 16.725 -15.050 1.00 23.50 N ATOM 610 NH2 ARG A 40 3.853 17.999 -15.162 1.00 23.23 N ATOM 0 H ARG A 40 1.456 12.050 -13.196 1.00 14.25 H new ATOM 0 HA ARG A 40 2.284 12.842 -10.589 1.00 44.11 H new ATOM 0 HB2 ARG A 40 3.740 12.816 -12.601 1.00 50.43 H new ATOM 0 HB3 ARG A 40 2.762 14.074 -13.331 1.00 50.43 H new ATOM 0 HG2 ARG A 40 3.341 15.464 -11.196 1.00 22.01 H new ATOM 0 HG3 ARG A 40 4.604 14.277 -10.942 1.00 22.01 H new ATOM 0 HD2 ARG A 40 5.704 15.927 -12.190 1.00 52.40 H new ATOM 0 HD3 ARG A 40 5.278 14.747 -13.414 1.00 52.40 H new ATOM 0 HE ARG A 40 3.217 16.783 -13.087 1.00 22.10 H new ATOM 0 HH11 ARG A 40 6.320 16.013 -14.583 1.00 23.50 H new ATOM 0 HH12 ARG A 40 6.105 17.170 -15.900 1.00 23.50 H new ATOM 0 HH21 ARG A 40 2.946 18.268 -14.781 1.00 23.23 H new ATOM 0 HH22 ARG A 40 4.201 18.442 -16.012 1.00 23.23 H new ATOM 624 N MET A 41 0.500 15.051 -12.305 1.00 13.21 N ATOM 625 CA MET A 41 -0.379 16.206 -12.163 1.00 13.21 C ATOM 626 C MET A 41 -1.544 15.891 -11.231 1.00 3.11 C ATOM 627 O MET A 41 -1.922 16.712 -10.396 1.00 13.13 O ATOM 628 CB MET A 41 -0.908 16.641 -13.531 1.00 61.43 C ATOM 629 CG MET A 41 -1.725 17.923 -13.486 1.00 21.14 C ATOM 630 SD MET A 41 -2.533 18.286 -15.057 1.00 11.24 S ATOM 631 CE MET A 41 -2.142 20.023 -15.245 1.00 71.35 C ATOM 0 H MET A 41 0.671 14.767 -13.270 1.00 13.21 H new ATOM 0 HA MET A 41 0.200 17.021 -11.729 1.00 13.21 H new ATOM 0 HB2 MET A 41 -0.066 16.779 -14.210 1.00 61.43 H new ATOM 0 HB3 MET A 41 -1.523 15.842 -13.945 1.00 61.43 H new ATOM 0 HG2 MET A 41 -2.480 17.841 -12.704 1.00 21.14 H new ATOM 0 HG3 MET A 41 -1.074 18.755 -13.216 1.00 21.14 H new ATOM 0 HE1 MET A 41 -2.574 20.395 -16.174 1.00 71.35 H new ATOM 0 HE2 MET A 41 -2.553 20.582 -14.404 1.00 71.35 H new ATOM 0 HE3 MET A 41 -1.060 20.152 -15.272 1.00 71.35 H new ATOM 641 N ALA A 42 -2.110 14.697 -11.380 1.00 60.53 N ATOM 642 CA ALA A 42 -3.231 14.275 -10.551 1.00 30.22 C ATOM 643 C ALA A 42 -2.836 14.224 -9.078 1.00 3.31 C ATOM 644 O ALA A 42 -3.609 14.616 -8.204 1.00 52.22 O ATOM 645 CB ALA A 42 -3.744 12.918 -11.008 1.00 4.24 C ATOM 0 H ALA A 42 -1.810 14.006 -12.067 1.00 60.53 H new ATOM 0 HA ALA A 42 -4.029 15.009 -10.662 1.00 30.22 H new ATOM 0 HB1 ALA A 42 -4.582 12.615 -10.380 1.00 4.24 H new ATOM 0 HB2 ALA A 42 -4.074 12.984 -12.045 1.00 4.24 H new ATOM 0 HB3 ALA A 42 -2.945 12.181 -10.927 1.00 4.24 H new ATOM 651 N ASN A 43 -1.628 13.739 -8.811 1.00 25.31 N ATOM 652 CA ASN A 43 -1.131 13.636 -7.444 1.00 61.52 C ATOM 653 C ASN A 43 -0.980 15.018 -6.814 1.00 22.11 C ATOM 654 O ASN A 43 -1.565 15.304 -5.769 1.00 11.51 O ATOM 655 CB ASN A 43 0.211 12.903 -7.421 1.00 72.51 C ATOM 656 CG ASN A 43 0.158 11.622 -6.612 1.00 5.15 C ATOM 657 OD1 ASN A 43 -0.905 11.019 -6.454 1.00 31.12 O ATOM 658 ND2 ASN A 43 1.304 11.200 -6.094 1.00 75.41 N ATOM 0 H ASN A 43 -0.975 13.411 -9.523 1.00 25.31 H new ATOM 0 HA ASN A 43 -1.857 13.069 -6.862 1.00 61.52 H new ATOM 0 HB2 ASN A 43 0.513 12.672 -8.443 1.00 72.51 H new ATOM 0 HB3 ASN A 43 0.974 13.561 -7.005 1.00 72.51 H new ATOM 0 HD21 ASN A 43 1.329 10.344 -5.539 1.00 75.41 H new ATOM 0 HD22 ASN A 43 2.161 11.731 -6.250 1.00 75.41 H new ATOM 665 N VAL A 44 -0.190 15.872 -7.458 1.00 42.20 N ATOM 666 CA VAL A 44 0.037 17.225 -6.964 1.00 21.24 C ATOM 667 C VAL A 44 -1.269 18.008 -6.882 1.00 52.42 C ATOM 668 O VAL A 44 -1.511 18.734 -5.919 1.00 64.12 O ATOM 669 CB VAL A 44 1.027 17.991 -7.860 1.00 21.12 C ATOM 670 CG1 VAL A 44 1.247 19.400 -7.330 1.00 11.40 C ATOM 671 CG2 VAL A 44 2.346 17.239 -7.961 1.00 30.14 C ATOM 0 H VAL A 44 0.303 15.651 -8.323 1.00 42.20 H new ATOM 0 HA VAL A 44 0.462 17.129 -5.965 1.00 21.24 H new ATOM 0 HB VAL A 44 0.601 18.067 -8.860 1.00 21.12 H new ATOM 0 HG11 VAL A 44 1.950 19.926 -7.976 1.00 11.40 H new ATOM 0 HG12 VAL A 44 0.298 19.935 -7.314 1.00 11.40 H new ATOM 0 HG13 VAL A 44 1.652 19.349 -6.319 1.00 11.40 H new ATOM 0 HG21 VAL A 44 3.034 17.795 -8.598 1.00 30.14 H new ATOM 0 HG22 VAL A 44 2.780 17.130 -6.967 1.00 30.14 H new ATOM 0 HG23 VAL A 44 2.171 16.253 -8.390 1.00 30.14 H new ATOM 681 N SER A 45 -2.109 17.853 -7.901 1.00 43.43 N ATOM 682 CA SER A 45 -3.390 18.548 -7.948 1.00 70.04 C ATOM 683 C SER A 45 -4.297 18.092 -6.809 1.00 23.44 C ATOM 684 O SER A 45 -5.215 18.807 -6.406 1.00 2.33 O ATOM 685 CB SER A 45 -4.079 18.303 -9.291 1.00 52.14 C ATOM 686 OG SER A 45 -5.318 18.986 -9.362 1.00 1.15 O ATOM 0 H SER A 45 -1.925 17.252 -8.705 1.00 43.43 H new ATOM 0 HA SER A 45 -3.200 19.615 -7.835 1.00 70.04 H new ATOM 0 HB2 SER A 45 -3.430 18.635 -10.102 1.00 52.14 H new ATOM 0 HB3 SER A 45 -4.241 17.234 -9.430 1.00 52.14 H new ATOM 0 HG SER A 45 -5.737 18.814 -10.231 1.00 1.15 H new ATOM 692 N THR A 46 -4.032 16.897 -6.291 1.00 62.13 N ATOM 693 CA THR A 46 -4.823 16.344 -5.199 1.00 52.12 C ATOM 694 C THR A 46 -4.023 16.314 -3.902 1.00 1.44 C ATOM 695 O THR A 46 -4.246 15.460 -3.044 1.00 25.10 O ATOM 696 CB THR A 46 -5.308 14.918 -5.523 1.00 22.31 C ATOM 697 OG1 THR A 46 -4.186 14.055 -5.734 1.00 32.25 O ATOM 698 CG2 THR A 46 -6.196 14.916 -6.759 1.00 71.45 C ATOM 0 H THR A 46 -3.275 16.293 -6.611 1.00 62.13 H new ATOM 0 HA THR A 46 -5.689 16.995 -5.074 1.00 52.12 H new ATOM 0 HB THR A 46 -5.890 14.555 -4.676 1.00 22.31 H new ATOM 0 HG1 THR A 46 -4.095 13.865 -6.691 1.00 32.25 H new ATOM 0 HG21 THR A 46 -6.526 13.898 -6.968 1.00 71.45 H new ATOM 0 HG22 THR A 46 -7.065 15.551 -6.584 1.00 71.45 H new ATOM 0 HG23 THR A 46 -5.634 15.297 -7.611 1.00 71.45 H new ATOM 706 N GLY A 47 -3.091 17.253 -3.764 1.00 11.34 N ATOM 707 CA GLY A 47 -2.274 17.315 -2.567 1.00 75.13 C ATOM 708 C GLY A 47 -1.617 15.988 -2.243 1.00 74.44 C ATOM 709 O GLY A 47 -1.876 15.400 -1.193 1.00 73.14 O ATOM 0 H GLY A 47 -2.888 17.971 -4.460 1.00 11.34 H new ATOM 0 HA2 GLY A 47 -1.504 18.076 -2.695 1.00 75.13 H new ATOM 0 HA3 GLY A 47 -2.892 17.626 -1.725 1.00 75.13 H new ATOM 713 N ARG A 48 -0.765 15.514 -3.147 1.00 43.21 N ATOM 714 CA ARG A 48 -0.073 14.246 -2.954 1.00 35.13 C ATOM 715 C ARG A 48 1.390 14.356 -3.374 1.00 23.45 C ATOM 716 O ARG A 48 1.698 14.840 -4.462 1.00 33.23 O ATOM 717 CB ARG A 48 -0.761 13.137 -3.750 1.00 43.44 C ATOM 718 CG ARG A 48 -0.427 11.737 -3.262 1.00 23.51 C ATOM 719 CD ARG A 48 -1.601 11.107 -2.530 1.00 25.31 C ATOM 720 NE ARG A 48 -1.195 10.493 -1.269 1.00 4.02 N ATOM 721 CZ ARG A 48 -0.640 9.289 -1.184 1.00 30.01 C ATOM 722 NH1 ARG A 48 -0.425 8.575 -2.280 1.00 0.11 N ATOM 723 NH2 ARG A 48 -0.298 8.798 0.001 1.00 54.15 N ATOM 0 H ARG A 48 -0.538 15.990 -4.020 1.00 43.21 H new ATOM 0 HA ARG A 48 -0.112 13.998 -1.893 1.00 35.13 H new ATOM 0 HB2 ARG A 48 -1.840 13.282 -3.700 1.00 43.44 H new ATOM 0 HB3 ARG A 48 -0.476 13.224 -4.799 1.00 43.44 H new ATOM 0 HG2 ARG A 48 -0.148 11.112 -4.110 1.00 23.51 H new ATOM 0 HG3 ARG A 48 0.437 11.778 -2.599 1.00 23.51 H new ATOM 0 HD2 ARG A 48 -2.357 11.868 -2.336 1.00 25.31 H new ATOM 0 HD3 ARG A 48 -2.063 10.353 -3.168 1.00 25.31 H new ATOM 0 HE ARG A 48 -1.346 11.017 -0.407 1.00 4.02 H new ATOM 0 HH11 ARG A 48 -0.686 8.950 -3.192 1.00 0.11 H new ATOM 0 HH12 ARG A 48 0.001 7.651 -2.211 1.00 0.11 H new ATOM 0 HH21 ARG A 48 -0.461 9.345 0.846 1.00 54.15 H new ATOM 0 HH22 ARG A 48 0.128 7.874 0.066 1.00 54.15 H new ATOM 737 N GLU A 49 2.286 13.905 -2.501 1.00 33.22 N ATOM 738 CA GLU A 49 3.717 13.955 -2.781 1.00 42.34 C ATOM 739 C GLU A 49 4.028 13.323 -4.136 1.00 32.21 C ATOM 740 O GLU A 49 3.241 12.553 -4.685 1.00 1.13 O ATOM 741 CB GLU A 49 4.500 13.238 -1.680 1.00 31.20 C ATOM 742 CG GLU A 49 5.001 14.167 -0.587 1.00 52.01 C ATOM 743 CD GLU A 49 4.000 14.336 0.540 1.00 54.53 C ATOM 744 OE1 GLU A 49 4.374 14.911 1.583 1.00 4.11 O ATOM 745 OE2 GLU A 49 2.845 13.891 0.378 1.00 21.42 O ATOM 0 H GLU A 49 2.047 13.501 -1.595 1.00 33.22 H new ATOM 0 HA GLU A 49 4.020 15.002 -2.809 1.00 42.34 H new ATOM 0 HB2 GLU A 49 3.865 12.474 -1.233 1.00 31.20 H new ATOM 0 HB3 GLU A 49 5.351 12.724 -2.127 1.00 31.20 H new ATOM 0 HG2 GLU A 49 5.935 13.776 -0.183 1.00 52.01 H new ATOM 0 HG3 GLU A 49 5.224 15.143 -1.019 1.00 52.01 H new ATOM 752 N PRO A 50 5.204 13.657 -4.687 1.00 45.20 N ATOM 753 CA PRO A 50 5.647 13.135 -5.983 1.00 41.42 C ATOM 754 C PRO A 50 5.985 11.649 -5.925 1.00 34.24 C ATOM 755 O PRO A 50 5.542 10.868 -6.764 1.00 54.42 O ATOM 756 CB PRO A 50 6.902 13.957 -6.287 1.00 15.04 C ATOM 757 CG PRO A 50 7.408 14.382 -4.952 1.00 72.12 C ATOM 758 CD PRO A 50 6.192 14.570 -4.088 1.00 71.02 C ATOM 0 HA PRO A 50 4.870 13.220 -6.743 1.00 41.42 H new ATOM 0 HB2 PRO A 50 7.644 13.364 -6.821 1.00 15.04 H new ATOM 0 HB3 PRO A 50 6.670 14.817 -6.915 1.00 15.04 H new ATOM 0 HG2 PRO A 50 8.074 13.630 -4.530 1.00 72.12 H new ATOM 0 HG3 PRO A 50 7.979 15.307 -5.028 1.00 72.12 H new ATOM 0 HD2 PRO A 50 6.395 14.316 -3.048 1.00 71.02 H new ATOM 0 HD3 PRO A 50 5.845 15.603 -4.102 1.00 71.02 H new ATOM 766 N GLY A 51 6.773 11.265 -4.925 1.00 22.25 N ATOM 767 CA GLY A 51 7.156 9.873 -4.774 1.00 52.32 C ATOM 768 C GLY A 51 6.153 9.080 -3.961 1.00 12.52 C ATOM 769 O GLY A 51 6.524 8.367 -3.028 1.00 73.34 O ATOM 0 H GLY A 51 7.153 11.893 -4.217 1.00 22.25 H new ATOM 0 HA2 GLY A 51 7.260 9.419 -5.760 1.00 52.32 H new ATOM 0 HA3 GLY A 51 8.133 9.818 -4.293 1.00 52.32 H new ATOM 773 N ASP A 52 4.878 9.204 -4.314 1.00 33.54 N ATOM 774 CA ASP A 52 3.818 8.492 -3.609 1.00 45.23 C ATOM 775 C ASP A 52 2.861 7.830 -4.595 1.00 3.30 C ATOM 776 O ASP A 52 1.850 8.416 -4.984 1.00 20.32 O ATOM 777 CB ASP A 52 3.048 9.452 -2.699 1.00 32.31 C ATOM 778 CG ASP A 52 2.487 8.761 -1.472 1.00 54.44 C ATOM 779 OD1 ASP A 52 2.410 9.409 -0.407 1.00 53.12 O ATOM 780 OD2 ASP A 52 2.123 7.570 -1.577 1.00 31.21 O ATOM 0 H ASP A 52 4.554 9.790 -5.083 1.00 33.54 H new ATOM 0 HA ASP A 52 4.278 7.715 -2.999 1.00 45.23 H new ATOM 0 HB2 ASP A 52 3.709 10.261 -2.387 1.00 32.31 H new ATOM 0 HB3 ASP A 52 2.232 9.906 -3.262 1.00 32.31 H new ATOM 785 N ILE A 53 3.185 6.606 -4.996 1.00 72.52 N ATOM 786 CA ILE A 53 2.355 5.864 -5.936 1.00 54.43 C ATOM 787 C ILE A 53 2.001 4.485 -5.388 1.00 64.44 C ATOM 788 O ILE A 53 2.539 3.464 -5.816 1.00 14.32 O ATOM 789 CB ILE A 53 3.055 5.698 -7.297 1.00 62.22 C ATOM 790 CG1 ILE A 53 3.442 7.066 -7.866 1.00 11.34 C ATOM 791 CG2 ILE A 53 2.156 4.950 -8.269 1.00 12.45 C ATOM 792 CD1 ILE A 53 4.136 6.987 -9.207 1.00 61.25 C ATOM 0 H ILE A 53 4.018 6.106 -4.684 1.00 72.52 H new ATOM 0 HA ILE A 53 1.442 6.443 -6.075 1.00 54.43 H new ATOM 0 HB ILE A 53 3.964 5.114 -7.152 1.00 62.22 H new ATOM 0 HG12 ILE A 53 2.544 7.676 -7.966 1.00 11.34 H new ATOM 0 HG13 ILE A 53 4.096 7.574 -7.157 1.00 11.34 H new ATOM 0 HG21 ILE A 53 2.666 4.841 -9.226 1.00 12.45 H new ATOM 0 HG22 ILE A 53 1.926 3.964 -7.866 1.00 12.45 H new ATOM 0 HG23 ILE A 53 1.231 5.508 -8.412 1.00 12.45 H new ATOM 0 HD11 ILE A 53 4.381 7.992 -9.550 1.00 61.25 H new ATOM 0 HD12 ILE A 53 5.052 6.404 -9.109 1.00 61.25 H new ATOM 0 HD13 ILE A 53 3.476 6.508 -9.930 1.00 61.25 H new ATOM 804 N PRO A 54 1.075 4.453 -4.420 1.00 24.44 N ATOM 805 CA PRO A 54 0.626 3.206 -3.793 1.00 63.00 C ATOM 806 C PRO A 54 -0.196 2.344 -4.744 1.00 2.44 C ATOM 807 O PRO A 54 -0.272 2.622 -5.941 1.00 34.04 O ATOM 808 CB PRO A 54 -0.237 3.687 -2.625 1.00 1.14 C ATOM 809 CG PRO A 54 -0.714 5.037 -3.035 1.00 53.30 C ATOM 810 CD PRO A 54 0.392 5.632 -3.861 1.00 64.22 C ATOM 0 HA PRO A 54 1.463 2.577 -3.491 1.00 63.00 H new ATOM 0 HB2 PRO A 54 -1.072 3.010 -2.445 1.00 1.14 H new ATOM 0 HB3 PRO A 54 0.339 3.735 -1.701 1.00 1.14 H new ATOM 0 HG2 PRO A 54 -1.637 4.967 -3.611 1.00 53.30 H new ATOM 0 HG3 PRO A 54 -0.928 5.657 -2.164 1.00 53.30 H new ATOM 0 HD2 PRO A 54 0.003 6.280 -4.646 1.00 64.22 H new ATOM 0 HD3 PRO A 54 1.066 6.236 -3.254 1.00 64.22 H new ATOM 818 N GLU A 55 -0.812 1.297 -4.204 1.00 14.14 N ATOM 819 CA GLU A 55 -1.629 0.394 -5.006 1.00 20.31 C ATOM 820 C GLU A 55 -2.859 -0.063 -4.227 1.00 11.22 C ATOM 821 O GLU A 55 -2.855 -1.125 -3.605 1.00 12.33 O ATOM 822 CB GLU A 55 -0.808 -0.821 -5.443 1.00 1.11 C ATOM 823 CG GLU A 55 -0.054 -1.486 -4.304 1.00 55.14 C ATOM 824 CD GLU A 55 -0.442 -2.940 -4.118 1.00 21.21 C ATOM 825 OE1 GLU A 55 -1.618 -3.277 -4.373 1.00 72.25 O ATOM 826 OE2 GLU A 55 0.428 -3.741 -3.716 1.00 23.21 O ATOM 0 H GLU A 55 -0.761 1.053 -3.215 1.00 14.14 H new ATOM 0 HA GLU A 55 -1.961 0.936 -5.891 1.00 20.31 H new ATOM 0 HB2 GLU A 55 -1.473 -1.552 -5.903 1.00 1.11 H new ATOM 0 HB3 GLU A 55 -0.096 -0.512 -6.208 1.00 1.11 H new ATOM 0 HG2 GLU A 55 1.017 -1.421 -4.496 1.00 55.14 H new ATOM 0 HG3 GLU A 55 -0.246 -0.942 -3.379 1.00 55.14 H new ATOM 833 N THR A 56 -3.913 0.747 -4.267 1.00 72.21 N ATOM 834 CA THR A 56 -5.149 0.428 -3.565 1.00 23.22 C ATOM 835 C THR A 56 -6.356 1.033 -4.273 1.00 52.32 C ATOM 836 O THR A 56 -6.272 2.119 -4.848 1.00 34.32 O ATOM 837 CB THR A 56 -5.116 0.934 -2.110 1.00 45.11 C ATOM 838 OG1 THR A 56 -5.028 2.364 -2.091 1.00 3.44 O ATOM 839 CG2 THR A 56 -3.936 0.338 -1.357 1.00 62.21 C ATOM 0 H THR A 56 -3.934 1.629 -4.779 1.00 72.21 H new ATOM 0 HA THR A 56 -5.239 -0.658 -3.563 1.00 23.22 H new ATOM 0 HB THR A 56 -6.037 0.620 -1.618 1.00 45.11 H new ATOM 0 HG1 THR A 56 -5.009 2.678 -1.163 1.00 3.44 H new ATOM 0 HG21 THR A 56 -3.933 0.709 -0.332 1.00 62.21 H new ATOM 0 HG22 THR A 56 -4.021 -0.749 -1.349 1.00 62.21 H new ATOM 0 HG23 THR A 56 -3.007 0.626 -1.850 1.00 62.21 H new ATOM 847 N LEU A 57 -7.479 0.324 -4.229 1.00 55.44 N ATOM 848 CA LEU A 57 -8.704 0.791 -4.868 1.00 70.02 C ATOM 849 C LEU A 57 -9.185 2.094 -4.235 1.00 54.40 C ATOM 850 O LEU A 57 -10.002 2.811 -4.813 1.00 34.05 O ATOM 851 CB LEU A 57 -9.796 -0.275 -4.761 1.00 31.31 C ATOM 852 CG LEU A 57 -11.087 0.008 -5.531 1.00 10.43 C ATOM 853 CD1 LEU A 57 -11.469 -1.187 -6.390 1.00 53.25 C ATOM 854 CD2 LEU A 57 -12.214 0.358 -4.571 1.00 31.43 C ATOM 0 H LEU A 57 -7.566 -0.576 -3.757 1.00 55.44 H new ATOM 0 HA LEU A 57 -8.489 0.977 -5.920 1.00 70.02 H new ATOM 0 HB2 LEU A 57 -9.387 -1.222 -5.112 1.00 31.31 H new ATOM 0 HB3 LEU A 57 -10.046 -0.407 -3.708 1.00 31.31 H new ATOM 0 HG LEU A 57 -10.916 0.862 -6.187 1.00 10.43 H new ATOM 0 HD11 LEU A 57 -12.390 -0.967 -6.930 1.00 53.25 H new ATOM 0 HD12 LEU A 57 -10.670 -1.393 -7.103 1.00 53.25 H new ATOM 0 HD13 LEU A 57 -11.621 -2.059 -5.754 1.00 53.25 H new ATOM 0 HD21 LEU A 57 -13.125 0.556 -5.136 1.00 31.43 H new ATOM 0 HD22 LEU A 57 -12.384 -0.476 -3.890 1.00 31.43 H new ATOM 0 HD23 LEU A 57 -11.942 1.245 -3.998 1.00 31.43 H new ATOM 866 N ASP A 58 -8.670 2.393 -3.048 1.00 20.14 N ATOM 867 CA ASP A 58 -9.044 3.611 -2.338 1.00 45.05 C ATOM 868 C ASP A 58 -8.281 4.814 -2.885 1.00 5.52 C ATOM 869 O ASP A 58 -8.884 5.791 -3.331 1.00 72.12 O ATOM 870 CB ASP A 58 -8.773 3.458 -0.841 1.00 51.00 C ATOM 871 CG ASP A 58 -9.813 4.158 0.010 1.00 2.34 C ATOM 872 OD1 ASP A 58 -10.334 3.525 0.954 1.00 54.04 O ATOM 873 OD2 ASP A 58 -10.109 5.340 -0.266 1.00 12.42 O ATOM 0 H ASP A 58 -7.993 1.809 -2.557 1.00 20.14 H new ATOM 0 HA ASP A 58 -10.110 3.779 -2.491 1.00 45.05 H new ATOM 0 HB2 ASP A 58 -8.752 2.399 -0.585 1.00 51.00 H new ATOM 0 HB3 ASP A 58 -7.787 3.862 -0.610 1.00 51.00 H new ATOM 878 N GLN A 59 -6.955 4.736 -2.846 1.00 2.30 N ATOM 879 CA GLN A 59 -6.113 5.820 -3.336 1.00 73.13 C ATOM 880 C GLN A 59 -6.400 6.111 -4.805 1.00 60.44 C ATOM 881 O GLN A 59 -6.231 7.240 -5.270 1.00 21.40 O ATOM 882 CB GLN A 59 -4.635 5.467 -3.154 1.00 62.31 C ATOM 883 CG GLN A 59 -4.107 4.498 -4.198 1.00 43.54 C ATOM 884 CD GLN A 59 -3.404 5.201 -5.343 1.00 54.31 C ATOM 885 OE1 GLN A 59 -3.767 6.315 -5.720 1.00 32.11 O ATOM 886 NE2 GLN A 59 -2.390 4.551 -5.904 1.00 31.12 N ATOM 0 H GLN A 59 -6.441 3.934 -2.481 1.00 2.30 H new ATOM 0 HA GLN A 59 -6.341 6.714 -2.756 1.00 73.13 H new ATOM 0 HB2 GLN A 59 -4.045 6.383 -3.189 1.00 62.31 H new ATOM 0 HB3 GLN A 59 -4.493 5.034 -2.164 1.00 62.31 H new ATOM 0 HG2 GLN A 59 -3.415 3.801 -3.725 1.00 43.54 H new ATOM 0 HG3 GLN A 59 -4.934 3.908 -4.592 1.00 43.54 H new ATOM 0 HE21 GLN A 59 -2.122 3.629 -5.560 1.00 31.12 H new ATOM 0 HE22 GLN A 59 -1.879 4.974 -6.679 1.00 31.12 H new ATOM 895 N LEU A 60 -6.834 5.089 -5.532 1.00 12.40 N ATOM 896 CA LEU A 60 -7.144 5.235 -6.950 1.00 11.51 C ATOM 897 C LEU A 60 -8.477 5.951 -7.144 1.00 43.31 C ATOM 898 O LEU A 60 -8.546 6.984 -7.812 1.00 73.10 O ATOM 899 CB LEU A 60 -7.187 3.863 -7.628 1.00 30.50 C ATOM 900 CG LEU A 60 -5.935 3.462 -8.410 1.00 22.22 C ATOM 901 CD1 LEU A 60 -5.689 4.431 -9.556 1.00 12.51 C ATOM 902 CD2 LEU A 60 -4.727 3.405 -7.487 1.00 73.04 C ATOM 0 H LEU A 60 -6.980 4.149 -5.163 1.00 12.40 H new ATOM 0 HA LEU A 60 -6.358 5.836 -7.408 1.00 11.51 H new ATOM 0 HB2 LEU A 60 -7.371 3.108 -6.864 1.00 30.50 H new ATOM 0 HB3 LEU A 60 -8.038 3.843 -8.308 1.00 30.50 H new ATOM 0 HG LEU A 60 -6.093 2.469 -8.830 1.00 22.22 H new ATOM 0 HD11 LEU A 60 -4.794 4.130 -10.101 1.00 12.51 H new ATOM 0 HD12 LEU A 60 -6.545 4.422 -10.230 1.00 12.51 H new ATOM 0 HD13 LEU A 60 -5.551 5.437 -9.159 1.00 12.51 H new ATOM 0 HD21 LEU A 60 -3.845 3.118 -8.059 1.00 73.04 H new ATOM 0 HD22 LEU A 60 -4.565 4.385 -7.038 1.00 73.04 H new ATOM 0 HD23 LEU A 60 -4.904 2.671 -6.701 1.00 73.04 H new ATOM 914 N ARG A 61 -9.532 5.398 -6.556 1.00 33.02 N ATOM 915 CA ARG A 61 -10.862 5.985 -6.663 1.00 5.23 C ATOM 916 C ARG A 61 -10.898 7.370 -6.023 1.00 1.13 C ATOM 917 O ARG A 61 -11.721 8.212 -6.386 1.00 31.02 O ATOM 918 CB ARG A 61 -11.899 5.078 -5.999 1.00 11.25 C ATOM 919 CG ARG A 61 -13.328 5.572 -6.151 1.00 33.43 C ATOM 920 CD ARG A 61 -13.912 6.006 -4.816 1.00 1.10 C ATOM 921 NE ARG A 61 -13.624 7.408 -4.522 1.00 13.03 N ATOM 922 CZ ARG A 61 -13.901 7.986 -3.359 1.00 41.33 C ATOM 923 NH1 ARG A 61 -14.469 7.288 -2.386 1.00 64.43 N ATOM 924 NH2 ARG A 61 -13.608 9.266 -3.168 1.00 5.02 N ATOM 0 H ARG A 61 -9.492 4.544 -6.000 1.00 33.02 H new ATOM 0 HA ARG A 61 -11.103 6.086 -7.721 1.00 5.23 H new ATOM 0 HB2 ARG A 61 -11.822 4.078 -6.427 1.00 11.25 H new ATOM 0 HB3 ARG A 61 -11.665 4.989 -4.938 1.00 11.25 H new ATOM 0 HG2 ARG A 61 -13.353 6.409 -6.849 1.00 33.43 H new ATOM 0 HG3 ARG A 61 -13.944 4.781 -6.579 1.00 33.43 H new ATOM 0 HD2 ARG A 61 -14.991 5.852 -4.825 1.00 1.10 H new ATOM 0 HD3 ARG A 61 -13.507 5.379 -4.022 1.00 1.10 H new ATOM 0 HE ARG A 61 -13.186 7.973 -5.250 1.00 13.03 H new ATOM 0 HH11 ARG A 61 -14.695 6.304 -2.529 1.00 64.43 H new ATOM 0 HH12 ARG A 61 -14.680 7.735 -1.494 1.00 64.43 H new ATOM 0 HH21 ARG A 61 -13.170 9.806 -3.914 1.00 5.02 H new ATOM 0 HH22 ARG A 61 -13.821 9.710 -2.275 1.00 5.02 H new ATOM 938 N LEU A 62 -10.002 7.598 -5.069 1.00 64.15 N ATOM 939 CA LEU A 62 -9.932 8.881 -4.378 1.00 60.21 C ATOM 940 C LEU A 62 -9.368 9.963 -5.294 1.00 62.35 C ATOM 941 O LEU A 62 -10.003 10.993 -5.520 1.00 61.14 O ATOM 942 CB LEU A 62 -9.067 8.760 -3.122 1.00 11.44 C ATOM 943 CG LEU A 62 -8.712 10.071 -2.422 1.00 32.21 C ATOM 944 CD1 LEU A 62 -9.972 10.799 -1.979 1.00 15.40 C ATOM 945 CD2 LEU A 62 -7.799 9.810 -1.232 1.00 64.42 C ATOM 0 H LEU A 62 -9.315 6.912 -4.757 1.00 64.15 H new ATOM 0 HA LEU A 62 -10.944 9.165 -4.089 1.00 60.21 H new ATOM 0 HB2 LEU A 62 -9.586 8.120 -2.409 1.00 11.44 H new ATOM 0 HB3 LEU A 62 -8.140 8.253 -3.391 1.00 11.44 H new ATOM 0 HG LEU A 62 -8.181 10.706 -3.131 1.00 32.21 H new ATOM 0 HD11 LEU A 62 -9.699 11.730 -1.483 1.00 15.40 H new ATOM 0 HD12 LEU A 62 -10.590 11.020 -2.849 1.00 15.40 H new ATOM 0 HD13 LEU A 62 -10.532 10.170 -1.287 1.00 15.40 H new ATOM 0 HD21 LEU A 62 -7.556 10.755 -0.745 1.00 64.42 H new ATOM 0 HD22 LEU A 62 -8.305 9.156 -0.522 1.00 64.42 H new ATOM 0 HD23 LEU A 62 -6.881 9.333 -1.575 1.00 64.42 H new ATOM 957 N VAL A 63 -8.171 9.722 -5.820 1.00 52.32 N ATOM 958 CA VAL A 63 -7.523 10.673 -6.714 1.00 73.42 C ATOM 959 C VAL A 63 -8.423 11.019 -7.896 1.00 60.40 C ATOM 960 O VAL A 63 -8.468 12.167 -8.340 1.00 34.25 O ATOM 961 CB VAL A 63 -6.186 10.123 -7.246 1.00 20.24 C ATOM 962 CG1 VAL A 63 -5.558 11.101 -8.227 1.00 41.42 C ATOM 963 CG2 VAL A 63 -5.237 9.827 -6.094 1.00 63.21 C ATOM 0 H VAL A 63 -7.631 8.875 -5.642 1.00 52.32 H new ATOM 0 HA VAL A 63 -7.331 11.574 -6.131 1.00 73.42 H new ATOM 0 HB VAL A 63 -6.381 9.190 -7.776 1.00 20.24 H new ATOM 0 HG11 VAL A 63 -4.615 10.695 -8.592 1.00 41.42 H new ATOM 0 HG12 VAL A 63 -6.234 11.258 -9.067 1.00 41.42 H new ATOM 0 HG13 VAL A 63 -5.374 12.051 -7.726 1.00 41.42 H new ATOM 0 HG21 VAL A 63 -4.297 9.439 -6.487 1.00 63.21 H new ATOM 0 HG22 VAL A 63 -5.046 10.743 -5.535 1.00 63.21 H new ATOM 0 HG23 VAL A 63 -5.687 9.086 -5.433 1.00 63.21 H new ATOM 973 N ILE A 64 -9.139 10.019 -8.399 1.00 71.22 N ATOM 974 CA ILE A 64 -10.039 10.218 -9.527 1.00 40.53 C ATOM 975 C ILE A 64 -11.187 11.152 -9.158 1.00 30.42 C ATOM 976 O ILE A 64 -11.490 12.098 -9.886 1.00 20.54 O ATOM 977 CB ILE A 64 -10.620 8.882 -10.026 1.00 40.52 C ATOM 978 CG1 ILE A 64 -9.495 7.944 -10.468 1.00 65.45 C ATOM 979 CG2 ILE A 64 -11.597 9.123 -11.168 1.00 12.34 C ATOM 980 CD1 ILE A 64 -9.872 6.481 -10.415 1.00 43.42 C ATOM 0 H ILE A 64 -9.113 9.063 -8.043 1.00 71.22 H new ATOM 0 HA ILE A 64 -9.449 10.669 -10.325 1.00 40.53 H new ATOM 0 HB ILE A 64 -11.160 8.409 -9.206 1.00 40.52 H new ATOM 0 HG12 ILE A 64 -9.200 8.198 -11.486 1.00 65.45 H new ATOM 0 HG13 ILE A 64 -8.624 8.110 -9.833 1.00 65.45 H new ATOM 0 HG21 ILE A 64 -11.999 8.169 -11.510 1.00 12.34 H new ATOM 0 HG22 ILE A 64 -12.413 9.757 -10.821 1.00 12.34 H new ATOM 0 HG23 ILE A 64 -11.080 9.615 -11.992 1.00 12.34 H new ATOM 0 HD11 ILE A 64 -9.027 5.875 -10.742 1.00 43.42 H new ATOM 0 HD12 ILE A 64 -10.139 6.211 -9.393 1.00 43.42 H new ATOM 0 HD13 ILE A 64 -10.723 6.301 -11.072 1.00 43.42 H new ATOM 992 N CYS A 65 -11.820 10.881 -8.022 1.00 63.54 N ATOM 993 CA CYS A 65 -12.934 11.699 -7.553 1.00 51.43 C ATOM 994 C CYS A 65 -12.495 13.142 -7.337 1.00 24.42 C ATOM 995 O CYS A 65 -13.127 14.076 -7.831 1.00 40.50 O ATOM 996 CB CYS A 65 -13.503 11.125 -6.256 1.00 4.25 C ATOM 997 SG CYS A 65 -15.025 10.173 -6.475 1.00 72.21 S ATOM 0 H CYS A 65 -11.581 10.102 -7.409 1.00 63.54 H new ATOM 0 HA CYS A 65 -13.710 11.686 -8.318 1.00 51.43 H new ATOM 0 HB2 CYS A 65 -12.751 10.486 -5.793 1.00 4.25 H new ATOM 0 HB3 CYS A 65 -13.696 11.944 -5.563 1.00 4.25 H new ATOM 0 HG CYS A 65 -15.428 9.727 -5.322 1.00 72.21 H new ATOM 1003 N ASP A 66 -11.408 13.320 -6.592 1.00 4.21 N ATOM 1004 CA ASP A 66 -10.884 14.651 -6.308 1.00 5.54 C ATOM 1005 C ASP A 66 -10.584 15.403 -7.601 1.00 71.44 C ATOM 1006 O ASP A 66 -10.966 16.563 -7.761 1.00 31.12 O ATOM 1007 CB ASP A 66 -9.621 14.553 -5.454 1.00 24.51 C ATOM 1008 CG ASP A 66 -9.905 14.042 -4.055 1.00 2.31 C ATOM 1009 OD1 ASP A 66 -11.091 13.813 -3.736 1.00 65.31 O ATOM 1010 OD2 ASP A 66 -8.942 13.868 -3.280 1.00 23.33 O ATOM 0 H ASP A 66 -10.873 12.559 -6.174 1.00 4.21 H new ATOM 0 HA ASP A 66 -11.643 15.204 -5.755 1.00 5.54 H new ATOM 0 HB2 ASP A 66 -8.907 13.889 -5.942 1.00 24.51 H new ATOM 0 HB3 ASP A 66 -9.152 15.535 -5.391 1.00 24.51 H new ATOM 1015 N LEU A 67 -9.894 14.736 -8.520 1.00 23.20 N ATOM 1016 CA LEU A 67 -9.539 15.342 -9.799 1.00 2.22 C ATOM 1017 C LEU A 67 -10.787 15.793 -10.552 1.00 53.13 C ATOM 1018 O LEU A 67 -10.788 16.840 -11.199 1.00 33.20 O ATOM 1019 CB LEU A 67 -8.745 14.352 -10.651 1.00 72.05 C ATOM 1020 CG LEU A 67 -7.795 14.964 -11.682 1.00 65.31 C ATOM 1021 CD1 LEU A 67 -8.575 15.754 -12.723 1.00 12.53 C ATOM 1022 CD2 LEU A 67 -6.766 15.853 -10.998 1.00 55.03 C ATOM 0 H LEU A 67 -9.569 13.776 -8.404 1.00 23.20 H new ATOM 0 HA LEU A 67 -8.921 16.217 -9.600 1.00 2.22 H new ATOM 0 HB2 LEU A 67 -8.164 13.714 -9.985 1.00 72.05 H new ATOM 0 HB3 LEU A 67 -9.450 13.707 -11.175 1.00 72.05 H new ATOM 0 HG LEU A 67 -7.268 14.155 -12.188 1.00 65.31 H new ATOM 0 HD11 LEU A 67 -7.883 16.182 -13.448 1.00 12.53 H new ATOM 0 HD12 LEU A 67 -9.273 15.091 -13.235 1.00 12.53 H new ATOM 0 HD13 LEU A 67 -9.128 16.555 -12.233 1.00 12.53 H new ATOM 0 HD21 LEU A 67 -6.099 16.280 -11.747 1.00 55.03 H new ATOM 0 HD22 LEU A 67 -7.276 16.656 -10.466 1.00 55.03 H new ATOM 0 HD23 LEU A 67 -6.186 15.260 -10.291 1.00 55.03 H new ATOM 1034 N GLN A 68 -11.847 14.996 -10.463 1.00 71.22 N ATOM 1035 CA GLN A 68 -13.101 15.314 -11.135 1.00 61.51 C ATOM 1036 C GLN A 68 -13.676 16.629 -10.620 1.00 64.21 C ATOM 1037 O GLN A 68 -14.102 17.478 -11.401 1.00 23.11 O ATOM 1038 CB GLN A 68 -14.113 14.185 -10.932 1.00 61.42 C ATOM 1039 CG GLN A 68 -15.127 14.068 -12.058 1.00 12.20 C ATOM 1040 CD GLN A 68 -16.456 13.507 -11.591 1.00 73.34 C ATOM 1041 OE1 GLN A 68 -17.334 14.248 -11.148 1.00 32.32 O ATOM 1042 NE2 GLN A 68 -16.611 12.192 -11.689 1.00 41.12 N ATOM 0 H GLN A 68 -11.862 14.125 -9.932 1.00 71.22 H new ATOM 0 HA GLN A 68 -12.897 15.421 -12.200 1.00 61.51 H new ATOM 0 HB2 GLN A 68 -13.577 13.241 -10.837 1.00 61.42 H new ATOM 0 HB3 GLN A 68 -14.642 14.347 -9.993 1.00 61.42 H new ATOM 0 HG2 GLN A 68 -15.287 15.051 -12.501 1.00 12.20 H new ATOM 0 HG3 GLN A 68 -14.722 13.428 -12.842 1.00 12.20 H new ATOM 0 HE21 GLN A 68 -15.857 11.616 -12.062 1.00 41.12 H new ATOM 0 HE22 GLN A 68 -17.485 11.758 -11.391 1.00 41.12 H new ATOM 1051 N GLU A 69 -13.685 16.788 -9.300 1.00 61.33 N ATOM 1052 CA GLU A 69 -14.209 18.000 -8.681 1.00 25.41 C ATOM 1053 C GLU A 69 -13.459 19.233 -9.176 1.00 45.34 C ATOM 1054 O GLU A 69 -14.069 20.231 -9.562 1.00 53.31 O ATOM 1055 CB GLU A 69 -14.108 17.906 -7.157 1.00 61.20 C ATOM 1056 CG GLU A 69 -15.412 17.518 -6.483 1.00 22.12 C ATOM 1057 CD GLU A 69 -15.275 17.386 -4.979 1.00 11.34 C ATOM 1058 OE1 GLU A 69 -15.694 18.318 -4.261 1.00 23.21 O ATOM 1059 OE2 GLU A 69 -14.749 16.350 -4.519 1.00 43.24 O ATOM 0 H GLU A 69 -13.336 16.094 -8.640 1.00 61.33 H new ATOM 0 HA GLU A 69 -15.257 18.096 -8.963 1.00 25.41 H new ATOM 0 HB2 GLU A 69 -13.343 17.175 -6.897 1.00 61.20 H new ATOM 0 HB3 GLU A 69 -13.777 18.867 -6.763 1.00 61.20 H new ATOM 0 HG2 GLU A 69 -16.171 18.267 -6.711 1.00 22.12 H new ATOM 0 HG3 GLU A 69 -15.763 16.572 -6.896 1.00 22.12 H new ATOM 1066 N ARG A 70 -12.133 19.156 -9.164 1.00 54.05 N ATOM 1067 CA ARG A 70 -11.298 20.266 -9.610 1.00 1.00 C ATOM 1068 C ARG A 70 -11.406 20.455 -11.121 1.00 13.43 C ATOM 1069 O ARG A 70 -11.249 21.563 -11.630 1.00 64.15 O ATOM 1070 CB ARG A 70 -9.839 20.025 -9.219 1.00 12.41 C ATOM 1071 CG ARG A 70 -9.022 21.300 -9.098 1.00 72.54 C ATOM 1072 CD ARG A 70 -7.656 21.030 -8.485 1.00 23.13 C ATOM 1073 NE ARG A 70 -6.590 21.735 -9.193 1.00 32.25 N ATOM 1074 CZ ARG A 70 -6.441 23.055 -9.171 1.00 2.21 C ATOM 1075 NH1 ARG A 70 -7.285 23.810 -8.481 1.00 55.13 N ATOM 1076 NH2 ARG A 70 -5.446 23.622 -9.840 1.00 44.42 N ATOM 0 H ARG A 70 -11.613 18.337 -8.850 1.00 54.05 H new ATOM 0 HA ARG A 70 -11.653 21.173 -9.121 1.00 1.00 H new ATOM 0 HB2 ARG A 70 -9.810 19.493 -8.268 1.00 12.41 H new ATOM 0 HB3 ARG A 70 -9.375 19.376 -9.962 1.00 12.41 H new ATOM 0 HG2 ARG A 70 -8.898 21.749 -10.084 1.00 72.54 H new ATOM 0 HG3 ARG A 70 -9.561 22.022 -8.485 1.00 72.54 H new ATOM 0 HD2 ARG A 70 -7.661 21.336 -7.439 1.00 23.13 H new ATOM 0 HD3 ARG A 70 -7.456 19.959 -8.502 1.00 23.13 H new ATOM 0 HE ARG A 70 -5.924 21.184 -9.734 1.00 32.25 H new ATOM 0 HH11 ARG A 70 -8.051 23.378 -7.965 1.00 55.13 H new ATOM 0 HH12 ARG A 70 -7.168 24.823 -8.466 1.00 55.13 H new ATOM 0 HH21 ARG A 70 -4.795 23.045 -10.372 1.00 44.42 H new ATOM 0 HH22 ARG A 70 -5.332 24.635 -9.823 1.00 44.42 H new ATOM 1090 N ARG A 71 -11.676 19.364 -11.830 1.00 13.43 N ATOM 1091 CA ARG A 71 -11.804 19.408 -13.282 1.00 21.31 C ATOM 1092 C ARG A 71 -12.970 20.300 -13.698 1.00 14.15 C ATOM 1093 O ARG A 71 -12.851 21.102 -14.622 1.00 44.25 O ATOM 1094 CB ARG A 71 -12.002 17.998 -13.841 1.00 55.13 C ATOM 1095 CG ARG A 71 -12.376 17.974 -15.314 1.00 62.31 C ATOM 1096 CD ARG A 71 -13.842 17.623 -15.510 1.00 12.22 C ATOM 1097 NE ARG A 71 -14.065 16.871 -16.742 1.00 63.23 N ATOM 1098 CZ ARG A 71 -15.255 16.738 -17.317 1.00 43.14 C ATOM 1099 NH1 ARG A 71 -16.324 17.303 -16.774 1.00 53.32 N ATOM 1100 NH2 ARG A 71 -15.377 16.039 -18.438 1.00 53.24 N ATOM 0 H ARG A 71 -11.810 18.439 -11.423 1.00 13.43 H new ATOM 0 HA ARG A 71 -10.884 19.827 -13.690 1.00 21.31 H new ATOM 0 HB2 ARG A 71 -11.084 17.428 -13.699 1.00 55.13 H new ATOM 0 HB3 ARG A 71 -12.782 17.495 -13.269 1.00 55.13 H new ATOM 0 HG2 ARG A 71 -12.171 18.948 -15.759 1.00 62.31 H new ATOM 0 HG3 ARG A 71 -11.754 17.248 -15.837 1.00 62.31 H new ATOM 0 HD2 ARG A 71 -14.191 17.037 -14.660 1.00 12.22 H new ATOM 0 HD3 ARG A 71 -14.434 18.538 -15.532 1.00 12.22 H new ATOM 0 HE ARG A 71 -13.263 16.423 -17.185 1.00 63.23 H new ATOM 0 HH11 ARG A 71 -16.234 17.842 -15.912 1.00 53.32 H new ATOM 0 HH12 ARG A 71 -17.237 17.199 -17.218 1.00 53.32 H new ATOM 0 HH21 ARG A 71 -14.557 15.603 -18.859 1.00 53.24 H new ATOM 0 HH22 ARG A 71 -16.291 15.937 -18.879 1.00 53.24 H new ATOM 1114 N GLU A 72 -14.097 20.152 -13.007 1.00 44.53 N ATOM 1115 CA GLU A 72 -15.284 20.943 -13.306 1.00 42.44 C ATOM 1116 C GLU A 72 -15.098 22.392 -12.865 1.00 2.32 C ATOM 1117 O GLU A 72 -15.292 23.322 -13.649 1.00 32.01 O ATOM 1118 CB GLU A 72 -16.512 20.342 -12.618 1.00 51.05 C ATOM 1119 CG GLU A 72 -17.195 19.256 -13.432 1.00 4.20 C ATOM 1120 CD GLU A 72 -18.557 19.683 -13.947 1.00 13.33 C ATOM 1121 OE1 GLU A 72 -19.571 19.150 -13.449 1.00 52.30 O ATOM 1122 OE2 GLU A 72 -18.608 20.547 -14.845 1.00 41.44 O ATOM 0 H GLU A 72 -14.212 19.492 -12.238 1.00 44.53 H new ATOM 0 HA GLU A 72 -15.437 20.927 -14.385 1.00 42.44 H new ATOM 0 HB2 GLU A 72 -16.212 19.928 -11.655 1.00 51.05 H new ATOM 0 HB3 GLU A 72 -17.229 21.137 -12.414 1.00 51.05 H new ATOM 0 HG2 GLU A 72 -16.560 18.986 -14.276 1.00 4.20 H new ATOM 0 HG3 GLU A 72 -17.307 18.362 -12.818 1.00 4.20 H new ATOM 1129 N LYS A 73 -14.723 22.576 -11.604 1.00 62.02 N ATOM 1130 CA LYS A 73 -14.510 23.910 -11.056 1.00 32.41 C ATOM 1131 C LYS A 73 -13.490 24.684 -11.886 1.00 42.33 C ATOM 1132 O LYS A 73 -13.499 25.915 -11.910 1.00 11.24 O ATOM 1133 CB LYS A 73 -14.035 23.818 -9.604 1.00 74.13 C ATOM 1134 CG LYS A 73 -14.912 24.582 -8.628 1.00 34.33 C ATOM 1135 CD LYS A 73 -14.080 25.387 -7.643 1.00 32.14 C ATOM 1136 CE LYS A 73 -14.875 25.733 -6.393 1.00 12.32 C ATOM 1137 NZ LYS A 73 -14.297 25.098 -5.175 1.00 64.21 N ATOM 0 H LYS A 73 -14.560 21.817 -10.942 1.00 62.02 H new ATOM 0 HA LYS A 73 -15.460 24.444 -11.089 1.00 32.41 H new ATOM 0 HB2 LYS A 73 -14.003 22.770 -9.307 1.00 74.13 H new ATOM 0 HB3 LYS A 73 -13.016 24.199 -9.539 1.00 74.13 H new ATOM 0 HG2 LYS A 73 -15.574 25.251 -9.179 1.00 34.33 H new ATOM 0 HG3 LYS A 73 -15.547 23.883 -8.083 1.00 34.33 H new ATOM 0 HD2 LYS A 73 -13.193 24.818 -7.365 1.00 32.14 H new ATOM 0 HD3 LYS A 73 -13.735 26.304 -8.121 1.00 32.14 H new ATOM 0 HE2 LYS A 73 -14.896 26.815 -6.264 1.00 12.32 H new ATOM 0 HE3 LYS A 73 -15.908 25.407 -6.517 1.00 12.32 H new ATOM 0 HZ1 LYS A 73 -14.867 25.358 -4.345 1.00 64.21 H new ATOM 0 HZ2 LYS A 73 -14.300 24.064 -5.288 1.00 64.21 H new ATOM 0 HZ3 LYS A 73 -13.320 25.428 -5.042 1.00 64.21 H new ATOM 1151 N PHE A 74 -12.614 23.953 -12.569 1.00 63.42 N ATOM 1152 CA PHE A 74 -11.588 24.572 -13.402 1.00 1.24 C ATOM 1153 C PHE A 74 -12.049 24.661 -14.854 1.00 5.11 C ATOM 1154 O PHE A 74 -11.582 25.509 -15.613 1.00 52.33 O ATOM 1155 CB PHE A 74 -10.285 23.776 -13.317 1.00 53.21 C ATOM 1156 CG PHE A 74 -9.224 24.261 -14.262 1.00 72.24 C ATOM 1157 CD1 PHE A 74 -8.574 23.378 -15.109 1.00 71.41 C ATOM 1158 CD2 PHE A 74 -8.875 25.602 -14.304 1.00 23.44 C ATOM 1159 CE1 PHE A 74 -7.596 23.822 -15.980 1.00 73.11 C ATOM 1160 CE2 PHE A 74 -7.899 26.052 -15.173 1.00 33.30 C ATOM 1161 CZ PHE A 74 -7.258 25.160 -16.010 1.00 70.23 C ATOM 0 H PHE A 74 -12.594 22.933 -12.562 1.00 63.42 H new ATOM 0 HA PHE A 74 -11.414 25.582 -13.031 1.00 1.24 H new ATOM 0 HB2 PHE A 74 -9.903 23.827 -12.297 1.00 53.21 H new ATOM 0 HB3 PHE A 74 -10.495 22.727 -13.526 1.00 53.21 H new ATOM 0 HD1 PHE A 74 -8.834 22.330 -15.089 1.00 71.41 H new ATOM 0 HD2 PHE A 74 -9.372 26.303 -13.650 1.00 23.44 H new ATOM 0 HE1 PHE A 74 -7.098 23.123 -16.636 1.00 73.11 H new ATOM 0 HE2 PHE A 74 -7.638 27.100 -15.197 1.00 33.30 H new ATOM 0 HZ PHE A 74 -6.493 25.509 -16.688 1.00 70.23 H new ATOM 1171 N GLY A 75 -12.969 23.779 -15.233 1.00 34.43 N ATOM 1172 CA GLY A 75 -13.478 23.774 -16.592 1.00 64.44 C ATOM 1173 C GLY A 75 -12.971 22.595 -17.397 1.00 73.22 C ATOM 1174 O GLY A 75 -12.057 21.889 -16.969 1.00 3.33 O ATOM 0 H GLY A 75 -13.371 23.068 -14.623 1.00 34.43 H new ATOM 0 HA2 GLY A 75 -14.568 23.752 -16.568 1.00 64.44 H new ATOM 0 HA3 GLY A 75 -13.188 24.700 -17.088 1.00 64.44 H new ATOM 1178 N SER A 76 -13.565 22.378 -18.566 1.00 24.12 N ATOM 1179 CA SER A 76 -13.173 21.271 -19.430 1.00 70.15 C ATOM 1180 C SER A 76 -11.947 21.640 -20.262 1.00 14.34 C ATOM 1181 O SER A 76 -11.809 22.776 -20.713 1.00 52.11 O ATOM 1182 CB SER A 76 -14.329 20.880 -20.351 1.00 42.13 C ATOM 1183 OG SER A 76 -14.956 19.689 -19.907 1.00 73.11 O ATOM 0 H SER A 76 -14.320 22.955 -18.937 1.00 24.12 H new ATOM 0 HA SER A 76 -12.920 20.421 -18.797 1.00 70.15 H new ATOM 0 HB2 SER A 76 -15.060 21.688 -20.385 1.00 42.13 H new ATOM 0 HB3 SER A 76 -13.958 20.742 -21.367 1.00 42.13 H new ATOM 0 HG SER A 76 -15.693 19.462 -20.512 1.00 73.11 H new ATOM 1189 N SER A 77 -11.061 20.670 -20.459 1.00 52.20 N ATOM 1190 CA SER A 77 -9.844 20.891 -21.233 1.00 21.53 C ATOM 1191 C SER A 77 -9.217 19.565 -21.651 1.00 1.42 C ATOM 1192 O SER A 77 -9.335 18.560 -20.950 1.00 13.23 O ATOM 1193 CB SER A 77 -8.839 21.708 -20.419 1.00 64.24 C ATOM 1194 OG SER A 77 -7.788 20.891 -19.936 1.00 14.34 O ATOM 0 H SER A 77 -11.162 19.723 -20.094 1.00 52.20 H new ATOM 0 HA SER A 77 -10.111 21.446 -22.132 1.00 21.53 H new ATOM 0 HB2 SER A 77 -8.428 22.506 -21.038 1.00 64.24 H new ATOM 0 HB3 SER A 77 -9.347 22.185 -19.581 1.00 64.24 H new ATOM 0 HG SER A 77 -7.159 21.438 -19.421 1.00 14.34 H new ATOM 1200 N LYS A 78 -8.551 19.570 -22.800 1.00 2.43 N ATOM 1201 CA LYS A 78 -7.903 18.369 -23.315 1.00 11.23 C ATOM 1202 C LYS A 78 -6.938 17.788 -22.286 1.00 43.33 C ATOM 1203 O LYS A 78 -6.774 16.572 -22.195 1.00 32.15 O ATOM 1204 CB LYS A 78 -7.155 18.684 -24.613 1.00 32.45 C ATOM 1205 CG LYS A 78 -6.033 19.693 -24.437 1.00 5.34 C ATOM 1206 CD LYS A 78 -5.538 20.214 -25.776 1.00 42.44 C ATOM 1207 CE LYS A 78 -4.019 20.212 -25.847 1.00 42.43 C ATOM 1208 NZ LYS A 78 -3.430 21.388 -25.149 1.00 74.33 N ATOM 0 H LYS A 78 -8.445 20.393 -23.393 1.00 2.43 H new ATOM 0 HA LYS A 78 -8.676 17.629 -23.520 1.00 11.23 H new ATOM 0 HB2 LYS A 78 -6.742 17.760 -25.018 1.00 32.45 H new ATOM 0 HB3 LYS A 78 -7.864 19.065 -25.348 1.00 32.45 H new ATOM 0 HG2 LYS A 78 -6.384 20.526 -23.828 1.00 5.34 H new ATOM 0 HG3 LYS A 78 -5.207 19.230 -23.898 1.00 5.34 H new ATOM 0 HD2 LYS A 78 -5.942 19.598 -26.579 1.00 42.44 H new ATOM 0 HD3 LYS A 78 -5.909 21.227 -25.934 1.00 42.44 H new ATOM 0 HE2 LYS A 78 -3.636 19.295 -25.400 1.00 42.43 H new ATOM 0 HE3 LYS A 78 -3.704 20.214 -26.891 1.00 42.43 H new ATOM 0 HZ1 LYS A 78 -2.393 21.350 -25.220 1.00 74.33 H new ATOM 0 HZ2 LYS A 78 -3.776 22.263 -25.592 1.00 74.33 H new ATOM 0 HZ3 LYS A 78 -3.709 21.373 -24.147 1.00 74.33 H new ATOM 1222 N GLU A 79 -6.303 18.666 -21.516 1.00 71.42 N ATOM 1223 CA GLU A 79 -5.354 18.238 -20.495 1.00 24.43 C ATOM 1224 C GLU A 79 -6.077 17.574 -19.326 1.00 74.41 C ATOM 1225 O GLU A 79 -5.886 16.387 -19.060 1.00 61.51 O ATOM 1226 CB GLU A 79 -4.539 19.432 -19.993 1.00 30.43 C ATOM 1227 CG GLU A 79 -3.666 20.065 -21.062 1.00 61.43 C ATOM 1228 CD GLU A 79 -2.299 19.414 -21.161 1.00 1.45 C ATOM 1229 OE1 GLU A 79 -1.315 20.029 -20.699 1.00 41.31 O ATOM 1230 OE2 GLU A 79 -2.215 18.290 -21.699 1.00 63.42 O ATOM 0 H GLU A 79 -6.428 19.676 -21.580 1.00 71.42 H new ATOM 0 HA GLU A 79 -4.679 17.509 -20.944 1.00 24.43 H new ATOM 0 HB2 GLU A 79 -5.220 20.186 -19.599 1.00 30.43 H new ATOM 0 HB3 GLU A 79 -3.908 19.108 -19.165 1.00 30.43 H new ATOM 0 HG2 GLU A 79 -4.169 19.993 -22.026 1.00 61.43 H new ATOM 0 HG3 GLU A 79 -3.544 21.126 -20.845 1.00 61.43 H new ATOM 1237 N ILE A 80 -6.904 18.348 -18.632 1.00 12.30 N ATOM 1238 CA ILE A 80 -7.655 17.835 -17.493 1.00 21.41 C ATOM 1239 C ILE A 80 -8.435 16.581 -17.869 1.00 13.51 C ATOM 1240 O ILE A 80 -8.672 15.710 -17.031 1.00 31.41 O ATOM 1241 CB ILE A 80 -8.634 18.889 -16.943 1.00 73.25 C ATOM 1242 CG1 ILE A 80 -9.223 18.423 -15.610 1.00 71.23 C ATOM 1243 CG2 ILE A 80 -9.740 19.161 -17.951 1.00 41.02 C ATOM 1244 CD1 ILE A 80 -8.218 18.404 -14.480 1.00 22.55 C ATOM 0 H ILE A 80 -7.071 19.333 -18.838 1.00 12.30 H new ATOM 0 HA ILE A 80 -6.927 17.589 -16.720 1.00 21.41 H new ATOM 0 HB ILE A 80 -8.088 19.817 -16.773 1.00 73.25 H new ATOM 0 HG12 ILE A 80 -10.051 19.078 -15.339 1.00 71.23 H new ATOM 0 HG13 ILE A 80 -9.637 17.422 -15.735 1.00 71.23 H new ATOM 0 HG21 ILE A 80 -10.424 19.908 -17.548 1.00 41.02 H new ATOM 0 HG22 ILE A 80 -9.304 19.531 -18.879 1.00 41.02 H new ATOM 0 HG23 ILE A 80 -10.286 18.239 -18.150 1.00 41.02 H new ATOM 0 HD11 ILE A 80 -8.705 18.064 -13.566 1.00 22.55 H new ATOM 0 HD12 ILE A 80 -7.402 17.726 -14.730 1.00 22.55 H new ATOM 0 HD13 ILE A 80 -7.822 19.408 -14.328 1.00 22.55 H new ATOM 1256 N ASP A 81 -8.831 16.493 -19.134 1.00 75.04 N ATOM 1257 CA ASP A 81 -9.582 15.342 -19.623 1.00 32.40 C ATOM 1258 C ASP A 81 -8.702 14.096 -19.664 1.00 33.54 C ATOM 1259 O ASP A 81 -9.092 13.033 -19.181 1.00 42.53 O ATOM 1260 CB ASP A 81 -10.146 15.629 -21.015 1.00 31.21 C ATOM 1261 CG ASP A 81 -11.094 14.545 -21.489 1.00 63.21 C ATOM 1262 OD1 ASP A 81 -11.514 14.597 -22.665 1.00 15.13 O ATOM 1263 OD2 ASP A 81 -11.417 13.647 -20.686 1.00 14.24 O ATOM 0 H ASP A 81 -8.644 17.205 -19.840 1.00 75.04 H new ATOM 0 HA ASP A 81 -10.408 15.159 -18.935 1.00 32.40 H new ATOM 0 HB2 ASP A 81 -10.669 16.585 -21.002 1.00 31.21 H new ATOM 0 HB3 ASP A 81 -9.324 15.725 -21.724 1.00 31.21 H new ATOM 1268 N MET A 82 -7.513 14.235 -20.242 1.00 3.03 N ATOM 1269 CA MET A 82 -6.579 13.121 -20.345 1.00 13.42 C ATOM 1270 C MET A 82 -6.109 12.675 -18.964 1.00 61.32 C ATOM 1271 O MET A 82 -5.772 11.510 -18.759 1.00 74.44 O ATOM 1272 CB MET A 82 -5.376 13.514 -21.204 1.00 50.23 C ATOM 1273 CG MET A 82 -4.316 12.428 -21.301 1.00 23.04 C ATOM 1274 SD MET A 82 -2.796 13.007 -22.077 1.00 32.33 S ATOM 1275 CE MET A 82 -3.292 13.060 -23.797 1.00 20.43 C ATOM 0 H MET A 82 -7.174 15.108 -20.646 1.00 3.03 H new ATOM 0 HA MET A 82 -7.098 12.288 -20.819 1.00 13.42 H new ATOM 0 HB2 MET A 82 -5.722 13.763 -22.207 1.00 50.23 H new ATOM 0 HB3 MET A 82 -4.924 14.415 -20.790 1.00 50.23 H new ATOM 0 HG2 MET A 82 -4.090 12.056 -20.302 1.00 23.04 H new ATOM 0 HG3 MET A 82 -4.713 11.588 -21.871 1.00 23.04 H new ATOM 0 HE1 MET A 82 -2.455 13.401 -24.407 1.00 20.43 H new ATOM 0 HE2 MET A 82 -3.594 12.063 -24.120 1.00 20.43 H new ATOM 0 HE3 MET A 82 -4.130 13.748 -23.913 1.00 20.43 H new ATOM 1285 N ALA A 83 -6.090 13.611 -18.020 1.00 73.13 N ATOM 1286 CA ALA A 83 -5.663 13.314 -16.659 1.00 61.11 C ATOM 1287 C ALA A 83 -6.659 12.396 -15.959 1.00 60.13 C ATOM 1288 O ALA A 83 -6.313 11.287 -15.550 1.00 33.13 O ATOM 1289 CB ALA A 83 -5.485 14.603 -15.869 1.00 11.45 C ATOM 0 H ALA A 83 -6.365 14.581 -18.174 1.00 73.13 H new ATOM 0 HA ALA A 83 -4.705 12.796 -16.710 1.00 61.11 H new ATOM 0 HB1 ALA A 83 -5.166 14.367 -14.854 1.00 11.45 H new ATOM 0 HB2 ALA A 83 -4.730 15.224 -16.351 1.00 11.45 H new ATOM 0 HB3 ALA A 83 -6.431 15.143 -15.835 1.00 11.45 H new ATOM 1295 N ILE A 84 -7.895 12.864 -15.824 1.00 53.40 N ATOM 1296 CA ILE A 84 -8.941 12.083 -15.174 1.00 51.24 C ATOM 1297 C ILE A 84 -9.068 10.701 -15.806 1.00 61.35 C ATOM 1298 O ILE A 84 -9.237 9.702 -15.108 1.00 14.31 O ATOM 1299 CB ILE A 84 -10.304 12.797 -15.248 1.00 11.22 C ATOM 1300 CG1 ILE A 84 -11.401 11.908 -14.657 1.00 70.40 C ATOM 1301 CG2 ILE A 84 -10.631 13.165 -16.688 1.00 22.13 C ATOM 1302 CD1 ILE A 84 -12.494 12.685 -13.958 1.00 1.43 C ATOM 0 H ILE A 84 -8.197 13.780 -16.156 1.00 53.40 H new ATOM 0 HA ILE A 84 -8.652 11.976 -14.128 1.00 51.24 H new ATOM 0 HB ILE A 84 -10.251 13.715 -14.662 1.00 11.22 H new ATOM 0 HG12 ILE A 84 -11.843 11.311 -15.455 1.00 70.40 H new ATOM 0 HG13 ILE A 84 -10.952 11.211 -13.949 1.00 70.40 H new ATOM 0 HG21 ILE A 84 -11.597 13.669 -16.724 1.00 22.13 H new ATOM 0 HG22 ILE A 84 -9.860 13.830 -17.078 1.00 22.13 H new ATOM 0 HG23 ILE A 84 -10.671 12.260 -17.295 1.00 22.13 H new ATOM 0 HD11 ILE A 84 -13.237 11.992 -13.563 1.00 1.43 H new ATOM 0 HD12 ILE A 84 -12.064 13.261 -13.139 1.00 1.43 H new ATOM 0 HD13 ILE A 84 -12.970 13.362 -14.667 1.00 1.43 H new ATOM 1314 N VAL A 85 -8.984 10.652 -17.132 1.00 33.12 N ATOM 1315 CA VAL A 85 -9.086 9.393 -17.858 1.00 55.33 C ATOM 1316 C VAL A 85 -7.942 8.453 -17.493 1.00 52.53 C ATOM 1317 O VAL A 85 -8.132 7.242 -17.372 1.00 63.51 O ATOM 1318 CB VAL A 85 -9.083 9.621 -19.381 1.00 54.52 C ATOM 1319 CG1 VAL A 85 -9.084 8.291 -20.121 1.00 72.24 C ATOM 1320 CG2 VAL A 85 -10.274 10.471 -19.795 1.00 23.10 C ATOM 0 H VAL A 85 -8.846 11.470 -17.725 1.00 33.12 H new ATOM 0 HA VAL A 85 -10.033 8.937 -17.569 1.00 55.33 H new ATOM 0 HB VAL A 85 -8.172 10.157 -19.648 1.00 54.52 H new ATOM 0 HG11 VAL A 85 -9.082 8.473 -21.196 1.00 72.24 H new ATOM 0 HG12 VAL A 85 -8.196 7.722 -19.847 1.00 72.24 H new ATOM 0 HG13 VAL A 85 -9.975 7.725 -19.851 1.00 72.24 H new ATOM 0 HG21 VAL A 85 -10.256 10.622 -20.874 1.00 23.10 H new ATOM 0 HG22 VAL A 85 -11.198 9.964 -19.515 1.00 23.10 H new ATOM 0 HG23 VAL A 85 -10.224 11.437 -19.293 1.00 23.10 H new ATOM 1330 N THR A 86 -6.751 9.019 -17.319 1.00 45.44 N ATOM 1331 CA THR A 86 -5.575 8.232 -16.969 1.00 45.02 C ATOM 1332 C THR A 86 -5.744 7.567 -15.609 1.00 13.24 C ATOM 1333 O THR A 86 -5.506 6.367 -15.460 1.00 13.30 O ATOM 1334 CB THR A 86 -4.304 9.102 -16.948 1.00 30.43 C ATOM 1335 OG1 THR A 86 -4.049 9.630 -18.255 1.00 13.04 O ATOM 1336 CG2 THR A 86 -3.104 8.294 -16.478 1.00 64.42 C ATOM 0 H THR A 86 -6.576 10.019 -17.415 1.00 45.44 H new ATOM 0 HA THR A 86 -5.469 7.464 -17.735 1.00 45.02 H new ATOM 0 HB THR A 86 -4.464 9.924 -16.251 1.00 30.43 H new ATOM 0 HG1 THR A 86 -4.807 10.183 -18.538 1.00 13.04 H new ATOM 0 HG21 THR A 86 -2.218 8.929 -16.471 1.00 64.42 H new ATOM 0 HG22 THR A 86 -3.289 7.919 -15.471 1.00 64.42 H new ATOM 0 HG23 THR A 86 -2.943 7.454 -17.154 1.00 64.42 H new ATOM 1344 N LEU A 87 -6.158 8.350 -14.619 1.00 44.42 N ATOM 1345 CA LEU A 87 -6.360 7.834 -13.269 1.00 43.25 C ATOM 1346 C LEU A 87 -7.325 6.653 -13.276 1.00 63.33 C ATOM 1347 O LEU A 87 -7.054 5.613 -12.676 1.00 4.54 O ATOM 1348 CB LEU A 87 -6.895 8.939 -12.356 1.00 21.44 C ATOM 1349 CG LEU A 87 -6.042 10.205 -12.263 1.00 34.25 C ATOM 1350 CD1 LEU A 87 -6.820 11.326 -11.592 1.00 10.51 C ATOM 1351 CD2 LEU A 87 -4.751 9.923 -11.507 1.00 62.23 C ATOM 0 H LEU A 87 -6.360 9.344 -14.725 1.00 44.42 H new ATOM 0 HA LEU A 87 -5.398 7.490 -12.889 1.00 43.25 H new ATOM 0 HB2 LEU A 87 -7.889 9.220 -12.703 1.00 21.44 H new ATOM 0 HB3 LEU A 87 -7.012 8.529 -11.353 1.00 21.44 H new ATOM 0 HG LEU A 87 -5.787 10.523 -13.274 1.00 34.25 H new ATOM 0 HD11 LEU A 87 -6.196 12.218 -11.535 1.00 10.51 H new ATOM 0 HD12 LEU A 87 -7.716 11.546 -12.173 1.00 10.51 H new ATOM 0 HD13 LEU A 87 -7.106 11.019 -10.586 1.00 10.51 H new ATOM 0 HD21 LEU A 87 -4.156 10.835 -11.450 1.00 62.23 H new ATOM 0 HD22 LEU A 87 -4.987 9.580 -10.500 1.00 62.23 H new ATOM 0 HD23 LEU A 87 -4.184 9.152 -12.029 1.00 62.23 H new ATOM 1363 N LYS A 88 -8.452 6.820 -13.962 1.00 33.20 N ATOM 1364 CA LYS A 88 -9.456 5.767 -14.051 1.00 54.12 C ATOM 1365 C LYS A 88 -8.862 4.498 -14.655 1.00 3.23 C ATOM 1366 O LYS A 88 -8.997 3.410 -14.094 1.00 60.53 O ATOM 1367 CB LYS A 88 -10.644 6.237 -14.892 1.00 25.30 C ATOM 1368 CG LYS A 88 -11.270 7.528 -14.392 1.00 24.11 C ATOM 1369 CD LYS A 88 -12.761 7.366 -14.147 1.00 0.23 C ATOM 1370 CE LYS A 88 -13.537 8.594 -14.600 1.00 1.40 C ATOM 1371 NZ LYS A 88 -14.273 9.232 -13.473 1.00 71.22 N ATOM 0 H LYS A 88 -8.692 7.675 -14.464 1.00 33.20 H new ATOM 0 HA LYS A 88 -9.800 5.541 -13.042 1.00 54.12 H new ATOM 0 HB2 LYS A 88 -10.316 6.377 -15.922 1.00 25.30 H new ATOM 0 HB3 LYS A 88 -11.403 5.455 -14.902 1.00 25.30 H new ATOM 0 HG2 LYS A 88 -10.780 7.837 -13.469 1.00 24.11 H new ATOM 0 HG3 LYS A 88 -11.104 8.320 -15.122 1.00 24.11 H new ATOM 0 HD2 LYS A 88 -13.125 6.487 -14.680 1.00 0.23 H new ATOM 0 HD3 LYS A 88 -12.940 7.192 -13.086 1.00 0.23 H new ATOM 0 HE2 LYS A 88 -12.849 9.316 -15.040 1.00 1.40 H new ATOM 0 HE3 LYS A 88 -14.243 8.310 -15.380 1.00 1.40 H new ATOM 0 HZ1 LYS A 88 -14.967 9.908 -13.850 1.00 71.22 H new ATOM 0 HZ2 LYS A 88 -14.766 8.501 -12.922 1.00 71.22 H new ATOM 0 HZ3 LYS A 88 -13.600 9.733 -12.859 1.00 71.22 H new ATOM 1385 N VAL A 89 -8.206 4.645 -15.801 1.00 51.24 N ATOM 1386 CA VAL A 89 -7.589 3.511 -16.480 1.00 63.30 C ATOM 1387 C VAL A 89 -6.458 2.920 -15.646 1.00 43.14 C ATOM 1388 O VAL A 89 -6.082 1.762 -15.824 1.00 31.31 O ATOM 1389 CB VAL A 89 -7.037 3.916 -17.860 1.00 10.44 C ATOM 1390 CG1 VAL A 89 -6.487 2.701 -18.591 1.00 61.25 C ATOM 1391 CG2 VAL A 89 -8.117 4.601 -18.685 1.00 21.51 C ATOM 0 H VAL A 89 -8.088 5.538 -16.279 1.00 51.24 H new ATOM 0 HA VAL A 89 -8.368 2.760 -16.614 1.00 63.30 H new ATOM 0 HB VAL A 89 -6.221 4.623 -17.713 1.00 10.44 H new ATOM 0 HG11 VAL A 89 -6.101 3.006 -19.564 1.00 61.25 H new ATOM 0 HG12 VAL A 89 -5.683 2.257 -18.005 1.00 61.25 H new ATOM 0 HG13 VAL A 89 -7.282 1.969 -18.729 1.00 61.25 H new ATOM 0 HG21 VAL A 89 -7.710 4.881 -19.657 1.00 21.51 H new ATOM 0 HG22 VAL A 89 -8.955 3.919 -18.825 1.00 21.51 H new ATOM 0 HG23 VAL A 89 -8.460 5.495 -18.165 1.00 21.51 H new ATOM 1401 N PHE A 90 -5.920 3.724 -14.735 1.00 70.02 N ATOM 1402 CA PHE A 90 -4.831 3.281 -13.872 1.00 72.12 C ATOM 1403 C PHE A 90 -5.325 2.256 -12.855 1.00 64.24 C ATOM 1404 O PHE A 90 -4.708 1.209 -12.664 1.00 12.42 O ATOM 1405 CB PHE A 90 -4.207 4.475 -13.148 1.00 64.31 C ATOM 1406 CG PHE A 90 -2.715 4.380 -13.009 1.00 72.12 C ATOM 1407 CD1 PHE A 90 -1.907 5.469 -13.296 1.00 30.20 C ATOM 1408 CD2 PHE A 90 -2.118 3.200 -12.593 1.00 3.35 C ATOM 1409 CE1 PHE A 90 -0.533 5.383 -13.168 1.00 43.14 C ATOM 1410 CE2 PHE A 90 -0.746 3.109 -12.463 1.00 73.32 C ATOM 1411 CZ PHE A 90 0.048 4.202 -12.753 1.00 24.24 C ATOM 0 H PHE A 90 -6.220 4.686 -14.575 1.00 70.02 H new ATOM 0 HA PHE A 90 -4.074 2.809 -14.498 1.00 72.12 H new ATOM 0 HB2 PHE A 90 -4.456 5.388 -13.689 1.00 64.31 H new ATOM 0 HB3 PHE A 90 -4.651 4.561 -12.156 1.00 64.31 H new ATOM 0 HD1 PHE A 90 -2.356 6.395 -13.623 1.00 30.20 H new ATOM 0 HD2 PHE A 90 -2.733 2.341 -12.368 1.00 3.35 H new ATOM 0 HE1 PHE A 90 0.085 6.240 -13.393 1.00 43.14 H new ATOM 0 HE2 PHE A 90 -0.294 2.184 -12.135 1.00 73.32 H new ATOM 0 HZ PHE A 90 1.121 4.132 -12.655 1.00 24.24 H new ATOM 1421 N ALA A 91 -6.441 2.569 -12.204 1.00 52.14 N ATOM 1422 CA ALA A 91 -7.019 1.676 -11.208 1.00 3.00 C ATOM 1423 C ALA A 91 -7.559 0.405 -11.856 1.00 63.33 C ATOM 1424 O ALA A 91 -7.470 -0.681 -11.285 1.00 24.25 O ATOM 1425 CB ALA A 91 -8.122 2.388 -10.438 1.00 62.40 C ATOM 0 H ALA A 91 -6.962 3.434 -12.349 1.00 52.14 H new ATOM 0 HA ALA A 91 -6.231 1.390 -10.512 1.00 3.00 H new ATOM 0 HB1 ALA A 91 -8.545 1.709 -9.697 1.00 62.40 H new ATOM 0 HB2 ALA A 91 -7.709 3.262 -9.935 1.00 62.40 H new ATOM 0 HB3 ALA A 91 -8.903 2.703 -11.130 1.00 62.40 H new ATOM 1431 N VAL A 92 -8.120 0.549 -13.052 1.00 71.04 N ATOM 1432 CA VAL A 92 -8.674 -0.587 -13.779 1.00 4.01 C ATOM 1433 C VAL A 92 -7.571 -1.423 -14.416 1.00 72.45 C ATOM 1434 O VAL A 92 -7.365 -2.581 -14.052 1.00 62.14 O ATOM 1435 CB VAL A 92 -9.654 -0.129 -14.875 1.00 64.14 C ATOM 1436 CG1 VAL A 92 -10.190 -1.325 -15.646 1.00 2.41 C ATOM 1437 CG2 VAL A 92 -10.792 0.678 -14.269 1.00 21.33 C ATOM 0 H VAL A 92 -8.203 1.442 -13.538 1.00 71.04 H new ATOM 0 HA VAL A 92 -9.212 -1.195 -13.052 1.00 4.01 H new ATOM 0 HB VAL A 92 -9.116 0.512 -15.574 1.00 64.14 H new ATOM 0 HG11 VAL A 92 -10.881 -0.982 -16.416 1.00 2.41 H new ATOM 0 HG12 VAL A 92 -9.362 -1.858 -16.113 1.00 2.41 H new ATOM 0 HG13 VAL A 92 -10.712 -1.994 -14.962 1.00 2.41 H new ATOM 0 HG21 VAL A 92 -11.475 0.993 -15.058 1.00 21.33 H new ATOM 0 HG22 VAL A 92 -11.330 0.063 -13.548 1.00 21.33 H new ATOM 0 HG23 VAL A 92 -10.388 1.557 -13.766 1.00 21.33 H new ATOM 1447 N ALA A 93 -6.861 -0.827 -15.370 1.00 14.50 N ATOM 1448 CA ALA A 93 -5.776 -1.517 -16.057 1.00 61.45 C ATOM 1449 C ALA A 93 -4.670 -1.907 -15.082 1.00 54.35 C ATOM 1450 O ALA A 93 -3.833 -2.757 -15.386 1.00 64.01 O ATOM 1451 CB ALA A 93 -5.216 -0.643 -17.170 1.00 10.10 C ATOM 0 H ALA A 93 -7.018 0.131 -15.684 1.00 14.50 H new ATOM 0 HA ALA A 93 -6.179 -2.431 -16.495 1.00 61.45 H new ATOM 0 HB1 ALA A 93 -4.407 -1.171 -17.675 1.00 10.10 H new ATOM 0 HB2 ALA A 93 -6.005 -0.418 -17.887 1.00 10.10 H new ATOM 0 HB3 ALA A 93 -4.835 0.286 -16.746 1.00 10.10 H new ATOM 1457 N GLY A 94 -4.672 -1.281 -13.910 1.00 11.11 N ATOM 1458 CA GLY A 94 -3.664 -1.578 -12.909 1.00 60.42 C ATOM 1459 C GLY A 94 -4.131 -2.608 -11.902 1.00 35.43 C ATOM 1460 O GLY A 94 -3.680 -3.754 -11.919 1.00 51.35 O ATOM 0 H GLY A 94 -5.353 -0.573 -13.635 1.00 11.11 H new ATOM 0 HA2 GLY A 94 -2.762 -1.940 -13.403 1.00 60.42 H new ATOM 0 HA3 GLY A 94 -3.394 -0.660 -12.386 1.00 60.42 H new ATOM 1464 N LEU A 95 -5.037 -2.202 -11.018 1.00 45.11 N ATOM 1465 CA LEU A 95 -5.565 -3.099 -9.997 1.00 0.44 C ATOM 1466 C LEU A 95 -6.266 -4.296 -10.632 1.00 22.42 C ATOM 1467 O LEU A 95 -6.043 -5.441 -10.238 1.00 12.04 O ATOM 1468 CB LEU A 95 -6.538 -2.349 -9.085 1.00 51.42 C ATOM 1469 CG LEU A 95 -6.099 -0.954 -8.637 1.00 14.02 C ATOM 1470 CD1 LEU A 95 -7.081 -0.384 -7.627 1.00 24.42 C ATOM 1471 CD2 LEU A 95 -4.695 -1.001 -8.051 1.00 31.33 C ATOM 0 H LEU A 95 -5.421 -1.257 -10.988 1.00 45.11 H new ATOM 0 HA LEU A 95 -4.728 -3.465 -9.403 1.00 0.44 H new ATOM 0 HB2 LEU A 95 -7.493 -2.259 -9.602 1.00 51.42 H new ATOM 0 HB3 LEU A 95 -6.713 -2.956 -8.197 1.00 51.42 H new ATOM 0 HG LEU A 95 -6.087 -0.300 -9.509 1.00 14.02 H new ATOM 0 HD11 LEU A 95 -6.752 0.609 -7.320 1.00 24.42 H new ATOM 0 HD12 LEU A 95 -8.070 -0.315 -8.080 1.00 24.42 H new ATOM 0 HD13 LEU A 95 -7.126 -1.037 -6.755 1.00 24.42 H new ATOM 0 HD21 LEU A 95 -4.398 -0.000 -7.737 1.00 31.33 H new ATOM 0 HD22 LEU A 95 -4.682 -1.670 -7.190 1.00 31.33 H new ATOM 0 HD23 LEU A 95 -3.998 -1.367 -8.805 1.00 31.33 H new ATOM 1483 N LEU A 96 -7.112 -4.023 -11.620 1.00 2.35 N ATOM 1484 CA LEU A 96 -7.845 -5.078 -12.312 1.00 64.43 C ATOM 1485 C LEU A 96 -7.001 -5.683 -13.429 1.00 51.15 C ATOM 1486 O LEU A 96 -7.431 -6.612 -14.112 1.00 4.20 O ATOM 1487 CB LEU A 96 -9.151 -4.526 -12.885 1.00 52.32 C ATOM 1488 CG LEU A 96 -10.438 -5.138 -12.332 1.00 24.52 C ATOM 1489 CD1 LEU A 96 -10.457 -6.641 -12.557 1.00 72.42 C ATOM 1490 CD2 LEU A 96 -10.587 -4.817 -10.851 1.00 52.22 C ATOM 0 H LEU A 96 -7.307 -3.081 -11.959 1.00 2.35 H new ATOM 0 HA LEU A 96 -8.075 -5.862 -11.590 1.00 64.43 H new ATOM 0 HB2 LEU A 96 -9.177 -3.451 -12.706 1.00 52.32 H new ATOM 0 HB3 LEU A 96 -9.139 -4.669 -13.966 1.00 52.32 H new ATOM 0 HG LEU A 96 -11.282 -4.702 -12.866 1.00 24.52 H new ATOM 0 HD11 LEU A 96 -11.381 -7.057 -12.156 1.00 72.42 H new ATOM 0 HD12 LEU A 96 -10.398 -6.850 -13.625 1.00 72.42 H new ATOM 0 HD13 LEU A 96 -9.605 -7.095 -12.051 1.00 72.42 H new ATOM 0 HD21 LEU A 96 -11.508 -5.260 -10.474 1.00 52.22 H new ATOM 0 HD22 LEU A 96 -9.737 -5.224 -10.303 1.00 52.22 H new ATOM 0 HD23 LEU A 96 -10.622 -3.736 -10.715 1.00 52.22 H new ATOM 1502 N ASN A 97 -5.796 -5.152 -13.608 1.00 35.20 N ATOM 1503 CA ASN A 97 -4.891 -5.641 -14.641 1.00 53.22 C ATOM 1504 C ASN A 97 -5.591 -5.698 -15.995 1.00 41.15 C ATOM 1505 O ASN A 97 -5.264 -6.532 -16.840 1.00 65.33 O ATOM 1506 CB ASN A 97 -4.361 -7.027 -14.270 1.00 53.00 C ATOM 1507 CG ASN A 97 -4.019 -7.140 -12.797 1.00 23.02 C ATOM 1508 OD1 ASN A 97 -4.905 -7.169 -11.943 1.00 4.11 O ATOM 1509 ND2 ASN A 97 -2.728 -7.204 -12.492 1.00 4.24 N ATOM 0 H ASN A 97 -5.424 -4.383 -13.051 1.00 35.20 H new ATOM 0 HA ASN A 97 -4.054 -4.947 -14.713 1.00 53.22 H new ATOM 0 HB2 ASN A 97 -5.108 -7.779 -14.526 1.00 53.00 H new ATOM 0 HB3 ASN A 97 -3.473 -7.245 -14.864 1.00 53.00 H new ATOM 0 HD21 ASN A 97 -2.437 -7.281 -11.517 1.00 4.24 H new ATOM 0 HD22 ASN A 97 -2.027 -7.177 -13.232 1.00 4.24 H new ATOM 1516 N MET A 98 -6.555 -4.805 -16.195 1.00 14.51 N ATOM 1517 CA MET A 98 -7.301 -4.753 -17.447 1.00 71.02 C ATOM 1518 C MET A 98 -6.407 -4.290 -18.593 1.00 24.50 C ATOM 1519 O MET A 98 -5.465 -3.522 -18.389 1.00 11.33 O ATOM 1520 CB MET A 98 -8.502 -3.817 -17.312 1.00 2.32 C ATOM 1521 CG MET A 98 -9.721 -4.274 -18.097 1.00 75.11 C ATOM 1522 SD MET A 98 -10.656 -5.559 -17.243 1.00 64.22 S ATOM 1523 CE MET A 98 -10.904 -6.735 -18.571 1.00 21.13 C ATOM 0 H MET A 98 -6.838 -4.108 -15.506 1.00 14.51 H new ATOM 0 HA MET A 98 -7.657 -5.759 -17.670 1.00 71.02 H new ATOM 0 HB2 MET A 98 -8.769 -3.732 -16.259 1.00 2.32 H new ATOM 0 HB3 MET A 98 -8.215 -2.821 -17.649 1.00 2.32 H new ATOM 0 HG2 MET A 98 -10.371 -3.419 -18.281 1.00 75.11 H new ATOM 0 HG3 MET A 98 -9.402 -4.648 -19.070 1.00 75.11 H new ATOM 0 HE1 MET A 98 -11.469 -7.590 -18.199 1.00 21.13 H new ATOM 0 HE2 MET A 98 -11.457 -6.258 -19.380 1.00 21.13 H new ATOM 0 HE3 MET A 98 -9.937 -7.074 -18.943 1.00 21.13 H new ATOM 1533 N THR A 99 -6.706 -4.761 -19.800 1.00 64.21 N ATOM 1534 CA THR A 99 -5.930 -4.395 -20.977 1.00 54.03 C ATOM 1535 C THR A 99 -6.816 -3.775 -22.051 1.00 1.11 C ATOM 1536 O THR A 99 -6.820 -4.219 -23.199 1.00 41.32 O ATOM 1537 CB THR A 99 -5.201 -5.616 -21.571 1.00 52.11 C ATOM 1538 OG1 THR A 99 -6.153 -6.609 -21.966 1.00 1.34 O ATOM 1539 CG2 THR A 99 -4.230 -6.209 -20.562 1.00 14.53 C ATOM 0 H THR A 99 -7.481 -5.397 -19.987 1.00 64.21 H new ATOM 0 HA THR A 99 -5.192 -3.662 -20.652 1.00 54.03 H new ATOM 0 HB THR A 99 -4.637 -5.287 -22.444 1.00 52.11 H new ATOM 0 HG1 THR A 99 -6.711 -6.257 -22.690 1.00 1.34 H new ATOM 0 HG21 THR A 99 -3.727 -7.069 -21.003 1.00 14.53 H new ATOM 0 HG22 THR A 99 -3.490 -5.459 -20.285 1.00 14.53 H new ATOM 0 HG23 THR A 99 -4.776 -6.525 -19.673 1.00 14.53 H new ATOM 1547 N VAL A 100 -7.567 -2.746 -21.671 1.00 1.15 N ATOM 1548 CA VAL A 100 -8.457 -2.064 -22.602 1.00 45.32 C ATOM 1549 C VAL A 100 -7.717 -1.657 -23.871 1.00 42.35 C ATOM 1550 O VAL A 100 -6.488 -1.626 -23.903 1.00 33.35 O ATOM 1551 CB VAL A 100 -9.086 -0.811 -21.962 1.00 73.12 C ATOM 1552 CG1 VAL A 100 -9.993 -1.200 -20.805 1.00 60.24 C ATOM 1553 CG2 VAL A 100 -8.001 0.150 -21.500 1.00 45.04 C ATOM 0 H VAL A 100 -7.576 -2.367 -20.724 1.00 1.15 H new ATOM 0 HA VAL A 100 -9.249 -2.768 -22.857 1.00 45.32 H new ATOM 0 HB VAL A 100 -9.693 -0.305 -22.713 1.00 73.12 H new ATOM 0 HG11 VAL A 100 -10.428 -0.302 -20.366 1.00 60.24 H new ATOM 0 HG12 VAL A 100 -10.790 -1.848 -21.169 1.00 60.24 H new ATOM 0 HG13 VAL A 100 -9.412 -1.729 -20.049 1.00 60.24 H new ATOM 0 HG21 VAL A 100 -8.461 1.030 -21.050 1.00 45.04 H new ATOM 0 HG22 VAL A 100 -7.367 -0.344 -20.764 1.00 45.04 H new ATOM 0 HG23 VAL A 100 -7.396 0.454 -22.354 1.00 45.04 H new ATOM 1563 N SER A 101 -8.476 -1.345 -24.917 1.00 71.12 N ATOM 1564 CA SER A 101 -7.892 -0.942 -26.191 1.00 41.42 C ATOM 1565 C SER A 101 -7.606 0.556 -26.209 1.00 2.21 C ATOM 1566 O SER A 101 -6.709 1.021 -26.912 1.00 24.10 O ATOM 1567 CB SER A 101 -8.830 -1.307 -27.344 1.00 35.10 C ATOM 1568 OG SER A 101 -9.050 -2.706 -27.399 1.00 44.03 O ATOM 0 H SER A 101 -9.496 -1.364 -24.907 1.00 71.12 H new ATOM 0 HA SER A 101 -6.950 -1.475 -26.315 1.00 41.42 H new ATOM 0 HB2 SER A 101 -9.782 -0.791 -27.220 1.00 35.10 H new ATOM 0 HB3 SER A 101 -8.403 -0.966 -28.287 1.00 35.10 H new ATOM 0 HG SER A 101 -9.654 -2.913 -28.143 1.00 44.03 H new ATOM 1574 N THR A 102 -8.375 1.308 -25.427 1.00 44.43 N ATOM 1575 CA THR A 102 -8.207 2.754 -25.353 1.00 63.32 C ATOM 1576 C THR A 102 -8.498 3.270 -23.948 1.00 2.54 C ATOM 1577 O THR A 102 -9.362 2.741 -23.249 1.00 44.33 O ATOM 1578 CB THR A 102 -9.126 3.480 -26.355 1.00 35.31 C ATOM 1579 OG1 THR A 102 -10.482 3.433 -25.898 1.00 31.32 O ATOM 1580 CG2 THR A 102 -9.029 2.847 -27.735 1.00 14.15 C ATOM 0 H THR A 102 -9.120 0.939 -24.836 1.00 44.43 H new ATOM 0 HA THR A 102 -7.168 2.964 -25.607 1.00 63.32 H new ATOM 0 HB THR A 102 -8.802 4.518 -26.425 1.00 35.31 H new ATOM 0 HG1 THR A 102 -11.060 3.898 -26.539 1.00 31.32 H new ATOM 0 HG21 THR A 102 -9.686 3.376 -28.425 1.00 14.15 H new ATOM 0 HG22 THR A 102 -8.001 2.910 -28.093 1.00 14.15 H new ATOM 0 HG23 THR A 102 -9.330 1.801 -27.677 1.00 14.15 H new ATOM 1588 N ALA A 103 -7.772 4.305 -23.540 1.00 40.34 N ATOM 1589 CA ALA A 103 -7.954 4.893 -22.220 1.00 23.43 C ATOM 1590 C ALA A 103 -9.409 5.291 -21.992 1.00 61.05 C ATOM 1591 O ALA A 103 -9.915 5.216 -20.873 1.00 35.03 O ATOM 1592 CB ALA A 103 -7.043 6.100 -22.049 1.00 24.12 C ATOM 0 H ALA A 103 -7.052 4.754 -24.106 1.00 40.34 H new ATOM 0 HA ALA A 103 -7.688 4.142 -21.476 1.00 23.43 H new ATOM 0 HB1 ALA A 103 -7.190 6.529 -21.058 1.00 24.12 H new ATOM 0 HB2 ALA A 103 -6.004 5.790 -22.160 1.00 24.12 H new ATOM 0 HB3 ALA A 103 -7.282 6.846 -22.807 1.00 24.12 H new ATOM 1598 N ALA A 104 -10.076 5.714 -23.061 1.00 60.34 N ATOM 1599 CA ALA A 104 -11.473 6.123 -22.978 1.00 21.35 C ATOM 1600 C ALA A 104 -12.368 4.944 -22.607 1.00 32.41 C ATOM 1601 O ALA A 104 -13.243 5.063 -21.751 1.00 33.24 O ATOM 1602 CB ALA A 104 -11.923 6.737 -24.295 1.00 13.34 C ATOM 0 H ALA A 104 -9.671 5.782 -23.995 1.00 60.34 H new ATOM 0 HA ALA A 104 -11.561 6.874 -22.193 1.00 21.35 H new ATOM 0 HB1 ALA A 104 -12.968 7.038 -24.218 1.00 13.34 H new ATOM 0 HB2 ALA A 104 -11.310 7.610 -24.518 1.00 13.34 H new ATOM 0 HB3 ALA A 104 -11.814 6.004 -25.094 1.00 13.34 H new ATOM 1608 N ALA A 105 -12.142 3.809 -23.259 1.00 74.11 N ATOM 1609 CA ALA A 105 -12.927 2.608 -22.996 1.00 63.44 C ATOM 1610 C ALA A 105 -12.764 2.151 -21.551 1.00 63.10 C ATOM 1611 O ALA A 105 -13.724 1.717 -20.916 1.00 20.20 O ATOM 1612 CB ALA A 105 -12.525 1.496 -23.953 1.00 1.30 C ATOM 0 H ALA A 105 -11.422 3.695 -23.973 1.00 74.11 H new ATOM 0 HA ALA A 105 -13.978 2.848 -23.156 1.00 63.44 H new ATOM 0 HB1 ALA A 105 -13.118 0.605 -23.746 1.00 1.30 H new ATOM 0 HB2 ALA A 105 -12.700 1.818 -24.979 1.00 1.30 H new ATOM 0 HB3 ALA A 105 -11.468 1.266 -23.820 1.00 1.30 H new ATOM 1618 N ALA A 106 -11.542 2.249 -21.038 1.00 60.35 N ATOM 1619 CA ALA A 106 -11.254 1.847 -19.668 1.00 35.24 C ATOM 1620 C ALA A 106 -11.950 2.765 -18.668 1.00 72.55 C ATOM 1621 O ALA A 106 -12.751 2.313 -17.850 1.00 60.55 O ATOM 1622 CB ALA A 106 -9.752 1.840 -19.423 1.00 53.23 C ATOM 0 H ALA A 106 -10.735 2.604 -21.552 1.00 60.35 H new ATOM 0 HA ALA A 106 -11.639 0.837 -19.525 1.00 35.24 H new ATOM 0 HB1 ALA A 106 -9.552 1.538 -18.395 1.00 53.23 H new ATOM 0 HB2 ALA A 106 -9.275 1.138 -20.107 1.00 53.23 H new ATOM 0 HB3 ALA A 106 -9.351 2.840 -19.591 1.00 53.23 H new ATOM 1628 N GLU A 107 -11.638 4.055 -18.739 1.00 60.12 N ATOM 1629 CA GLU A 107 -12.233 5.036 -17.838 1.00 55.34 C ATOM 1630 C GLU A 107 -13.756 4.956 -17.877 1.00 45.32 C ATOM 1631 O GLU A 107 -14.420 5.061 -16.848 1.00 62.33 O ATOM 1632 CB GLU A 107 -11.776 6.447 -18.211 1.00 72.04 C ATOM 1633 CG GLU A 107 -12.521 7.544 -17.471 1.00 11.00 C ATOM 1634 CD GLU A 107 -13.413 8.363 -18.383 1.00 1.11 C ATOM 1635 OE1 GLU A 107 -13.493 9.593 -18.186 1.00 74.45 O ATOM 1636 OE2 GLU A 107 -14.031 7.773 -19.294 1.00 23.12 O ATOM 0 H GLU A 107 -10.977 4.445 -19.411 1.00 60.12 H new ATOM 0 HA GLU A 107 -11.900 4.810 -16.825 1.00 55.34 H new ATOM 0 HB2 GLU A 107 -10.710 6.541 -18.005 1.00 72.04 H new ATOM 0 HB3 GLU A 107 -11.907 6.590 -19.284 1.00 72.04 H new ATOM 0 HG2 GLU A 107 -13.127 7.098 -16.682 1.00 11.00 H new ATOM 0 HG3 GLU A 107 -11.801 8.203 -16.986 1.00 11.00 H new ATOM 1643 N ASN A 108 -14.303 4.770 -19.075 1.00 13.15 N ATOM 1644 CA ASN A 108 -15.747 4.677 -19.250 1.00 4.14 C ATOM 1645 C ASN A 108 -16.316 3.498 -18.466 1.00 50.42 C ATOM 1646 O ASN A 108 -17.338 3.621 -17.793 1.00 73.15 O ATOM 1647 CB ASN A 108 -16.095 4.534 -20.733 1.00 31.05 C ATOM 1648 CG ASN A 108 -17.588 4.615 -20.987 1.00 15.31 C ATOM 1649 OD1 ASN A 108 -18.113 5.671 -21.337 1.00 41.22 O ATOM 1650 ND2 ASN A 108 -18.278 3.494 -20.812 1.00 3.22 N ATOM 0 H ASN A 108 -13.767 4.681 -19.938 1.00 13.15 H new ATOM 0 HA ASN A 108 -16.193 5.594 -18.866 1.00 4.14 H new ATOM 0 HB2 ASN A 108 -15.590 5.317 -21.299 1.00 31.05 H new ATOM 0 HB3 ASN A 108 -15.718 3.580 -21.102 1.00 31.05 H new ATOM 0 HD21 ASN A 108 -19.286 3.486 -20.969 1.00 3.22 H new ATOM 0 HD22 ASN A 108 -17.800 2.641 -20.521 1.00 3.22 H new ATOM 1657 N MET A 109 -15.644 2.354 -18.561 1.00 23.21 N ATOM 1658 CA MET A 109 -16.082 1.152 -17.860 1.00 31.35 C ATOM 1659 C MET A 109 -15.935 1.320 -16.350 1.00 53.15 C ATOM 1660 O MET A 109 -16.714 0.763 -15.576 1.00 3.01 O ATOM 1661 CB MET A 109 -15.276 -0.060 -18.331 1.00 3.34 C ATOM 1662 CG MET A 109 -15.693 -1.362 -17.665 1.00 54.03 C ATOM 1663 SD MET A 109 -14.295 -2.264 -16.968 1.00 42.12 S ATOM 1664 CE MET A 109 -13.740 -1.112 -15.715 1.00 24.12 C ATOM 0 H MET A 109 -14.796 2.235 -19.115 1.00 23.21 H new ATOM 0 HA MET A 109 -17.135 0.990 -18.089 1.00 31.35 H new ATOM 0 HB2 MET A 109 -15.386 -0.162 -19.411 1.00 3.34 H new ATOM 0 HB3 MET A 109 -14.219 0.118 -18.133 1.00 3.34 H new ATOM 0 HG2 MET A 109 -16.412 -1.147 -16.875 1.00 54.03 H new ATOM 0 HG3 MET A 109 -16.200 -1.993 -18.395 1.00 54.03 H new ATOM 0 HE1 MET A 109 -13.122 -1.637 -14.986 1.00 24.12 H new ATOM 0 HE2 MET A 109 -13.155 -0.320 -16.183 1.00 24.12 H new ATOM 0 HE3 MET A 109 -14.604 -0.677 -15.212 1.00 24.12 H new ATOM 1674 N TYR A 110 -14.932 2.088 -15.940 1.00 61.32 N ATOM 1675 CA TYR A 110 -14.683 2.326 -14.523 1.00 34.42 C ATOM 1676 C TYR A 110 -15.862 3.042 -13.874 1.00 3.21 C ATOM 1677 O TYR A 110 -16.350 2.631 -12.821 1.00 24.21 O ATOM 1678 CB TYR A 110 -13.407 3.150 -14.340 1.00 63.34 C ATOM 1679 CG TYR A 110 -13.193 3.627 -12.922 1.00 20.33 C ATOM 1680 CD1 TYR A 110 -12.436 2.883 -12.024 1.00 41.10 C ATOM 1681 CD2 TYR A 110 -13.748 4.821 -12.477 1.00 70.43 C ATOM 1682 CE1 TYR A 110 -12.238 3.314 -10.727 1.00 23.33 C ATOM 1683 CE2 TYR A 110 -13.554 5.261 -11.182 1.00 44.02 C ATOM 1684 CZ TYR A 110 -12.799 4.505 -10.310 1.00 55.23 C ATOM 1685 OH TYR A 110 -12.604 4.938 -9.019 1.00 3.20 O ATOM 0 H TYR A 110 -14.279 2.556 -16.568 1.00 61.32 H new ATOM 0 HA TYR A 110 -14.557 1.359 -14.035 1.00 34.42 H new ATOM 0 HB2 TYR A 110 -12.550 2.550 -14.646 1.00 63.34 H new ATOM 0 HB3 TYR A 110 -13.444 4.014 -15.003 1.00 63.34 H new ATOM 0 HD1 TYR A 110 -11.995 1.951 -12.346 1.00 41.10 H new ATOM 0 HD2 TYR A 110 -14.342 5.415 -13.156 1.00 70.43 H new ATOM 0 HE1 TYR A 110 -11.648 2.723 -10.043 1.00 23.33 H new ATOM 0 HE2 TYR A 110 -13.991 6.192 -10.854 1.00 44.02 H new ATOM 0 HH TYR A 110 -12.851 5.884 -8.950 1.00 3.20 H new ATOM 1695 N SER A 111 -16.318 4.116 -14.512 1.00 20.32 N ATOM 1696 CA SER A 111 -17.439 4.893 -13.998 1.00 33.33 C ATOM 1697 C SER A 111 -18.767 4.240 -14.365 1.00 21.04 C ATOM 1698 O SER A 111 -19.773 4.428 -13.682 1.00 23.02 O ATOM 1699 CB SER A 111 -17.391 6.321 -14.543 1.00 41.54 C ATOM 1700 OG SER A 111 -17.916 6.381 -15.860 1.00 34.41 O ATOM 0 H SER A 111 -15.928 4.467 -15.386 1.00 20.32 H new ATOM 0 HA SER A 111 -17.358 4.925 -12.911 1.00 33.33 H new ATOM 0 HB2 SER A 111 -17.961 6.982 -13.890 1.00 41.54 H new ATOM 0 HB3 SER A 111 -16.362 6.680 -14.541 1.00 41.54 H new ATOM 0 HG SER A 111 -17.876 7.304 -16.186 1.00 34.41 H new ATOM 1706 N GLN A 112 -18.761 3.471 -15.449 1.00 4.02 N ATOM 1707 CA GLN A 112 -19.965 2.789 -15.909 1.00 24.41 C ATOM 1708 C GLN A 112 -20.492 1.835 -14.842 1.00 74.02 C ATOM 1709 O GLN A 112 -21.678 1.849 -14.514 1.00 63.55 O ATOM 1710 CB GLN A 112 -19.681 2.023 -17.201 1.00 51.30 C ATOM 1711 CG GLN A 112 -20.836 1.144 -17.654 1.00 1.02 C ATOM 1712 CD GLN A 112 -21.100 1.249 -19.143 1.00 15.54 C ATOM 1713 OE1 GLN A 112 -20.576 0.463 -19.934 1.00 45.45 O ATOM 1714 NE2 GLN A 112 -21.917 2.220 -19.532 1.00 50.33 N ATOM 0 H GLN A 112 -17.936 3.305 -16.025 1.00 4.02 H new ATOM 0 HA GLN A 112 -20.727 3.543 -16.103 1.00 24.41 H new ATOM 0 HB2 GLN A 112 -19.446 2.735 -17.992 1.00 51.30 H new ATOM 0 HB3 GLN A 112 -18.797 1.402 -17.058 1.00 51.30 H new ATOM 0 HG2 GLN A 112 -20.619 0.106 -17.400 1.00 1.02 H new ATOM 0 HG3 GLN A 112 -21.737 1.425 -17.108 1.00 1.02 H new ATOM 0 HE21 GLN A 112 -22.328 2.848 -18.841 1.00 50.33 H new ATOM 0 HE22 GLN A 112 -22.134 2.338 -20.522 1.00 50.33 H new ATOM 1723 N MET A 113 -19.602 1.007 -14.306 1.00 32.21 N ATOM 1724 CA MET A 113 -19.977 0.045 -13.275 1.00 24.24 C ATOM 1725 C MET A 113 -19.785 0.638 -11.883 1.00 21.50 C ATOM 1726 O MET A 113 -19.799 -0.081 -10.885 1.00 22.41 O ATOM 1727 CB MET A 113 -19.151 -1.235 -13.416 1.00 24.11 C ATOM 1728 CG MET A 113 -17.657 -1.015 -13.249 1.00 72.33 C ATOM 1729 SD MET A 113 -16.672 -2.129 -14.269 1.00 11.35 S ATOM 1730 CE MET A 113 -15.419 -2.641 -13.097 1.00 12.23 C ATOM 0 H MET A 113 -18.616 0.982 -14.568 1.00 32.21 H new ATOM 0 HA MET A 113 -21.032 -0.197 -13.405 1.00 24.24 H new ATOM 0 HB2 MET A 113 -19.488 -1.959 -12.674 1.00 24.11 H new ATOM 0 HB3 MET A 113 -19.338 -1.672 -14.397 1.00 24.11 H new ATOM 0 HG2 MET A 113 -17.415 0.016 -13.506 1.00 72.33 H new ATOM 0 HG3 MET A 113 -17.388 -1.154 -12.202 1.00 72.33 H new ATOM 0 HE1 MET A 113 -15.035 -3.621 -13.380 1.00 12.23 H new ATOM 0 HE2 MET A 113 -14.604 -1.917 -13.097 1.00 12.23 H new ATOM 0 HE3 MET A 113 -15.855 -2.697 -12.100 1.00 12.23 H new ATOM 1740 N GLY A 114 -19.604 1.955 -11.824 1.00 1.04 N ATOM 1741 CA GLY A 114 -19.410 2.621 -10.549 1.00 0.51 C ATOM 1742 C GLY A 114 -18.314 1.981 -9.722 1.00 31.24 C ATOM 1743 O GLY A 114 -18.338 2.042 -8.492 1.00 64.52 O ATOM 0 H GLY A 114 -19.588 2.572 -12.636 1.00 1.04 H new ATOM 0 HA2 GLY A 114 -19.165 3.669 -10.723 1.00 0.51 H new ATOM 0 HA3 GLY A 114 -20.344 2.602 -9.987 1.00 0.51 H new ATOM 1747 N LEU A 115 -17.349 1.366 -10.396 1.00 0.54 N ATOM 1748 CA LEU A 115 -16.237 0.710 -9.715 1.00 0.54 C ATOM 1749 C LEU A 115 -16.741 -0.398 -8.795 1.00 74.53 C ATOM 1750 O LEU A 115 -16.410 -0.432 -7.609 1.00 65.13 O ATOM 1751 CB LEU A 115 -15.434 1.731 -8.909 1.00 70.11 C ATOM 1752 CG LEU A 115 -14.110 1.235 -8.327 1.00 23.23 C ATOM 1753 CD1 LEU A 115 -13.260 0.589 -9.408 1.00 74.15 C ATOM 1754 CD2 LEU A 115 -13.356 2.380 -7.665 1.00 10.34 C ATOM 0 H LEU A 115 -17.313 1.307 -11.414 1.00 0.54 H new ATOM 0 HA LEU A 115 -15.591 0.264 -10.471 1.00 0.54 H new ATOM 0 HB2 LEU A 115 -15.228 2.589 -9.549 1.00 70.11 H new ATOM 0 HB3 LEU A 115 -16.057 2.088 -8.089 1.00 70.11 H new ATOM 0 HG LEU A 115 -14.328 0.483 -7.568 1.00 23.23 H new ATOM 0 HD11 LEU A 115 -12.322 0.242 -8.975 1.00 74.15 H new ATOM 0 HD12 LEU A 115 -13.797 -0.258 -9.836 1.00 74.15 H new ATOM 0 HD13 LEU A 115 -13.050 1.318 -10.190 1.00 74.15 H new ATOM 0 HD21 LEU A 115 -12.416 2.009 -7.256 1.00 10.34 H new ATOM 0 HD22 LEU A 115 -13.150 3.155 -8.403 1.00 10.34 H new ATOM 0 HD23 LEU A 115 -13.962 2.798 -6.861 1.00 10.34 H new ATOM 1766 N ASP A 116 -17.538 -1.304 -9.350 1.00 24.34 N ATOM 1767 CA ASP A 116 -18.084 -2.416 -8.579 1.00 54.34 C ATOM 1768 C ASP A 116 -17.616 -3.752 -9.149 1.00 30.11 C ATOM 1769 O ASP A 116 -16.947 -4.530 -8.467 1.00 63.35 O ATOM 1770 CB ASP A 116 -19.612 -2.358 -8.573 1.00 24.13 C ATOM 1771 CG ASP A 116 -20.204 -2.835 -7.261 1.00 22.12 C ATOM 1772 OD1 ASP A 116 -20.886 -3.881 -7.263 1.00 54.14 O ATOM 1773 OD2 ASP A 116 -19.984 -2.163 -6.232 1.00 61.23 O ATOM 0 H ASP A 116 -17.821 -1.291 -10.330 1.00 24.34 H new ATOM 0 HA ASP A 116 -17.721 -2.330 -7.555 1.00 54.34 H new ATOM 0 HB2 ASP A 116 -19.935 -1.334 -8.763 1.00 24.13 H new ATOM 0 HB3 ASP A 116 -19.999 -2.971 -9.387 1.00 24.13 H new ATOM 1778 N THR A 117 -17.974 -4.014 -10.402 1.00 74.53 N ATOM 1779 CA THR A 117 -17.592 -5.255 -11.062 1.00 52.35 C ATOM 1780 C THR A 117 -16.080 -5.445 -11.047 1.00 52.13 C ATOM 1781 O THR A 117 -15.329 -4.503 -10.790 1.00 54.43 O ATOM 1782 CB THR A 117 -18.088 -5.293 -12.520 1.00 62.20 C ATOM 1783 OG1 THR A 117 -19.186 -4.388 -12.687 1.00 53.21 O ATOM 1784 CG2 THR A 117 -18.518 -6.698 -12.911 1.00 33.04 C ATOM 0 H THR A 117 -18.528 -3.382 -10.980 1.00 74.53 H new ATOM 0 HA THR A 117 -18.062 -6.065 -10.505 1.00 52.35 H new ATOM 0 HB THR A 117 -17.265 -4.990 -13.168 1.00 62.20 H new ATOM 0 HG1 THR A 117 -19.495 -4.416 -13.617 1.00 53.21 H new ATOM 0 HG21 THR A 117 -18.864 -6.698 -13.945 1.00 33.04 H new ATOM 0 HG22 THR A 117 -17.672 -7.378 -12.811 1.00 33.04 H new ATOM 0 HG23 THR A 117 -19.327 -7.026 -12.258 1.00 33.04 H new ATOM 1792 N ARG A 118 -15.638 -6.668 -11.323 1.00 51.24 N ATOM 1793 CA ARG A 118 -14.214 -6.980 -11.341 1.00 2.41 C ATOM 1794 C ARG A 118 -13.963 -8.340 -11.988 1.00 45.13 C ATOM 1795 O ARG A 118 -13.604 -9.312 -11.326 1.00 12.45 O ATOM 1796 CB ARG A 118 -13.651 -6.970 -9.919 1.00 31.52 C ATOM 1797 CG ARG A 118 -14.479 -7.773 -8.929 1.00 51.12 C ATOM 1798 CD ARG A 118 -13.597 -8.552 -7.967 1.00 51.14 C ATOM 1799 NE ARG A 118 -13.446 -9.948 -8.370 1.00 41.25 N ATOM 1800 CZ ARG A 118 -12.766 -10.847 -7.668 1.00 53.12 C ATOM 1801 NH1 ARG A 118 -12.176 -10.498 -6.533 1.00 15.34 N ATOM 1802 NH2 ARG A 118 -12.674 -12.098 -8.102 1.00 30.14 N ATOM 0 H ARG A 118 -16.246 -7.459 -11.537 1.00 51.24 H new ATOM 0 HA ARG A 118 -13.708 -6.216 -11.932 1.00 2.41 H new ATOM 0 HB2 ARG A 118 -12.636 -7.367 -9.937 1.00 31.52 H new ATOM 0 HB3 ARG A 118 -13.584 -5.939 -9.571 1.00 31.52 H new ATOM 0 HG2 ARG A 118 -15.128 -7.101 -8.367 1.00 51.12 H new ATOM 0 HG3 ARG A 118 -15.127 -8.463 -9.470 1.00 51.12 H new ATOM 0 HD2 ARG A 118 -12.615 -8.082 -7.914 1.00 51.14 H new ATOM 0 HD3 ARG A 118 -14.026 -8.508 -6.966 1.00 51.14 H new ATOM 0 HE ARG A 118 -13.887 -10.249 -9.239 1.00 41.25 H new ATOM 0 HH11 ARG A 118 -12.244 -9.537 -6.197 1.00 15.34 H new ATOM 0 HH12 ARG A 118 -11.654 -11.190 -5.996 1.00 15.34 H new ATOM 0 HH21 ARG A 118 -13.126 -12.369 -8.975 1.00 30.14 H new ATOM 0 HH22 ARG A 118 -12.151 -12.788 -7.562 1.00 30.14 H new ATOM 1816 N PRO A 119 -14.158 -8.408 -13.314 1.00 0.33 N ATOM 1817 CA PRO A 119 -13.959 -9.642 -14.080 1.00 33.55 C ATOM 1818 C PRO A 119 -12.489 -10.034 -14.176 1.00 53.11 C ATOM 1819 O PRO A 119 -11.609 -9.174 -14.220 1.00 73.44 O ATOM 1820 CB PRO A 119 -14.511 -9.294 -15.464 1.00 24.24 C ATOM 1821 CG PRO A 119 -14.382 -7.812 -15.560 1.00 44.43 C ATOM 1822 CD PRO A 119 -14.586 -7.286 -14.166 1.00 13.42 C ATOM 0 HA PRO A 119 -14.451 -10.495 -13.612 1.00 33.55 H new ATOM 0 HB2 PRO A 119 -13.947 -9.793 -16.252 1.00 24.24 H new ATOM 0 HB3 PRO A 119 -15.549 -9.609 -15.567 1.00 24.24 H new ATOM 0 HG2 PRO A 119 -13.402 -7.530 -15.944 1.00 44.43 H new ATOM 0 HG3 PRO A 119 -15.123 -7.400 -16.245 1.00 44.43 H new ATOM 0 HD2 PRO A 119 -13.990 -6.392 -13.982 1.00 13.42 H new ATOM 0 HD3 PRO A 119 -15.627 -7.018 -13.986 1.00 13.42 H new TER 1830 PRO A 119