USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 910 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 30 TYR OH : rot 143:sc= -0.995! USER MOD Set 1.2: A 67 ASN : amide:sc= -1.39! C(o=-2.4!,f=-4.1!) USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.0203 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 MET CE :methyl 151:sc= -0.188 (180deg=-1.56!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 67:sc= 0.1 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 CYS SG : rot 180:sc= -5.28! USER MOD Single : A 19 TYR OH : rot -165:sc= -3.58 USER MOD Single : A 21 SER OG : rot -31:sc= -0.587! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -110:sc= -0.489 (180deg=-2.92!) USER MOD Single : A 26 GLN : amide:sc= -0.525 X(o=-0.53,f=-0.29) USER MOD Single : A 27 THR OG1 : rot -30:sc= -0.178 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -144:sc= -1.38 (180deg=-3.32!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl 176:sc= -7.61! (180deg=-8.02!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN :FLIP amide:sc= -1.65 F(o=-3.5!,f=-1.7) USER MOD Single : A 52 GLN : amide:sc= -2.76 K(o=-2.8,f=-4.6!) USER MOD Single : A 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ -169:sc= -0.133 (180deg=-0.252) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 GLN : amide:sc= -8.8! C(o=-8.8!,f=-20!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.315 K(o=-0.32,f=-0.95) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 GLN :FLIP amide:sc= -4.92! C(o=-6.9!,f=-4.9!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HE2:sc= -0.12! C(o=-0.12!,f=-6.3!) USER MOD Single : A 99 SER OG : rot 8:sc= -0.507 USER MOD Single : A 101 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -0.718 X(o=-0.72,f=-0.77) USER MOD Single : A 104 LYS NZ :NH3+ 155:sc= -0.122 (180deg=-1.25!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.0926 USER MOD Single : A 109 ASN : amide:sc= -0.268 K(o=-0.27,f=-1.6) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.455 -1.876 -9.113 1.00 70.43 N ATOM 2 CA GLY A 1 17.160 -2.732 -7.929 1.00 23.40 C ATOM 3 C GLY A 1 17.487 -4.189 -8.258 1.00 21.30 C ATOM 4 O GLY A 1 18.458 -4.482 -8.927 1.00 62.24 O ATOM 0 H1 GLY A 1 17.905 -0.992 -8.799 1.00 70.43 H new ATOM 0 H2 GLY A 1 18.097 -2.382 -9.756 1.00 70.43 H new ATOM 0 H3 GLY A 1 16.569 -1.655 -9.611 1.00 70.43 H new ATOM 0 HA2 GLY A 1 17.747 -2.401 -7.072 1.00 23.40 H new ATOM 0 HA3 GLY A 1 16.110 -2.638 -7.651 1.00 23.40 H new ATOM 8 N SER A 2 16.686 -5.106 -7.791 1.00 35.23 N ATOM 9 CA SER A 2 16.950 -6.545 -8.076 1.00 1.24 C ATOM 10 C SER A 2 15.809 -7.408 -7.533 1.00 32.13 C ATOM 11 O SER A 2 15.452 -8.416 -8.106 1.00 35.42 O ATOM 12 CB SER A 2 18.253 -6.858 -7.343 1.00 21.43 C ATOM 13 OG SER A 2 18.217 -6.264 -6.051 1.00 32.03 O ATOM 0 H SER A 2 15.859 -4.921 -7.224 1.00 35.23 H new ATOM 0 HA SER A 2 17.023 -6.750 -9.144 1.00 1.24 H new ATOM 0 HB2 SER A 2 18.386 -7.936 -7.257 1.00 21.43 H new ATOM 0 HB3 SER A 2 19.103 -6.476 -7.908 1.00 21.43 H new ATOM 0 HG SER A 2 19.051 -6.463 -5.576 1.00 32.03 H new ATOM 19 N MET A 3 15.235 -7.014 -6.430 1.00 13.25 N ATOM 20 CA MET A 3 14.116 -7.807 -5.845 1.00 54.40 C ATOM 21 C MET A 3 14.566 -9.243 -5.569 1.00 30.03 C ATOM 22 O MET A 3 14.497 -10.092 -6.436 1.00 53.03 O ATOM 23 CB MET A 3 13.018 -7.783 -6.908 1.00 12.03 C ATOM 24 CG MET A 3 11.712 -7.287 -6.285 1.00 41.14 C ATOM 25 SD MET A 3 10.829 -6.249 -7.476 1.00 22.23 S ATOM 26 CE MET A 3 10.939 -7.378 -8.884 1.00 75.10 C ATOM 0 H MET A 3 15.492 -6.177 -5.908 1.00 13.25 H new ATOM 0 HA MET A 3 13.774 -7.397 -4.894 1.00 54.40 H new ATOM 0 HB2 MET A 3 13.310 -7.132 -7.732 1.00 12.03 H new ATOM 0 HB3 MET A 3 12.878 -8.781 -7.324 1.00 12.03 H new ATOM 0 HG2 MET A 3 11.091 -8.134 -5.995 1.00 41.14 H new ATOM 0 HG3 MET A 3 11.922 -6.720 -5.378 1.00 41.14 H new ATOM 0 HE1 MET A 3 10.082 -7.226 -9.540 1.00 75.10 H new ATOM 0 HE2 MET A 3 11.858 -7.182 -9.436 1.00 75.10 H new ATOM 0 HE3 MET A 3 10.944 -8.407 -8.525 1.00 75.10 H new ATOM 36 N PRO A 4 15.010 -9.466 -4.361 1.00 30.31 N ATOM 37 CA PRO A 4 15.473 -10.814 -3.957 1.00 13.52 C ATOM 38 C PRO A 4 14.279 -11.759 -3.807 1.00 1.22 C ATOM 39 O PRO A 4 14.042 -12.315 -2.751 1.00 30.53 O ATOM 40 CB PRO A 4 16.151 -10.572 -2.611 1.00 14.51 C ATOM 41 CG PRO A 4 15.520 -9.323 -2.080 1.00 63.25 C ATOM 42 CD PRO A 4 15.119 -8.492 -3.270 1.00 24.14 C ATOM 0 HA PRO A 4 16.140 -11.278 -4.684 1.00 13.52 H new ATOM 0 HB2 PRO A 4 15.995 -11.412 -1.934 1.00 14.51 H new ATOM 0 HB3 PRO A 4 17.228 -10.452 -2.727 1.00 14.51 H new ATOM 0 HG2 PRO A 4 14.652 -9.561 -1.466 1.00 63.25 H new ATOM 0 HG3 PRO A 4 16.219 -8.777 -1.446 1.00 63.25 H new ATOM 0 HD2 PRO A 4 14.173 -7.978 -3.098 1.00 24.14 H new ATOM 0 HD3 PRO A 4 15.862 -7.726 -3.491 1.00 24.14 H new ATOM 50 N LYS A 5 13.520 -11.941 -4.853 1.00 61.12 N ATOM 51 CA LYS A 5 12.336 -12.844 -4.770 1.00 3.43 C ATOM 52 C LYS A 5 12.786 -14.299 -4.622 1.00 52.33 C ATOM 53 O LYS A 5 13.483 -14.824 -5.469 1.00 42.00 O ATOM 54 CB LYS A 5 11.599 -12.646 -6.094 1.00 12.44 C ATOM 55 CG LYS A 5 10.090 -12.736 -5.857 1.00 65.05 C ATOM 56 CD LYS A 5 9.393 -11.574 -6.565 1.00 42.43 C ATOM 57 CE LYS A 5 7.936 -11.952 -6.849 1.00 24.24 C ATOM 58 NZ LYS A 5 7.191 -11.596 -5.608 1.00 1.25 N ATOM 0 H LYS A 5 13.668 -11.503 -5.762 1.00 61.12 H new ATOM 0 HA LYS A 5 11.705 -12.619 -3.910 1.00 3.43 H new ATOM 0 HB2 LYS A 5 11.853 -11.677 -6.522 1.00 12.44 H new ATOM 0 HB3 LYS A 5 11.911 -13.404 -6.813 1.00 12.44 H new ATOM 0 HG2 LYS A 5 9.708 -13.686 -6.232 1.00 65.05 H new ATOM 0 HG3 LYS A 5 9.876 -12.706 -4.789 1.00 65.05 H new ATOM 0 HD2 LYS A 5 9.434 -10.679 -5.945 1.00 42.43 H new ATOM 0 HD3 LYS A 5 9.908 -11.340 -7.497 1.00 42.43 H new ATOM 0 HE2 LYS A 5 7.549 -11.408 -7.711 1.00 24.24 H new ATOM 0 HE3 LYS A 5 7.841 -13.014 -7.074 1.00 24.24 H new ATOM 0 HZ1 LYS A 5 6.184 -11.827 -5.729 1.00 1.25 H new ATOM 0 HZ2 LYS A 5 7.576 -12.134 -4.806 1.00 1.25 H new ATOM 0 HZ3 LYS A 5 7.292 -10.578 -5.422 1.00 1.25 H new ATOM 72 N PRO A 6 12.366 -14.911 -3.546 1.00 23.41 N ATOM 73 CA PRO A 6 12.724 -16.324 -3.285 1.00 1.01 C ATOM 74 C PRO A 6 11.858 -17.256 -4.137 1.00 34.15 C ATOM 75 O PRO A 6 10.785 -17.659 -3.737 1.00 42.41 O ATOM 76 CB PRO A 6 12.414 -16.502 -1.803 1.00 21.41 C ATOM 77 CG PRO A 6 11.371 -15.475 -1.491 1.00 42.52 C ATOM 78 CD PRO A 6 11.527 -14.346 -2.482 1.00 74.12 C ATOM 0 HA PRO A 6 13.760 -16.558 -3.530 1.00 1.01 H new ATOM 0 HB2 PRO A 6 12.050 -17.508 -1.596 1.00 21.41 H new ATOM 0 HB3 PRO A 6 13.306 -16.354 -1.194 1.00 21.41 H new ATOM 0 HG2 PRO A 6 10.374 -15.910 -1.560 1.00 42.52 H new ATOM 0 HG3 PRO A 6 11.489 -15.108 -0.471 1.00 42.52 H new ATOM 0 HD2 PRO A 6 10.561 -14.019 -2.868 1.00 74.12 H new ATOM 0 HD3 PRO A 6 11.998 -13.476 -2.024 1.00 74.12 H new ATOM 86 N GLY A 7 12.316 -17.605 -5.308 1.00 12.23 N ATOM 87 CA GLY A 7 11.515 -18.512 -6.180 1.00 23.41 C ATOM 88 C GLY A 7 12.133 -18.556 -7.578 1.00 23.13 C ATOM 89 O GLY A 7 13.190 -18.006 -7.819 1.00 71.43 O ATOM 0 H GLY A 7 13.208 -17.302 -5.699 1.00 12.23 H new ATOM 0 HA2 GLY A 7 11.487 -19.514 -5.752 1.00 23.41 H new ATOM 0 HA3 GLY A 7 10.485 -18.161 -6.238 1.00 23.41 H new ATOM 93 N ILE A 8 11.482 -19.208 -8.502 1.00 11.04 N ATOM 94 CA ILE A 8 12.030 -19.288 -9.886 1.00 14.12 C ATOM 95 C ILE A 8 13.514 -19.665 -9.851 1.00 70.43 C ATOM 96 O ILE A 8 14.381 -18.813 -9.837 1.00 1.01 O ATOM 97 CB ILE A 8 11.847 -17.883 -10.463 1.00 64.34 C ATOM 98 CG1 ILE A 8 10.379 -17.677 -10.844 1.00 14.51 C ATOM 99 CG2 ILE A 8 12.721 -17.720 -11.708 1.00 71.11 C ATOM 100 CD1 ILE A 8 9.739 -16.671 -9.882 1.00 23.42 C ATOM 0 H ILE A 8 10.594 -19.689 -8.359 1.00 11.04 H new ATOM 0 HA ILE A 8 11.527 -20.046 -10.486 1.00 14.12 H new ATOM 0 HB ILE A 8 12.139 -17.145 -9.716 1.00 64.34 H new ATOM 0 HG12 ILE A 8 10.306 -17.314 -11.869 1.00 14.51 H new ATOM 0 HG13 ILE A 8 9.845 -18.626 -10.803 1.00 14.51 H new ATOM 0 HG21 ILE A 8 12.589 -16.718 -12.117 1.00 71.11 H new ATOM 0 HG22 ILE A 8 13.767 -17.867 -11.440 1.00 71.11 H new ATOM 0 HG23 ILE A 8 12.431 -18.458 -12.456 1.00 71.11 H new ATOM 0 HD11 ILE A 8 8.693 -16.523 -10.152 1.00 23.42 H new ATOM 0 HD12 ILE A 8 9.800 -17.053 -8.863 1.00 23.42 H new ATOM 0 HD13 ILE A 8 10.268 -15.720 -9.945 1.00 23.42 H new ATOM 112 N LEU A 9 13.815 -20.935 -9.839 1.00 25.21 N ATOM 113 CA LEU A 9 15.244 -21.361 -9.808 1.00 44.13 C ATOM 114 C LEU A 9 15.357 -22.855 -10.119 1.00 42.41 C ATOM 115 O LEU A 9 15.888 -23.249 -11.140 1.00 61.23 O ATOM 116 CB LEU A 9 15.715 -21.069 -8.385 1.00 23.14 C ATOM 117 CG LEU A 9 17.021 -20.276 -8.433 1.00 52.41 C ATOM 118 CD1 LEU A 9 17.196 -19.502 -7.125 1.00 34.11 C ATOM 119 CD2 LEU A 9 18.198 -21.238 -8.614 1.00 35.33 C ATOM 0 H LEU A 9 13.135 -21.695 -9.849 1.00 25.21 H new ATOM 0 HA LEU A 9 15.847 -20.838 -10.550 1.00 44.13 H new ATOM 0 HB2 LEU A 9 14.954 -20.504 -7.847 1.00 23.14 H new ATOM 0 HB3 LEU A 9 15.863 -22.002 -7.841 1.00 23.14 H new ATOM 0 HG LEU A 9 16.990 -19.578 -9.269 1.00 52.41 H new ATOM 0 HD11 LEU A 9 18.127 -18.936 -7.159 1.00 34.11 H new ATOM 0 HD12 LEU A 9 16.359 -18.816 -6.993 1.00 34.11 H new ATOM 0 HD13 LEU A 9 17.226 -20.201 -6.290 1.00 34.11 H new ATOM 0 HD21 LEU A 9 19.129 -20.672 -8.648 1.00 35.33 H new ATOM 0 HD22 LEU A 9 18.229 -21.937 -7.778 1.00 35.33 H new ATOM 0 HD23 LEU A 9 18.076 -21.791 -9.545 1.00 35.33 H new ATOM 131 N LYS A 10 14.864 -23.693 -9.247 1.00 4.20 N ATOM 132 CA LYS A 10 14.948 -25.161 -9.497 1.00 60.13 C ATOM 133 C LYS A 10 13.572 -25.714 -9.887 1.00 12.25 C ATOM 134 O LYS A 10 13.419 -26.890 -10.146 1.00 65.30 O ATOM 135 CB LYS A 10 15.416 -25.763 -8.170 1.00 54.22 C ATOM 136 CG LYS A 10 15.294 -27.288 -8.228 1.00 14.03 C ATOM 137 CD LYS A 10 16.080 -27.818 -9.429 1.00 63.34 C ATOM 138 CE LYS A 10 17.129 -28.825 -8.956 1.00 45.34 C ATOM 139 NZ LYS A 10 18.315 -28.001 -8.589 1.00 54.01 N ATOM 0 H LYS A 10 14.408 -23.426 -8.375 1.00 4.20 H new ATOM 0 HA LYS A 10 15.627 -25.402 -10.315 1.00 60.13 H new ATOM 0 HB2 LYS A 10 16.450 -25.478 -7.974 1.00 54.22 H new ATOM 0 HB3 LYS A 10 14.816 -25.371 -7.349 1.00 54.22 H new ATOM 0 HG2 LYS A 10 15.675 -27.729 -7.307 1.00 14.03 H new ATOM 0 HG3 LYS A 10 14.246 -27.577 -8.310 1.00 14.03 H new ATOM 0 HD2 LYS A 10 15.402 -28.291 -10.139 1.00 63.34 H new ATOM 0 HD3 LYS A 10 16.564 -26.993 -9.952 1.00 63.34 H new ATOM 0 HE2 LYS A 10 16.768 -29.400 -8.103 1.00 45.34 H new ATOM 0 HE3 LYS A 10 17.373 -29.540 -9.742 1.00 45.34 H new ATOM 0 HZ1 LYS A 10 19.079 -28.622 -8.254 1.00 54.01 H new ATOM 0 HZ2 LYS A 10 18.640 -27.470 -9.422 1.00 54.01 H new ATOM 0 HZ3 LYS A 10 18.055 -27.335 -7.834 1.00 54.01 H new ATOM 153 N SER A 11 12.575 -24.876 -9.932 1.00 22.51 N ATOM 154 CA SER A 11 11.213 -25.354 -10.308 1.00 11.13 C ATOM 155 C SER A 11 10.762 -26.468 -9.360 1.00 42.33 C ATOM 156 O SER A 11 11.297 -27.559 -9.371 1.00 42.23 O ATOM 157 CB SER A 11 11.363 -25.890 -11.732 1.00 44.14 C ATOM 158 OG SER A 11 10.071 -26.101 -12.292 1.00 11.24 O ATOM 0 H SER A 11 12.643 -23.880 -9.725 1.00 22.51 H new ATOM 0 HA SER A 11 10.465 -24.563 -10.245 1.00 11.13 H new ATOM 0 HB2 SER A 11 11.926 -25.183 -12.342 1.00 44.14 H new ATOM 0 HB3 SER A 11 11.926 -26.823 -11.725 1.00 44.14 H new ATOM 0 HG SER A 11 10.162 -26.443 -13.206 1.00 11.24 H new ATOM 164 N LYS A 12 9.778 -26.206 -8.542 1.00 71.24 N ATOM 165 CA LYS A 12 9.296 -27.255 -7.599 1.00 21.15 C ATOM 166 C LYS A 12 7.837 -27.611 -7.904 1.00 51.22 C ATOM 167 O LYS A 12 7.167 -26.935 -8.659 1.00 71.33 O ATOM 168 CB LYS A 12 9.413 -26.627 -6.210 1.00 61.41 C ATOM 169 CG LYS A 12 10.810 -26.030 -6.036 1.00 53.51 C ATOM 170 CD LYS A 12 10.689 -24.592 -5.520 1.00 11.41 C ATOM 171 CE LYS A 12 9.977 -23.738 -6.568 1.00 42.43 C ATOM 172 NZ LYS A 12 9.482 -22.546 -5.823 1.00 34.44 N ATOM 0 H LYS A 12 9.288 -25.313 -8.486 1.00 71.24 H new ATOM 0 HA LYS A 12 9.873 -28.176 -7.679 1.00 21.15 H new ATOM 0 HB2 LYS A 12 8.657 -25.852 -6.085 1.00 61.41 H new ATOM 0 HB3 LYS A 12 9.229 -27.379 -5.443 1.00 61.41 H new ATOM 0 HG2 LYS A 12 11.390 -26.632 -5.336 1.00 53.51 H new ATOM 0 HG3 LYS A 12 11.344 -26.043 -6.986 1.00 53.51 H new ATOM 0 HD2 LYS A 12 10.134 -24.575 -4.582 1.00 11.41 H new ATOM 0 HD3 LYS A 12 11.678 -24.184 -5.312 1.00 11.41 H new ATOM 0 HE2 LYS A 12 10.657 -23.448 -7.369 1.00 42.43 H new ATOM 0 HE3 LYS A 12 9.155 -24.284 -7.030 1.00 42.43 H new ATOM 0 HZ1 LYS A 12 8.981 -21.911 -6.477 1.00 34.44 H new ATOM 0 HZ2 LYS A 12 8.832 -22.852 -5.071 1.00 34.44 H new ATOM 0 HZ3 LYS A 12 10.287 -22.042 -5.400 1.00 34.44 H new ATOM 186 N SER A 13 7.343 -28.670 -7.322 1.00 41.42 N ATOM 187 CA SER A 13 5.928 -29.067 -7.575 1.00 12.23 C ATOM 188 C SER A 13 5.141 -29.084 -6.262 1.00 12.31 C ATOM 189 O SER A 13 5.632 -29.518 -5.240 1.00 55.32 O ATOM 190 CB SER A 13 6.009 -30.475 -8.163 1.00 5.31 C ATOM 191 OG SER A 13 4.694 -30.979 -8.357 1.00 64.00 O ATOM 0 H SER A 13 7.857 -29.277 -6.683 1.00 41.42 H new ATOM 0 HA SER A 13 5.420 -28.373 -8.244 1.00 12.23 H new ATOM 0 HB2 SER A 13 6.547 -30.455 -9.111 1.00 5.31 H new ATOM 0 HB3 SER A 13 6.567 -31.130 -7.493 1.00 5.31 H new ATOM 0 HG SER A 13 4.243 -30.457 -9.053 1.00 64.00 H new ATOM 197 N MET A 14 3.926 -28.610 -6.281 1.00 11.21 N ATOM 198 CA MET A 14 3.114 -28.601 -5.032 1.00 64.10 C ATOM 199 C MET A 14 1.620 -28.668 -5.367 1.00 31.34 C ATOM 200 O MET A 14 1.228 -28.621 -6.516 1.00 53.02 O ATOM 201 CB MET A 14 3.451 -27.273 -4.351 1.00 34.23 C ATOM 202 CG MET A 14 3.856 -27.534 -2.900 1.00 45.52 C ATOM 203 SD MET A 14 3.271 -26.176 -1.855 1.00 1.01 S ATOM 204 CE MET A 14 4.863 -25.763 -1.097 1.00 43.51 C ATOM 0 H MET A 14 3.461 -28.229 -7.105 1.00 11.21 H new ATOM 0 HA MET A 14 3.333 -29.456 -4.393 1.00 64.10 H new ATOM 0 HB2 MET A 14 4.262 -26.775 -4.882 1.00 34.23 H new ATOM 0 HB3 MET A 14 2.590 -26.605 -4.385 1.00 34.23 H new ATOM 0 HG2 MET A 14 3.433 -28.478 -2.558 1.00 45.52 H new ATOM 0 HG3 MET A 14 4.940 -27.624 -2.824 1.00 45.52 H new ATOM 0 HE1 MET A 14 4.731 -24.933 -0.403 1.00 43.51 H new ATOM 0 HE2 MET A 14 5.245 -26.630 -0.558 1.00 43.51 H new ATOM 0 HE3 MET A 14 5.572 -25.477 -1.874 1.00 43.51 H new ATOM 214 N PHE A 15 0.785 -28.781 -4.370 1.00 40.04 N ATOM 215 CA PHE A 15 -0.684 -28.853 -4.625 1.00 41.01 C ATOM 216 C PHE A 15 -1.360 -27.551 -4.184 1.00 3.21 C ATOM 217 O PHE A 15 -1.020 -26.978 -3.167 1.00 1.15 O ATOM 218 CB PHE A 15 -1.170 -30.033 -3.774 1.00 23.43 C ATOM 219 CG PHE A 15 -2.651 -29.898 -3.504 1.00 44.01 C ATOM 220 CD1 PHE A 15 -3.101 -29.020 -2.511 1.00 53.33 C ATOM 221 CD2 PHE A 15 -3.571 -30.650 -4.245 1.00 21.35 C ATOM 222 CE1 PHE A 15 -4.471 -28.892 -2.259 1.00 14.03 C ATOM 223 CE2 PHE A 15 -4.942 -30.522 -3.992 1.00 30.20 C ATOM 224 CZ PHE A 15 -5.392 -29.643 -2.999 1.00 22.05 C ATOM 0 H PHE A 15 1.056 -28.827 -3.388 1.00 40.04 H new ATOM 0 HA PHE A 15 -0.919 -28.987 -5.681 1.00 41.01 H new ATOM 0 HB2 PHE A 15 -0.970 -30.972 -4.291 1.00 23.43 H new ATOM 0 HB3 PHE A 15 -0.621 -30.064 -2.833 1.00 23.43 H new ATOM 0 HD1 PHE A 15 -2.390 -28.441 -1.939 1.00 53.33 H new ATOM 0 HD2 PHE A 15 -3.223 -31.328 -5.011 1.00 21.35 H new ATOM 0 HE1 PHE A 15 -4.818 -28.214 -1.494 1.00 14.03 H new ATOM 0 HE2 PHE A 15 -5.653 -31.101 -4.563 1.00 30.20 H new ATOM 0 HZ PHE A 15 -6.450 -29.544 -2.804 1.00 22.05 H new ATOM 234 N CYS A 16 -2.320 -27.088 -4.934 1.00 20.43 N ATOM 235 CA CYS A 16 -3.025 -25.831 -4.549 1.00 72.30 C ATOM 236 C CYS A 16 -4.527 -25.971 -4.833 1.00 4.43 C ATOM 237 O CYS A 16 -4.943 -26.802 -5.615 1.00 4.21 O ATOM 238 CB CYS A 16 -2.365 -24.720 -5.389 1.00 74.22 C ATOM 239 SG CYS A 16 -3.214 -24.497 -6.978 1.00 11.15 S ATOM 0 H CYS A 16 -2.648 -27.524 -5.796 1.00 20.43 H new ATOM 0 HA CYS A 16 -2.941 -25.602 -3.487 1.00 72.30 H new ATOM 0 HB2 CYS A 16 -2.380 -23.783 -4.832 1.00 74.22 H new ATOM 0 HB3 CYS A 16 -1.319 -24.969 -5.566 1.00 74.22 H new ATOM 0 HG CYS A 16 -2.630 -23.552 -7.653 1.00 11.15 H new ATOM 245 N VAL A 17 -5.343 -25.178 -4.196 1.00 2.12 N ATOM 246 CA VAL A 17 -6.812 -25.286 -4.426 1.00 43.52 C ATOM 247 C VAL A 17 -7.330 -24.052 -5.166 1.00 21.41 C ATOM 248 O VAL A 17 -7.154 -22.932 -4.727 1.00 3.13 O ATOM 249 CB VAL A 17 -7.442 -25.363 -3.032 1.00 42.24 C ATOM 250 CG1 VAL A 17 -8.809 -26.044 -3.127 1.00 2.10 C ATOM 251 CG2 VAL A 17 -6.541 -26.170 -2.090 1.00 2.43 C ATOM 0 H VAL A 17 -5.058 -24.462 -3.528 1.00 2.12 H new ATOM 0 HA VAL A 17 -7.059 -26.156 -5.035 1.00 43.52 H new ATOM 0 HB VAL A 17 -7.558 -24.353 -2.640 1.00 42.24 H new ATOM 0 HG11 VAL A 17 -9.258 -26.099 -2.135 1.00 2.10 H new ATOM 0 HG12 VAL A 17 -9.457 -25.468 -3.787 1.00 2.10 H new ATOM 0 HG13 VAL A 17 -8.687 -27.051 -3.526 1.00 2.10 H new ATOM 0 HG21 VAL A 17 -6.998 -26.218 -1.102 1.00 2.43 H new ATOM 0 HG22 VAL A 17 -6.416 -27.179 -2.482 1.00 2.43 H new ATOM 0 HG23 VAL A 17 -5.567 -25.687 -2.016 1.00 2.43 H new ATOM 261 N ILE A 18 -7.974 -24.252 -6.279 1.00 74.22 N ATOM 262 CA ILE A 18 -8.514 -23.095 -7.049 1.00 34.32 C ATOM 263 C ILE A 18 -9.972 -22.832 -6.647 1.00 14.12 C ATOM 264 O ILE A 18 -10.857 -23.607 -6.949 1.00 3.14 O ATOM 265 CB ILE A 18 -8.417 -23.524 -8.517 1.00 74.03 C ATOM 266 CG1 ILE A 18 -6.994 -23.285 -9.021 1.00 10.42 C ATOM 267 CG2 ILE A 18 -9.396 -22.707 -9.367 1.00 24.51 C ATOM 268 CD1 ILE A 18 -6.381 -24.617 -9.458 1.00 3.24 C ATOM 0 H ILE A 18 -8.151 -25.168 -6.692 1.00 74.22 H new ATOM 0 HA ILE A 18 -7.967 -22.171 -6.861 1.00 34.32 H new ATOM 0 HB ILE A 18 -8.667 -24.582 -8.597 1.00 74.03 H new ATOM 0 HG12 ILE A 18 -7.005 -22.585 -9.857 1.00 10.42 H new ATOM 0 HG13 ILE A 18 -6.389 -22.834 -8.235 1.00 10.42 H new ATOM 0 HG21 ILE A 18 -9.321 -23.018 -10.409 1.00 24.51 H new ATOM 0 HG22 ILE A 18 -10.413 -22.873 -9.011 1.00 24.51 H new ATOM 0 HG23 ILE A 18 -9.152 -21.648 -9.286 1.00 24.51 H new ATOM 0 HD11 ILE A 18 -5.366 -24.450 -9.818 1.00 3.24 H new ATOM 0 HD12 ILE A 18 -6.357 -25.302 -8.610 1.00 3.24 H new ATOM 0 HD13 ILE A 18 -6.983 -25.050 -10.257 1.00 3.24 H new ATOM 280 N TYR A 19 -10.224 -21.744 -5.968 1.00 4.31 N ATOM 281 CA TYR A 19 -11.622 -21.435 -5.545 1.00 2.30 C ATOM 282 C TYR A 19 -12.332 -20.604 -6.617 1.00 42.21 C ATOM 283 O TYR A 19 -11.705 -20.029 -7.486 1.00 65.01 O ATOM 284 CB TYR A 19 -11.479 -20.621 -4.261 1.00 30.11 C ATOM 285 CG TYR A 19 -11.220 -21.553 -3.100 1.00 2.52 C ATOM 286 CD1 TYR A 19 -9.920 -22.004 -2.843 1.00 63.24 C ATOM 287 CD2 TYR A 19 -12.281 -21.969 -2.286 1.00 64.42 C ATOM 288 CE1 TYR A 19 -9.681 -22.871 -1.768 1.00 11.01 C ATOM 289 CE2 TYR A 19 -12.041 -22.834 -1.212 1.00 13.14 C ATOM 290 CZ TYR A 19 -10.740 -23.285 -0.952 1.00 20.14 C ATOM 291 OH TYR A 19 -10.504 -24.139 0.106 1.00 23.23 O ATOM 0 H TYR A 19 -9.524 -21.057 -5.688 1.00 4.31 H new ATOM 0 HA TYR A 19 -12.212 -22.340 -5.396 1.00 2.30 H new ATOM 0 HB2 TYR A 19 -10.660 -19.908 -4.359 1.00 30.11 H new ATOM 0 HB3 TYR A 19 -12.385 -20.042 -4.082 1.00 30.11 H new ATOM 0 HD1 TYR A 19 -9.102 -21.684 -3.472 1.00 63.24 H new ATOM 0 HD2 TYR A 19 -13.284 -21.623 -2.487 1.00 64.42 H new ATOM 0 HE1 TYR A 19 -8.678 -23.220 -1.569 1.00 11.01 H new ATOM 0 HE2 TYR A 19 -12.859 -23.154 -0.583 1.00 13.14 H new ATOM 0 HH TYR A 19 -11.353 -24.516 0.418 1.00 23.23 H new ATOM 301 N ARG A 20 -13.633 -20.533 -6.555 1.00 61.25 N ATOM 302 CA ARG A 20 -14.382 -19.734 -7.568 1.00 62.51 C ATOM 303 C ARG A 20 -15.401 -18.825 -6.872 1.00 74.34 C ATOM 304 O ARG A 20 -16.031 -19.202 -5.904 1.00 73.21 O ATOM 305 CB ARG A 20 -15.090 -20.765 -8.448 1.00 71.10 C ATOM 306 CG ARG A 20 -16.065 -21.587 -7.602 1.00 50.15 C ATOM 307 CD ARG A 20 -17.120 -22.219 -8.511 1.00 63.03 C ATOM 308 NE ARG A 20 -18.418 -21.964 -7.825 1.00 31.14 N ATOM 309 CZ ARG A 20 -19.526 -22.438 -8.329 1.00 61.14 C ATOM 310 NH1 ARG A 20 -19.593 -23.693 -8.690 1.00 53.42 N ATOM 311 NH2 ARG A 20 -20.564 -21.661 -8.471 1.00 10.24 N ATOM 0 H ARG A 20 -14.209 -20.992 -5.849 1.00 61.25 H new ATOM 0 HA ARG A 20 -13.727 -19.088 -8.152 1.00 62.51 H new ATOM 0 HB2 ARG A 20 -15.627 -20.262 -9.253 1.00 71.10 H new ATOM 0 HB3 ARG A 20 -14.357 -21.422 -8.916 1.00 71.10 H new ATOM 0 HG2 ARG A 20 -15.526 -22.363 -7.058 1.00 50.15 H new ATOM 0 HG3 ARG A 20 -16.544 -20.950 -6.858 1.00 50.15 H new ATOM 0 HD2 ARG A 20 -17.104 -21.772 -9.505 1.00 63.03 H new ATOM 0 HD3 ARG A 20 -16.943 -23.287 -8.638 1.00 63.03 H new ATOM 0 HE ARG A 20 -18.441 -21.420 -6.963 1.00 31.14 H new ATOM 0 HH11 ARG A 20 -18.781 -24.300 -8.578 1.00 53.42 H new ATOM 0 HH12 ARG A 20 -20.457 -24.065 -9.084 1.00 53.42 H new ATOM 0 HH21 ARG A 20 -20.511 -20.682 -8.188 1.00 10.24 H new ATOM 0 HH22 ARG A 20 -21.429 -22.032 -8.865 1.00 10.24 H new ATOM 325 N SER A 21 -15.565 -17.628 -7.360 1.00 63.05 N ATOM 326 CA SER A 21 -16.542 -16.693 -6.733 1.00 4.01 C ATOM 327 C SER A 21 -17.968 -17.086 -7.129 1.00 64.31 C ATOM 328 O SER A 21 -18.240 -17.404 -8.269 1.00 65.00 O ATOM 329 CB SER A 21 -16.187 -15.315 -7.291 1.00 4.12 C ATOM 330 OG SER A 21 -15.003 -14.844 -6.664 1.00 43.41 O ATOM 0 H SER A 21 -15.065 -17.255 -8.167 1.00 63.05 H new ATOM 0 HA SER A 21 -16.497 -16.711 -5.644 1.00 4.01 H new ATOM 0 HB2 SER A 21 -16.042 -15.373 -8.370 1.00 4.12 H new ATOM 0 HB3 SER A 21 -17.006 -14.618 -7.117 1.00 4.12 H new ATOM 0 HG SER A 21 -14.953 -15.198 -5.752 1.00 43.41 H new ATOM 336 N SER A 22 -18.881 -17.070 -6.197 1.00 12.23 N ATOM 337 CA SER A 22 -20.285 -17.449 -6.525 1.00 12.40 C ATOM 338 C SER A 22 -20.836 -16.550 -7.636 1.00 51.13 C ATOM 339 O SER A 22 -21.524 -17.005 -8.528 1.00 12.04 O ATOM 340 CB SER A 22 -21.067 -17.238 -5.230 1.00 13.20 C ATOM 341 OG SER A 22 -20.641 -18.191 -4.264 1.00 33.05 O ATOM 0 H SER A 22 -18.716 -16.811 -5.224 1.00 12.23 H new ATOM 0 HA SER A 22 -20.358 -18.476 -6.884 1.00 12.40 H new ATOM 0 HB2 SER A 22 -20.907 -16.227 -4.856 1.00 13.20 H new ATOM 0 HB3 SER A 22 -22.136 -17.344 -5.416 1.00 13.20 H new ATOM 0 HG SER A 22 -21.140 -18.058 -3.431 1.00 33.05 H new ATOM 347 N LYS A 23 -20.544 -15.280 -7.588 1.00 74.14 N ATOM 348 CA LYS A 23 -21.059 -14.360 -8.644 1.00 1.20 C ATOM 349 C LYS A 23 -20.001 -13.312 -9.001 1.00 63.22 C ATOM 350 O LYS A 23 -19.889 -12.287 -8.358 1.00 3.42 O ATOM 351 CB LYS A 23 -22.283 -13.693 -8.018 1.00 64.20 C ATOM 352 CG LYS A 23 -21.871 -12.990 -6.722 1.00 5.04 C ATOM 353 CD LYS A 23 -22.538 -13.680 -5.530 1.00 44.02 C ATOM 354 CE LYS A 23 -21.928 -13.152 -4.228 1.00 34.31 C ATOM 355 NZ LYS A 23 -20.585 -13.795 -4.133 1.00 64.24 N ATOM 0 H LYS A 23 -19.973 -14.839 -6.867 1.00 74.14 H new ATOM 0 HA LYS A 23 -21.304 -14.886 -9.567 1.00 1.20 H new ATOM 0 HB2 LYS A 23 -22.715 -12.973 -8.714 1.00 64.20 H new ATOM 0 HB3 LYS A 23 -23.052 -14.438 -7.812 1.00 64.20 H new ATOM 0 HG2 LYS A 23 -20.787 -13.016 -6.611 1.00 5.04 H new ATOM 0 HG3 LYS A 23 -22.162 -11.940 -6.757 1.00 5.04 H new ATOM 0 HD2 LYS A 23 -23.612 -13.494 -5.543 1.00 44.02 H new ATOM 0 HD3 LYS A 23 -22.401 -14.759 -5.597 1.00 44.02 H new ATOM 0 HE2 LYS A 23 -21.843 -12.065 -4.246 1.00 34.31 H new ATOM 0 HE3 LYS A 23 -22.549 -13.410 -3.370 1.00 34.31 H new ATOM 0 HZ1 LYS A 23 -20.588 -14.492 -3.361 1.00 64.24 H new ATOM 0 HZ2 LYS A 23 -20.365 -14.273 -5.030 1.00 64.24 H new ATOM 0 HZ3 LYS A 23 -19.865 -13.069 -3.942 1.00 64.24 H new ATOM 369 N ARG A 24 -19.228 -13.560 -10.023 1.00 61.13 N ATOM 370 CA ARG A 24 -18.178 -12.578 -10.426 1.00 23.50 C ATOM 371 C ARG A 24 -17.804 -12.783 -11.896 1.00 11.32 C ATOM 372 O ARG A 24 -18.498 -13.455 -12.634 1.00 40.13 O ATOM 373 CB ARG A 24 -16.982 -12.881 -9.519 1.00 72.04 C ATOM 374 CG ARG A 24 -16.954 -11.887 -8.354 1.00 52.42 C ATOM 375 CD ARG A 24 -16.065 -10.694 -8.717 1.00 4.42 C ATOM 376 NE ARG A 24 -16.678 -9.533 -8.013 1.00 54.21 N ATOM 377 CZ ARG A 24 -16.085 -8.370 -8.034 1.00 35.14 C ATOM 378 NH1 ARG A 24 -14.822 -8.283 -8.349 1.00 4.10 N ATOM 379 NH2 ARG A 24 -16.760 -7.290 -7.742 1.00 61.02 N ATOM 0 H ARG A 24 -19.277 -14.401 -10.598 1.00 61.13 H new ATOM 0 HA ARG A 24 -18.514 -11.546 -10.324 1.00 23.50 H new ATOM 0 HB2 ARG A 24 -17.050 -13.900 -9.139 1.00 72.04 H new ATOM 0 HB3 ARG A 24 -16.055 -12.815 -10.089 1.00 72.04 H new ATOM 0 HG2 ARG A 24 -17.965 -11.545 -8.130 1.00 52.42 H new ATOM 0 HG3 ARG A 24 -16.576 -12.375 -7.456 1.00 52.42 H new ATOM 0 HD2 ARG A 24 -15.037 -10.854 -8.394 1.00 4.42 H new ATOM 0 HD3 ARG A 24 -16.039 -10.534 -9.795 1.00 4.42 H new ATOM 0 HE ARG A 24 -17.561 -9.647 -7.515 1.00 54.21 H new ATOM 0 HH11 ARG A 24 -14.295 -9.125 -8.580 1.00 4.10 H new ATOM 0 HH12 ARG A 24 -14.362 -7.373 -8.364 1.00 4.10 H new ATOM 0 HH21 ARG A 24 -17.748 -7.357 -7.498 1.00 61.02 H new ATOM 0 HH22 ARG A 24 -16.299 -6.380 -7.758 1.00 61.02 H new ATOM 393 N ASP A 25 -16.713 -12.210 -12.331 1.00 63.14 N ATOM 394 CA ASP A 25 -16.302 -12.375 -13.755 1.00 41.11 C ATOM 395 C ASP A 25 -15.103 -13.325 -13.852 1.00 1.52 C ATOM 396 O ASP A 25 -14.007 -12.926 -14.186 1.00 62.31 O ATOM 397 CB ASP A 25 -15.915 -10.973 -14.227 1.00 4.33 C ATOM 398 CG ASP A 25 -17.120 -10.040 -14.093 1.00 4.31 C ATOM 399 OD1 ASP A 25 -18.218 -10.470 -14.408 1.00 20.03 O ATOM 400 OD2 ASP A 25 -16.925 -8.910 -13.676 1.00 21.33 O ATOM 0 H ASP A 25 -16.090 -11.636 -11.763 1.00 63.14 H new ATOM 0 HA ASP A 25 -17.098 -12.802 -14.365 1.00 41.11 H new ATOM 0 HB2 ASP A 25 -15.081 -10.595 -13.635 1.00 4.33 H new ATOM 0 HB3 ASP A 25 -15.580 -11.006 -15.264 1.00 4.33 H new ATOM 405 N GLN A 26 -15.308 -14.583 -13.567 1.00 70.53 N ATOM 406 CA GLN A 26 -14.185 -15.563 -13.644 1.00 54.40 C ATOM 407 C GLN A 26 -13.143 -15.274 -12.558 1.00 34.42 C ATOM 408 O GLN A 26 -11.954 -15.272 -12.810 1.00 50.14 O ATOM 409 CB GLN A 26 -13.578 -15.365 -15.035 1.00 51.42 C ATOM 410 CG GLN A 26 -13.463 -16.717 -15.739 1.00 15.12 C ATOM 411 CD GLN A 26 -14.851 -17.347 -15.874 1.00 23.03 C ATOM 412 OE1 GLN A 26 -15.031 -18.514 -15.589 1.00 14.24 O ATOM 413 NE2 GLN A 26 -15.846 -16.619 -16.297 1.00 12.03 N ATOM 0 H GLN A 26 -16.206 -14.975 -13.284 1.00 70.53 H new ATOM 0 HA GLN A 26 -14.525 -16.587 -13.488 1.00 54.40 H new ATOM 0 HB2 GLN A 26 -14.200 -14.689 -15.622 1.00 51.42 H new ATOM 0 HB3 GLN A 26 -12.595 -14.902 -14.952 1.00 51.42 H new ATOM 0 HG2 GLN A 26 -13.014 -16.588 -16.724 1.00 15.12 H new ATOM 0 HG3 GLN A 26 -12.806 -17.378 -15.173 1.00 15.12 H new ATOM 0 HE21 GLN A 26 -15.695 -15.639 -16.536 1.00 12.03 H new ATOM 0 HE22 GLN A 26 -16.775 -17.029 -16.389 1.00 12.03 H new ATOM 422 N THR A 27 -13.578 -15.036 -11.350 1.00 71.32 N ATOM 423 CA THR A 27 -12.610 -14.756 -10.246 1.00 44.35 C ATOM 424 C THR A 27 -12.285 -16.055 -9.504 1.00 50.33 C ATOM 425 O THR A 27 -13.168 -16.772 -9.079 1.00 32.11 O ATOM 426 CB THR A 27 -13.339 -13.775 -9.324 1.00 4.43 C ATOM 427 OG1 THR A 27 -13.590 -12.564 -10.026 1.00 41.13 O ATOM 428 CG2 THR A 27 -12.479 -13.494 -8.091 1.00 21.00 C ATOM 0 H THR A 27 -14.561 -15.023 -11.078 1.00 71.32 H new ATOM 0 HA THR A 27 -11.666 -14.347 -10.607 1.00 44.35 H new ATOM 0 HB THR A 27 -14.287 -14.209 -9.006 1.00 4.43 H new ATOM 0 HG1 THR A 27 -12.887 -12.421 -10.693 1.00 41.13 H new ATOM 0 HG21 THR A 27 -13.000 -12.795 -7.436 1.00 21.00 H new ATOM 0 HG22 THR A 27 -12.295 -14.425 -7.556 1.00 21.00 H new ATOM 0 HG23 THR A 27 -11.528 -13.060 -8.402 1.00 21.00 H new ATOM 436 N TYR A 28 -11.027 -16.370 -9.346 1.00 3.34 N ATOM 437 CA TYR A 28 -10.674 -17.633 -8.634 1.00 44.11 C ATOM 438 C TYR A 28 -9.543 -17.394 -7.631 1.00 71.31 C ATOM 439 O TYR A 28 -8.651 -16.601 -7.859 1.00 21.24 O ATOM 440 CB TYR A 28 -10.224 -18.594 -9.733 1.00 34.22 C ATOM 441 CG TYR A 28 -11.434 -19.121 -10.471 1.00 73.13 C ATOM 442 CD1 TYR A 28 -12.087 -18.314 -11.409 1.00 44.35 C ATOM 443 CD2 TYR A 28 -11.900 -20.417 -10.215 1.00 52.41 C ATOM 444 CE1 TYR A 28 -13.209 -18.801 -12.091 1.00 60.01 C ATOM 445 CE2 TYR A 28 -13.021 -20.904 -10.898 1.00 23.33 C ATOM 446 CZ TYR A 28 -13.675 -20.097 -11.836 1.00 10.12 C ATOM 447 OH TYR A 28 -14.780 -20.577 -12.510 1.00 44.51 O ATOM 0 H TYR A 28 -10.237 -15.815 -9.675 1.00 3.34 H new ATOM 0 HA TYR A 28 -11.515 -18.027 -8.063 1.00 44.11 H new ATOM 0 HB2 TYR A 28 -9.556 -18.083 -10.427 1.00 34.22 H new ATOM 0 HB3 TYR A 28 -9.661 -19.421 -9.300 1.00 34.22 H new ATOM 0 HD1 TYR A 28 -11.726 -17.316 -11.607 1.00 44.35 H new ATOM 0 HD2 TYR A 28 -11.395 -21.040 -9.492 1.00 52.41 H new ATOM 0 HE1 TYR A 28 -13.715 -18.177 -12.813 1.00 60.01 H new ATOM 0 HE2 TYR A 28 -13.381 -21.903 -10.701 1.00 23.33 H new ATOM 0 HH TYR A 28 -14.970 -21.493 -12.217 1.00 44.51 H new ATOM 457 N LEU A 29 -9.575 -18.082 -6.523 1.00 40.03 N ATOM 458 CA LEU A 29 -8.503 -17.910 -5.498 1.00 35.14 C ATOM 459 C LEU A 29 -7.583 -19.135 -5.499 1.00 50.35 C ATOM 460 O LEU A 29 -7.975 -20.217 -5.889 1.00 0.25 O ATOM 461 CB LEU A 29 -9.246 -17.800 -4.164 1.00 30.23 C ATOM 462 CG LEU A 29 -9.129 -16.371 -3.622 1.00 20.32 C ATOM 463 CD1 LEU A 29 -9.875 -16.271 -2.290 1.00 23.42 C ATOM 464 CD2 LEU A 29 -7.656 -16.025 -3.406 1.00 61.31 C ATOM 0 H LEU A 29 -10.299 -18.758 -6.281 1.00 40.03 H new ATOM 0 HA LEU A 29 -7.879 -17.037 -5.689 1.00 35.14 H new ATOM 0 HB2 LEU A 29 -10.295 -18.063 -4.299 1.00 30.23 H new ATOM 0 HB3 LEU A 29 -8.830 -18.507 -3.446 1.00 30.23 H new ATOM 0 HG LEU A 29 -9.564 -15.674 -4.338 1.00 20.32 H new ATOM 0 HD11 LEU A 29 -9.793 -15.255 -1.903 1.00 23.42 H new ATOM 0 HD12 LEU A 29 -10.926 -16.518 -2.442 1.00 23.42 H new ATOM 0 HD13 LEU A 29 -9.438 -16.968 -1.575 1.00 23.42 H new ATOM 0 HD21 LEU A 29 -7.574 -15.009 -3.021 1.00 61.31 H new ATOM 0 HD22 LEU A 29 -7.220 -16.721 -2.690 1.00 61.31 H new ATOM 0 HD23 LEU A 29 -7.122 -16.098 -4.354 1.00 61.31 H new ATOM 476 N TYR A 30 -6.366 -18.979 -5.062 1.00 71.24 N ATOM 477 CA TYR A 30 -5.432 -20.141 -5.038 1.00 2.13 C ATOM 478 C TYR A 30 -4.781 -20.267 -3.658 1.00 4.14 C ATOM 479 O TYR A 30 -4.406 -19.286 -3.046 1.00 14.14 O ATOM 480 CB TYR A 30 -4.381 -19.836 -6.105 1.00 64.31 C ATOM 481 CG TYR A 30 -4.987 -20.017 -7.477 1.00 34.23 C ATOM 482 CD1 TYR A 30 -5.957 -19.117 -7.933 1.00 11.03 C ATOM 483 CD2 TYR A 30 -4.579 -21.082 -8.290 1.00 73.35 C ATOM 484 CE1 TYR A 30 -6.518 -19.283 -9.205 1.00 1.31 C ATOM 485 CE2 TYR A 30 -5.143 -21.245 -9.563 1.00 14.53 C ATOM 486 CZ TYR A 30 -6.111 -20.346 -10.019 1.00 70.14 C ATOM 487 OH TYR A 30 -6.665 -20.507 -11.272 1.00 30.43 O ATOM 0 H TYR A 30 -5.977 -18.100 -4.721 1.00 71.24 H new ATOM 0 HA TYR A 30 -5.943 -21.083 -5.235 1.00 2.13 H new ATOM 0 HB2 TYR A 30 -4.016 -18.816 -5.989 1.00 64.31 H new ATOM 0 HB3 TYR A 30 -3.523 -20.497 -5.985 1.00 64.31 H new ATOM 0 HD1 TYR A 30 -6.272 -18.297 -7.305 1.00 11.03 H new ATOM 0 HD2 TYR A 30 -3.831 -21.776 -7.937 1.00 73.35 H new ATOM 0 HE1 TYR A 30 -7.266 -18.589 -9.559 1.00 1.31 H new ATOM 0 HE2 TYR A 30 -4.829 -22.065 -10.191 1.00 14.53 H new ATOM 0 HH TYR A 30 -5.978 -20.822 -11.896 1.00 30.43 H new ATOM 497 N VAL A 31 -4.648 -21.465 -3.166 1.00 43.24 N ATOM 498 CA VAL A 31 -4.024 -21.660 -1.821 1.00 33.53 C ATOM 499 C VAL A 31 -3.278 -22.994 -1.775 1.00 44.33 C ATOM 500 O VAL A 31 -3.627 -23.934 -2.461 1.00 44.51 O ATOM 501 CB VAL A 31 -5.177 -21.674 -0.806 1.00 31.31 C ATOM 502 CG1 VAL A 31 -5.400 -20.261 -0.272 1.00 1.24 C ATOM 503 CG2 VAL A 31 -6.467 -22.180 -1.461 1.00 41.00 C ATOM 0 H VAL A 31 -4.944 -22.321 -3.634 1.00 43.24 H new ATOM 0 HA VAL A 31 -3.308 -20.869 -1.601 1.00 33.53 H new ATOM 0 HB VAL A 31 -4.914 -22.344 0.013 1.00 31.31 H new ATOM 0 HG11 VAL A 31 -6.218 -20.269 0.448 1.00 1.24 H new ATOM 0 HG12 VAL A 31 -4.491 -19.908 0.215 1.00 1.24 H new ATOM 0 HG13 VAL A 31 -5.651 -19.595 -1.098 1.00 1.24 H new ATOM 0 HG21 VAL A 31 -7.272 -22.182 -0.726 1.00 41.00 H new ATOM 0 HG22 VAL A 31 -6.735 -21.525 -2.290 1.00 41.00 H new ATOM 0 HG23 VAL A 31 -6.313 -23.193 -1.834 1.00 41.00 H new ATOM 513 N GLU A 32 -2.266 -23.088 -0.961 1.00 33.34 N ATOM 514 CA GLU A 32 -1.514 -24.370 -0.863 1.00 21.31 C ATOM 515 C GLU A 32 -2.460 -25.471 -0.378 1.00 14.15 C ATOM 516 O GLU A 32 -2.169 -26.648 -0.475 1.00 23.24 O ATOM 517 CB GLU A 32 -0.414 -24.112 0.167 1.00 72.23 C ATOM 518 CG GLU A 32 -1.045 -23.807 1.526 1.00 3.10 C ATOM 519 CD GLU A 32 -0.087 -24.233 2.639 1.00 63.33 C ATOM 520 OE1 GLU A 32 1.047 -24.553 2.327 1.00 74.21 O ATOM 521 OE2 GLU A 32 -0.504 -24.233 3.786 1.00 3.51 O ATOM 0 H GLU A 32 -1.927 -22.336 -0.361 1.00 33.34 H new ATOM 0 HA GLU A 32 -1.097 -24.690 -1.818 1.00 21.31 H new ATOM 0 HB2 GLU A 32 0.237 -24.983 0.244 1.00 72.23 H new ATOM 0 HB3 GLU A 32 0.208 -23.276 -0.152 1.00 72.23 H new ATOM 0 HG2 GLU A 32 -1.263 -22.742 1.607 1.00 3.10 H new ATOM 0 HG3 GLU A 32 -1.993 -24.335 1.626 1.00 3.10 H new ATOM 528 N LYS A 33 -3.594 -25.087 0.141 1.00 2.13 N ATOM 529 CA LYS A 33 -4.579 -26.088 0.634 1.00 62.01 C ATOM 530 C LYS A 33 -5.965 -25.441 0.703 1.00 4.35 C ATOM 531 O LYS A 33 -6.105 -24.240 0.583 1.00 10.50 O ATOM 532 CB LYS A 33 -4.086 -26.471 2.031 1.00 2.14 C ATOM 533 CG LYS A 33 -4.366 -25.324 3.007 1.00 34.52 C ATOM 534 CD LYS A 33 -3.269 -25.281 4.073 1.00 75.24 C ATOM 535 CE LYS A 33 -3.365 -23.966 4.848 1.00 71.50 C ATOM 536 NZ LYS A 33 -3.438 -22.907 3.802 1.00 35.34 N ATOM 0 H LYS A 33 -3.882 -24.114 0.245 1.00 2.13 H new ATOM 0 HA LYS A 33 -4.660 -26.961 -0.014 1.00 62.01 H new ATOM 0 HB2 LYS A 33 -4.586 -27.379 2.368 1.00 2.14 H new ATOM 0 HB3 LYS A 33 -3.018 -26.687 2.004 1.00 2.14 H new ATOM 0 HG2 LYS A 33 -4.403 -24.376 2.470 1.00 34.52 H new ATOM 0 HG3 LYS A 33 -5.340 -25.462 3.477 1.00 34.52 H new ATOM 0 HD2 LYS A 33 -3.375 -26.126 4.754 1.00 75.24 H new ATOM 0 HD3 LYS A 33 -2.288 -25.370 3.605 1.00 75.24 H new ATOM 0 HE2 LYS A 33 -4.246 -23.949 5.489 1.00 71.50 H new ATOM 0 HE3 LYS A 33 -2.498 -23.824 5.494 1.00 71.50 H new ATOM 0 HZ1 LYS A 33 -2.921 -22.064 4.125 1.00 35.34 H new ATOM 0 HZ2 LYS A 33 -3.011 -23.259 2.921 1.00 35.34 H new ATOM 0 HZ3 LYS A 33 -4.433 -22.658 3.629 1.00 35.34 H new ATOM 550 N LYS A 34 -6.990 -26.222 0.894 1.00 24.33 N ATOM 551 CA LYS A 34 -8.362 -25.642 0.967 1.00 31.42 C ATOM 552 C LYS A 34 -8.751 -25.381 2.424 1.00 63.21 C ATOM 553 O LYS A 34 -9.709 -25.936 2.927 1.00 10.14 O ATOM 554 CB LYS A 34 -9.272 -26.704 0.349 1.00 1.22 C ATOM 555 CG LYS A 34 -9.308 -27.937 1.255 1.00 71.02 C ATOM 556 CD LYS A 34 -9.574 -29.188 0.413 1.00 65.04 C ATOM 557 CE LYS A 34 -8.582 -30.288 0.806 1.00 2.43 C ATOM 558 NZ LYS A 34 -9.072 -31.510 0.110 1.00 3.05 N ATOM 0 H LYS A 34 -6.939 -27.235 1.003 1.00 24.33 H new ATOM 0 HA LYS A 34 -8.436 -24.688 0.446 1.00 31.42 H new ATOM 0 HB2 LYS A 34 -10.278 -26.305 0.220 1.00 1.22 H new ATOM 0 HB3 LYS A 34 -8.908 -26.978 -0.641 1.00 1.22 H new ATOM 0 HG2 LYS A 34 -8.361 -28.038 1.785 1.00 71.02 H new ATOM 0 HG3 LYS A 34 -10.086 -27.823 2.010 1.00 71.02 H new ATOM 0 HD2 LYS A 34 -10.596 -29.533 0.568 1.00 65.04 H new ATOM 0 HD3 LYS A 34 -9.473 -28.954 -0.647 1.00 65.04 H new ATOM 0 HE2 LYS A 34 -7.568 -30.036 0.495 1.00 2.43 H new ATOM 0 HE3 LYS A 34 -8.558 -30.431 1.886 1.00 2.43 H new ATOM 0 HZ1 LYS A 34 -8.444 -32.310 0.329 1.00 3.05 H new ATOM 0 HZ2 LYS A 34 -10.037 -31.729 0.431 1.00 3.05 H new ATOM 0 HZ3 LYS A 34 -9.078 -31.346 -0.917 1.00 3.05 H new ATOM 572 N ASP A 35 -8.018 -24.547 3.111 1.00 33.24 N ATOM 573 CA ASP A 35 -8.356 -24.267 4.536 1.00 0.10 C ATOM 574 C ASP A 35 -9.178 -22.981 4.660 1.00 45.13 C ATOM 575 O ASP A 35 -10.359 -23.014 4.942 1.00 11.11 O ATOM 576 CB ASP A 35 -7.006 -24.107 5.240 1.00 64.41 C ATOM 577 CG ASP A 35 -6.853 -25.192 6.306 1.00 0.50 C ATOM 578 OD1 ASP A 35 -7.778 -25.368 7.083 1.00 11.03 O ATOM 579 OD2 ASP A 35 -5.812 -25.831 6.329 1.00 35.33 O ATOM 0 H ASP A 35 -7.204 -24.050 2.750 1.00 33.24 H new ATOM 0 HA ASP A 35 -8.958 -25.064 4.973 1.00 0.10 H new ATOM 0 HB2 ASP A 35 -6.195 -24.178 4.515 1.00 64.41 H new ATOM 0 HB3 ASP A 35 -6.938 -23.120 5.698 1.00 64.41 H new ATOM 584 N ASP A 36 -8.563 -21.846 4.464 1.00 2.41 N ATOM 585 CA ASP A 36 -9.314 -20.563 4.583 1.00 41.25 C ATOM 586 C ASP A 36 -8.500 -19.406 4.001 1.00 31.42 C ATOM 587 O ASP A 36 -7.347 -19.555 3.650 1.00 32.11 O ATOM 588 CB ASP A 36 -9.531 -20.357 6.082 1.00 64.42 C ATOM 589 CG ASP A 36 -10.893 -20.925 6.485 1.00 21.11 C ATOM 590 OD1 ASP A 36 -11.855 -20.660 5.781 1.00 2.12 O ATOM 591 OD2 ASP A 36 -10.953 -21.612 7.491 1.00 54.22 O ATOM 0 H ASP A 36 -7.575 -21.752 4.227 1.00 2.41 H new ATOM 0 HA ASP A 36 -10.256 -20.596 4.035 1.00 41.25 H new ATOM 0 HB2 ASP A 36 -8.739 -20.850 6.646 1.00 64.42 H new ATOM 0 HB3 ASP A 36 -9.482 -19.295 6.325 1.00 64.42 H new ATOM 596 N PHE A 37 -9.095 -18.251 3.909 1.00 34.41 N ATOM 597 CA PHE A 37 -8.368 -17.069 3.364 1.00 21.41 C ATOM 598 C PHE A 37 -8.364 -15.949 4.409 1.00 53.13 C ATOM 599 O PHE A 37 -9.344 -15.257 4.595 1.00 12.21 O ATOM 600 CB PHE A 37 -9.175 -16.642 2.138 1.00 5.24 C ATOM 601 CG PHE A 37 -8.861 -17.551 0.976 1.00 14.42 C ATOM 602 CD1 PHE A 37 -9.615 -18.712 0.770 1.00 64.34 C ATOM 603 CD2 PHE A 37 -7.816 -17.233 0.099 1.00 23.33 C ATOM 604 CE1 PHE A 37 -9.328 -19.554 -0.312 1.00 11.50 C ATOM 605 CE2 PHE A 37 -7.528 -18.073 -0.983 1.00 54.33 C ATOM 606 CZ PHE A 37 -8.283 -19.235 -1.189 1.00 65.33 C ATOM 0 H PHE A 37 -10.059 -18.072 4.189 1.00 34.41 H new ATOM 0 HA PHE A 37 -7.331 -17.292 3.112 1.00 21.41 H new ATOM 0 HB2 PHE A 37 -10.241 -16.679 2.362 1.00 5.24 H new ATOM 0 HB3 PHE A 37 -8.940 -15.610 1.878 1.00 5.24 H new ATOM 0 HD1 PHE A 37 -10.420 -18.959 1.447 1.00 64.34 H new ATOM 0 HD2 PHE A 37 -7.232 -16.339 0.258 1.00 23.33 H new ATOM 0 HE1 PHE A 37 -9.912 -20.449 -0.470 1.00 11.50 H new ATOM 0 HE2 PHE A 37 -6.723 -17.825 -1.659 1.00 54.33 H new ATOM 0 HZ PHE A 37 -8.060 -19.884 -2.023 1.00 65.33 H new ATOM 616 N SER A 38 -7.269 -15.777 5.101 1.00 52.51 N ATOM 617 CA SER A 38 -7.205 -14.706 6.142 1.00 24.23 C ATOM 618 C SER A 38 -6.247 -13.595 5.710 1.00 4.12 C ATOM 619 O SER A 38 -6.163 -12.555 6.337 1.00 41.35 O ATOM 620 CB SER A 38 -6.684 -15.405 7.396 1.00 54.42 C ATOM 621 OG SER A 38 -6.277 -14.428 8.344 1.00 44.52 O ATOM 0 H SER A 38 -6.418 -16.329 4.992 1.00 52.51 H new ATOM 0 HA SER A 38 -8.175 -14.237 6.307 1.00 24.23 H new ATOM 0 HB2 SER A 38 -7.461 -16.040 7.822 1.00 54.42 H new ATOM 0 HB3 SER A 38 -5.846 -16.054 7.143 1.00 54.42 H new ATOM 0 HG SER A 38 -5.944 -14.874 9.151 1.00 44.52 H new ATOM 627 N ARG A 39 -5.517 -13.803 4.651 1.00 63.23 N ATOM 628 CA ARG A 39 -4.559 -12.760 4.189 1.00 74.15 C ATOM 629 C ARG A 39 -5.212 -11.865 3.135 1.00 75.30 C ATOM 630 O ARG A 39 -4.794 -10.747 2.911 1.00 42.11 O ATOM 631 CB ARG A 39 -3.390 -13.539 3.588 1.00 54.33 C ATOM 632 CG ARG A 39 -2.109 -12.708 3.695 1.00 22.23 C ATOM 633 CD ARG A 39 -2.308 -11.365 2.989 1.00 62.24 C ATOM 634 NE ARG A 39 -0.931 -10.871 2.706 1.00 41.15 N ATOM 635 CZ ARG A 39 -0.711 -9.591 2.573 1.00 3.15 C ATOM 636 NH1 ARG A 39 -0.963 -8.780 3.564 1.00 63.32 N ATOM 637 NH2 ARG A 39 -0.239 -9.122 1.452 1.00 15.51 N ATOM 0 H ARG A 39 -5.542 -14.651 4.084 1.00 63.23 H new ATOM 0 HA ARG A 39 -4.239 -12.105 4.999 1.00 74.15 H new ATOM 0 HB2 ARG A 39 -3.265 -14.487 4.111 1.00 54.33 H new ATOM 0 HB3 ARG A 39 -3.596 -13.775 2.544 1.00 54.33 H new ATOM 0 HG2 ARG A 39 -1.855 -12.546 4.743 1.00 22.23 H new ATOM 0 HG3 ARG A 39 -1.275 -13.247 3.245 1.00 22.23 H new ATOM 0 HD2 ARG A 39 -2.882 -11.483 2.070 1.00 62.24 H new ATOM 0 HD3 ARG A 39 -2.857 -10.665 3.619 1.00 62.24 H new ATOM 0 HE ARG A 39 -0.160 -11.533 2.616 1.00 41.15 H new ATOM 0 HH11 ARG A 39 -1.332 -9.146 4.442 1.00 63.32 H new ATOM 0 HH12 ARG A 39 -0.791 -7.780 3.461 1.00 63.32 H new ATOM 0 HH21 ARG A 39 -0.041 -9.755 0.677 1.00 15.51 H new ATOM 0 HH22 ARG A 39 -0.068 -8.122 1.350 1.00 15.51 H new ATOM 651 N VAL A 40 -6.239 -12.344 2.485 1.00 51.05 N ATOM 652 CA VAL A 40 -6.907 -11.509 1.452 1.00 52.31 C ATOM 653 C VAL A 40 -7.550 -10.284 2.104 1.00 72.22 C ATOM 654 O VAL A 40 -8.264 -10.401 3.080 1.00 41.31 O ATOM 655 CB VAL A 40 -7.977 -12.410 0.836 1.00 64.34 C ATOM 656 CG1 VAL A 40 -9.018 -12.769 1.899 1.00 71.14 C ATOM 657 CG2 VAL A 40 -8.663 -11.665 -0.312 1.00 21.21 C ATOM 0 H VAL A 40 -6.640 -13.271 2.625 1.00 51.05 H new ATOM 0 HA VAL A 40 -6.206 -11.143 0.702 1.00 52.31 H new ATOM 0 HB VAL A 40 -7.513 -13.322 0.459 1.00 64.34 H new ATOM 0 HG11 VAL A 40 -9.781 -13.411 1.459 1.00 71.14 H new ATOM 0 HG12 VAL A 40 -8.532 -13.294 2.722 1.00 71.14 H new ATOM 0 HG13 VAL A 40 -9.484 -11.858 2.275 1.00 71.14 H new ATOM 0 HG21 VAL A 40 -9.427 -12.304 -0.755 1.00 21.21 H new ATOM 0 HG22 VAL A 40 -9.127 -10.756 0.070 1.00 21.21 H new ATOM 0 HG23 VAL A 40 -7.924 -11.405 -1.070 1.00 21.21 H new ATOM 667 N PRO A 41 -7.272 -9.143 1.541 1.00 72.04 N ATOM 668 CA PRO A 41 -7.825 -7.870 2.071 1.00 13.25 C ATOM 669 C PRO A 41 -9.333 -7.789 1.815 1.00 31.31 C ATOM 670 O PRO A 41 -9.833 -8.287 0.826 1.00 21.10 O ATOM 671 CB PRO A 41 -7.079 -6.799 1.275 1.00 54.24 C ATOM 672 CG PRO A 41 -6.661 -7.482 0.013 1.00 54.14 C ATOM 673 CD PRO A 41 -6.424 -8.927 0.365 1.00 42.31 C ATOM 0 HA PRO A 41 -7.697 -7.763 3.148 1.00 13.25 H new ATOM 0 HB2 PRO A 41 -7.720 -5.942 1.067 1.00 54.24 H new ATOM 0 HB3 PRO A 41 -6.216 -6.425 1.827 1.00 54.24 H new ATOM 0 HG2 PRO A 41 -7.433 -7.391 -0.751 1.00 54.14 H new ATOM 0 HG3 PRO A 41 -5.756 -7.028 -0.392 1.00 54.14 H new ATOM 0 HD2 PRO A 41 -6.701 -9.589 -0.455 1.00 42.31 H new ATOM 0 HD3 PRO A 41 -5.374 -9.118 0.588 1.00 42.31 H new ATOM 681 N GLU A 42 -10.060 -7.161 2.700 1.00 11.32 N ATOM 682 CA GLU A 42 -11.537 -7.045 2.508 1.00 70.32 C ATOM 683 C GLU A 42 -11.841 -6.136 1.316 1.00 1.11 C ATOM 684 O GLU A 42 -12.952 -6.095 0.823 1.00 33.32 O ATOM 685 CB GLU A 42 -12.059 -6.425 3.806 1.00 73.24 C ATOM 686 CG GLU A 42 -13.299 -7.187 4.275 1.00 31.03 C ATOM 687 CD GLU A 42 -14.086 -6.321 5.261 1.00 21.03 C ATOM 688 OE1 GLU A 42 -13.699 -5.182 5.458 1.00 41.02 O ATOM 689 OE2 GLU A 42 -15.065 -6.813 5.802 1.00 14.44 O ATOM 0 H GLU A 42 -9.697 -6.724 3.547 1.00 11.32 H new ATOM 0 HA GLU A 42 -12.006 -8.007 2.302 1.00 70.32 H new ATOM 0 HB2 GLU A 42 -11.286 -6.460 4.574 1.00 73.24 H new ATOM 0 HB3 GLU A 42 -12.304 -5.375 3.647 1.00 73.24 H new ATOM 0 HG2 GLU A 42 -13.925 -7.445 3.421 1.00 31.03 H new ATOM 0 HG3 GLU A 42 -13.006 -8.123 4.750 1.00 31.03 H new ATOM 696 N GLU A 43 -10.865 -5.408 0.843 1.00 45.32 N ATOM 697 CA GLU A 43 -11.103 -4.509 -0.323 1.00 11.10 C ATOM 698 C GLU A 43 -11.281 -5.350 -1.589 1.00 60.05 C ATOM 699 O GLU A 43 -12.094 -5.050 -2.440 1.00 1.14 O ATOM 700 CB GLU A 43 -9.848 -3.633 -0.418 1.00 40.33 C ATOM 701 CG GLU A 43 -8.711 -4.420 -1.077 1.00 1.51 C ATOM 702 CD GLU A 43 -7.455 -3.549 -1.146 1.00 4.10 C ATOM 703 OE1 GLU A 43 -7.487 -2.454 -0.610 1.00 12.34 O ATOM 704 OE2 GLU A 43 -6.482 -3.993 -1.733 1.00 51.50 O ATOM 0 H GLU A 43 -9.915 -5.397 1.213 1.00 45.32 H new ATOM 0 HA GLU A 43 -12.002 -3.903 -0.211 1.00 11.10 H new ATOM 0 HB2 GLU A 43 -10.064 -2.735 -0.997 1.00 40.33 H new ATOM 0 HB3 GLU A 43 -9.546 -3.306 0.577 1.00 40.33 H new ATOM 0 HG2 GLU A 43 -8.506 -5.327 -0.508 1.00 1.51 H new ATOM 0 HG3 GLU A 43 -9.005 -4.732 -2.079 1.00 1.51 H new ATOM 711 N LEU A 44 -10.529 -6.408 -1.706 1.00 54.23 N ATOM 712 CA LEU A 44 -10.648 -7.287 -2.899 1.00 33.42 C ATOM 713 C LEU A 44 -11.698 -8.364 -2.635 1.00 11.21 C ATOM 714 O LEU A 44 -12.590 -8.588 -3.428 1.00 65.03 O ATOM 715 CB LEU A 44 -9.261 -7.909 -3.066 1.00 13.31 C ATOM 716 CG LEU A 44 -8.900 -7.969 -4.549 1.00 42.40 C ATOM 717 CD1 LEU A 44 -7.506 -7.379 -4.758 1.00 62.32 C ATOM 718 CD2 LEU A 44 -8.910 -9.426 -5.013 1.00 22.41 C ATOM 0 H LEU A 44 -9.833 -6.702 -1.021 1.00 54.23 H new ATOM 0 HA LEU A 44 -10.958 -6.749 -3.795 1.00 33.42 H new ATOM 0 HB2 LEU A 44 -8.520 -7.320 -2.525 1.00 13.31 H new ATOM 0 HB3 LEU A 44 -9.247 -8.911 -2.637 1.00 13.31 H new ATOM 0 HG LEU A 44 -9.627 -7.396 -5.125 1.00 42.40 H new ATOM 0 HD11 LEU A 44 -7.248 -7.422 -5.816 1.00 62.32 H new ATOM 0 HD12 LEU A 44 -7.496 -6.342 -4.423 1.00 62.32 H new ATOM 0 HD13 LEU A 44 -6.778 -7.952 -4.184 1.00 62.32 H new ATOM 0 HD21 LEU A 44 -8.653 -9.473 -6.071 1.00 22.41 H new ATOM 0 HD22 LEU A 44 -8.181 -9.996 -4.437 1.00 22.41 H new ATOM 0 HD23 LEU A 44 -9.903 -9.849 -4.862 1.00 22.41 H new ATOM 730 N MET A 45 -11.607 -9.021 -1.510 1.00 55.23 N ATOM 731 CA MET A 45 -12.608 -10.070 -1.180 1.00 24.51 C ATOM 732 C MET A 45 -14.011 -9.467 -1.233 1.00 64.35 C ATOM 733 O MET A 45 -14.998 -10.164 -1.367 1.00 11.21 O ATOM 734 CB MET A 45 -12.264 -10.514 0.241 1.00 25.33 C ATOM 735 CG MET A 45 -13.195 -11.654 0.660 1.00 70.03 C ATOM 736 SD MET A 45 -12.394 -12.649 1.943 1.00 55.14 S ATOM 737 CE MET A 45 -11.545 -13.807 0.839 1.00 50.14 C ATOM 0 H MET A 45 -10.882 -8.875 -0.807 1.00 55.23 H new ATOM 0 HA MET A 45 -12.587 -10.908 -1.877 1.00 24.51 H new ATOM 0 HB2 MET A 45 -11.226 -10.842 0.289 1.00 25.33 H new ATOM 0 HB3 MET A 45 -12.366 -9.675 0.930 1.00 25.33 H new ATOM 0 HG2 MET A 45 -14.136 -11.250 1.033 1.00 70.03 H new ATOM 0 HG3 MET A 45 -13.435 -12.277 -0.202 1.00 70.03 H new ATOM 0 HE1 MET A 45 -10.922 -14.480 1.428 1.00 50.14 H new ATOM 0 HE2 MET A 45 -12.282 -14.387 0.284 1.00 50.14 H new ATOM 0 HE3 MET A 45 -10.920 -13.251 0.140 1.00 50.14 H new ATOM 747 N LYS A 46 -14.104 -8.169 -1.132 1.00 75.41 N ATOM 748 CA LYS A 46 -15.436 -7.504 -1.180 1.00 11.02 C ATOM 749 C LYS A 46 -16.237 -8.032 -2.372 1.00 62.42 C ATOM 750 O LYS A 46 -17.446 -8.131 -2.328 1.00 0.24 O ATOM 751 CB LYS A 46 -15.128 -6.016 -1.354 1.00 54.34 C ATOM 752 CG LYS A 46 -16.031 -5.196 -0.432 1.00 15.23 C ATOM 753 CD LYS A 46 -17.401 -5.018 -1.087 1.00 4.50 C ATOM 754 CE LYS A 46 -18.167 -3.899 -0.379 1.00 73.24 C ATOM 755 NZ LYS A 46 -18.855 -3.153 -1.469 1.00 1.14 N ATOM 0 H LYS A 46 -13.311 -7.538 -1.018 1.00 75.41 H new ATOM 0 HA LYS A 46 -16.030 -7.692 -0.286 1.00 11.02 H new ATOM 0 HB2 LYS A 46 -14.081 -5.821 -1.122 1.00 54.34 H new ATOM 0 HB3 LYS A 46 -15.285 -5.720 -2.391 1.00 54.34 H new ATOM 0 HG2 LYS A 46 -16.138 -5.698 0.530 1.00 15.23 H new ATOM 0 HG3 LYS A 46 -15.581 -4.223 -0.236 1.00 15.23 H new ATOM 0 HD2 LYS A 46 -17.282 -4.779 -2.144 1.00 4.50 H new ATOM 0 HD3 LYS A 46 -17.965 -5.949 -1.033 1.00 4.50 H new ATOM 0 HE2 LYS A 46 -18.884 -4.303 0.336 1.00 73.24 H new ATOM 0 HE3 LYS A 46 -17.492 -3.250 0.178 1.00 73.24 H new ATOM 0 HZ1 LYS A 46 -19.402 -2.368 -1.061 1.00 1.14 H new ATOM 0 HZ2 LYS A 46 -18.148 -2.774 -2.131 1.00 1.14 H new ATOM 0 HZ3 LYS A 46 -19.496 -3.795 -1.978 1.00 1.14 H new ATOM 769 N GLY A 47 -15.566 -8.369 -3.438 1.00 51.31 N ATOM 770 CA GLY A 47 -16.285 -8.890 -4.637 1.00 54.21 C ATOM 771 C GLY A 47 -16.432 -10.409 -4.524 1.00 34.10 C ATOM 772 O GLY A 47 -17.478 -10.963 -4.790 1.00 15.33 O ATOM 0 H GLY A 47 -14.552 -8.307 -3.532 1.00 51.31 H new ATOM 0 HA2 GLY A 47 -17.267 -8.424 -4.716 1.00 54.21 H new ATOM 0 HA3 GLY A 47 -15.736 -8.633 -5.543 1.00 54.21 H new ATOM 776 N PHE A 48 -15.387 -11.088 -4.131 1.00 3.33 N ATOM 777 CA PHE A 48 -15.467 -12.572 -4.002 1.00 33.11 C ATOM 778 C PHE A 48 -16.585 -12.958 -3.033 1.00 51.34 C ATOM 779 O PHE A 48 -17.470 -13.724 -3.363 1.00 50.52 O ATOM 780 CB PHE A 48 -14.107 -12.995 -3.446 1.00 12.43 C ATOM 781 CG PHE A 48 -13.695 -14.307 -4.070 1.00 41.42 C ATOM 782 CD1 PHE A 48 -14.612 -15.362 -4.154 1.00 3.14 C ATOM 783 CD2 PHE A 48 -12.396 -14.469 -4.566 1.00 74.30 C ATOM 784 CE1 PHE A 48 -14.230 -16.578 -4.734 1.00 70.12 C ATOM 785 CE2 PHE A 48 -12.014 -15.685 -5.143 1.00 24.11 C ATOM 786 CZ PHE A 48 -12.931 -16.738 -5.227 1.00 45.32 C ATOM 0 H PHE A 48 -14.483 -10.680 -3.894 1.00 3.33 H new ATOM 0 HA PHE A 48 -15.688 -13.058 -4.952 1.00 33.11 H new ATOM 0 HB2 PHE A 48 -13.361 -12.229 -3.658 1.00 12.43 H new ATOM 0 HB3 PHE A 48 -14.161 -13.096 -2.362 1.00 12.43 H new ATOM 0 HD1 PHE A 48 -15.614 -15.238 -3.771 1.00 3.14 H new ATOM 0 HD2 PHE A 48 -11.689 -13.655 -4.503 1.00 74.30 H new ATOM 0 HE1 PHE A 48 -14.938 -17.391 -4.801 1.00 70.12 H new ATOM 0 HE2 PHE A 48 -11.011 -15.811 -5.524 1.00 24.11 H new ATOM 0 HZ PHE A 48 -12.635 -17.676 -5.673 1.00 45.32 H new ATOM 796 N GLY A 49 -16.553 -12.438 -1.836 1.00 54.14 N ATOM 797 CA GLY A 49 -17.615 -12.781 -0.848 1.00 14.30 C ATOM 798 C GLY A 49 -17.374 -14.193 -0.311 1.00 5.24 C ATOM 799 O GLY A 49 -16.578 -14.402 0.582 1.00 50.23 O ATOM 0 H GLY A 49 -15.839 -11.792 -1.500 1.00 54.14 H new ATOM 0 HA2 GLY A 49 -17.610 -12.063 -0.028 1.00 14.30 H new ATOM 0 HA3 GLY A 49 -18.597 -12.722 -1.318 1.00 14.30 H new ATOM 803 N GLN A 50 -18.057 -15.166 -0.852 1.00 63.22 N ATOM 804 CA GLN A 50 -17.865 -16.565 -0.373 1.00 44.32 C ATOM 805 C GLN A 50 -17.212 -17.412 -1.469 1.00 0.21 C ATOM 806 O GLN A 50 -17.802 -17.646 -2.504 1.00 34.53 O ATOM 807 CB GLN A 50 -19.275 -17.071 -0.066 1.00 64.51 C ATOM 808 CG GLN A 50 -19.528 -17.000 1.442 1.00 12.24 C ATOM 809 CD GLN A 50 -19.572 -15.535 1.882 1.00 52.42 C ATOM 810 OE1 GLN A 50 -18.458 -14.917 2.163 1.00 74.22 O flip ATOM 811 NE2 GLN A 50 -20.632 -14.947 1.971 1.00 14.24 N flip ATOM 0 H GLN A 50 -18.738 -15.053 -1.603 1.00 63.22 H new ATOM 0 HA GLN A 50 -17.214 -16.622 0.499 1.00 44.32 H new ATOM 0 HB2 GLN A 50 -20.012 -16.469 -0.598 1.00 64.51 H new ATOM 0 HB3 GLN A 50 -19.389 -18.097 -0.416 1.00 64.51 H new ATOM 0 HG2 GLN A 50 -20.468 -17.493 1.688 1.00 12.24 H new ATOM 0 HG3 GLN A 50 -18.741 -17.529 1.979 1.00 12.24 H new ATOM 0 HE21 GLN A 50 -21.503 -15.430 1.751 1.00 14.24 H new ATOM 0 HE22 GLN A 50 -20.650 -13.971 2.265 1.00 14.24 H new ATOM 820 N PRO A 51 -16.008 -17.844 -1.202 1.00 73.05 N ATOM 821 CA PRO A 51 -15.263 -18.671 -2.182 1.00 54.25 C ATOM 822 C PRO A 51 -15.828 -20.094 -2.223 1.00 22.50 C ATOM 823 O PRO A 51 -16.335 -20.600 -1.242 1.00 3.33 O ATOM 824 CB PRO A 51 -13.835 -18.669 -1.639 1.00 64.05 C ATOM 825 CG PRO A 51 -13.976 -18.407 -0.173 1.00 52.13 C ATOM 826 CD PRO A 51 -15.236 -17.602 0.021 1.00 71.22 C ATOM 0 HA PRO A 51 -15.328 -18.290 -3.201 1.00 54.25 H new ATOM 0 HB2 PRO A 51 -13.342 -19.623 -1.823 1.00 64.05 H new ATOM 0 HB3 PRO A 51 -13.231 -17.900 -2.121 1.00 64.05 H new ATOM 0 HG2 PRO A 51 -14.030 -19.344 0.381 1.00 52.13 H new ATOM 0 HG3 PRO A 51 -13.111 -17.863 0.205 1.00 52.13 H new ATOM 0 HD2 PRO A 51 -15.782 -17.924 0.907 1.00 71.22 H new ATOM 0 HD3 PRO A 51 -15.016 -16.542 0.150 1.00 71.22 H new ATOM 834 N GLN A 52 -15.745 -20.743 -3.354 1.00 41.01 N ATOM 835 CA GLN A 52 -16.277 -22.131 -3.461 1.00 52.13 C ATOM 836 C GLN A 52 -15.241 -23.043 -4.126 1.00 13.21 C ATOM 837 O GLN A 52 -14.346 -22.584 -4.810 1.00 2.04 O ATOM 838 CB GLN A 52 -17.526 -22.013 -4.338 1.00 13.12 C ATOM 839 CG GLN A 52 -18.424 -20.897 -3.802 1.00 73.33 C ATOM 840 CD GLN A 52 -18.819 -21.207 -2.357 1.00 72.33 C ATOM 841 OE1 GLN A 52 -18.668 -22.323 -1.898 1.00 71.40 O ATOM 842 NE2 GLN A 52 -19.322 -20.257 -1.613 1.00 63.15 N ATOM 0 H GLN A 52 -15.331 -20.371 -4.209 1.00 41.01 H new ATOM 0 HA GLN A 52 -16.504 -22.562 -2.486 1.00 52.13 H new ATOM 0 HB2 GLN A 52 -17.241 -21.801 -5.368 1.00 13.12 H new ATOM 0 HB3 GLN A 52 -18.068 -22.958 -4.345 1.00 13.12 H new ATOM 0 HG2 GLN A 52 -17.902 -19.941 -3.850 1.00 73.33 H new ATOM 0 HG3 GLN A 52 -19.316 -20.805 -4.422 1.00 73.33 H new ATOM 0 HE21 GLN A 52 -19.449 -19.321 -1.998 1.00 63.15 H new ATOM 0 HE22 GLN A 52 -19.588 -20.452 -0.648 1.00 63.15 H new ATOM 851 N LEU A 53 -15.351 -24.327 -3.929 1.00 44.04 N ATOM 852 CA LEU A 53 -14.372 -25.266 -4.546 1.00 43.05 C ATOM 853 C LEU A 53 -14.823 -25.650 -5.959 1.00 44.10 C ATOM 854 O LEU A 53 -15.734 -26.435 -6.138 1.00 25.24 O ATOM 855 CB LEU A 53 -14.369 -26.491 -3.633 1.00 45.13 C ATOM 856 CG LEU A 53 -12.957 -27.083 -3.579 1.00 44.50 C ATOM 857 CD1 LEU A 53 -12.537 -27.531 -4.978 1.00 73.04 C ATOM 858 CD2 LEU A 53 -11.980 -26.023 -3.070 1.00 34.23 C ATOM 0 H LEU A 53 -16.078 -24.768 -3.366 1.00 44.04 H new ATOM 0 HA LEU A 53 -13.380 -24.825 -4.639 1.00 43.05 H new ATOM 0 HB2 LEU A 53 -14.697 -26.212 -2.631 1.00 45.13 H new ATOM 0 HB3 LEU A 53 -15.073 -27.236 -4.003 1.00 45.13 H new ATOM 0 HG LEU A 53 -12.949 -27.940 -2.906 1.00 44.50 H new ATOM 0 HD11 LEU A 53 -11.532 -27.952 -4.939 1.00 73.04 H new ATOM 0 HD12 LEU A 53 -13.233 -28.286 -5.342 1.00 73.04 H new ATOM 0 HD13 LEU A 53 -12.545 -26.675 -5.652 1.00 73.04 H new ATOM 0 HD21 LEU A 53 -10.975 -26.443 -3.031 1.00 34.23 H new ATOM 0 HD22 LEU A 53 -11.989 -25.166 -3.744 1.00 34.23 H new ATOM 0 HD23 LEU A 53 -12.278 -25.703 -2.072 1.00 34.23 H new ATOM 870 N ALA A 54 -14.192 -25.107 -6.964 1.00 34.32 N ATOM 871 CA ALA A 54 -14.581 -25.445 -8.363 1.00 1.21 C ATOM 872 C ALA A 54 -13.569 -26.418 -8.968 1.00 53.24 C ATOM 873 O ALA A 54 -13.926 -27.355 -9.658 1.00 61.33 O ATOM 874 CB ALA A 54 -14.560 -24.116 -9.117 1.00 53.21 C ATOM 0 H ALA A 54 -13.423 -24.443 -6.877 1.00 34.32 H new ATOM 0 HA ALA A 54 -15.558 -25.925 -8.414 1.00 1.21 H new ATOM 0 HB1 ALA A 54 -14.837 -24.284 -10.158 1.00 53.21 H new ATOM 0 HB2 ALA A 54 -15.270 -23.427 -8.659 1.00 53.21 H new ATOM 0 HB3 ALA A 54 -13.559 -23.688 -9.072 1.00 53.21 H new ATOM 880 N MET A 55 -12.308 -26.205 -8.717 1.00 73.14 N ATOM 881 CA MET A 55 -11.270 -27.117 -9.276 1.00 55.41 C ATOM 882 C MET A 55 -10.103 -27.255 -8.294 1.00 40.21 C ATOM 883 O MET A 55 -9.678 -26.297 -7.679 1.00 62.31 O ATOM 884 CB MET A 55 -10.806 -26.448 -10.568 1.00 61.34 C ATOM 885 CG MET A 55 -10.438 -27.519 -11.596 1.00 12.25 C ATOM 886 SD MET A 55 -8.645 -27.766 -11.595 1.00 11.34 S ATOM 887 CE MET A 55 -8.259 -26.585 -12.910 1.00 44.24 C ATOM 0 H MET A 55 -11.950 -25.438 -8.148 1.00 73.14 H new ATOM 0 HA MET A 55 -11.656 -28.121 -9.454 1.00 55.41 H new ATOM 0 HB2 MET A 55 -11.595 -25.807 -10.962 1.00 61.34 H new ATOM 0 HB3 MET A 55 -9.946 -25.809 -10.370 1.00 61.34 H new ATOM 0 HG2 MET A 55 -10.945 -28.455 -11.359 1.00 12.25 H new ATOM 0 HG3 MET A 55 -10.774 -27.217 -12.588 1.00 12.25 H new ATOM 0 HE1 MET A 55 -7.183 -26.571 -13.082 1.00 44.24 H new ATOM 0 HE2 MET A 55 -8.769 -26.881 -13.826 1.00 44.24 H new ATOM 0 HE3 MET A 55 -8.592 -25.590 -12.615 1.00 44.24 H new ATOM 897 N ILE A 56 -9.582 -28.441 -8.145 1.00 25.20 N ATOM 898 CA ILE A 56 -8.444 -28.642 -7.206 1.00 1.51 C ATOM 899 C ILE A 56 -7.158 -28.901 -7.993 1.00 42.42 C ATOM 900 O ILE A 56 -7.093 -29.784 -8.825 1.00 55.10 O ATOM 901 CB ILE A 56 -8.826 -29.869 -6.382 1.00 1.31 C ATOM 902 CG1 ILE A 56 -9.960 -29.507 -5.423 1.00 11.25 C ATOM 903 CG2 ILE A 56 -7.616 -30.344 -5.577 1.00 44.21 C ATOM 904 CD1 ILE A 56 -10.355 -30.744 -4.613 1.00 50.12 C ATOM 0 H ILE A 56 -9.895 -29.280 -8.633 1.00 25.20 H new ATOM 0 HA ILE A 56 -8.263 -27.771 -6.577 1.00 1.51 H new ATOM 0 HB ILE A 56 -9.153 -30.665 -7.051 1.00 1.31 H new ATOM 0 HG12 ILE A 56 -9.644 -28.706 -4.754 1.00 11.25 H new ATOM 0 HG13 ILE A 56 -10.819 -29.135 -5.982 1.00 11.25 H new ATOM 0 HG21 ILE A 56 -7.891 -31.220 -4.990 1.00 44.21 H new ATOM 0 HG22 ILE A 56 -6.805 -30.604 -6.258 1.00 44.21 H new ATOM 0 HG23 ILE A 56 -7.288 -29.548 -4.909 1.00 44.21 H new ATOM 0 HD11 ILE A 56 -11.164 -30.488 -3.928 1.00 50.12 H new ATOM 0 HD12 ILE A 56 -10.688 -31.531 -5.290 1.00 50.12 H new ATOM 0 HD13 ILE A 56 -9.495 -31.096 -4.043 1.00 50.12 H new ATOM 916 N LEU A 57 -6.136 -28.138 -7.731 1.00 70.43 N ATOM 917 CA LEU A 57 -4.851 -28.334 -8.456 1.00 24.33 C ATOM 918 C LEU A 57 -4.041 -29.449 -7.784 1.00 63.53 C ATOM 919 O LEU A 57 -3.679 -29.346 -6.629 1.00 24.34 O ATOM 920 CB LEU A 57 -4.143 -26.986 -8.324 1.00 71.52 C ATOM 921 CG LEU A 57 -2.986 -26.879 -9.326 1.00 11.23 C ATOM 922 CD1 LEU A 57 -2.074 -28.104 -9.216 1.00 72.41 C ATOM 923 CD2 LEU A 57 -3.548 -26.781 -10.745 1.00 1.12 C ATOM 0 H LEU A 57 -6.135 -27.384 -7.044 1.00 70.43 H new ATOM 0 HA LEU A 57 -4.983 -28.629 -9.497 1.00 24.33 H new ATOM 0 HB2 LEU A 57 -4.854 -26.178 -8.495 1.00 71.52 H new ATOM 0 HB3 LEU A 57 -3.764 -26.867 -7.309 1.00 71.52 H new ATOM 0 HG LEU A 57 -2.403 -25.986 -9.101 1.00 11.23 H new ATOM 0 HD11 LEU A 57 -1.257 -28.015 -9.932 1.00 72.41 H new ATOM 0 HD12 LEU A 57 -1.666 -28.165 -8.207 1.00 72.41 H new ATOM 0 HD13 LEU A 57 -2.648 -29.005 -9.430 1.00 72.41 H new ATOM 0 HD21 LEU A 57 -2.726 -26.705 -11.457 1.00 1.12 H new ATOM 0 HD22 LEU A 57 -4.138 -27.671 -10.965 1.00 1.12 H new ATOM 0 HD23 LEU A 57 -4.181 -25.897 -10.825 1.00 1.12 H new ATOM 935 N PRO A 58 -3.792 -30.486 -8.538 1.00 52.33 N ATOM 936 CA PRO A 58 -3.023 -31.647 -8.020 1.00 11.02 C ATOM 937 C PRO A 58 -1.538 -31.304 -7.874 1.00 54.11 C ATOM 938 O PRO A 58 -1.065 -30.305 -8.372 1.00 34.35 O ATOM 939 CB PRO A 58 -3.221 -32.714 -9.093 1.00 72.25 C ATOM 940 CG PRO A 58 -3.514 -31.949 -10.345 1.00 21.41 C ATOM 941 CD PRO A 58 -4.206 -30.679 -9.929 1.00 14.11 C ATOM 0 HA PRO A 58 -3.356 -31.963 -7.032 1.00 11.02 H new ATOM 0 HB2 PRO A 58 -2.330 -33.331 -9.206 1.00 72.25 H new ATOM 0 HB3 PRO A 58 -4.042 -33.384 -8.838 1.00 72.25 H new ATOM 0 HG2 PRO A 58 -2.594 -31.728 -10.887 1.00 21.41 H new ATOM 0 HG3 PRO A 58 -4.146 -32.532 -11.015 1.00 21.41 H new ATOM 0 HD2 PRO A 58 -3.906 -29.838 -10.555 1.00 14.11 H new ATOM 0 HD3 PRO A 58 -5.289 -30.769 -10.014 1.00 14.11 H new ATOM 949 N LEU A 59 -0.807 -32.143 -7.197 1.00 51.42 N ATOM 950 CA LEU A 59 0.656 -31.899 -7.015 1.00 22.32 C ATOM 951 C LEU A 59 1.457 -33.003 -7.702 1.00 53.00 C ATOM 952 O LEU A 59 2.205 -33.726 -7.070 1.00 23.22 O ATOM 953 CB LEU A 59 0.904 -31.930 -5.501 1.00 2.32 C ATOM 954 CG LEU A 59 0.007 -32.981 -4.835 1.00 52.11 C ATOM 955 CD1 LEU A 59 0.264 -34.354 -5.458 1.00 12.33 C ATOM 956 CD2 LEU A 59 0.324 -33.039 -3.338 1.00 33.51 C ATOM 0 H LEU A 59 -1.159 -32.994 -6.758 1.00 51.42 H new ATOM 0 HA LEU A 59 0.963 -30.948 -7.450 1.00 22.32 H new ATOM 0 HB2 LEU A 59 1.951 -32.157 -5.302 1.00 2.32 H new ATOM 0 HB3 LEU A 59 0.704 -30.948 -5.073 1.00 2.32 H new ATOM 0 HG LEU A 59 -1.038 -32.708 -4.983 1.00 52.11 H new ATOM 0 HD11 LEU A 59 -0.376 -35.096 -4.981 1.00 12.33 H new ATOM 0 HD12 LEU A 59 0.043 -34.317 -6.525 1.00 12.33 H new ATOM 0 HD13 LEU A 59 1.309 -34.629 -5.313 1.00 12.33 H new ATOM 0 HD21 LEU A 59 -0.311 -33.785 -2.860 1.00 33.51 H new ATOM 0 HD22 LEU A 59 1.370 -33.310 -3.198 1.00 33.51 H new ATOM 0 HD23 LEU A 59 0.139 -32.063 -2.889 1.00 33.51 H new ATOM 968 N ASP A 60 1.311 -33.143 -8.987 1.00 60.13 N ATOM 969 CA ASP A 60 2.064 -34.205 -9.712 1.00 64.22 C ATOM 970 C ASP A 60 3.012 -33.570 -10.728 1.00 64.40 C ATOM 971 O ASP A 60 3.484 -34.218 -11.642 1.00 61.22 O ATOM 972 CB ASP A 60 0.991 -35.035 -10.418 1.00 54.21 C ATOM 973 CG ASP A 60 1.420 -36.505 -10.442 1.00 23.23 C ATOM 974 OD1 ASP A 60 1.409 -37.122 -9.390 1.00 30.14 O ATOM 975 OD2 ASP A 60 1.748 -36.985 -11.514 1.00 51.01 O ATOM 0 H ASP A 60 0.702 -32.568 -9.569 1.00 60.13 H new ATOM 0 HA ASP A 60 2.674 -34.815 -9.046 1.00 64.22 H new ATOM 0 HB2 ASP A 60 0.037 -34.931 -9.901 1.00 54.21 H new ATOM 0 HB3 ASP A 60 0.844 -34.671 -11.435 1.00 54.21 H new ATOM 980 N GLY A 61 3.292 -32.308 -10.575 1.00 51.40 N ATOM 981 CA GLY A 61 4.209 -31.626 -11.529 1.00 31.42 C ATOM 982 C GLY A 61 3.706 -30.209 -11.795 1.00 63.13 C ATOM 983 O GLY A 61 3.547 -29.416 -10.888 1.00 72.50 O ATOM 0 H GLY A 61 2.925 -31.717 -9.829 1.00 51.40 H new ATOM 0 HA2 GLY A 61 5.219 -31.594 -11.119 1.00 31.42 H new ATOM 0 HA3 GLY A 61 4.261 -32.186 -12.463 1.00 31.42 H new ATOM 987 N ARG A 62 3.456 -29.881 -13.031 1.00 35.23 N ATOM 988 CA ARG A 62 2.966 -28.512 -13.355 1.00 24.35 C ATOM 989 C ARG A 62 1.742 -28.584 -14.274 1.00 13.15 C ATOM 990 O ARG A 62 1.862 -28.797 -15.464 1.00 4.14 O ATOM 991 CB ARG A 62 4.133 -27.834 -14.072 1.00 51.23 C ATOM 992 CG ARG A 62 5.411 -28.013 -13.248 1.00 51.34 C ATOM 993 CD ARG A 62 6.073 -29.346 -13.611 1.00 51.41 C ATOM 994 NE ARG A 62 7.535 -29.065 -13.589 1.00 61.33 N ATOM 995 CZ ARG A 62 8.330 -29.684 -14.416 1.00 12.11 C ATOM 996 NH1 ARG A 62 8.025 -29.757 -15.683 1.00 62.52 N ATOM 997 NH2 ARG A 62 9.431 -30.231 -13.975 1.00 23.41 N ATOM 0 H ARG A 62 3.570 -30.502 -13.832 1.00 35.23 H new ATOM 0 HA ARG A 62 2.659 -27.965 -12.464 1.00 24.35 H new ATOM 0 HB2 ARG A 62 4.264 -28.265 -15.064 1.00 51.23 H new ATOM 0 HB3 ARG A 62 3.922 -26.774 -14.210 1.00 51.23 H new ATOM 0 HG2 ARG A 62 6.099 -27.189 -13.441 1.00 51.34 H new ATOM 0 HG3 ARG A 62 5.176 -27.990 -12.184 1.00 51.34 H new ATOM 0 HD2 ARG A 62 5.810 -30.126 -12.896 1.00 51.41 H new ATOM 0 HD3 ARG A 62 5.752 -29.692 -14.593 1.00 51.41 H new ATOM 0 HE ARG A 62 7.914 -28.388 -12.927 1.00 61.33 H new ATOM 0 HH11 ARG A 62 7.165 -29.330 -16.026 1.00 62.52 H new ATOM 0 HH12 ARG A 62 8.647 -30.241 -16.330 1.00 62.52 H new ATOM 0 HH21 ARG A 62 9.668 -30.174 -12.985 1.00 23.41 H new ATOM 0 HH22 ARG A 62 10.054 -30.716 -14.621 1.00 23.41 H new ATOM 1011 N LYS A 63 0.566 -28.403 -13.733 1.00 33.52 N ATOM 1012 CA LYS A 63 -0.656 -28.459 -14.586 1.00 10.24 C ATOM 1013 C LYS A 63 -0.830 -27.130 -15.331 1.00 45.32 C ATOM 1014 O LYS A 63 -0.540 -26.073 -14.805 1.00 15.21 O ATOM 1015 CB LYS A 63 -1.811 -28.692 -13.612 1.00 34.14 C ATOM 1016 CG LYS A 63 -2.907 -29.503 -14.308 1.00 31.42 C ATOM 1017 CD LYS A 63 -2.494 -30.978 -14.365 1.00 31.11 C ATOM 1018 CE LYS A 63 -1.824 -31.270 -15.709 1.00 11.03 C ATOM 1019 NZ LYS A 63 -0.471 -31.786 -15.360 1.00 12.22 N ATOM 0 H LYS A 63 0.400 -28.220 -12.743 1.00 33.52 H new ATOM 0 HA LYS A 63 -0.604 -29.244 -15.341 1.00 10.24 H new ATOM 0 HB2 LYS A 63 -1.455 -29.223 -12.729 1.00 34.14 H new ATOM 0 HB3 LYS A 63 -2.211 -27.738 -13.270 1.00 34.14 H new ATOM 0 HG2 LYS A 63 -3.849 -29.399 -13.769 1.00 31.42 H new ATOM 0 HG3 LYS A 63 -3.072 -29.121 -15.316 1.00 31.42 H new ATOM 0 HD2 LYS A 63 -1.809 -31.207 -13.548 1.00 31.11 H new ATOM 0 HD3 LYS A 63 -3.368 -31.616 -14.236 1.00 31.11 H new ATOM 0 HE2 LYS A 63 -2.391 -32.004 -16.282 1.00 11.03 H new ATOM 0 HE3 LYS A 63 -1.758 -30.370 -16.321 1.00 11.03 H new ATOM 0 HZ1 LYS A 63 0.115 -31.833 -16.218 1.00 12.22 H new ATOM 0 HZ2 LYS A 63 -0.024 -31.149 -14.670 1.00 12.22 H new ATOM 0 HZ3 LYS A 63 -0.558 -32.737 -14.948 1.00 12.22 H new ATOM 1033 N LYS A 64 -1.285 -27.176 -16.552 1.00 24.14 N ATOM 1034 CA LYS A 64 -1.460 -25.913 -17.328 1.00 11.11 C ATOM 1035 C LYS A 64 -2.837 -25.299 -17.070 1.00 54.24 C ATOM 1036 O LYS A 64 -3.853 -25.958 -17.165 1.00 63.34 O ATOM 1037 CB LYS A 64 -1.325 -26.328 -18.795 1.00 15.34 C ATOM 1038 CG LYS A 64 -2.289 -27.479 -19.093 1.00 74.32 C ATOM 1039 CD LYS A 64 -2.898 -27.288 -20.483 1.00 15.15 C ATOM 1040 CE LYS A 64 -4.394 -27.601 -20.431 1.00 4.32 C ATOM 1041 NZ LYS A 64 -4.809 -27.721 -21.856 1.00 24.53 N ATOM 0 H LYS A 64 -1.543 -28.030 -17.046 1.00 24.14 H new ATOM 0 HA LYS A 64 -0.727 -25.158 -17.043 1.00 11.11 H new ATOM 0 HB2 LYS A 64 -1.543 -25.480 -19.445 1.00 15.34 H new ATOM 0 HB3 LYS A 64 -0.300 -26.635 -19.004 1.00 15.34 H new ATOM 0 HG2 LYS A 64 -1.761 -28.431 -19.043 1.00 74.32 H new ATOM 0 HG3 LYS A 64 -3.077 -27.512 -18.341 1.00 74.32 H new ATOM 0 HD2 LYS A 64 -2.741 -26.264 -20.823 1.00 15.15 H new ATOM 0 HD3 LYS A 64 -2.403 -27.942 -21.201 1.00 15.15 H new ATOM 0 HE2 LYS A 64 -4.586 -28.524 -19.884 1.00 4.32 H new ATOM 0 HE3 LYS A 64 -4.946 -26.810 -19.924 1.00 4.32 H new ATOM 0 HZ1 LYS A 64 -5.825 -27.936 -21.905 1.00 24.53 H new ATOM 0 HZ2 LYS A 64 -4.620 -26.825 -22.349 1.00 24.53 H new ATOM 0 HZ3 LYS A 64 -4.271 -28.486 -22.311 1.00 24.53 H new ATOM 1055 N LEU A 65 -2.877 -24.032 -16.753 1.00 34.42 N ATOM 1056 CA LEU A 65 -4.185 -23.365 -16.495 1.00 51.31 C ATOM 1057 C LEU A 65 -4.508 -22.400 -17.638 1.00 23.15 C ATOM 1058 O LEU A 65 -3.713 -22.204 -18.537 1.00 24.10 O ATOM 1059 CB LEU A 65 -3.988 -22.604 -15.184 1.00 30.13 C ATOM 1060 CG LEU A 65 -3.807 -23.604 -14.038 1.00 72.35 C ATOM 1061 CD1 LEU A 65 -2.335 -24.010 -13.945 1.00 71.33 C ATOM 1062 CD2 LEU A 65 -4.240 -22.951 -12.726 1.00 60.42 C ATOM 0 H LEU A 65 -2.059 -23.430 -16.662 1.00 34.42 H new ATOM 0 HA LEU A 65 -5.011 -24.073 -16.430 1.00 51.31 H new ATOM 0 HB2 LEU A 65 -3.116 -21.954 -15.255 1.00 30.13 H new ATOM 0 HB3 LEU A 65 -4.848 -21.963 -14.990 1.00 30.13 H new ATOM 0 HG LEU A 65 -4.416 -24.489 -14.224 1.00 72.35 H new ATOM 0 HD11 LEU A 65 -2.205 -24.722 -13.130 1.00 71.33 H new ATOM 0 HD12 LEU A 65 -2.025 -24.471 -14.883 1.00 71.33 H new ATOM 0 HD13 LEU A 65 -1.725 -23.127 -13.756 1.00 71.33 H new ATOM 0 HD21 LEU A 65 -4.113 -23.660 -11.908 1.00 60.42 H new ATOM 0 HD22 LEU A 65 -3.629 -22.068 -12.540 1.00 60.42 H new ATOM 0 HD23 LEU A 65 -5.288 -22.659 -12.793 1.00 60.42 H new ATOM 1074 N VAL A 66 -5.664 -21.797 -17.617 1.00 32.31 N ATOM 1075 CA VAL A 66 -6.025 -20.849 -18.712 1.00 42.12 C ATOM 1076 C VAL A 66 -6.355 -19.465 -18.142 1.00 61.32 C ATOM 1077 O VAL A 66 -6.487 -18.502 -18.871 1.00 60.15 O ATOM 1078 CB VAL A 66 -7.260 -21.458 -19.375 1.00 10.12 C ATOM 1079 CG1 VAL A 66 -7.914 -20.415 -20.281 1.00 61.14 C ATOM 1080 CG2 VAL A 66 -6.844 -22.671 -20.211 1.00 61.24 C ATOM 0 H VAL A 66 -6.373 -21.918 -16.893 1.00 32.31 H new ATOM 0 HA VAL A 66 -5.205 -20.712 -19.417 1.00 42.12 H new ATOM 0 HB VAL A 66 -7.969 -21.772 -18.609 1.00 10.12 H new ATOM 0 HG11 VAL A 66 -8.795 -20.847 -20.755 1.00 61.14 H new ATOM 0 HG12 VAL A 66 -8.209 -19.550 -19.687 1.00 61.14 H new ATOM 0 HG13 VAL A 66 -7.205 -20.103 -21.048 1.00 61.14 H new ATOM 0 HG21 VAL A 66 -7.724 -23.106 -20.684 1.00 61.24 H new ATOM 0 HG22 VAL A 66 -6.136 -22.358 -20.979 1.00 61.24 H new ATOM 0 HG23 VAL A 66 -6.375 -23.414 -19.566 1.00 61.24 H new ATOM 1090 N ASN A 67 -6.496 -19.357 -16.850 1.00 61.34 N ATOM 1091 CA ASN A 67 -6.823 -18.029 -16.250 1.00 2.41 C ATOM 1092 C ASN A 67 -5.636 -17.490 -15.445 1.00 14.30 C ATOM 1093 O ASN A 67 -5.165 -16.395 -15.682 1.00 2.05 O ATOM 1094 CB ASN A 67 -8.029 -18.281 -15.340 1.00 54.40 C ATOM 1095 CG ASN A 67 -7.819 -19.568 -14.542 1.00 34.30 C ATOM 1096 OD1 ASN A 67 -7.828 -20.650 -15.097 1.00 61.20 O ATOM 1097 ND2 ASN A 67 -7.629 -19.499 -13.253 1.00 32.23 N ATOM 0 H ASN A 67 -6.400 -20.125 -16.185 1.00 61.34 H new ATOM 0 HA ASN A 67 -7.042 -17.283 -17.013 1.00 2.41 H new ATOM 0 HB2 ASN A 67 -8.165 -17.440 -14.661 1.00 54.40 H new ATOM 0 HB3 ASN A 67 -8.937 -18.358 -15.938 1.00 54.40 H new ATOM 0 HD21 ASN A 67 -7.488 -20.352 -12.712 1.00 32.23 H new ATOM 0 HD22 ASN A 67 -7.621 -18.592 -12.786 1.00 32.23 H new ATOM 1104 N ALA A 68 -5.147 -18.243 -14.499 1.00 55.04 N ATOM 1105 CA ALA A 68 -3.992 -17.760 -13.688 1.00 13.32 C ATOM 1106 C ALA A 68 -2.758 -18.618 -13.949 1.00 21.41 C ATOM 1107 O ALA A 68 -2.856 -19.772 -14.317 1.00 3.33 O ATOM 1108 CB ALA A 68 -4.443 -17.899 -12.234 1.00 1.50 C ATOM 0 H ALA A 68 -5.495 -19.169 -14.252 1.00 55.04 H new ATOM 0 HA ALA A 68 -3.719 -16.734 -13.936 1.00 13.32 H new ATOM 0 HB1 ALA A 68 -3.645 -17.563 -11.572 1.00 1.50 H new ATOM 0 HB2 ALA A 68 -5.332 -17.291 -12.069 1.00 1.50 H new ATOM 0 HB3 ALA A 68 -4.674 -18.943 -12.023 1.00 1.50 H new ATOM 1114 N ASP A 69 -1.593 -18.067 -13.751 1.00 62.31 N ATOM 1115 CA ASP A 69 -0.353 -18.856 -13.977 1.00 34.53 C ATOM 1116 C ASP A 69 0.109 -19.468 -12.655 1.00 12.41 C ATOM 1117 O ASP A 69 0.559 -18.779 -11.762 1.00 20.42 O ATOM 1118 CB ASP A 69 0.675 -17.846 -14.488 1.00 22.34 C ATOM 1119 CG ASP A 69 0.092 -17.077 -15.675 1.00 24.41 C ATOM 1120 OD1 ASP A 69 -1.019 -17.388 -16.067 1.00 40.31 O ATOM 1121 OD2 ASP A 69 0.767 -16.190 -16.168 1.00 12.41 O ATOM 0 H ASP A 69 -1.447 -17.106 -13.443 1.00 62.31 H new ATOM 0 HA ASP A 69 -0.499 -19.674 -14.683 1.00 34.53 H new ATOM 0 HB2 ASP A 69 0.947 -17.154 -13.691 1.00 22.34 H new ATOM 0 HB3 ASP A 69 1.588 -18.361 -14.788 1.00 22.34 H new ATOM 1126 N ILE A 70 -0.005 -20.758 -12.526 1.00 34.33 N ATOM 1127 CA ILE A 70 0.424 -21.420 -11.260 1.00 31.12 C ATOM 1128 C ILE A 70 1.795 -20.884 -10.822 1.00 31.50 C ATOM 1129 O ILE A 70 2.071 -20.744 -9.648 1.00 64.24 O ATOM 1130 CB ILE A 70 0.459 -22.924 -11.593 1.00 14.32 C ATOM 1131 CG1 ILE A 70 -0.288 -23.695 -10.504 1.00 53.24 C ATOM 1132 CG2 ILE A 70 1.901 -23.440 -11.682 1.00 32.43 C ATOM 1133 CD1 ILE A 70 0.318 -23.365 -9.138 1.00 24.21 C ATOM 0 H ILE A 70 -0.376 -21.385 -13.240 1.00 34.33 H new ATOM 0 HA ILE A 70 -0.248 -21.224 -10.425 1.00 31.12 H new ATOM 0 HB ILE A 70 -0.018 -23.075 -12.561 1.00 14.32 H new ATOM 0 HG12 ILE A 70 -1.346 -23.432 -10.518 1.00 53.24 H new ATOM 0 HG13 ILE A 70 -0.224 -24.767 -10.693 1.00 53.24 H new ATOM 0 HG21 ILE A 70 1.893 -24.504 -11.918 1.00 32.43 H new ATOM 0 HG22 ILE A 70 2.433 -22.899 -12.464 1.00 32.43 H new ATOM 0 HG23 ILE A 70 2.403 -23.284 -10.727 1.00 32.43 H new ATOM 0 HD11 ILE A 70 -0.214 -23.914 -8.362 1.00 24.21 H new ATOM 0 HD12 ILE A 70 1.370 -23.650 -9.128 1.00 24.21 H new ATOM 0 HD13 ILE A 70 0.231 -22.295 -8.950 1.00 24.21 H new ATOM 1145 N GLU A 71 2.655 -20.585 -11.760 1.00 35.43 N ATOM 1146 CA GLU A 71 4.002 -20.063 -11.392 1.00 64.25 C ATOM 1147 C GLU A 71 3.867 -18.708 -10.696 1.00 41.02 C ATOM 1148 O GLU A 71 4.475 -18.460 -9.673 1.00 25.33 O ATOM 1149 CB GLU A 71 4.746 -19.907 -12.719 1.00 30.42 C ATOM 1150 CG GLU A 71 5.454 -21.218 -13.066 1.00 33.03 C ATOM 1151 CD GLU A 71 5.047 -21.661 -14.472 1.00 45.01 C ATOM 1152 OE1 GLU A 71 4.727 -20.798 -15.273 1.00 70.24 O ATOM 1153 OE2 GLU A 71 5.063 -22.854 -14.724 1.00 21.32 O ATOM 0 H GLU A 71 2.483 -20.680 -12.761 1.00 35.43 H new ATOM 0 HA GLU A 71 4.528 -20.727 -10.706 1.00 64.25 H new ATOM 0 HB2 GLU A 71 4.046 -19.639 -13.511 1.00 30.42 H new ATOM 0 HB3 GLU A 71 5.472 -19.097 -12.648 1.00 30.42 H new ATOM 0 HG2 GLU A 71 6.535 -21.085 -13.014 1.00 33.03 H new ATOM 0 HG3 GLU A 71 5.192 -21.988 -12.340 1.00 33.03 H new ATOM 1160 N LYS A 72 3.075 -17.828 -11.243 1.00 0.20 N ATOM 1161 CA LYS A 72 2.899 -16.489 -10.615 1.00 10.22 C ATOM 1162 C LYS A 72 2.169 -16.626 -9.276 1.00 3.42 C ATOM 1163 O LYS A 72 2.050 -15.679 -8.525 1.00 61.12 O ATOM 1164 CB LYS A 72 2.051 -15.697 -11.612 1.00 4.41 C ATOM 1165 CG LYS A 72 2.955 -15.136 -12.712 1.00 32.13 C ATOM 1166 CD LYS A 72 3.017 -13.612 -12.589 1.00 34.31 C ATOM 1167 CE LYS A 72 4.262 -13.214 -11.793 1.00 0.24 C ATOM 1168 NZ LYS A 72 4.672 -11.896 -12.353 1.00 21.21 N ATOM 0 H LYS A 72 2.541 -17.979 -12.099 1.00 0.20 H new ATOM 0 HA LYS A 72 3.850 -15.999 -10.408 1.00 10.22 H new ATOM 0 HB2 LYS A 72 1.286 -16.340 -12.047 1.00 4.41 H new ATOM 0 HB3 LYS A 72 1.533 -14.885 -11.102 1.00 4.41 H new ATOM 0 HG2 LYS A 72 3.956 -15.560 -12.627 1.00 32.13 H new ATOM 0 HG3 LYS A 72 2.571 -15.418 -13.693 1.00 32.13 H new ATOM 0 HD2 LYS A 72 3.045 -13.158 -13.579 1.00 34.31 H new ATOM 0 HD3 LYS A 72 2.121 -13.240 -12.093 1.00 34.31 H new ATOM 0 HE2 LYS A 72 4.042 -13.139 -10.728 1.00 0.24 H new ATOM 0 HE3 LYS A 72 5.055 -13.954 -11.904 1.00 0.24 H new ATOM 0 HZ1 LYS A 72 5.521 -11.557 -11.857 1.00 21.21 H new ATOM 0 HZ2 LYS A 72 4.881 -11.999 -13.366 1.00 21.21 H new ATOM 0 HZ3 LYS A 72 3.900 -11.210 -12.227 1.00 21.21 H new ATOM 1182 N VAL A 73 1.675 -17.795 -8.973 1.00 61.21 N ATOM 1183 CA VAL A 73 0.949 -17.993 -7.682 1.00 12.13 C ATOM 1184 C VAL A 73 1.900 -18.509 -6.595 1.00 24.40 C ATOM 1185 O VAL A 73 1.661 -18.336 -5.418 1.00 24.15 O ATOM 1186 CB VAL A 73 -0.119 -19.041 -7.991 1.00 24.23 C ATOM 1187 CG1 VAL A 73 -0.847 -19.421 -6.701 1.00 72.23 C ATOM 1188 CG2 VAL A 73 -1.121 -18.462 -8.991 1.00 41.33 C ATOM 0 H VAL A 73 1.742 -18.624 -9.563 1.00 61.21 H new ATOM 0 HA VAL A 73 0.523 -17.062 -7.308 1.00 12.13 H new ATOM 0 HB VAL A 73 0.351 -19.928 -8.417 1.00 24.23 H new ATOM 0 HG11 VAL A 73 -1.609 -20.169 -6.920 1.00 72.23 H new ATOM 0 HG12 VAL A 73 -0.132 -19.830 -5.987 1.00 72.23 H new ATOM 0 HG13 VAL A 73 -1.319 -18.536 -6.275 1.00 72.23 H new ATOM 0 HG21 VAL A 73 -1.885 -19.207 -9.214 1.00 41.33 H new ATOM 0 HG22 VAL A 73 -1.592 -17.577 -8.563 1.00 41.33 H new ATOM 0 HG23 VAL A 73 -0.602 -18.189 -9.910 1.00 41.33 H new ATOM 1198 N LYS A 74 2.964 -19.156 -6.983 1.00 61.24 N ATOM 1199 CA LYS A 74 3.922 -19.705 -5.974 1.00 35.33 C ATOM 1200 C LYS A 74 4.427 -18.607 -5.029 1.00 3.13 C ATOM 1201 O LYS A 74 4.363 -18.738 -3.823 1.00 10.43 O ATOM 1202 CB LYS A 74 5.073 -20.272 -6.800 1.00 2.22 C ATOM 1203 CG LYS A 74 4.552 -21.409 -7.683 1.00 41.52 C ATOM 1204 CD LYS A 74 4.228 -22.621 -6.808 1.00 52.00 C ATOM 1205 CE LYS A 74 2.725 -22.911 -6.870 1.00 41.41 C ATOM 1206 NZ LYS A 74 2.373 -23.401 -5.508 1.00 71.24 N ATOM 0 H LYS A 74 3.214 -19.330 -7.956 1.00 61.24 H new ATOM 0 HA LYS A 74 3.453 -20.457 -5.339 1.00 35.33 H new ATOM 0 HB2 LYS A 74 5.512 -19.489 -7.418 1.00 2.22 H new ATOM 0 HB3 LYS A 74 5.861 -20.639 -6.142 1.00 2.22 H new ATOM 0 HG2 LYS A 74 3.661 -21.087 -8.222 1.00 41.52 H new ATOM 0 HG3 LYS A 74 5.299 -21.675 -8.431 1.00 41.52 H new ATOM 0 HD2 LYS A 74 4.791 -23.490 -7.149 1.00 52.00 H new ATOM 0 HD3 LYS A 74 4.530 -22.430 -5.778 1.00 52.00 H new ATOM 0 HE2 LYS A 74 2.160 -22.015 -7.126 1.00 41.41 H new ATOM 0 HE3 LYS A 74 2.498 -23.659 -7.630 1.00 41.41 H new ATOM 0 HZ1 LYS A 74 1.357 -23.621 -5.470 1.00 71.24 H new ATOM 0 HZ2 LYS A 74 2.922 -24.258 -5.295 1.00 71.24 H new ATOM 0 HZ3 LYS A 74 2.594 -22.666 -4.807 1.00 71.24 H new ATOM 1220 N GLN A 75 4.948 -17.537 -5.563 1.00 21.12 N ATOM 1221 CA GLN A 75 5.476 -16.449 -4.682 1.00 44.34 C ATOM 1222 C GLN A 75 4.376 -15.899 -3.769 1.00 12.13 C ATOM 1223 O GLN A 75 4.643 -15.171 -2.833 1.00 45.14 O ATOM 1224 CB GLN A 75 6.007 -15.353 -5.624 1.00 53.04 C ATOM 1225 CG GLN A 75 5.019 -15.073 -6.767 1.00 43.41 C ATOM 1226 CD GLN A 75 3.626 -14.790 -6.208 1.00 65.53 C ATOM 1227 OE1 GLN A 75 2.736 -15.609 -6.317 1.00 62.15 O ATOM 1228 NE2 GLN A 75 3.395 -13.655 -5.607 1.00 13.01 N ATOM 0 H GLN A 75 5.032 -17.366 -6.565 1.00 21.12 H new ATOM 0 HA GLN A 75 6.263 -16.822 -4.027 1.00 44.34 H new ATOM 0 HB2 GLN A 75 6.181 -14.438 -5.059 1.00 53.04 H new ATOM 0 HB3 GLN A 75 6.968 -15.660 -6.038 1.00 53.04 H new ATOM 0 HG2 GLN A 75 5.363 -14.221 -7.353 1.00 43.41 H new ATOM 0 HG3 GLN A 75 4.981 -15.929 -7.441 1.00 43.41 H new ATOM 0 HE21 GLN A 75 4.141 -12.966 -5.514 1.00 13.01 H new ATOM 0 HE22 GLN A 75 2.468 -13.457 -5.230 1.00 13.01 H new ATOM 1237 N ALA A 76 3.143 -16.236 -4.027 1.00 15.41 N ATOM 1238 CA ALA A 76 2.038 -15.730 -3.167 1.00 64.40 C ATOM 1239 C ALA A 76 1.705 -16.753 -2.081 1.00 33.41 C ATOM 1240 O ALA A 76 1.519 -16.413 -0.931 1.00 22.22 O ATOM 1241 CB ALA A 76 0.852 -15.546 -4.110 1.00 64.51 C ATOM 0 H ALA A 76 2.853 -16.840 -4.796 1.00 15.41 H new ATOM 0 HA ALA A 76 2.302 -14.802 -2.660 1.00 64.40 H new ATOM 0 HB1 ALA A 76 -0.005 -15.174 -3.549 1.00 64.51 H new ATOM 0 HB2 ALA A 76 1.114 -14.830 -4.889 1.00 64.51 H new ATOM 0 HB3 ALA A 76 0.599 -16.503 -4.567 1.00 64.51 H new ATOM 1247 N LEU A 77 1.633 -18.006 -2.437 1.00 54.12 N ATOM 1248 CA LEU A 77 1.317 -19.045 -1.418 1.00 51.31 C ATOM 1249 C LEU A 77 2.535 -19.285 -0.520 1.00 72.31 C ATOM 1250 O LEU A 77 2.415 -19.768 0.590 1.00 32.34 O ATOM 1251 CB LEU A 77 0.973 -20.303 -2.216 1.00 75.01 C ATOM 1252 CG LEU A 77 -0.134 -19.979 -3.222 1.00 30.30 C ATOM 1253 CD1 LEU A 77 -0.562 -21.257 -3.945 1.00 10.51 C ATOM 1254 CD2 LEU A 77 -1.336 -19.386 -2.481 1.00 14.10 C ATOM 0 H LEU A 77 1.779 -18.354 -3.385 1.00 54.12 H new ATOM 0 HA LEU A 77 0.495 -18.749 -0.766 1.00 51.31 H new ATOM 0 HB2 LEU A 77 1.857 -20.670 -2.737 1.00 75.01 H new ATOM 0 HB3 LEU A 77 0.648 -21.096 -1.543 1.00 75.01 H new ATOM 0 HG LEU A 77 0.238 -19.259 -3.951 1.00 30.30 H new ATOM 0 HD11 LEU A 77 -1.350 -21.024 -4.661 1.00 10.51 H new ATOM 0 HD12 LEU A 77 0.293 -21.681 -4.472 1.00 10.51 H new ATOM 0 HD13 LEU A 77 -0.934 -21.979 -3.218 1.00 10.51 H new ATOM 0 HD21 LEU A 77 -2.126 -19.154 -3.196 1.00 14.10 H new ATOM 0 HD22 LEU A 77 -1.706 -20.107 -1.752 1.00 14.10 H new ATOM 0 HD23 LEU A 77 -1.033 -18.474 -1.967 1.00 14.10 H new ATOM 1266 N THR A 78 3.704 -18.938 -0.987 1.00 23.15 N ATOM 1267 CA THR A 78 4.927 -19.136 -0.158 1.00 72.41 C ATOM 1268 C THR A 78 5.162 -17.904 0.724 1.00 12.42 C ATOM 1269 O THR A 78 5.712 -17.994 1.803 1.00 3.10 O ATOM 1270 CB THR A 78 6.070 -19.311 -1.164 1.00 55.01 C ATOM 1271 OG1 THR A 78 7.196 -19.873 -0.506 1.00 53.32 O ATOM 1272 CG2 THR A 78 6.450 -17.951 -1.756 1.00 32.14 C ATOM 0 H THR A 78 3.865 -18.526 -1.906 1.00 23.15 H new ATOM 0 HA THR A 78 4.845 -19.995 0.508 1.00 72.41 H new ATOM 0 HB THR A 78 5.747 -19.975 -1.966 1.00 55.01 H new ATOM 0 HG1 THR A 78 7.927 -19.987 -1.148 1.00 53.32 H new ATOM 0 HG21 THR A 78 7.263 -18.080 -2.471 1.00 32.14 H new ATOM 0 HG22 THR A 78 5.586 -17.520 -2.263 1.00 32.14 H new ATOM 0 HG23 THR A 78 6.772 -17.283 -0.957 1.00 32.14 H new ATOM 1280 N GLU A 79 4.741 -16.755 0.268 1.00 54.20 N ATOM 1281 CA GLU A 79 4.930 -15.515 1.072 1.00 0.20 C ATOM 1282 C GLU A 79 3.672 -15.227 1.893 1.00 43.04 C ATOM 1283 O GLU A 79 3.739 -14.922 3.067 1.00 0.13 O ATOM 1284 CB GLU A 79 5.162 -14.410 0.042 1.00 15.40 C ATOM 1285 CG GLU A 79 6.490 -14.655 -0.680 1.00 44.50 C ATOM 1286 CD GLU A 79 7.608 -13.901 0.042 1.00 50.24 C ATOM 1287 OE1 GLU A 79 7.675 -12.694 -0.111 1.00 35.32 O ATOM 1288 OE2 GLU A 79 8.374 -14.546 0.737 1.00 75.11 O ATOM 0 H GLU A 79 4.273 -16.622 -0.629 1.00 54.20 H new ATOM 0 HA GLU A 79 5.759 -15.597 1.775 1.00 0.20 H new ATOM 0 HB2 GLU A 79 4.343 -14.391 -0.677 1.00 15.40 H new ATOM 0 HB3 GLU A 79 5.177 -13.437 0.534 1.00 15.40 H new ATOM 0 HG2 GLU A 79 6.712 -15.722 -0.704 1.00 44.50 H new ATOM 0 HG3 GLU A 79 6.421 -14.321 -1.715 1.00 44.50 H new ATOM 1295 N GLN A 80 2.524 -15.325 1.283 1.00 61.10 N ATOM 1296 CA GLN A 80 1.257 -15.060 2.023 1.00 62.11 C ATOM 1297 C GLN A 80 0.526 -16.378 2.274 1.00 33.13 C ATOM 1298 O GLN A 80 0.252 -16.749 3.398 1.00 23.24 O ATOM 1299 CB GLN A 80 0.413 -14.162 1.108 1.00 63.24 C ATOM 1300 CG GLN A 80 1.304 -13.183 0.333 1.00 1.20 C ATOM 1301 CD GLN A 80 0.502 -12.577 -0.819 1.00 30.22 C ATOM 1302 OE1 GLN A 80 0.412 -11.371 -0.945 1.00 64.31 O ATOM 1303 NE2 GLN A 80 -0.089 -13.368 -1.674 1.00 75.12 N ATOM 0 H GLN A 80 2.407 -15.578 0.302 1.00 61.10 H new ATOM 0 HA GLN A 80 1.442 -14.587 2.987 1.00 62.11 H new ATOM 0 HB2 GLN A 80 -0.153 -14.777 0.409 1.00 63.24 H new ATOM 0 HB3 GLN A 80 -0.312 -13.607 1.704 1.00 63.24 H new ATOM 0 HG2 GLN A 80 1.662 -12.396 0.996 1.00 1.20 H new ATOM 0 HG3 GLN A 80 2.183 -13.700 -0.052 1.00 1.20 H new ATOM 0 HE21 GLN A 80 -0.014 -14.380 -1.569 1.00 75.12 H new ATOM 0 HE22 GLN A 80 -0.626 -12.974 -2.447 1.00 75.12 H new ATOM 1312 N GLY A 81 0.216 -17.090 1.227 1.00 44.44 N ATOM 1313 CA GLY A 81 -0.493 -18.387 1.386 1.00 53.33 C ATOM 1314 C GLY A 81 -1.756 -18.392 0.524 1.00 11.11 C ATOM 1315 O GLY A 81 -2.520 -19.336 0.535 1.00 63.42 O ATOM 0 H GLY A 81 0.425 -16.827 0.264 1.00 44.44 H new ATOM 0 HA2 GLY A 81 0.161 -19.208 1.094 1.00 53.33 H new ATOM 0 HA3 GLY A 81 -0.754 -18.544 2.432 1.00 53.33 H new ATOM 1319 N TYR A 82 -1.979 -17.346 -0.225 1.00 5.30 N ATOM 1320 CA TYR A 82 -3.195 -17.298 -1.090 1.00 3.33 C ATOM 1321 C TYR A 82 -2.936 -16.410 -2.309 1.00 20.12 C ATOM 1322 O TYR A 82 -2.232 -15.424 -2.234 1.00 31.20 O ATOM 1323 CB TYR A 82 -4.314 -16.690 -0.230 1.00 20.53 C ATOM 1324 CG TYR A 82 -4.102 -17.018 1.230 1.00 71.41 C ATOM 1325 CD1 TYR A 82 -3.132 -16.327 1.964 1.00 10.14 C ATOM 1326 CD2 TYR A 82 -4.874 -18.007 1.850 1.00 31.03 C ATOM 1327 CE1 TYR A 82 -2.929 -16.627 3.315 1.00 1.11 C ATOM 1328 CE2 TYR A 82 -4.672 -18.307 3.204 1.00 43.33 C ATOM 1329 CZ TYR A 82 -3.701 -17.617 3.936 1.00 43.02 C ATOM 1330 OH TYR A 82 -3.501 -17.912 5.269 1.00 52.14 O ATOM 0 H TYR A 82 -1.375 -16.525 -0.276 1.00 5.30 H new ATOM 0 HA TYR A 82 -3.464 -18.291 -1.450 1.00 3.33 H new ATOM 0 HB2 TYR A 82 -4.337 -15.609 -0.366 1.00 20.53 H new ATOM 0 HB3 TYR A 82 -5.280 -17.073 -0.558 1.00 20.53 H new ATOM 0 HD1 TYR A 82 -2.539 -15.561 1.487 1.00 10.14 H new ATOM 0 HD2 TYR A 82 -5.625 -18.539 1.285 1.00 31.03 H new ATOM 0 HE1 TYR A 82 -2.177 -16.095 3.879 1.00 1.11 H new ATOM 0 HE2 TYR A 82 -5.267 -19.071 3.682 1.00 43.33 H new ATOM 0 HH TYR A 82 -4.119 -18.621 5.543 1.00 52.14 H new ATOM 1340 N TYR A 83 -3.509 -16.749 -3.428 1.00 25.42 N ATOM 1341 CA TYR A 83 -3.310 -15.922 -4.653 1.00 54.02 C ATOM 1342 C TYR A 83 -4.627 -15.816 -5.418 1.00 35.21 C ATOM 1343 O TYR A 83 -5.182 -16.803 -5.859 1.00 44.14 O ATOM 1344 CB TYR A 83 -2.267 -16.669 -5.481 1.00 64.03 C ATOM 1345 CG TYR A 83 -2.049 -15.941 -6.784 1.00 25.00 C ATOM 1346 CD1 TYR A 83 -3.024 -15.994 -7.790 1.00 13.51 C ATOM 1347 CD2 TYR A 83 -0.874 -15.216 -6.989 1.00 73.21 C ATOM 1348 CE1 TYR A 83 -2.818 -15.317 -8.999 1.00 53.30 C ATOM 1349 CE2 TYR A 83 -0.666 -14.540 -8.197 1.00 51.31 C ATOM 1350 CZ TYR A 83 -1.639 -14.591 -9.203 1.00 71.31 C ATOM 1351 OH TYR A 83 -1.435 -13.927 -10.395 1.00 63.41 O ATOM 0 H TYR A 83 -4.109 -17.565 -3.549 1.00 25.42 H new ATOM 0 HA TYR A 83 -2.984 -14.908 -4.422 1.00 54.02 H new ATOM 0 HB2 TYR A 83 -1.330 -16.739 -4.929 1.00 64.03 H new ATOM 0 HB3 TYR A 83 -2.601 -17.689 -5.673 1.00 64.03 H new ATOM 0 HD1 TYR A 83 -3.933 -16.556 -7.633 1.00 13.51 H new ATOM 0 HD2 TYR A 83 -0.123 -15.176 -6.214 1.00 73.21 H new ATOM 0 HE1 TYR A 83 -3.569 -15.355 -9.774 1.00 53.30 H new ATOM 0 HE2 TYR A 83 0.244 -13.980 -8.353 1.00 51.31 H new ATOM 0 HH TYR A 83 -0.567 -13.472 -10.372 1.00 63.41 H new ATOM 1361 N LEU A 84 -5.140 -14.628 -5.572 1.00 45.23 N ATOM 1362 CA LEU A 84 -6.431 -14.464 -6.299 1.00 44.21 C ATOM 1363 C LEU A 84 -6.185 -14.083 -7.756 1.00 12.25 C ATOM 1364 O LEU A 84 -5.463 -13.153 -8.055 1.00 71.14 O ATOM 1365 CB LEU A 84 -7.154 -13.338 -5.563 1.00 74.22 C ATOM 1366 CG LEU A 84 -8.450 -12.986 -6.299 1.00 54.52 C ATOM 1367 CD1 LEU A 84 -9.182 -14.267 -6.704 1.00 61.24 C ATOM 1368 CD2 LEU A 84 -9.347 -12.160 -5.374 1.00 21.42 C ATOM 0 H LEU A 84 -4.723 -13.764 -5.227 1.00 45.23 H new ATOM 0 HA LEU A 84 -7.013 -15.386 -6.315 1.00 44.21 H new ATOM 0 HB2 LEU A 84 -7.377 -13.644 -4.541 1.00 74.22 H new ATOM 0 HB3 LEU A 84 -6.511 -12.460 -5.500 1.00 74.22 H new ATOM 0 HG LEU A 84 -8.212 -12.411 -7.194 1.00 54.52 H new ATOM 0 HD11 LEU A 84 -10.103 -14.010 -7.227 1.00 61.24 H new ATOM 0 HD12 LEU A 84 -8.544 -14.858 -7.361 1.00 61.24 H new ATOM 0 HD13 LEU A 84 -9.421 -14.847 -5.813 1.00 61.24 H new ATOM 0 HD21 LEU A 84 -10.271 -11.907 -5.894 1.00 21.42 H new ATOM 0 HD22 LEU A 84 -9.580 -12.739 -4.481 1.00 21.42 H new ATOM 0 HD23 LEU A 84 -8.829 -11.244 -5.088 1.00 21.42 H new ATOM 1380 N GLN A 85 -6.789 -14.793 -8.669 1.00 42.24 N ATOM 1381 CA GLN A 85 -6.601 -14.470 -10.107 1.00 54.21 C ATOM 1382 C GLN A 85 -7.829 -13.718 -10.635 1.00 24.25 C ATOM 1383 O GLN A 85 -8.950 -14.179 -10.523 1.00 4.11 O ATOM 1384 CB GLN A 85 -6.432 -15.827 -10.803 1.00 31.11 C ATOM 1385 CG GLN A 85 -7.801 -16.476 -11.027 1.00 44.42 C ATOM 1386 CD GLN A 85 -8.393 -16.015 -12.367 1.00 53.41 C ATOM 1387 OE1 GLN A 85 -7.847 -15.021 -13.016 1.00 54.14 O flip ATOM 1388 NE2 GLN A 85 -9.368 -16.573 -12.828 1.00 33.43 N flip ATOM 0 H GLN A 85 -7.405 -15.583 -8.479 1.00 42.24 H new ATOM 0 HA GLN A 85 -5.740 -13.826 -10.286 1.00 54.21 H new ATOM 0 HB2 GLN A 85 -5.923 -15.694 -11.758 1.00 31.11 H new ATOM 0 HB3 GLN A 85 -5.806 -16.481 -10.196 1.00 31.11 H new ATOM 0 HG2 GLN A 85 -7.703 -17.562 -11.019 1.00 44.42 H new ATOM 0 HG3 GLN A 85 -8.475 -16.211 -10.213 1.00 44.42 H new ATOM 0 HE21 GLN A 85 -9.797 -17.349 -12.324 1.00 33.43 H new ATOM 0 HE22 GLN A 85 -9.758 -16.265 -13.719 1.00 33.43 H new ATOM 1397 N LEU A 86 -7.623 -12.559 -11.204 1.00 13.52 N ATOM 1398 CA LEU A 86 -8.770 -11.767 -11.735 1.00 41.40 C ATOM 1399 C LEU A 86 -8.494 -11.335 -13.181 1.00 4.23 C ATOM 1400 O LEU A 86 -7.478 -10.730 -13.461 1.00 74.04 O ATOM 1401 CB LEU A 86 -8.855 -10.543 -10.821 1.00 40.15 C ATOM 1402 CG LEU A 86 -10.250 -10.458 -10.202 1.00 44.42 C ATOM 1403 CD1 LEU A 86 -11.292 -10.287 -11.310 1.00 13.15 C ATOM 1404 CD2 LEU A 86 -10.539 -11.744 -9.423 1.00 42.21 C ATOM 0 H LEU A 86 -6.707 -12.126 -11.324 1.00 13.52 H new ATOM 0 HA LEU A 86 -9.698 -12.339 -11.746 1.00 41.40 H new ATOM 0 HB2 LEU A 86 -8.102 -10.610 -10.036 1.00 40.15 H new ATOM 0 HB3 LEU A 86 -8.643 -9.637 -11.389 1.00 40.15 H new ATOM 0 HG LEU A 86 -10.297 -9.604 -9.526 1.00 44.42 H new ATOM 0 HD11 LEU A 86 -12.287 -10.226 -10.868 1.00 13.15 H new ATOM 0 HD12 LEU A 86 -11.086 -9.372 -11.866 1.00 13.15 H new ATOM 0 HD13 LEU A 86 -11.247 -11.140 -11.987 1.00 13.15 H new ATOM 0 HD21 LEU A 86 -11.533 -11.686 -8.981 1.00 42.21 H new ATOM 0 HD22 LEU A 86 -10.492 -12.597 -10.099 1.00 42.21 H new ATOM 0 HD23 LEU A 86 -9.797 -11.866 -8.634 1.00 42.21 H new ATOM 1416 N PRO A 87 -9.413 -11.659 -14.048 1.00 44.02 N ATOM 1417 CA PRO A 87 -9.272 -11.298 -15.482 1.00 11.24 C ATOM 1418 C PRO A 87 -9.483 -9.794 -15.674 1.00 64.30 C ATOM 1419 O PRO A 87 -9.812 -9.091 -14.738 1.00 62.34 O ATOM 1420 CB PRO A 87 -10.390 -12.085 -16.160 1.00 43.24 C ATOM 1421 CG PRO A 87 -11.406 -12.311 -15.088 1.00 31.04 C ATOM 1422 CD PRO A 87 -10.660 -12.388 -13.783 1.00 0.33 C ATOM 0 HA PRO A 87 -8.286 -11.527 -15.886 1.00 11.24 H new ATOM 0 HB2 PRO A 87 -10.814 -11.528 -16.996 1.00 43.24 H new ATOM 0 HB3 PRO A 87 -10.022 -13.029 -16.561 1.00 43.24 H new ATOM 0 HG2 PRO A 87 -12.133 -11.499 -15.069 1.00 31.04 H new ATOM 0 HG3 PRO A 87 -11.960 -13.232 -15.270 1.00 31.04 H new ATOM 0 HD2 PRO A 87 -11.226 -11.931 -12.971 1.00 0.33 H new ATOM 0 HD3 PRO A 87 -10.466 -13.421 -13.494 1.00 0.33 H new ATOM 1430 N PRO A 88 -9.300 -9.351 -16.888 1.00 53.12 N ATOM 1431 CA PRO A 88 -9.488 -7.915 -17.208 1.00 52.10 C ATOM 1432 C PRO A 88 -10.973 -7.555 -17.112 1.00 53.05 C ATOM 1433 O PRO A 88 -11.773 -8.012 -17.903 1.00 2.42 O ATOM 1434 CB PRO A 88 -8.980 -7.798 -18.643 1.00 23.11 C ATOM 1435 CG PRO A 88 -9.123 -9.174 -19.211 1.00 32.10 C ATOM 1436 CD PRO A 88 -8.904 -10.130 -18.068 1.00 62.11 C ATOM 0 HA PRO A 88 -8.964 -7.242 -16.529 1.00 52.10 H new ATOM 0 HB2 PRO A 88 -9.563 -7.073 -19.211 1.00 23.11 H new ATOM 0 HB3 PRO A 88 -7.943 -7.465 -18.670 1.00 23.11 H new ATOM 0 HG2 PRO A 88 -10.111 -9.313 -19.649 1.00 32.10 H new ATOM 0 HG3 PRO A 88 -8.396 -9.344 -20.005 1.00 32.10 H new ATOM 0 HD2 PRO A 88 -9.509 -11.030 -18.176 1.00 62.11 H new ATOM 0 HD3 PRO A 88 -7.864 -10.451 -18.007 1.00 62.11 H new ATOM 1444 N PRO A 89 -11.290 -6.752 -16.135 1.00 10.24 N ATOM 1445 CA PRO A 89 -12.698 -6.337 -15.919 1.00 23.30 C ATOM 1446 C PRO A 89 -13.155 -5.369 -17.013 1.00 14.43 C ATOM 1447 O PRO A 89 -12.352 -4.840 -17.755 1.00 44.21 O ATOM 1448 CB PRO A 89 -12.662 -5.647 -14.558 1.00 63.40 C ATOM 1449 CG PRO A 89 -11.251 -5.187 -14.395 1.00 72.53 C ATOM 1450 CD PRO A 89 -10.381 -6.160 -15.147 1.00 5.21 C ATOM 0 HA PRO A 89 -13.398 -7.172 -15.952 1.00 23.30 H new ATOM 0 HB2 PRO A 89 -13.357 -4.808 -14.522 1.00 63.40 H new ATOM 0 HB3 PRO A 89 -12.948 -6.332 -13.760 1.00 63.40 H new ATOM 0 HG2 PRO A 89 -11.127 -4.177 -14.786 1.00 72.53 H new ATOM 0 HG3 PRO A 89 -10.974 -5.157 -13.341 1.00 72.53 H new ATOM 0 HD2 PRO A 89 -9.541 -5.657 -15.627 1.00 5.21 H new ATOM 0 HD3 PRO A 89 -9.963 -6.917 -14.484 1.00 5.21 H new ATOM 1458 N PRO A 90 -14.444 -5.177 -17.071 1.00 44.03 N ATOM 1459 CA PRO A 90 -15.048 -4.268 -18.081 1.00 74.11 C ATOM 1460 C PRO A 90 -14.736 -2.811 -17.741 1.00 24.21 C ATOM 1461 O PRO A 90 -15.021 -1.910 -18.505 1.00 13.11 O ATOM 1462 CB PRO A 90 -16.544 -4.535 -17.949 1.00 54.40 C ATOM 1463 CG PRO A 90 -16.716 -5.039 -16.554 1.00 32.32 C ATOM 1464 CD PRO A 90 -15.459 -5.785 -16.204 1.00 65.11 C ATOM 0 HA PRO A 90 -14.670 -4.438 -19.089 1.00 74.11 H new ATOM 0 HB2 PRO A 90 -17.125 -3.628 -18.117 1.00 54.40 H new ATOM 0 HB3 PRO A 90 -16.881 -5.270 -18.680 1.00 54.40 H new ATOM 0 HG2 PRO A 90 -16.881 -4.213 -15.862 1.00 32.32 H new ATOM 0 HG3 PRO A 90 -17.586 -5.692 -16.483 1.00 32.32 H new ATOM 0 HD2 PRO A 90 -15.206 -5.672 -15.150 1.00 65.11 H new ATOM 0 HD3 PRO A 90 -15.561 -6.853 -16.394 1.00 65.11 H new ATOM 1472 N GLU A 91 -14.156 -2.574 -16.598 1.00 70.10 N ATOM 1473 CA GLU A 91 -13.825 -1.179 -16.203 1.00 70.30 C ATOM 1474 C GLU A 91 -12.870 -0.567 -17.227 1.00 75.32 C ATOM 1475 O GLU A 91 -12.995 -0.788 -18.415 1.00 74.02 O ATOM 1476 CB GLU A 91 -13.143 -1.303 -14.840 1.00 53.41 C ATOM 1477 CG GLU A 91 -14.075 -2.025 -13.865 1.00 51.42 C ATOM 1478 CD GLU A 91 -13.244 -2.814 -12.854 1.00 23.52 C ATOM 1479 OE1 GLU A 91 -12.094 -3.091 -13.148 1.00 73.30 O ATOM 1480 OE2 GLU A 91 -13.774 -3.134 -11.801 1.00 41.02 O ATOM 0 H GLU A 91 -13.897 -3.289 -15.919 1.00 70.10 H new ATOM 0 HA GLU A 91 -14.705 -0.537 -16.157 1.00 70.30 H new ATOM 0 HB2 GLU A 91 -12.207 -1.853 -14.939 1.00 53.41 H new ATOM 0 HB3 GLU A 91 -12.893 -0.314 -14.456 1.00 53.41 H new ATOM 0 HG2 GLU A 91 -14.707 -1.303 -13.348 1.00 51.42 H new ATOM 0 HG3 GLU A 91 -14.738 -2.697 -14.410 1.00 51.42 H new ATOM 1487 N ASP A 92 -11.915 0.193 -16.781 1.00 22.30 N ATOM 1488 CA ASP A 92 -10.960 0.802 -17.741 1.00 42.21 C ATOM 1489 C ASP A 92 -9.653 1.160 -17.030 1.00 22.35 C ATOM 1490 O ASP A 92 -9.011 2.141 -17.352 1.00 14.23 O ATOM 1491 CB ASP A 92 -11.661 2.063 -18.250 1.00 41.14 C ATOM 1492 CG ASP A 92 -11.397 2.228 -19.747 1.00 74.32 C ATOM 1493 OD1 ASP A 92 -11.637 1.283 -20.481 1.00 41.24 O ATOM 1494 OD2 ASP A 92 -10.959 3.299 -20.136 1.00 14.24 O ATOM 0 H ASP A 92 -11.754 0.418 -15.799 1.00 22.30 H new ATOM 0 HA ASP A 92 -10.701 0.125 -18.555 1.00 42.21 H new ATOM 0 HB2 ASP A 92 -12.733 1.995 -18.065 1.00 41.14 H new ATOM 0 HB3 ASP A 92 -11.299 2.937 -17.708 1.00 41.14 H new ATOM 1499 N LEU A 93 -9.255 0.377 -16.064 1.00 72.34 N ATOM 1500 CA LEU A 93 -7.991 0.680 -15.335 1.00 24.30 C ATOM 1501 C LEU A 93 -7.410 -0.595 -14.715 1.00 30.23 C ATOM 1502 O LEU A 93 -8.121 -1.527 -14.404 1.00 51.24 O ATOM 1503 CB LEU A 93 -8.396 1.669 -14.241 1.00 30.12 C ATOM 1504 CG LEU A 93 -9.507 1.056 -13.387 1.00 62.52 C ATOM 1505 CD1 LEU A 93 -9.038 0.959 -11.933 1.00 71.41 C ATOM 1506 CD2 LEU A 93 -10.753 1.943 -13.464 1.00 13.50 C ATOM 0 H LEU A 93 -9.750 -0.458 -15.749 1.00 72.34 H new ATOM 0 HA LEU A 93 -7.224 1.086 -15.994 1.00 24.30 H new ATOM 0 HB2 LEU A 93 -7.535 1.911 -13.618 1.00 30.12 H new ATOM 0 HB3 LEU A 93 -8.739 2.602 -14.688 1.00 30.12 H new ATOM 0 HG LEU A 93 -9.745 0.059 -13.758 1.00 62.52 H new ATOM 0 HD11 LEU A 93 -9.829 0.522 -11.324 1.00 71.41 H new ATOM 0 HD12 LEU A 93 -8.149 0.330 -11.879 1.00 71.41 H new ATOM 0 HD13 LEU A 93 -8.801 1.955 -11.560 1.00 71.41 H new ATOM 0 HD21 LEU A 93 -11.547 1.509 -12.856 1.00 13.50 H new ATOM 0 HD22 LEU A 93 -10.514 2.939 -13.091 1.00 13.50 H new ATOM 0 HD23 LEU A 93 -11.086 2.013 -14.499 1.00 13.50 H new ATOM 1518 N LEU A 94 -6.117 -0.632 -14.530 1.00 63.14 N ATOM 1519 CA LEU A 94 -5.477 -1.837 -13.925 1.00 1.41 C ATOM 1520 C LEU A 94 -4.011 -1.537 -13.607 1.00 63.43 C ATOM 1521 O LEU A 94 -3.427 -0.621 -14.148 1.00 43.52 O ATOM 1522 CB LEU A 94 -5.587 -2.928 -14.992 1.00 41.23 C ATOM 1523 CG LEU A 94 -4.767 -4.146 -14.563 1.00 42.34 C ATOM 1524 CD1 LEU A 94 -5.441 -4.821 -13.368 1.00 60.44 C ATOM 1525 CD2 LEU A 94 -4.686 -5.139 -15.726 1.00 45.33 C ATOM 0 H LEU A 94 -5.475 0.122 -14.772 1.00 63.14 H new ATOM 0 HA LEU A 94 -5.954 -2.140 -12.993 1.00 1.41 H new ATOM 0 HB2 LEU A 94 -6.630 -3.210 -15.133 1.00 41.23 H new ATOM 0 HB3 LEU A 94 -5.226 -2.553 -15.950 1.00 41.23 H new ATOM 0 HG LEU A 94 -3.763 -3.827 -14.282 1.00 42.34 H new ATOM 0 HD11 LEU A 94 -4.856 -5.689 -13.063 1.00 60.44 H new ATOM 0 HD12 LEU A 94 -5.503 -4.116 -12.539 1.00 60.44 H new ATOM 0 HD13 LEU A 94 -6.445 -5.140 -13.649 1.00 60.44 H new ATOM 0 HD21 LEU A 94 -4.102 -6.008 -15.423 1.00 45.33 H new ATOM 0 HD22 LEU A 94 -5.691 -5.456 -16.004 1.00 45.33 H new ATOM 0 HD23 LEU A 94 -4.207 -4.660 -16.580 1.00 45.33 H new ATOM 1537 N LYS A 95 -3.408 -2.296 -12.731 1.00 24.04 N ATOM 1538 CA LYS A 95 -1.979 -2.041 -12.385 1.00 52.02 C ATOM 1539 C LYS A 95 -1.163 -1.773 -13.653 1.00 35.04 C ATOM 1540 O LYS A 95 -1.441 -2.312 -14.706 1.00 12.15 O ATOM 1541 CB LYS A 95 -1.500 -3.317 -11.690 1.00 1.13 C ATOM 1542 CG LYS A 95 -1.826 -4.533 -12.559 1.00 61.34 C ATOM 1543 CD LYS A 95 -0.877 -5.680 -12.199 1.00 2.24 C ATOM 1544 CE LYS A 95 -1.523 -7.016 -12.573 1.00 2.14 C ATOM 1545 NZ LYS A 95 -0.572 -7.643 -13.532 1.00 72.25 N ATOM 0 H LYS A 95 -3.841 -3.079 -12.241 1.00 24.04 H new ATOM 0 HA LYS A 95 -1.861 -1.166 -11.746 1.00 52.02 H new ATOM 0 HB2 LYS A 95 -0.426 -3.264 -11.511 1.00 1.13 H new ATOM 0 HB3 LYS A 95 -1.981 -3.415 -10.717 1.00 1.13 H new ATOM 0 HG2 LYS A 95 -2.861 -4.839 -12.403 1.00 61.34 H new ATOM 0 HG3 LYS A 95 -1.724 -4.279 -13.614 1.00 61.34 H new ATOM 0 HD2 LYS A 95 0.070 -5.562 -12.726 1.00 2.24 H new ATOM 0 HD3 LYS A 95 -0.652 -5.659 -11.133 1.00 2.24 H new ATOM 0 HE2 LYS A 95 -1.670 -7.644 -11.694 1.00 2.14 H new ATOM 0 HE3 LYS A 95 -2.503 -6.868 -13.027 1.00 2.14 H new ATOM 0 HZ1 LYS A 95 -0.944 -8.565 -13.837 1.00 72.25 H new ATOM 0 HZ2 LYS A 95 -0.457 -7.025 -14.361 1.00 72.25 H new ATOM 0 HZ3 LYS A 95 0.350 -7.777 -13.069 1.00 72.25 H new ATOM 1559 N GLN A 96 -0.163 -0.938 -13.563 1.00 24.24 N ATOM 1560 CA GLN A 96 0.665 -0.630 -14.768 1.00 74.33 C ATOM 1561 C GLN A 96 2.156 -0.733 -14.434 1.00 54.31 C ATOM 1562 O GLN A 96 2.543 -1.289 -13.424 1.00 24.02 O ATOM 1563 CB GLN A 96 0.305 0.808 -15.142 1.00 31.04 C ATOM 1564 CG GLN A 96 -1.132 0.860 -15.666 1.00 54.31 C ATOM 1565 CD GLN A 96 -1.661 2.291 -15.553 1.00 1.42 C ATOM 1566 OE1 GLN A 96 -1.081 3.210 -16.097 1.00 12.51 O ATOM 1567 NE2 GLN A 96 -2.746 2.522 -14.865 1.00 73.12 N ATOM 0 H GLN A 96 0.117 -0.456 -12.709 1.00 24.24 H new ATOM 0 HA GLN A 96 0.473 -1.327 -15.583 1.00 74.33 H new ATOM 0 HB2 GLN A 96 0.409 1.457 -14.273 1.00 31.04 H new ATOM 0 HB3 GLN A 96 0.993 1.180 -15.901 1.00 31.04 H new ATOM 0 HG2 GLN A 96 -1.165 0.529 -16.704 1.00 54.31 H new ATOM 0 HG3 GLN A 96 -1.764 0.180 -15.095 1.00 54.31 H new ATOM 0 HE21 GLN A 96 -3.234 1.752 -14.408 1.00 73.12 H new ATOM 0 HE22 GLN A 96 -3.106 3.473 -14.784 1.00 73.12 H new ATOM 1576 N HIS A 97 2.997 -0.196 -15.278 1.00 73.34 N ATOM 1577 CA HIS A 97 4.465 -0.256 -15.016 1.00 62.50 C ATOM 1578 C HIS A 97 5.035 1.162 -14.913 1.00 2.22 C ATOM 1579 O HIS A 97 5.984 1.511 -15.589 1.00 1.15 O ATOM 1580 CB HIS A 97 5.055 -0.985 -16.222 1.00 61.01 C ATOM 1581 CG HIS A 97 6.484 -1.358 -15.935 1.00 62.11 C ATOM 1582 ND1 HIS A 97 7.470 -0.406 -15.731 1.00 20.11 N ATOM 1583 CD2 HIS A 97 7.108 -2.577 -15.819 1.00 52.42 C ATOM 1584 CE1 HIS A 97 8.624 -1.059 -15.505 1.00 13.53 C ATOM 1585 NE2 HIS A 97 8.460 -2.384 -15.547 1.00 14.24 N ATOM 0 H HIS A 97 2.730 0.282 -16.139 1.00 73.34 H new ATOM 0 HA HIS A 97 4.700 -0.765 -14.081 1.00 62.50 H new ATOM 0 HB2 HIS A 97 4.472 -1.879 -16.440 1.00 61.01 H new ATOM 0 HB3 HIS A 97 5.005 -0.348 -17.105 1.00 61.01 H new ATOM 0 HD1 HIS A 97 7.344 0.606 -15.749 1.00 20.11 H new ATOM 0 HD2 HIS A 97 6.624 -3.537 -15.923 1.00 52.42 H new ATOM 0 HE1 HIS A 97 9.568 -0.571 -15.313 1.00 13.53 H new ATOM 1593 N LEU A 98 4.464 1.982 -14.074 1.00 64.43 N ATOM 1594 CA LEU A 98 4.971 3.377 -13.927 1.00 72.43 C ATOM 1595 C LEU A 98 6.135 3.414 -12.934 1.00 31.22 C ATOM 1596 O LEU A 98 5.979 3.797 -11.792 1.00 53.11 O ATOM 1597 CB LEU A 98 3.782 4.174 -13.390 1.00 50.13 C ATOM 1598 CG LEU A 98 3.689 5.513 -14.125 1.00 33.24 C ATOM 1599 CD1 LEU A 98 2.749 5.377 -15.324 1.00 45.42 C ATOM 1600 CD2 LEU A 98 3.145 6.581 -13.171 1.00 54.32 C ATOM 0 H LEU A 98 3.667 1.746 -13.483 1.00 64.43 H new ATOM 0 HA LEU A 98 5.343 3.784 -14.867 1.00 72.43 H new ATOM 0 HB2 LEU A 98 2.860 3.608 -13.526 1.00 50.13 H new ATOM 0 HB3 LEU A 98 3.898 4.342 -12.319 1.00 50.13 H new ATOM 0 HG LEU A 98 4.680 5.804 -14.473 1.00 33.24 H new ATOM 0 HD11 LEU A 98 2.684 6.332 -15.846 1.00 45.42 H new ATOM 0 HD12 LEU A 98 3.134 4.617 -16.004 1.00 45.42 H new ATOM 0 HD13 LEU A 98 1.758 5.085 -14.978 1.00 45.42 H new ATOM 0 HD21 LEU A 98 3.078 7.535 -13.693 1.00 54.32 H new ATOM 0 HD22 LEU A 98 2.155 6.288 -12.823 1.00 54.32 H new ATOM 0 HD23 LEU A 98 3.815 6.681 -12.317 1.00 54.32 H new ATOM 1612 N SER A 99 7.305 3.020 -13.362 1.00 41.20 N ATOM 1613 CA SER A 99 8.480 3.034 -12.444 1.00 3.31 C ATOM 1614 C SER A 99 8.091 2.458 -11.079 1.00 75.30 C ATOM 1615 O SER A 99 7.143 1.711 -10.957 1.00 4.42 O ATOM 1616 CB SER A 99 8.863 4.505 -12.321 1.00 52.52 C ATOM 1617 OG SER A 99 7.853 5.192 -11.588 1.00 61.25 O ATOM 0 H SER A 99 7.497 2.689 -14.308 1.00 41.20 H new ATOM 0 HA SER A 99 9.307 2.429 -12.816 1.00 3.31 H new ATOM 0 HB2 SER A 99 9.825 4.602 -11.817 1.00 52.52 H new ATOM 0 HB3 SER A 99 8.976 4.948 -13.311 1.00 52.52 H new ATOM 0 HG SER A 99 7.216 4.543 -11.221 1.00 61.25 H new ATOM 1623 N VAL A 100 8.816 2.804 -10.049 1.00 74.32 N ATOM 1624 CA VAL A 100 8.484 2.273 -8.696 1.00 35.40 C ATOM 1625 C VAL A 100 7.840 3.374 -7.843 1.00 43.40 C ATOM 1626 O VAL A 100 8.358 4.466 -7.726 1.00 5.03 O ATOM 1627 CB VAL A 100 9.823 1.836 -8.098 1.00 72.31 C ATOM 1628 CG1 VAL A 100 10.612 3.065 -7.638 1.00 45.31 C ATOM 1629 CG2 VAL A 100 9.567 0.920 -6.900 1.00 4.35 C ATOM 0 H VAL A 100 9.621 3.429 -10.086 1.00 74.32 H new ATOM 0 HA VAL A 100 7.774 1.447 -8.737 1.00 35.40 H new ATOM 0 HB VAL A 100 10.398 1.302 -8.854 1.00 72.31 H new ATOM 0 HG11 VAL A 100 11.564 2.748 -7.213 1.00 45.31 H new ATOM 0 HG12 VAL A 100 10.795 3.720 -8.490 1.00 45.31 H new ATOM 0 HG13 VAL A 100 10.039 3.603 -6.883 1.00 45.31 H new ATOM 0 HG21 VAL A 100 10.519 0.607 -6.472 1.00 4.35 H new ATOM 0 HG22 VAL A 100 8.990 1.458 -6.148 1.00 4.35 H new ATOM 0 HG23 VAL A 100 9.009 0.042 -7.226 1.00 4.35 H new ATOM 1639 N MET A 101 6.711 3.093 -7.250 1.00 51.34 N ATOM 1640 CA MET A 101 6.034 4.121 -6.410 1.00 54.42 C ATOM 1641 C MET A 101 5.980 5.459 -7.155 1.00 13.24 C ATOM 1642 O MET A 101 6.342 5.551 -8.310 1.00 10.32 O ATOM 1643 CB MET A 101 6.902 4.243 -5.154 1.00 35.40 C ATOM 1644 CG MET A 101 6.016 4.588 -3.956 1.00 2.01 C ATOM 1645 SD MET A 101 6.879 5.769 -2.889 1.00 2.21 S ATOM 1646 CE MET A 101 6.076 5.301 -1.335 1.00 52.30 C ATOM 0 H MET A 101 6.229 2.196 -7.311 1.00 51.34 H new ATOM 0 HA MET A 101 5.007 3.847 -6.170 1.00 54.42 H new ATOM 0 HB2 MET A 101 7.431 3.308 -4.972 1.00 35.40 H new ATOM 0 HB3 MET A 101 7.659 5.015 -5.295 1.00 35.40 H new ATOM 0 HG2 MET A 101 5.072 5.013 -4.298 1.00 2.01 H new ATOM 0 HG3 MET A 101 5.775 3.684 -3.396 1.00 2.01 H new ATOM 0 HE1 MET A 101 6.466 5.916 -0.524 1.00 52.30 H new ATOM 0 HE2 MET A 101 5.000 5.454 -1.421 1.00 52.30 H new ATOM 0 HE3 MET A 101 6.278 4.251 -1.123 1.00 52.30 H new ATOM 1656 N GLY A 102 5.529 6.494 -6.500 1.00 61.41 N ATOM 1657 CA GLY A 102 5.452 7.823 -7.170 1.00 31.22 C ATOM 1658 C GLY A 102 4.831 7.666 -8.560 1.00 11.33 C ATOM 1659 O GLY A 102 5.520 7.452 -9.539 1.00 71.14 O ATOM 0 H GLY A 102 5.211 6.477 -5.531 1.00 61.41 H new ATOM 0 HA2 GLY A 102 4.855 8.509 -6.570 1.00 31.22 H new ATOM 0 HA3 GLY A 102 6.448 8.257 -7.253 1.00 31.22 H new ATOM 1663 N GLN A 103 3.534 7.775 -8.656 1.00 12.51 N ATOM 1664 CA GLN A 103 2.873 7.636 -9.984 1.00 15.03 C ATOM 1665 C GLN A 103 2.170 8.945 -10.361 1.00 73.42 C ATOM 1666 O GLN A 103 2.105 9.872 -9.580 1.00 1.24 O ATOM 1667 CB GLN A 103 1.852 6.509 -9.811 1.00 22.53 C ATOM 1668 CG GLN A 103 1.110 6.678 -8.486 1.00 44.52 C ATOM 1669 CD GLN A 103 1.737 5.769 -7.428 1.00 24.24 C ATOM 1670 OE1 GLN A 103 1.835 4.573 -7.620 1.00 52.41 O ATOM 1671 NE2 GLN A 103 2.171 6.286 -6.311 1.00 4.31 N ATOM 0 H GLN A 103 2.905 7.954 -7.874 1.00 12.51 H new ATOM 0 HA GLN A 103 3.587 7.415 -10.778 1.00 15.03 H new ATOM 0 HB2 GLN A 103 1.143 6.519 -10.639 1.00 22.53 H new ATOM 0 HB3 GLN A 103 2.356 5.543 -9.835 1.00 22.53 H new ATOM 0 HG2 GLN A 103 1.157 7.717 -8.161 1.00 44.52 H new ATOM 0 HG3 GLN A 103 0.056 6.431 -8.614 1.00 44.52 H new ATOM 0 HE21 GLN A 103 2.090 7.290 -6.148 1.00 4.31 H new ATOM 0 HE22 GLN A 103 2.592 5.686 -5.601 1.00 4.31 H new ATOM 1680 N LYS A 104 1.648 9.028 -11.554 1.00 1.20 N ATOM 1681 CA LYS A 104 0.960 10.280 -11.978 1.00 44.41 C ATOM 1682 C LYS A 104 -0.552 10.054 -12.078 1.00 22.13 C ATOM 1683 O LYS A 104 -1.015 8.944 -12.243 1.00 42.22 O ATOM 1684 CB LYS A 104 1.544 10.607 -13.352 1.00 21.43 C ATOM 1685 CG LYS A 104 2.696 11.602 -13.193 1.00 31.14 C ATOM 1686 CD LYS A 104 3.493 11.672 -14.497 1.00 74.52 C ATOM 1687 CE LYS A 104 4.430 12.882 -14.456 1.00 1.14 C ATOM 1688 NZ LYS A 104 5.166 12.756 -13.168 1.00 34.42 N ATOM 0 H LYS A 104 1.668 8.285 -12.252 1.00 1.20 H new ATOM 0 HA LYS A 104 1.110 11.091 -11.265 1.00 44.41 H new ATOM 0 HB2 LYS A 104 1.900 9.696 -13.834 1.00 21.43 H new ATOM 0 HB3 LYS A 104 0.772 11.028 -13.996 1.00 21.43 H new ATOM 0 HG2 LYS A 104 2.307 12.588 -12.939 1.00 31.14 H new ATOM 0 HG3 LYS A 104 3.346 11.295 -12.373 1.00 31.14 H new ATOM 0 HD2 LYS A 104 4.069 10.757 -14.634 1.00 74.52 H new ATOM 0 HD3 LYS A 104 2.815 11.752 -15.347 1.00 74.52 H new ATOM 0 HE2 LYS A 104 5.115 12.880 -15.304 1.00 1.14 H new ATOM 0 HE3 LYS A 104 3.870 13.816 -14.501 1.00 1.14 H new ATOM 0 HZ1 LYS A 104 6.077 13.252 -13.239 1.00 34.42 H new ATOM 0 HZ2 LYS A 104 4.601 13.177 -12.403 1.00 34.42 H new ATOM 0 HZ3 LYS A 104 5.335 11.751 -12.961 1.00 34.42 H new ATOM 1702 N THR A 105 -1.322 11.103 -11.983 1.00 22.34 N ATOM 1703 CA THR A 105 -2.803 10.958 -12.076 1.00 11.43 C ATOM 1704 C THR A 105 -3.361 11.957 -13.091 1.00 22.11 C ATOM 1705 O THR A 105 -2.813 13.023 -13.291 1.00 64.34 O ATOM 1706 CB THR A 105 -3.321 11.270 -10.672 1.00 30.22 C ATOM 1707 OG1 THR A 105 -2.839 12.544 -10.265 1.00 51.41 O ATOM 1708 CG2 THR A 105 -2.830 10.201 -9.696 1.00 11.41 C ATOM 0 H THR A 105 -0.989 12.057 -11.845 1.00 22.34 H new ATOM 0 HA THR A 105 -3.105 9.964 -12.406 1.00 11.43 H new ATOM 0 HB THR A 105 -4.411 11.278 -10.679 1.00 30.22 H new ATOM 0 HG1 THR A 105 -3.171 12.747 -9.366 1.00 51.41 H new ATOM 0 HG21 THR A 105 -3.200 10.424 -8.695 1.00 11.41 H new ATOM 0 HG22 THR A 105 -3.199 9.225 -10.010 1.00 11.41 H new ATOM 0 HG23 THR A 105 -1.740 10.191 -9.686 1.00 11.41 H new ATOM 1716 N ASP A 106 -4.445 11.622 -13.737 1.00 11.04 N ATOM 1717 CA ASP A 106 -5.027 12.560 -14.740 1.00 72.04 C ATOM 1718 C ASP A 106 -6.518 12.273 -14.938 1.00 34.31 C ATOM 1719 O ASP A 106 -7.034 11.274 -14.480 1.00 22.34 O ATOM 1720 CB ASP A 106 -4.253 12.285 -16.031 1.00 62.33 C ATOM 1721 CG ASP A 106 -4.241 10.781 -16.307 1.00 71.14 C ATOM 1722 OD1 ASP A 106 -4.999 10.073 -15.663 1.00 74.32 O ATOM 1723 OD2 ASP A 106 -3.475 10.359 -17.158 1.00 20.12 O ATOM 0 H ASP A 106 -4.951 10.745 -13.615 1.00 11.04 H new ATOM 0 HA ASP A 106 -4.946 13.601 -14.426 1.00 72.04 H new ATOM 0 HB2 ASP A 106 -4.714 12.815 -16.864 1.00 62.33 H new ATOM 0 HB3 ASP A 106 -3.232 12.658 -15.942 1.00 62.33 H new ATOM 1728 N ASP A 107 -7.207 13.144 -15.622 1.00 34.25 N ATOM 1729 CA ASP A 107 -8.664 12.925 -15.856 1.00 5.40 C ATOM 1730 C ASP A 107 -9.004 13.195 -17.323 1.00 63.23 C ATOM 1731 O ASP A 107 -9.832 12.527 -17.910 1.00 11.00 O ATOM 1732 CB ASP A 107 -9.366 13.934 -14.946 1.00 51.31 C ATOM 1733 CG ASP A 107 -9.195 15.342 -15.519 1.00 64.33 C ATOM 1734 OD1 ASP A 107 -8.069 15.810 -15.564 1.00 1.30 O ATOM 1735 OD2 ASP A 107 -10.194 15.927 -15.904 1.00 25.31 O ATOM 0 H ASP A 107 -6.825 13.998 -16.029 1.00 34.25 H new ATOM 0 HA ASP A 107 -8.971 11.902 -15.641 1.00 5.40 H new ATOM 0 HB2 ASP A 107 -10.425 13.690 -14.863 1.00 51.31 H new ATOM 0 HB3 ASP A 107 -8.948 13.886 -13.941 1.00 51.31 H new ATOM 1740 N THR A 108 -8.370 14.167 -17.918 1.00 23.41 N ATOM 1741 CA THR A 108 -8.659 14.475 -19.347 1.00 32.22 C ATOM 1742 C THR A 108 -8.252 13.295 -20.233 1.00 34.43 C ATOM 1743 O THR A 108 -7.090 12.959 -20.341 1.00 72.21 O ATOM 1744 CB THR A 108 -7.808 15.705 -19.669 1.00 10.42 C ATOM 1745 OG1 THR A 108 -7.714 16.528 -18.515 1.00 54.22 O ATOM 1746 CG2 THR A 108 -8.459 16.492 -20.810 1.00 0.25 C ATOM 0 H THR A 108 -7.666 14.760 -17.478 1.00 23.41 H new ATOM 0 HA THR A 108 -9.719 14.656 -19.524 1.00 32.22 H new ATOM 0 HB THR A 108 -6.810 15.389 -19.972 1.00 10.42 H new ATOM 0 HG1 THR A 108 -7.168 17.316 -18.719 1.00 54.22 H new ATOM 0 HG21 THR A 108 -7.853 17.368 -21.040 1.00 0.25 H new ATOM 0 HG22 THR A 108 -8.531 15.859 -21.694 1.00 0.25 H new ATOM 0 HG23 THR A 108 -9.457 16.810 -20.509 1.00 0.25 H new ATOM 1754 N ASN A 109 -9.202 12.666 -20.867 1.00 63.33 N ATOM 1755 CA ASN A 109 -8.872 11.508 -21.746 1.00 41.32 C ATOM 1756 C ASN A 109 -9.899 11.401 -22.877 1.00 3.24 C ATOM 1757 O ASN A 109 -11.047 11.767 -22.722 1.00 64.34 O ATOM 1758 CB ASN A 109 -8.949 10.284 -20.831 1.00 51.05 C ATOM 1759 CG ASN A 109 -8.510 9.039 -21.604 1.00 51.12 C ATOM 1760 OD1 ASN A 109 -9.228 8.555 -22.456 1.00 23.12 O ATOM 1761 ND2 ASN A 109 -7.352 8.496 -21.343 1.00 13.24 N ATOM 0 H ASN A 109 -10.193 12.903 -20.815 1.00 63.33 H new ATOM 0 HA ASN A 109 -7.892 11.605 -22.213 1.00 41.32 H new ATOM 0 HB2 ASN A 109 -8.310 10.428 -19.960 1.00 51.05 H new ATOM 0 HB3 ASN A 109 -9.967 10.156 -20.463 1.00 51.05 H new ATOM 0 HD21 ASN A 109 -7.051 7.666 -21.854 1.00 13.24 H new ATOM 0 HD22 ASN A 109 -6.748 8.901 -20.628 1.00 13.24 H new ATOM 1768 N LYS A 110 -9.495 10.907 -24.014 1.00 44.20 N ATOM 1769 CA LYS A 110 -10.452 10.782 -25.153 1.00 2.14 C ATOM 1770 C LYS A 110 -9.846 9.924 -26.266 1.00 1.03 C ATOM 1771 O LYS A 110 -8.661 9.640 -26.192 1.00 44.51 O ATOM 1772 CB LYS A 110 -10.672 12.216 -25.639 1.00 14.04 C ATOM 1773 CG LYS A 110 -9.347 12.794 -26.139 1.00 33.52 C ATOM 1774 CD LYS A 110 -9.601 13.655 -27.378 1.00 31.43 C ATOM 1775 CE LYS A 110 -8.509 14.721 -27.496 1.00 61.33 C ATOM 1776 NZ LYS A 110 -7.906 14.505 -28.840 1.00 74.15 N ATOM 0 H LYS A 110 -8.546 10.585 -24.205 1.00 44.20 H new ATOM 0 HA LYS A 110 -11.385 10.301 -24.859 1.00 2.14 H new ATOM 0 HB2 LYS A 110 -11.412 12.231 -26.439 1.00 14.04 H new ATOM 0 HB3 LYS A 110 -11.066 12.830 -24.829 1.00 14.04 H new ATOM 0 HG2 LYS A 110 -8.881 13.393 -25.356 1.00 33.52 H new ATOM 0 HG3 LYS A 110 -8.654 11.988 -26.379 1.00 33.52 H new ATOM 0 HD2 LYS A 110 -9.611 13.030 -28.271 1.00 31.43 H new ATOM 0 HD3 LYS A 110 -10.580 14.129 -27.309 1.00 31.43 H new ATOM 0 HE2 LYS A 110 -8.925 15.724 -27.406 1.00 61.33 H new ATOM 0 HE3 LYS A 110 -7.765 14.613 -26.707 1.00 61.33 H new ATOM 0 HZ1 LYS A 110 -7.147 15.199 -28.996 1.00 74.15 H new ATOM 0 HZ2 LYS A 110 -7.512 13.544 -28.893 1.00 74.15 H new ATOM 0 HZ3 LYS A 110 -8.637 14.621 -29.571 1.00 74.15 H new TER 1790 LYS A 110