USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 705 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 36 ASN : amide:sc= -1.21! C(o=-1.2!,f=-4.7!) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 121:sc= 1.27 USER MOD Single : A 58 LYS NZ :NH3+ -149:sc= 1.19 (180deg=0.822) USER MOD Single : A 61 LYS NZ :NH3+ -128:sc= -0.0371 (180deg=-0.383) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -7.35! C(o=-7.4!,f=-19!) USER MOD Single : A 66 SER OG : rot 60:sc= 0.00242 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -114:sc= -1.89! (180deg=-4.11!) USER MOD Single : A 100 SER OG : rot -149:sc= -4! USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -18.1! C(o=-18!,f=-21!) USER MOD Single : A 109 SER OG : rot -91:sc= 1.4 USER MOD Single : A 110 SER OG : rot -26:sc= -3.32! USER MOD Single : A 111 THR OG1 : rot -9:sc= -3.41! USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 180:sc= -4.43! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot -13:sc= 0.599 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.259 USER MOD Single : A 126 SER OG : rot -90:sc= -2.25! USER MOD ----------------------------------------------------------------- ATOM 12 N ASN A 36 -1.278 -17.000 -8.170 1.00 0.00 N ATOM 13 CA ASN A 36 -1.051 -15.973 -7.114 1.00 0.00 C ATOM 14 C ASN A 36 -0.325 -14.762 -7.697 1.00 0.00 C ATOM 15 O ASN A 36 -0.653 -13.627 -7.412 1.00 0.00 O ATOM 16 CB ASN A 36 -0.173 -16.665 -6.073 1.00 0.00 C ATOM 17 CG ASN A 36 1.180 -17.020 -6.692 1.00 0.00 C ATOM 18 OD1 ASN A 36 1.259 -17.341 -7.862 1.00 0.00 O ATOM 19 ND2 ASN A 36 2.255 -16.974 -5.955 1.00 0.00 N ATOM 0 HA ASN A 36 -1.986 -15.609 -6.688 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -0.030 -16.012 -5.212 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -0.665 -17.567 -5.710 1.00 0.00 H new ATOM 0 HD21 ASN A 36 3.162 -17.207 -6.360 1.00 0.00 H new ATOM 0 HD22 ASN A 36 2.189 -16.705 -4.973 1.00 0.00 H new ATOM 26 N ALA A 37 0.667 -15.003 -8.501 1.00 0.00 N ATOM 27 CA ALA A 37 1.436 -13.894 -9.105 1.00 0.00 C ATOM 28 C ALA A 37 0.511 -12.745 -9.516 1.00 0.00 C ATOM 29 O ALA A 37 -0.522 -12.951 -10.122 1.00 0.00 O ATOM 30 CB ALA A 37 2.103 -14.518 -10.325 1.00 0.00 C ATOM 0 H ALA A 37 0.980 -15.937 -8.767 1.00 0.00 H new ATOM 0 HA ALA A 37 2.158 -13.464 -8.411 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.699 -13.764 -10.839 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.749 -15.337 -10.008 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.339 -14.900 -11.002 1.00 0.00 H new ATOM 36 N VAL A 38 0.878 -11.535 -9.193 1.00 0.00 N ATOM 37 CA VAL A 38 0.026 -10.368 -9.566 1.00 0.00 C ATOM 38 C VAL A 38 0.914 -9.195 -9.994 1.00 0.00 C ATOM 39 O VAL A 38 2.044 -9.077 -9.564 1.00 0.00 O ATOM 40 CB VAL A 38 -0.752 -10.025 -8.295 1.00 0.00 C ATOM 41 CG1 VAL A 38 0.228 -9.749 -7.153 1.00 0.00 C ATOM 42 CG2 VAL A 38 -1.609 -8.783 -8.543 1.00 0.00 C ATOM 0 H VAL A 38 1.732 -11.303 -8.686 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.642 -10.584 -10.400 1.00 0.00 H new ATOM 0 HB VAL A 38 -1.395 -10.863 -8.026 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.328 -9.505 -6.248 1.00 0.00 H new ATOM 0 HG12 VAL A 38 0.839 -10.634 -6.976 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.872 -8.911 -7.421 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -2.164 -8.537 -7.638 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.966 -7.945 -8.813 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.309 -8.980 -9.355 1.00 0.00 H new ATOM 52 N VAL A 39 0.423 -8.328 -10.839 1.00 0.00 N ATOM 53 CA VAL A 39 1.266 -7.178 -11.282 1.00 0.00 C ATOM 54 C VAL A 39 0.688 -5.847 -10.809 1.00 0.00 C ATOM 55 O VAL A 39 -0.493 -5.587 -10.936 1.00 0.00 O ATOM 56 CB VAL A 39 1.253 -7.210 -12.814 1.00 0.00 C ATOM 57 CG1 VAL A 39 -0.170 -6.958 -13.324 1.00 0.00 C ATOM 58 CG2 VAL A 39 2.168 -6.102 -13.349 1.00 0.00 C ATOM 0 H VAL A 39 -0.515 -8.364 -11.238 1.00 0.00 H new ATOM 0 HA VAL A 39 2.270 -7.263 -10.867 1.00 0.00 H new ATOM 0 HB VAL A 39 1.600 -8.185 -13.156 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.175 -6.981 -14.414 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.836 -7.731 -12.941 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.512 -5.982 -12.980 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.163 -6.120 -14.439 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.809 -5.134 -13.000 1.00 0.00 H new ATOM 0 HG23 VAL A 39 3.184 -6.263 -12.989 1.00 0.00 H new ATOM 68 N LEU A 40 1.524 -4.979 -10.320 1.00 0.00 N ATOM 69 CA LEU A 40 1.043 -3.637 -9.906 1.00 0.00 C ATOM 70 C LEU A 40 1.413 -2.690 -11.045 1.00 0.00 C ATOM 71 O LEU A 40 2.410 -2.887 -11.713 1.00 0.00 O ATOM 72 CB LEU A 40 1.808 -3.311 -8.614 1.00 0.00 C ATOM 73 CG LEU A 40 1.970 -1.794 -8.456 1.00 0.00 C ATOM 74 CD1 LEU A 40 0.631 -1.171 -8.056 1.00 0.00 C ATOM 75 CD2 LEU A 40 3.006 -1.507 -7.366 1.00 0.00 C ATOM 0 H LEU A 40 2.522 -5.142 -10.189 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.029 -3.565 -9.721 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.274 -3.717 -7.755 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.788 -3.788 -8.634 1.00 0.00 H new ATOM 0 HG LEU A 40 2.300 -1.365 -9.402 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.750 -0.093 -7.945 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.111 -1.376 -8.828 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.299 -1.599 -7.110 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.124 -0.430 -7.251 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.671 -1.938 -6.423 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.962 -1.949 -7.647 1.00 0.00 H new ATOM 87 N VAL A 41 0.628 -1.698 -11.317 1.00 0.00 N ATOM 88 CA VAL A 41 0.975 -0.813 -12.461 1.00 0.00 C ATOM 89 C VAL A 41 0.719 0.653 -12.127 1.00 0.00 C ATOM 90 O VAL A 41 -0.382 1.046 -11.821 1.00 0.00 O ATOM 91 CB VAL A 41 0.056 -1.306 -13.585 1.00 0.00 C ATOM 92 CG1 VAL A 41 -0.309 -0.167 -14.538 1.00 0.00 C ATOM 93 CG2 VAL A 41 0.764 -2.423 -14.358 1.00 0.00 C ATOM 0 H VAL A 41 -0.225 -1.459 -10.811 1.00 0.00 H new ATOM 0 HA VAL A 41 2.030 -0.860 -12.730 1.00 0.00 H new ATOM 0 HB VAL A 41 -0.866 -1.684 -13.143 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -0.961 -0.546 -15.325 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.825 0.618 -13.986 1.00 0.00 H new ATOM 0 HG13 VAL A 41 0.599 0.240 -14.984 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.116 -2.778 -15.159 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.691 -2.039 -14.784 1.00 0.00 H new ATOM 0 HG23 VAL A 41 0.990 -3.247 -13.681 1.00 0.00 H new ATOM 103 N LEU A 42 1.732 1.469 -12.203 1.00 0.00 N ATOM 104 CA LEU A 42 1.551 2.901 -11.921 1.00 0.00 C ATOM 105 C LEU A 42 2.240 3.722 -13.017 1.00 0.00 C ATOM 106 O LEU A 42 3.189 3.274 -13.630 1.00 0.00 O ATOM 107 CB LEU A 42 2.221 3.151 -10.570 1.00 0.00 C ATOM 108 CG LEU A 42 1.185 3.154 -9.442 1.00 0.00 C ATOM 109 CD1 LEU A 42 0.193 4.297 -9.657 1.00 0.00 C ATOM 110 CD2 LEU A 42 0.436 1.822 -9.417 1.00 0.00 C ATOM 0 H LEU A 42 2.682 1.194 -12.451 1.00 0.00 H new ATOM 0 HA LEU A 42 0.499 3.187 -11.897 1.00 0.00 H new ATOM 0 HB2 LEU A 42 2.968 2.380 -10.381 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.746 4.106 -10.590 1.00 0.00 H new ATOM 0 HG LEU A 42 1.697 3.293 -8.490 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -0.543 4.296 -8.853 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.727 5.247 -9.659 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -0.314 4.164 -10.613 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.299 1.833 -8.612 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.072 1.672 -10.370 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.144 1.010 -9.251 1.00 0.00 H new ATOM 122 N MET A 43 1.782 4.917 -13.273 1.00 0.00 N ATOM 123 CA MET A 43 2.434 5.745 -14.331 1.00 0.00 C ATOM 124 C MET A 43 3.763 6.301 -13.807 1.00 0.00 C ATOM 125 O MET A 43 3.946 6.468 -12.621 1.00 0.00 O ATOM 126 CB MET A 43 1.447 6.879 -14.622 1.00 0.00 C ATOM 127 CG MET A 43 1.512 7.919 -13.502 1.00 0.00 C ATOM 128 SD MET A 43 0.378 9.279 -13.875 1.00 0.00 S ATOM 129 CE MET A 43 1.598 10.397 -14.607 1.00 0.00 C ATOM 0 H MET A 43 0.991 5.354 -12.800 1.00 0.00 H new ATOM 0 HA MET A 43 2.658 5.171 -15.230 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.685 7.345 -15.578 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.435 6.482 -14.704 1.00 0.00 H new ATOM 0 HG2 MET A 43 1.246 7.460 -12.550 1.00 0.00 H new ATOM 0 HG3 MET A 43 2.529 8.297 -13.401 1.00 0.00 H new ATOM 0 HE1 MET A 43 1.107 11.320 -14.915 1.00 0.00 H new ATOM 0 HE2 MET A 43 2.370 10.625 -13.872 1.00 0.00 H new ATOM 0 HE3 MET A 43 2.053 9.921 -15.475 1.00 0.00 H new ATOM 139 N LYS A 44 4.692 6.582 -14.676 1.00 0.00 N ATOM 140 CA LYS A 44 6.005 7.113 -14.206 1.00 0.00 C ATOM 141 C LYS A 44 5.805 8.210 -13.152 1.00 0.00 C ATOM 142 O LYS A 44 5.141 9.200 -13.381 1.00 0.00 O ATOM 143 CB LYS A 44 6.692 7.674 -15.455 1.00 0.00 C ATOM 144 CG LYS A 44 5.807 8.734 -16.114 1.00 0.00 C ATOM 145 CD LYS A 44 6.605 9.447 -17.206 1.00 0.00 C ATOM 146 CE LYS A 44 7.593 10.423 -16.563 1.00 0.00 C ATOM 147 NZ LYS A 44 8.681 10.587 -17.567 1.00 0.00 N ATOM 0 H LYS A 44 4.602 6.469 -15.686 1.00 0.00 H new ATOM 0 HA LYS A 44 6.606 6.337 -13.732 1.00 0.00 H new ATOM 0 HB2 LYS A 44 7.654 8.110 -15.185 1.00 0.00 H new ATOM 0 HB3 LYS A 44 6.894 6.868 -16.161 1.00 0.00 H new ATOM 0 HG2 LYS A 44 4.919 8.269 -16.541 1.00 0.00 H new ATOM 0 HG3 LYS A 44 5.464 9.453 -15.370 1.00 0.00 H new ATOM 0 HD2 LYS A 44 7.141 8.718 -17.814 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.930 9.983 -17.873 1.00 0.00 H new ATOM 0 HE2 LYS A 44 7.116 11.377 -16.339 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.980 10.031 -15.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 9.398 11.244 -17.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 9.121 9.664 -17.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 8.284 10.968 -18.450 1.00 0.00 H new ATOM 161 N SER A 45 6.384 8.037 -11.996 1.00 0.00 N ATOM 162 CA SER A 45 6.243 9.067 -10.929 1.00 0.00 C ATOM 163 C SER A 45 7.500 9.943 -10.891 1.00 0.00 C ATOM 164 O SER A 45 7.559 10.985 -11.515 1.00 0.00 O ATOM 165 CB SER A 45 6.096 8.277 -9.629 1.00 0.00 C ATOM 166 OG SER A 45 4.769 7.774 -9.533 1.00 0.00 O ATOM 0 H SER A 45 6.949 7.226 -11.744 1.00 0.00 H new ATOM 0 HA SER A 45 5.393 9.728 -11.094 1.00 0.00 H new ATOM 0 HB2 SER A 45 6.811 7.455 -9.606 1.00 0.00 H new ATOM 0 HB3 SER A 45 6.318 8.916 -8.774 1.00 0.00 H new ATOM 0 HG SER A 45 4.794 6.796 -9.469 1.00 0.00 H new ATOM 172 N ASP A 46 8.508 9.527 -10.171 1.00 0.00 N ATOM 173 CA ASP A 46 9.758 10.340 -10.109 1.00 0.00 C ATOM 174 C ASP A 46 10.957 9.472 -9.699 1.00 0.00 C ATOM 175 O ASP A 46 11.757 9.073 -10.522 1.00 0.00 O ATOM 176 CB ASP A 46 9.482 11.406 -9.049 1.00 0.00 C ATOM 177 CG ASP A 46 8.988 12.686 -9.727 1.00 0.00 C ATOM 178 OD1 ASP A 46 9.461 12.977 -10.814 1.00 0.00 O ATOM 179 OD2 ASP A 46 8.145 13.352 -9.150 1.00 0.00 O ATOM 0 H ASP A 46 8.521 8.665 -9.626 1.00 0.00 H new ATOM 0 HA ASP A 46 10.008 10.774 -11.077 1.00 0.00 H new ATOM 0 HB2 ASP A 46 8.735 11.045 -8.342 1.00 0.00 H new ATOM 0 HB3 ASP A 46 10.388 11.610 -8.479 1.00 0.00 H new ATOM 184 N GLU A 47 11.090 9.190 -8.432 1.00 0.00 N ATOM 185 CA GLU A 47 12.238 8.364 -7.955 1.00 0.00 C ATOM 186 C GLU A 47 11.818 6.906 -7.809 1.00 0.00 C ATOM 187 O GLU A 47 12.201 6.242 -6.877 1.00 0.00 O ATOM 188 CB GLU A 47 12.603 8.947 -6.589 1.00 0.00 C ATOM 189 CG GLU A 47 12.591 10.471 -6.672 1.00 0.00 C ATOM 190 CD GLU A 47 13.904 11.024 -6.111 1.00 0.00 C ATOM 191 OE1 GLU A 47 14.163 10.805 -4.939 1.00 0.00 O ATOM 192 OE2 GLU A 47 14.627 11.656 -6.864 1.00 0.00 O ATOM 0 H GLU A 47 10.449 9.498 -7.701 1.00 0.00 H new ATOM 0 HA GLU A 47 13.076 8.387 -8.651 1.00 0.00 H new ATOM 0 HB2 GLU A 47 11.894 8.607 -5.834 1.00 0.00 H new ATOM 0 HB3 GLU A 47 13.588 8.596 -6.282 1.00 0.00 H new ATOM 0 HG2 GLU A 47 12.463 10.788 -7.707 1.00 0.00 H new ATOM 0 HG3 GLU A 47 11.747 10.870 -6.110 1.00 0.00 H new ATOM 199 N ILE A 48 11.023 6.407 -8.707 1.00 0.00 N ATOM 200 CA ILE A 48 10.566 5.006 -8.600 1.00 0.00 C ATOM 201 C ILE A 48 11.726 4.054 -8.448 1.00 0.00 C ATOM 202 O ILE A 48 11.929 3.466 -7.409 1.00 0.00 O ATOM 203 CB ILE A 48 9.786 4.731 -9.851 1.00 0.00 C ATOM 204 CG1 ILE A 48 10.312 5.513 -11.055 1.00 0.00 C ATOM 205 CG2 ILE A 48 8.353 5.119 -9.554 1.00 0.00 C ATOM 206 CD1 ILE A 48 9.376 6.680 -11.325 1.00 0.00 C ATOM 0 H ILE A 48 10.669 6.917 -9.516 1.00 0.00 H new ATOM 0 HA ILE A 48 9.951 4.859 -7.712 1.00 0.00 H new ATOM 0 HB ILE A 48 9.877 3.679 -10.120 1.00 0.00 H new ATOM 0 HG12 ILE A 48 11.321 5.876 -10.859 1.00 0.00 H new ATOM 0 HG13 ILE A 48 10.371 4.865 -11.930 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.737 4.939 -10.435 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.979 4.522 -8.722 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.309 6.176 -9.291 1.00 0.00 H new ATOM 0 HD11 ILE A 48 9.739 7.247 -12.182 1.00 0.00 H new ATOM 0 HD12 ILE A 48 8.376 6.303 -11.537 1.00 0.00 H new ATOM 0 HD13 ILE A 48 9.341 7.328 -10.449 1.00 0.00 H new ATOM 218 N ASP A 49 12.488 3.889 -9.468 1.00 0.00 N ATOM 219 CA ASP A 49 13.651 2.961 -9.361 1.00 0.00 C ATOM 220 C ASP A 49 14.323 3.155 -7.995 1.00 0.00 C ATOM 221 O ASP A 49 14.774 2.216 -7.367 1.00 0.00 O ATOM 222 CB ASP A 49 14.600 3.356 -10.494 1.00 0.00 C ATOM 223 CG ASP A 49 14.406 2.408 -11.679 1.00 0.00 C ATOM 224 OD1 ASP A 49 13.467 1.631 -11.645 1.00 0.00 O ATOM 225 OD2 ASP A 49 15.203 2.476 -12.601 1.00 0.00 O ATOM 0 H ASP A 49 12.370 4.346 -10.372 1.00 0.00 H new ATOM 0 HA ASP A 49 13.361 1.913 -9.442 1.00 0.00 H new ATOM 0 HB2 ASP A 49 14.407 4.384 -10.802 1.00 0.00 H new ATOM 0 HB3 ASP A 49 15.633 3.315 -10.148 1.00 0.00 H new ATOM 230 N ALA A 50 14.354 4.374 -7.522 1.00 0.00 N ATOM 231 CA ALA A 50 14.960 4.646 -6.188 1.00 0.00 C ATOM 232 C ALA A 50 13.990 4.242 -5.086 1.00 0.00 C ATOM 233 O ALA A 50 14.347 3.521 -4.176 1.00 0.00 O ATOM 234 CB ALA A 50 15.220 6.155 -6.162 1.00 0.00 C ATOM 0 H ALA A 50 13.985 5.193 -8.004 1.00 0.00 H new ATOM 0 HA ALA A 50 15.878 4.081 -6.026 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.667 6.431 -5.207 1.00 0.00 H new ATOM 0 HB2 ALA A 50 15.900 6.421 -6.971 1.00 0.00 H new ATOM 0 HB3 ALA A 50 14.278 6.689 -6.289 1.00 0.00 H new ATOM 240 N ILE A 51 12.762 4.676 -5.153 1.00 0.00 N ATOM 241 CA ILE A 51 11.813 4.290 -4.119 1.00 0.00 C ATOM 242 C ILE A 51 11.427 2.827 -4.309 1.00 0.00 C ATOM 243 O ILE A 51 11.547 2.066 -3.401 1.00 0.00 O ATOM 244 CB ILE A 51 10.648 5.231 -4.308 1.00 0.00 C ATOM 245 CG1 ILE A 51 10.052 5.066 -5.688 1.00 0.00 C ATOM 246 CG2 ILE A 51 11.113 6.680 -4.118 1.00 0.00 C ATOM 247 CD1 ILE A 51 9.438 6.390 -6.168 1.00 0.00 C ATOM 0 H ILE A 51 12.392 5.281 -5.886 1.00 0.00 H new ATOM 0 HA ILE A 51 12.207 4.365 -3.105 1.00 0.00 H new ATOM 0 HB ILE A 51 9.886 4.993 -3.566 1.00 0.00 H new ATOM 0 HG12 ILE A 51 10.822 4.740 -6.387 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.288 4.289 -5.671 1.00 0.00 H new ATOM 0 HG21 ILE A 51 10.268 7.354 -4.256 1.00 0.00 H new ATOM 0 HG22 ILE A 51 11.516 6.804 -3.113 1.00 0.00 H new ATOM 0 HG23 ILE A 51 11.886 6.913 -4.850 1.00 0.00 H new ATOM 0 HD11 ILE A 51 9.013 6.255 -7.163 1.00 0.00 H new ATOM 0 HD12 ILE A 51 8.653 6.699 -5.477 1.00 0.00 H new ATOM 0 HD13 ILE A 51 10.211 7.157 -6.205 1.00 0.00 H new ATOM 259 N ILE A 52 11.024 2.392 -5.475 1.00 0.00 N ATOM 260 CA ILE A 52 10.711 0.939 -5.620 1.00 0.00 C ATOM 261 C ILE A 52 11.850 0.145 -5.000 1.00 0.00 C ATOM 262 O ILE A 52 11.657 -0.834 -4.315 1.00 0.00 O ATOM 263 CB ILE A 52 10.657 0.674 -7.108 1.00 0.00 C ATOM 264 CG1 ILE A 52 9.523 1.481 -7.736 1.00 0.00 C ATOM 265 CG2 ILE A 52 10.421 -0.817 -7.334 1.00 0.00 C ATOM 266 CD1 ILE A 52 8.191 1.073 -7.102 1.00 0.00 C ATOM 0 H ILE A 52 10.900 2.962 -6.312 1.00 0.00 H new ATOM 0 HA ILE A 52 9.776 0.660 -5.135 1.00 0.00 H new ATOM 0 HB ILE A 52 11.597 0.972 -7.571 1.00 0.00 H new ATOM 0 HG12 ILE A 52 9.696 2.547 -7.588 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.493 1.309 -8.812 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.380 -1.021 -8.404 1.00 0.00 H new ATOM 0 HG22 ILE A 52 11.236 -1.386 -6.887 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.478 -1.110 -6.872 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.382 1.650 -7.551 1.00 0.00 H new ATOM 0 HD12 ILE A 52 8.017 0.011 -7.273 1.00 0.00 H new ATOM 0 HD13 ILE A 52 8.224 1.268 -6.030 1.00 0.00 H new ATOM 278 N GLU A 53 13.047 0.582 -5.224 1.00 0.00 N ATOM 279 CA GLU A 53 14.201 -0.130 -4.640 1.00 0.00 C ATOM 280 C GLU A 53 14.113 -0.128 -3.111 1.00 0.00 C ATOM 281 O GLU A 53 14.030 -1.169 -2.490 1.00 0.00 O ATOM 282 CB GLU A 53 15.422 0.655 -5.109 1.00 0.00 C ATOM 283 CG GLU A 53 16.681 0.098 -4.437 1.00 0.00 C ATOM 284 CD GLU A 53 17.923 0.734 -5.065 1.00 0.00 C ATOM 285 OE1 GLU A 53 17.821 1.205 -6.187 1.00 0.00 O ATOM 286 OE2 GLU A 53 18.955 0.739 -4.415 1.00 0.00 O ATOM 0 H GLU A 53 13.276 1.402 -5.786 1.00 0.00 H new ATOM 0 HA GLU A 53 14.241 -1.174 -4.949 1.00 0.00 H new ATOM 0 HB2 GLU A 53 15.516 0.587 -6.193 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.304 1.711 -4.865 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.656 0.305 -3.367 1.00 0.00 H new ATOM 0 HG3 GLU A 53 16.718 -0.985 -4.552 1.00 0.00 H new ATOM 293 N ASP A 54 14.130 1.027 -2.498 1.00 0.00 N ATOM 294 CA ASP A 54 14.073 1.069 -0.998 1.00 0.00 C ATOM 295 C ASP A 54 12.637 0.989 -0.486 1.00 0.00 C ATOM 296 O ASP A 54 12.392 0.856 0.696 1.00 0.00 O ATOM 297 CB ASP A 54 14.692 2.406 -0.621 1.00 0.00 C ATOM 298 CG ASP A 54 15.372 2.286 0.744 1.00 0.00 C ATOM 299 OD1 ASP A 54 16.113 1.334 0.934 1.00 0.00 O ATOM 300 OD2 ASP A 54 15.143 3.148 1.577 1.00 0.00 O ATOM 0 H ASP A 54 14.180 1.935 -2.960 1.00 0.00 H new ATOM 0 HA ASP A 54 14.599 0.222 -0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 54 15.418 2.708 -1.376 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.924 3.179 -0.590 1.00 0.00 H new ATOM 305 N ILE A 55 11.695 1.083 -1.365 1.00 0.00 N ATOM 306 CA ILE A 55 10.267 1.032 -0.958 1.00 0.00 C ATOM 307 C ILE A 55 9.655 -0.307 -1.359 1.00 0.00 C ATOM 308 O ILE A 55 8.757 -0.816 -0.718 1.00 0.00 O ATOM 309 CB ILE A 55 9.616 2.190 -1.724 1.00 0.00 C ATOM 310 CG1 ILE A 55 8.463 2.767 -0.922 1.00 0.00 C ATOM 311 CG2 ILE A 55 9.066 1.695 -3.046 1.00 0.00 C ATOM 312 CD1 ILE A 55 8.990 3.372 0.380 1.00 0.00 C ATOM 0 H ILE A 55 11.851 1.195 -2.367 1.00 0.00 H new ATOM 0 HA ILE A 55 10.126 1.124 0.119 1.00 0.00 H new ATOM 0 HB ILE A 55 10.375 2.954 -1.893 1.00 0.00 H new ATOM 0 HG12 ILE A 55 7.948 3.530 -1.506 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.734 1.987 -0.702 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.606 2.525 -3.582 1.00 0.00 H new ATOM 0 HG22 ILE A 55 9.877 1.281 -3.645 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.319 0.923 -2.863 1.00 0.00 H new ATOM 0 HD11 ILE A 55 8.159 3.785 0.952 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.485 2.598 0.966 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.702 4.165 0.151 1.00 0.00 H new ATOM 324 N VAL A 56 10.113 -0.849 -2.447 1.00 0.00 N ATOM 325 CA VAL A 56 9.538 -2.122 -2.937 1.00 0.00 C ATOM 326 C VAL A 56 10.569 -3.263 -2.937 1.00 0.00 C ATOM 327 O VAL A 56 10.271 -4.357 -2.504 1.00 0.00 O ATOM 328 CB VAL A 56 9.060 -1.782 -4.344 1.00 0.00 C ATOM 329 CG1 VAL A 56 8.910 -3.055 -5.162 1.00 0.00 C ATOM 330 CG2 VAL A 56 7.706 -1.074 -4.235 1.00 0.00 C ATOM 0 H VAL A 56 10.864 -0.462 -3.019 1.00 0.00 H new ATOM 0 HA VAL A 56 8.735 -2.490 -2.299 1.00 0.00 H new ATOM 0 HB VAL A 56 9.784 -1.134 -4.838 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.568 -2.804 -6.166 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.872 -3.564 -5.223 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.182 -3.711 -4.684 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.346 -0.822 -5.232 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.989 -1.734 -3.746 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.818 -0.162 -3.649 1.00 0.00 H new ATOM 340 N LEU A 57 11.775 -3.041 -3.404 1.00 0.00 N ATOM 341 CA LEU A 57 12.761 -4.162 -3.390 1.00 0.00 C ATOM 342 C LEU A 57 13.054 -4.533 -1.939 1.00 0.00 C ATOM 343 O LEU A 57 13.200 -5.687 -1.592 1.00 0.00 O ATOM 344 CB LEU A 57 14.010 -3.633 -4.107 1.00 0.00 C ATOM 345 CG LEU A 57 15.262 -4.356 -3.602 1.00 0.00 C ATOM 346 CD1 LEU A 57 16.381 -4.214 -4.635 1.00 0.00 C ATOM 347 CD2 LEU A 57 15.714 -3.736 -2.277 1.00 0.00 C ATOM 0 H LEU A 57 12.111 -2.156 -3.784 1.00 0.00 H new ATOM 0 HA LEU A 57 12.397 -5.060 -3.889 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.908 -3.777 -5.183 1.00 0.00 H new ATOM 0 HB3 LEU A 57 14.108 -2.561 -3.937 1.00 0.00 H new ATOM 0 HG LEU A 57 15.034 -5.411 -3.450 1.00 0.00 H new ATOM 0 HD11 LEU A 57 17.273 -4.728 -4.278 1.00 0.00 H new ATOM 0 HD12 LEU A 57 16.062 -4.655 -5.580 1.00 0.00 H new ATOM 0 HD13 LEU A 57 16.606 -3.158 -4.785 1.00 0.00 H new ATOM 0 HD21 LEU A 57 16.605 -4.252 -1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 57 15.942 -2.681 -2.428 1.00 0.00 H new ATOM 0 HD23 LEU A 57 14.918 -3.833 -1.539 1.00 0.00 H new ATOM 359 N LYS A 58 13.118 -3.553 -1.086 1.00 0.00 N ATOM 360 CA LYS A 58 13.372 -3.825 0.354 1.00 0.00 C ATOM 361 C LYS A 58 12.040 -3.855 1.103 1.00 0.00 C ATOM 362 O LYS A 58 11.807 -4.689 1.955 1.00 0.00 O ATOM 363 CB LYS A 58 14.217 -2.647 0.832 1.00 0.00 C ATOM 364 CG LYS A 58 15.568 -3.153 1.338 1.00 0.00 C ATOM 365 CD LYS A 58 16.402 -1.967 1.829 1.00 0.00 C ATOM 366 CE LYS A 58 15.546 -1.086 2.742 1.00 0.00 C ATOM 367 NZ LYS A 58 16.468 -0.023 3.227 1.00 0.00 N ATOM 0 H LYS A 58 13.005 -2.568 -1.326 1.00 0.00 H new ATOM 0 HA LYS A 58 13.871 -4.779 0.522 1.00 0.00 H new ATOM 0 HB2 LYS A 58 14.365 -1.939 0.017 1.00 0.00 H new ATOM 0 HB3 LYS A 58 13.697 -2.113 1.627 1.00 0.00 H new ATOM 0 HG2 LYS A 58 15.421 -3.869 2.147 1.00 0.00 H new ATOM 0 HG3 LYS A 58 16.095 -3.677 0.540 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.279 -2.324 2.368 1.00 0.00 H new ATOM 0 HD3 LYS A 58 16.764 -1.387 0.980 1.00 0.00 H new ATOM 0 HE2 LYS A 58 14.702 -0.659 2.200 1.00 0.00 H new ATOM 0 HE3 LYS A 58 15.135 -1.660 3.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 16.182 0.276 4.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 17.439 -0.393 3.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 16.428 0.792 2.582 1.00 0.00 H new ATOM 381 N GLY A 59 11.168 -2.937 0.785 1.00 0.00 N ATOM 382 CA GLY A 59 9.844 -2.884 1.469 1.00 0.00 C ATOM 383 C GLY A 59 8.911 -3.962 0.907 1.00 0.00 C ATOM 384 O GLY A 59 8.298 -4.706 1.647 1.00 0.00 O ATOM 0 H GLY A 59 11.317 -2.218 0.077 1.00 0.00 H new ATOM 0 HA2 GLY A 59 9.975 -3.030 2.541 1.00 0.00 H new ATOM 0 HA3 GLY A 59 9.396 -1.899 1.334 1.00 0.00 H new ATOM 388 N GLY A 60 8.782 -4.048 -0.392 1.00 0.00 N ATOM 389 CA GLY A 60 7.870 -5.070 -0.975 1.00 0.00 C ATOM 390 C GLY A 60 8.442 -6.473 -0.756 1.00 0.00 C ATOM 391 O GLY A 60 7.744 -7.367 -0.330 1.00 0.00 O ATOM 0 H GLY A 60 9.266 -3.458 -1.068 1.00 0.00 H new ATOM 0 HA2 GLY A 60 6.885 -4.995 -0.514 1.00 0.00 H new ATOM 0 HA3 GLY A 60 7.738 -4.885 -2.041 1.00 0.00 H new ATOM 395 N LYS A 61 9.702 -6.668 -1.053 1.00 0.00 N ATOM 396 CA LYS A 61 10.344 -8.016 -0.890 1.00 0.00 C ATOM 397 C LYS A 61 10.418 -8.477 0.577 1.00 0.00 C ATOM 398 O LYS A 61 11.064 -9.461 0.881 1.00 0.00 O ATOM 399 CB LYS A 61 11.755 -7.836 -1.446 1.00 0.00 C ATOM 400 CG LYS A 61 12.333 -9.199 -1.822 1.00 0.00 C ATOM 401 CD LYS A 61 13.791 -9.030 -2.256 1.00 0.00 C ATOM 402 CE LYS A 61 14.682 -8.894 -1.020 1.00 0.00 C ATOM 403 NZ LYS A 61 14.842 -10.282 -0.506 1.00 0.00 N ATOM 0 H LYS A 61 10.325 -5.942 -1.407 1.00 0.00 H new ATOM 0 HA LYS A 61 9.762 -8.781 -1.403 1.00 0.00 H new ATOM 0 HB2 LYS A 61 11.732 -7.185 -2.320 1.00 0.00 H new ATOM 0 HB3 LYS A 61 12.390 -7.352 -0.704 1.00 0.00 H new ATOM 0 HG2 LYS A 61 12.271 -9.879 -0.973 1.00 0.00 H new ATOM 0 HG3 LYS A 61 11.751 -9.643 -2.629 1.00 0.00 H new ATOM 0 HD2 LYS A 61 14.106 -9.887 -2.851 1.00 0.00 H new ATOM 0 HD3 LYS A 61 13.893 -8.148 -2.889 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.646 -8.454 -1.275 1.00 0.00 H new ATOM 0 HE3 LYS A 61 14.224 -8.247 -0.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 14.599 -10.308 0.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 14.211 -10.921 -1.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 15.828 -10.588 -0.633 1.00 0.00 H new ATOM 417 N ALA A 62 9.774 -7.803 1.489 1.00 0.00 N ATOM 418 CA ALA A 62 9.834 -8.242 2.904 1.00 0.00 C ATOM 419 C ALA A 62 9.471 -9.722 2.978 1.00 0.00 C ATOM 420 O ALA A 62 10.270 -10.563 3.336 1.00 0.00 O ATOM 421 CB ALA A 62 8.790 -7.397 3.631 1.00 0.00 C ATOM 0 H ALA A 62 9.212 -6.970 1.313 1.00 0.00 H new ATOM 0 HA ALA A 62 10.823 -8.118 3.346 1.00 0.00 H new ATOM 0 HB1 ALA A 62 8.776 -7.666 4.687 1.00 0.00 H new ATOM 0 HB2 ALA A 62 9.041 -6.341 3.529 1.00 0.00 H new ATOM 0 HB3 ALA A 62 7.807 -7.580 3.197 1.00 0.00 H new ATOM 427 N LYS A 63 8.270 -10.028 2.598 1.00 0.00 N ATOM 428 CA LYS A 63 7.802 -11.444 2.580 1.00 0.00 C ATOM 429 C LYS A 63 7.856 -11.925 1.133 1.00 0.00 C ATOM 430 O LYS A 63 7.824 -13.102 0.836 1.00 0.00 O ATOM 431 CB LYS A 63 6.342 -11.424 3.055 1.00 0.00 C ATOM 432 CG LYS A 63 6.106 -10.306 4.079 1.00 0.00 C ATOM 433 CD LYS A 63 4.633 -9.896 4.041 1.00 0.00 C ATOM 434 CE LYS A 63 4.359 -9.129 2.744 1.00 0.00 C ATOM 435 NZ LYS A 63 2.923 -8.740 2.816 1.00 0.00 N ATOM 0 H LYS A 63 7.575 -9.347 2.292 1.00 0.00 H new ATOM 0 HA LYS A 63 8.407 -12.095 3.211 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.681 -11.283 2.200 1.00 0.00 H new ATOM 0 HB3 LYS A 63 6.088 -12.387 3.499 1.00 0.00 H new ATOM 0 HG2 LYS A 63 6.376 -10.648 5.078 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.741 -9.449 3.853 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.996 -10.778 4.098 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.394 -9.274 4.903 1.00 0.00 H new ATOM 0 HE2 LYS A 63 5.001 -8.252 2.662 1.00 0.00 H new ATOM 0 HE3 LYS A 63 4.555 -9.750 1.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 2.664 -8.210 1.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 2.335 -9.595 2.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.767 -8.143 3.653 1.00 0.00 H new ATOM 449 N ASN A 64 7.923 -10.981 0.241 1.00 0.00 N ATOM 450 CA ASN A 64 7.964 -11.279 -1.216 1.00 0.00 C ATOM 451 C ASN A 64 9.280 -11.965 -1.606 1.00 0.00 C ATOM 452 O ASN A 64 10.354 -11.483 -1.303 1.00 0.00 O ATOM 453 CB ASN A 64 7.868 -9.890 -1.843 1.00 0.00 C ATOM 454 CG ASN A 64 6.448 -9.650 -2.359 1.00 0.00 C ATOM 455 OD1 ASN A 64 6.251 -8.939 -3.323 1.00 0.00 O ATOM 456 ND2 ASN A 64 5.443 -10.216 -1.749 1.00 0.00 N ATOM 0 H ASN A 64 7.952 -9.987 0.467 1.00 0.00 H new ATOM 0 HA ASN A 64 7.176 -11.960 -1.539 1.00 0.00 H new ATOM 0 HB2 ASN A 64 8.130 -9.130 -1.107 1.00 0.00 H new ATOM 0 HB3 ASN A 64 8.582 -9.801 -2.662 1.00 0.00 H new ATOM 0 HD21 ASN A 64 4.491 -10.061 -2.082 1.00 0.00 H new ATOM 0 HD22 ASN A 64 5.609 -10.813 -0.939 1.00 0.00 H new ATOM 463 N PRO A 65 9.133 -13.082 -2.267 1.00 0.00 N ATOM 464 CA PRO A 65 10.292 -13.892 -2.727 1.00 0.00 C ATOM 465 C PRO A 65 11.110 -13.152 -3.795 1.00 0.00 C ATOM 466 O PRO A 65 12.318 -13.057 -3.704 1.00 0.00 O ATOM 467 CB PRO A 65 9.618 -15.123 -3.328 1.00 0.00 C ATOM 468 CG PRO A 65 8.267 -14.652 -3.718 1.00 0.00 C ATOM 469 CD PRO A 65 7.867 -13.708 -2.648 1.00 0.00 C ATOM 0 HA PRO A 65 10.998 -14.118 -1.927 1.00 0.00 H new ATOM 0 HB2 PRO A 65 10.172 -15.498 -4.189 1.00 0.00 H new ATOM 0 HB3 PRO A 65 9.561 -15.937 -2.606 1.00 0.00 H new ATOM 0 HG2 PRO A 65 8.286 -14.161 -4.691 1.00 0.00 H new ATOM 0 HG3 PRO A 65 7.566 -15.483 -3.794 1.00 0.00 H new ATOM 0 HD2 PRO A 65 7.146 -12.973 -3.007 1.00 0.00 H new ATOM 0 HD3 PRO A 65 7.404 -14.224 -1.807 1.00 0.00 H new ATOM 477 N SER A 66 10.468 -12.631 -4.807 1.00 0.00 N ATOM 478 CA SER A 66 11.212 -11.906 -5.873 1.00 0.00 C ATOM 479 C SER A 66 10.238 -11.140 -6.735 1.00 0.00 C ATOM 480 O SER A 66 9.461 -11.677 -7.500 1.00 0.00 O ATOM 481 CB SER A 66 11.957 -12.975 -6.669 1.00 0.00 C ATOM 482 OG SER A 66 13.356 -12.733 -6.588 1.00 0.00 O ATOM 0 H SER A 66 9.458 -12.678 -4.940 1.00 0.00 H new ATOM 0 HA SER A 66 11.916 -11.178 -5.470 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.724 -13.965 -6.276 1.00 0.00 H new ATOM 0 HB3 SER A 66 11.634 -12.961 -7.710 1.00 0.00 H new ATOM 0 HG SER A 66 13.639 -12.760 -5.650 1.00 0.00 H new ATOM 488 N ILE A 67 10.260 -9.877 -6.530 1.00 0.00 N ATOM 489 CA ILE A 67 9.352 -8.952 -7.197 1.00 0.00 C ATOM 490 C ILE A 67 10.001 -8.301 -8.424 1.00 0.00 C ATOM 491 O ILE A 67 11.196 -8.086 -8.464 1.00 0.00 O ATOM 492 CB ILE A 67 9.123 -7.955 -6.072 1.00 0.00 C ATOM 493 CG1 ILE A 67 8.077 -8.514 -5.090 1.00 0.00 C ATOM 494 CG2 ILE A 67 8.653 -6.611 -6.631 1.00 0.00 C ATOM 495 CD1 ILE A 67 8.276 -10.030 -4.922 1.00 0.00 C ATOM 0 H ILE A 67 10.911 -9.425 -5.888 1.00 0.00 H new ATOM 0 HA ILE A 67 8.445 -9.403 -7.599 1.00 0.00 H new ATOM 0 HB ILE A 67 10.064 -7.797 -5.546 1.00 0.00 H new ATOM 0 HG12 ILE A 67 8.169 -8.017 -4.124 1.00 0.00 H new ATOM 0 HG13 ILE A 67 7.072 -8.309 -5.459 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.495 -5.911 -5.811 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.410 -6.213 -7.306 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.719 -6.750 -7.175 1.00 0.00 H new ATOM 0 HD11 ILE A 67 7.533 -10.420 -4.226 1.00 0.00 H new ATOM 0 HD12 ILE A 67 8.161 -10.521 -5.888 1.00 0.00 H new ATOM 0 HD13 ILE A 67 9.275 -10.225 -4.533 1.00 0.00 H new ATOM 507 N VAL A 68 9.219 -7.981 -9.423 1.00 0.00 N ATOM 508 CA VAL A 68 9.801 -7.338 -10.641 1.00 0.00 C ATOM 509 C VAL A 68 9.411 -5.856 -10.695 1.00 0.00 C ATOM 510 O VAL A 68 8.327 -5.474 -10.301 1.00 0.00 O ATOM 511 CB VAL A 68 9.224 -8.115 -11.840 1.00 0.00 C ATOM 512 CG1 VAL A 68 8.003 -7.392 -12.425 1.00 0.00 C ATOM 513 CG2 VAL A 68 10.298 -8.225 -12.926 1.00 0.00 C ATOM 0 H VAL A 68 8.211 -8.135 -9.449 1.00 0.00 H new ATOM 0 HA VAL A 68 10.890 -7.372 -10.642 1.00 0.00 H new ATOM 0 HB VAL A 68 8.917 -9.104 -11.498 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.614 -7.960 -13.270 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.231 -7.304 -11.660 1.00 0.00 H new ATOM 0 HG13 VAL A 68 8.296 -6.397 -12.761 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.898 -8.774 -13.779 1.00 0.00 H new ATOM 0 HG22 VAL A 68 10.597 -7.226 -13.245 1.00 0.00 H new ATOM 0 HG23 VAL A 68 11.165 -8.753 -12.529 1.00 0.00 H new ATOM 523 N VAL A 69 10.281 -5.021 -11.191 1.00 0.00 N ATOM 524 CA VAL A 69 9.946 -3.573 -11.278 1.00 0.00 C ATOM 525 C VAL A 69 10.027 -3.101 -12.732 1.00 0.00 C ATOM 526 O VAL A 69 11.085 -2.781 -13.235 1.00 0.00 O ATOM 527 CB VAL A 69 10.989 -2.864 -10.415 1.00 0.00 C ATOM 528 CG1 VAL A 69 10.792 -1.349 -10.503 1.00 0.00 C ATOM 529 CG2 VAL A 69 10.828 -3.313 -8.960 1.00 0.00 C ATOM 0 H VAL A 69 11.205 -5.277 -11.538 1.00 0.00 H new ATOM 0 HA VAL A 69 8.934 -3.362 -10.934 1.00 0.00 H new ATOM 0 HB VAL A 69 11.987 -3.118 -10.772 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.538 -0.849 -9.886 1.00 0.00 H new ATOM 0 HG12 VAL A 69 10.903 -1.027 -11.539 1.00 0.00 H new ATOM 0 HG13 VAL A 69 9.795 -1.091 -10.147 1.00 0.00 H new ATOM 0 HG21 VAL A 69 11.570 -2.810 -8.340 1.00 0.00 H new ATOM 0 HG22 VAL A 69 9.828 -3.058 -8.609 1.00 0.00 H new ATOM 0 HG23 VAL A 69 10.971 -4.392 -8.894 1.00 0.00 H new ATOM 539 N GLU A 70 8.912 -3.057 -13.412 1.00 0.00 N ATOM 540 CA GLU A 70 8.920 -2.606 -14.835 1.00 0.00 C ATOM 541 C GLU A 70 8.981 -1.078 -14.902 1.00 0.00 C ATOM 542 O GLU A 70 8.270 -0.386 -14.200 1.00 0.00 O ATOM 543 CB GLU A 70 7.597 -3.094 -15.427 1.00 0.00 C ATOM 544 CG GLU A 70 7.317 -4.534 -15.003 1.00 0.00 C ATOM 545 CD GLU A 70 8.541 -5.403 -15.296 1.00 0.00 C ATOM 546 OE1 GLU A 70 8.631 -5.913 -16.401 1.00 0.00 O ATOM 547 OE2 GLU A 70 9.367 -5.546 -14.410 1.00 0.00 O ATOM 0 H GLU A 70 7.996 -3.314 -13.044 1.00 0.00 H new ATOM 0 HA GLU A 70 9.781 -2.997 -15.377 1.00 0.00 H new ATOM 0 HB2 GLU A 70 6.784 -2.447 -15.097 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.633 -3.030 -16.515 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.079 -4.571 -13.940 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.449 -4.919 -15.538 1.00 0.00 H new ATOM 554 N ASP A 71 9.821 -0.545 -15.746 1.00 0.00 N ATOM 555 CA ASP A 71 9.923 0.938 -15.860 1.00 0.00 C ATOM 556 C ASP A 71 10.163 1.336 -17.318 1.00 0.00 C ATOM 557 O ASP A 71 11.202 1.059 -17.883 1.00 0.00 O ATOM 558 CB ASP A 71 11.119 1.323 -14.985 1.00 0.00 C ATOM 559 CG ASP A 71 12.271 0.340 -15.216 1.00 0.00 C ATOM 560 OD1 ASP A 71 12.728 0.245 -16.342 1.00 0.00 O ATOM 561 OD2 ASP A 71 12.677 -0.300 -14.259 1.00 0.00 O ATOM 0 H ASP A 71 10.441 -1.072 -16.361 1.00 0.00 H new ATOM 0 HA ASP A 71 9.012 1.444 -15.541 1.00 0.00 H new ATOM 0 HB2 ASP A 71 11.442 2.337 -15.221 1.00 0.00 H new ATOM 0 HB3 ASP A 71 10.829 1.317 -13.934 1.00 0.00 H new ATOM 566 N LYS A 72 9.210 1.977 -17.942 1.00 0.00 N ATOM 567 CA LYS A 72 9.410 2.373 -19.367 1.00 0.00 C ATOM 568 C LYS A 72 8.687 3.686 -19.685 1.00 0.00 C ATOM 569 O LYS A 72 8.190 4.366 -18.809 1.00 0.00 O ATOM 570 CB LYS A 72 8.826 1.220 -20.186 1.00 0.00 C ATOM 571 CG LYS A 72 7.353 1.022 -19.824 1.00 0.00 C ATOM 572 CD LYS A 72 6.937 -0.416 -20.144 1.00 0.00 C ATOM 573 CE LYS A 72 5.428 -0.469 -20.397 1.00 0.00 C ATOM 574 NZ LYS A 72 5.280 -1.231 -21.668 1.00 0.00 N ATOM 0 H LYS A 72 8.313 2.241 -17.533 1.00 0.00 H new ATOM 0 HA LYS A 72 10.462 2.546 -19.593 1.00 0.00 H new ATOM 0 HB2 LYS A 72 8.923 1.432 -21.251 1.00 0.00 H new ATOM 0 HB3 LYS A 72 9.384 0.304 -19.991 1.00 0.00 H new ATOM 0 HG2 LYS A 72 7.197 1.230 -18.766 1.00 0.00 H new ATOM 0 HG3 LYS A 72 6.733 1.724 -20.382 1.00 0.00 H new ATOM 0 HD2 LYS A 72 7.476 -0.775 -21.021 1.00 0.00 H new ATOM 0 HD3 LYS A 72 7.201 -1.074 -19.316 1.00 0.00 H new ATOM 0 HE2 LYS A 72 4.907 -0.963 -19.577 1.00 0.00 H new ATOM 0 HE3 LYS A 72 5.007 0.532 -20.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 4.272 -1.311 -21.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 5.781 -0.733 -22.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 5.684 -2.182 -21.552 1.00 0.00 H new ATOM 588 N ALA A 73 8.642 4.050 -20.940 1.00 0.00 N ATOM 589 CA ALA A 73 7.970 5.323 -21.340 1.00 0.00 C ATOM 590 C ALA A 73 6.679 5.533 -20.544 1.00 0.00 C ATOM 591 O ALA A 73 5.705 4.833 -20.730 1.00 0.00 O ATOM 592 CB ALA A 73 7.658 5.157 -22.828 1.00 0.00 C ATOM 0 H ALA A 73 9.045 3.517 -21.711 1.00 0.00 H new ATOM 0 HA ALA A 73 8.600 6.191 -21.145 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.162 6.054 -23.198 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.586 5.002 -23.379 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.004 4.296 -22.969 1.00 0.00 H new ATOM 598 N GLY A 74 6.673 6.506 -19.672 1.00 0.00 N ATOM 599 CA GLY A 74 5.458 6.798 -18.855 1.00 0.00 C ATOM 600 C GLY A 74 4.747 5.506 -18.483 1.00 0.00 C ATOM 601 O GLY A 74 3.594 5.295 -18.803 1.00 0.00 O ATOM 0 H GLY A 74 7.468 7.118 -19.489 1.00 0.00 H new ATOM 0 HA2 GLY A 74 5.741 7.338 -17.952 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.782 7.444 -19.415 1.00 0.00 H new ATOM 605 N PHE A 75 5.431 4.652 -17.798 1.00 0.00 N ATOM 606 CA PHE A 75 4.818 3.363 -17.377 1.00 0.00 C ATOM 607 C PHE A 75 5.612 2.759 -16.218 1.00 0.00 C ATOM 608 O PHE A 75 6.360 1.816 -16.383 1.00 0.00 O ATOM 609 CB PHE A 75 4.883 2.463 -18.612 1.00 0.00 C ATOM 610 CG PHE A 75 3.620 2.638 -19.421 1.00 0.00 C ATOM 611 CD1 PHE A 75 2.377 2.648 -18.780 1.00 0.00 C ATOM 612 CD2 PHE A 75 3.693 2.792 -20.811 1.00 0.00 C ATOM 613 CE1 PHE A 75 1.205 2.814 -19.527 1.00 0.00 C ATOM 614 CE2 PHE A 75 2.521 2.956 -21.559 1.00 0.00 C ATOM 615 CZ PHE A 75 1.277 2.967 -20.917 1.00 0.00 C ATOM 0 H PHE A 75 6.399 4.786 -17.505 1.00 0.00 H new ATOM 0 HA PHE A 75 3.793 3.486 -17.027 1.00 0.00 H new ATOM 0 HB2 PHE A 75 5.754 2.717 -19.216 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.996 1.421 -18.312 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.321 2.528 -17.708 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.653 2.784 -21.306 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.245 2.824 -19.031 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.577 3.074 -22.631 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.373 3.094 -21.494 1.00 0.00 H new ATOM 625 N TRP A 76 5.449 3.302 -15.045 1.00 0.00 N ATOM 626 CA TRP A 76 6.180 2.775 -13.859 1.00 0.00 C ATOM 627 C TRP A 76 5.424 1.564 -13.302 1.00 0.00 C ATOM 628 O TRP A 76 4.696 1.657 -12.334 1.00 0.00 O ATOM 629 CB TRP A 76 6.185 3.958 -12.882 1.00 0.00 C ATOM 630 CG TRP A 76 6.397 3.510 -11.487 1.00 0.00 C ATOM 631 CD1 TRP A 76 7.315 2.614 -11.093 1.00 0.00 C ATOM 632 CD2 TRP A 76 5.729 3.972 -10.279 1.00 0.00 C ATOM 633 NE1 TRP A 76 7.240 2.473 -9.733 1.00 0.00 N ATOM 634 CE2 TRP A 76 6.268 3.281 -9.179 1.00 0.00 C ATOM 635 CE3 TRP A 76 4.714 4.904 -10.042 1.00 0.00 C ATOM 636 CZ2 TRP A 76 5.814 3.507 -7.878 1.00 0.00 C ATOM 637 CZ3 TRP A 76 4.250 5.139 -8.740 1.00 0.00 C ATOM 638 CH2 TRP A 76 4.798 4.441 -7.658 1.00 0.00 C ATOM 0 H TRP A 76 4.836 4.095 -14.855 1.00 0.00 H new ATOM 0 HA TRP A 76 7.192 2.430 -14.070 1.00 0.00 H new ATOM 0 HB2 TRP A 76 6.970 4.660 -13.163 1.00 0.00 H new ATOM 0 HB3 TRP A 76 5.238 4.494 -12.953 1.00 0.00 H new ATOM 0 HD1 TRP A 76 8.001 2.090 -11.742 1.00 0.00 H new ATOM 0 HE1 TRP A 76 7.834 1.844 -9.192 1.00 0.00 H new ATOM 0 HE3 TRP A 76 4.283 5.448 -10.870 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 6.244 2.965 -7.049 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 3.466 5.862 -8.571 1.00 0.00 H new ATOM 0 HH2 TRP A 76 4.437 4.623 -6.657 1.00 0.00 H new ATOM 649 N TRP A 77 5.577 0.430 -13.939 1.00 0.00 N ATOM 650 CA TRP A 77 4.857 -0.799 -13.493 1.00 0.00 C ATOM 651 C TRP A 77 5.756 -1.704 -12.649 1.00 0.00 C ATOM 652 O TRP A 77 6.947 -1.785 -12.856 1.00 0.00 O ATOM 653 CB TRP A 77 4.496 -1.524 -14.793 1.00 0.00 C ATOM 654 CG TRP A 77 3.361 -0.829 -15.468 1.00 0.00 C ATOM 655 CD1 TRP A 77 3.038 0.473 -15.307 1.00 0.00 C ATOM 656 CD2 TRP A 77 2.401 -1.376 -16.417 1.00 0.00 C ATOM 657 NE1 TRP A 77 1.937 0.760 -16.093 1.00 0.00 N ATOM 658 CE2 TRP A 77 1.508 -0.348 -16.796 1.00 0.00 C ATOM 659 CE3 TRP A 77 2.220 -2.653 -16.979 1.00 0.00 C ATOM 660 CZ2 TRP A 77 0.470 -0.577 -17.698 1.00 0.00 C ATOM 661 CZ3 TRP A 77 1.175 -2.887 -17.888 1.00 0.00 C ATOM 662 CH2 TRP A 77 0.302 -1.851 -18.246 1.00 0.00 C ATOM 0 H TRP A 77 6.175 0.304 -14.755 1.00 0.00 H new ATOM 0 HA TRP A 77 3.994 -0.549 -12.877 1.00 0.00 H new ATOM 0 HB2 TRP A 77 5.361 -1.552 -15.455 1.00 0.00 H new ATOM 0 HB3 TRP A 77 4.224 -2.558 -14.579 1.00 0.00 H new ATOM 0 HD1 TRP A 77 3.555 1.175 -14.669 1.00 0.00 H new ATOM 0 HE1 TRP A 77 1.496 1.678 -16.147 1.00 0.00 H new ATOM 0 HE3 TRP A 77 2.888 -3.458 -16.710 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -0.200 0.225 -17.971 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 1.044 -3.871 -18.313 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -0.500 -2.037 -18.945 1.00 0.00 H new ATOM 673 N ILE A 78 5.176 -2.407 -11.715 1.00 0.00 N ATOM 674 CA ILE A 78 5.966 -3.341 -10.871 1.00 0.00 C ATOM 675 C ILE A 78 5.091 -4.544 -10.514 1.00 0.00 C ATOM 676 O ILE A 78 3.908 -4.412 -10.281 1.00 0.00 O ATOM 677 CB ILE A 78 6.348 -2.536 -9.631 1.00 0.00 C ATOM 678 CG1 ILE A 78 7.566 -1.679 -9.963 1.00 0.00 C ATOM 679 CG2 ILE A 78 6.691 -3.482 -8.479 1.00 0.00 C ATOM 680 CD1 ILE A 78 7.178 -0.209 -9.909 1.00 0.00 C ATOM 0 H ILE A 78 4.179 -2.372 -11.500 1.00 0.00 H new ATOM 0 HA ILE A 78 6.856 -3.726 -11.369 1.00 0.00 H new ATOM 0 HB ILE A 78 5.512 -1.904 -9.332 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.370 -1.881 -9.255 1.00 0.00 H new ATOM 0 HG13 ILE A 78 7.943 -1.931 -10.954 1.00 0.00 H new ATOM 0 HG21 ILE A 78 6.962 -2.900 -7.598 1.00 0.00 H new ATOM 0 HG22 ILE A 78 5.826 -4.105 -8.250 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.529 -4.117 -8.767 1.00 0.00 H new ATOM 0 HD11 ILE A 78 8.047 0.405 -10.146 1.00 0.00 H new ATOM 0 HD12 ILE A 78 6.387 -0.015 -10.634 1.00 0.00 H new ATOM 0 HD13 ILE A 78 6.822 0.037 -8.909 1.00 0.00 H new ATOM 692 N LYS A 79 5.655 -5.718 -10.491 1.00 0.00 N ATOM 693 CA LYS A 79 4.839 -6.924 -10.170 1.00 0.00 C ATOM 694 C LYS A 79 5.330 -7.581 -8.878 1.00 0.00 C ATOM 695 O LYS A 79 6.513 -7.654 -8.617 1.00 0.00 O ATOM 696 CB LYS A 79 5.010 -7.848 -11.390 1.00 0.00 C ATOM 697 CG LYS A 79 5.875 -9.061 -11.035 1.00 0.00 C ATOM 698 CD LYS A 79 6.051 -9.945 -12.270 1.00 0.00 C ATOM 699 CE LYS A 79 4.764 -10.732 -12.522 1.00 0.00 C ATOM 700 NZ LYS A 79 4.265 -10.237 -13.835 1.00 0.00 N ATOM 0 H LYS A 79 6.641 -5.896 -10.680 1.00 0.00 H new ATOM 0 HA LYS A 79 3.789 -6.688 -9.995 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.033 -8.182 -11.739 1.00 0.00 H new ATOM 0 HB3 LYS A 79 5.469 -7.295 -12.209 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.848 -8.732 -10.669 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.408 -9.630 -10.231 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.290 -9.331 -13.138 1.00 0.00 H new ATOM 0 HD3 LYS A 79 6.886 -10.630 -12.124 1.00 0.00 H new ATOM 0 HE2 LYS A 79 4.956 -11.805 -12.551 1.00 0.00 H new ATOM 0 HE3 LYS A 79 4.034 -10.560 -11.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 3.382 -10.730 -14.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.085 -9.214 -13.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 4.978 -10.421 -14.569 1.00 0.00 H new ATOM 714 N ALA A 80 4.427 -8.069 -8.076 1.00 0.00 N ATOM 715 CA ALA A 80 4.842 -8.729 -6.810 1.00 0.00 C ATOM 716 C ALA A 80 4.217 -10.124 -6.717 1.00 0.00 C ATOM 717 O ALA A 80 3.281 -10.439 -7.424 1.00 0.00 O ATOM 718 CB ALA A 80 4.312 -7.823 -5.699 1.00 0.00 C ATOM 0 H ALA A 80 3.421 -8.039 -8.243 1.00 0.00 H new ATOM 0 HA ALA A 80 5.922 -8.860 -6.743 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.578 -8.243 -4.729 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.752 -6.831 -5.798 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.227 -7.748 -5.777 1.00 0.00 H new ATOM 724 N ASP A 81 4.722 -10.964 -5.853 1.00 0.00 N ATOM 725 CA ASP A 81 4.142 -12.333 -5.729 1.00 0.00 C ATOM 726 C ASP A 81 3.331 -12.447 -4.439 1.00 0.00 C ATOM 727 O ASP A 81 3.458 -13.392 -3.687 1.00 0.00 O ATOM 728 CB ASP A 81 5.342 -13.281 -5.696 1.00 0.00 C ATOM 729 CG ASP A 81 5.768 -13.619 -7.127 1.00 0.00 C ATOM 730 OD1 ASP A 81 5.235 -14.571 -7.674 1.00 0.00 O ATOM 731 OD2 ASP A 81 6.623 -12.922 -7.652 1.00 0.00 O ATOM 0 H ASP A 81 5.506 -10.763 -5.232 1.00 0.00 H new ATOM 0 HA ASP A 81 3.467 -12.568 -6.552 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.170 -12.818 -5.159 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.083 -14.193 -5.158 1.00 0.00 H new ATOM 736 N GLY A 82 2.493 -11.486 -4.189 1.00 0.00 N ATOM 737 CA GLY A 82 1.662 -11.510 -2.970 1.00 0.00 C ATOM 738 C GLY A 82 0.621 -10.395 -3.045 1.00 0.00 C ATOM 739 O GLY A 82 -0.319 -10.460 -3.810 1.00 0.00 O ATOM 0 H GLY A 82 2.350 -10.674 -4.790 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.169 -12.477 -2.871 1.00 0.00 H new ATOM 0 HA3 GLY A 82 2.288 -11.380 -2.087 1.00 0.00 H new ATOM 743 N ALA A 83 0.789 -9.369 -2.260 1.00 0.00 N ATOM 744 CA ALA A 83 -0.185 -8.241 -2.286 1.00 0.00 C ATOM 745 C ALA A 83 0.550 -6.916 -2.516 1.00 0.00 C ATOM 746 O ALA A 83 1.758 -6.841 -2.405 1.00 0.00 O ATOM 747 CB ALA A 83 -0.849 -8.259 -0.908 1.00 0.00 C ATOM 0 H ALA A 83 1.559 -9.262 -1.600 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.915 -8.341 -3.089 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.582 -7.455 -0.847 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.347 -9.217 -0.757 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.091 -8.118 -0.137 1.00 0.00 H new ATOM 753 N ILE A 84 -0.164 -5.872 -2.840 1.00 0.00 N ATOM 754 CA ILE A 84 0.504 -4.561 -3.081 1.00 0.00 C ATOM 755 C ILE A 84 -0.370 -3.413 -2.575 1.00 0.00 C ATOM 756 O ILE A 84 -1.566 -3.554 -2.425 1.00 0.00 O ATOM 757 CB ILE A 84 0.666 -4.476 -4.596 1.00 0.00 C ATOM 758 CG1 ILE A 84 1.575 -3.301 -4.939 1.00 0.00 C ATOM 759 CG2 ILE A 84 -0.702 -4.270 -5.249 1.00 0.00 C ATOM 760 CD1 ILE A 84 3.011 -3.683 -4.601 1.00 0.00 C ATOM 0 H ILE A 84 -1.178 -5.870 -2.948 1.00 0.00 H new ATOM 0 HA ILE A 84 1.458 -4.485 -2.559 1.00 0.00 H new ATOM 0 HB ILE A 84 1.106 -5.401 -4.967 1.00 0.00 H new ATOM 0 HG12 ILE A 84 1.489 -3.052 -5.997 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.277 -2.415 -4.378 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -0.583 -4.210 -6.331 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -1.353 -5.108 -5.002 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.145 -3.345 -4.880 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.675 -2.852 -4.841 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.086 -3.912 -3.538 1.00 0.00 H new ATOM 0 HD13 ILE A 84 3.301 -4.558 -5.182 1.00 0.00 H new ATOM 772 N GLU A 85 0.216 -2.275 -2.316 1.00 0.00 N ATOM 773 CA GLU A 85 -0.576 -1.132 -1.826 1.00 0.00 C ATOM 774 C GLU A 85 -0.415 0.079 -2.752 1.00 0.00 C ATOM 775 O GLU A 85 0.368 0.060 -3.681 1.00 0.00 O ATOM 776 CB GLU A 85 -0.032 -0.827 -0.432 1.00 0.00 C ATOM 777 CG GLU A 85 -0.844 0.306 0.195 1.00 0.00 C ATOM 778 CD GLU A 85 -0.523 0.404 1.687 1.00 0.00 C ATOM 779 OE1 GLU A 85 0.624 0.668 2.010 1.00 0.00 O ATOM 780 OE2 GLU A 85 -1.428 0.216 2.482 1.00 0.00 O ATOM 0 H GLU A 85 1.214 -2.096 -2.426 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.641 -1.361 -1.801 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -0.086 -1.718 0.194 1.00 0.00 H new ATOM 0 HB3 GLU A 85 1.019 -0.545 -0.494 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -0.613 1.249 -0.300 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -1.909 0.125 0.053 1.00 0.00 H new ATOM 787 N ILE A 86 -1.158 1.132 -2.513 1.00 0.00 N ATOM 788 CA ILE A 86 -1.059 2.323 -3.369 1.00 0.00 C ATOM 789 C ILE A 86 -1.556 3.574 -2.631 1.00 0.00 C ATOM 790 O ILE A 86 -2.449 3.517 -1.810 1.00 0.00 O ATOM 791 CB ILE A 86 -1.937 1.988 -4.574 1.00 0.00 C ATOM 792 CG1 ILE A 86 -1.028 1.625 -5.741 1.00 0.00 C ATOM 793 CG2 ILE A 86 -2.827 3.182 -4.947 1.00 0.00 C ATOM 794 CD1 ILE A 86 -0.752 2.879 -6.533 1.00 0.00 C ATOM 0 H ILE A 86 -1.831 1.204 -1.750 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.034 2.551 -3.660 1.00 0.00 H new ATOM 0 HB ILE A 86 -2.590 1.150 -4.330 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.096 1.193 -5.376 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.502 0.874 -6.372 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -3.444 2.921 -5.807 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.469 3.435 -4.103 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -2.201 4.039 -5.196 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -0.102 2.642 -7.375 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.691 3.289 -6.904 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.263 3.613 -5.893 1.00 0.00 H new ATOM 806 N ASP A 87 -1.001 4.708 -2.968 1.00 0.00 N ATOM 807 CA ASP A 87 -1.441 5.990 -2.343 1.00 0.00 C ATOM 808 C ASP A 87 -1.515 7.071 -3.413 1.00 0.00 C ATOM 809 O ASP A 87 -0.791 7.030 -4.389 1.00 0.00 O ATOM 810 CB ASP A 87 -0.350 6.365 -1.354 1.00 0.00 C ATOM 811 CG ASP A 87 -0.271 5.318 -0.240 1.00 0.00 C ATOM 812 OD1 ASP A 87 -1.308 4.995 0.317 1.00 0.00 O ATOM 813 OD2 ASP A 87 0.825 4.857 0.038 1.00 0.00 O ATOM 0 H ASP A 87 -0.254 4.802 -3.656 1.00 0.00 H new ATOM 0 HA ASP A 87 -2.417 5.891 -1.867 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.609 6.435 -1.867 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.556 7.347 -0.928 1.00 0.00 H new ATOM 818 N ALA A 88 -2.352 8.052 -3.247 1.00 0.00 N ATOM 819 CA ALA A 88 -2.401 9.117 -4.277 1.00 0.00 C ATOM 820 C ALA A 88 -2.845 10.456 -3.682 1.00 0.00 C ATOM 821 O ALA A 88 -2.404 11.507 -4.105 1.00 0.00 O ATOM 822 CB ALA A 88 -3.407 8.633 -5.320 1.00 0.00 C ATOM 0 H ALA A 88 -2.991 8.162 -2.460 1.00 0.00 H new ATOM 0 HA ALA A 88 -1.415 9.290 -4.709 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.493 9.375 -6.114 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.067 7.687 -5.742 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.380 8.491 -4.849 1.00 0.00 H new ATOM 828 N ALA A 89 -3.725 10.429 -2.720 1.00 0.00 N ATOM 829 CA ALA A 89 -4.209 11.704 -2.112 1.00 0.00 C ATOM 830 C ALA A 89 -3.046 12.677 -1.933 1.00 0.00 C ATOM 831 O ALA A 89 -3.138 13.840 -2.269 1.00 0.00 O ATOM 832 CB ALA A 89 -4.794 11.301 -0.763 1.00 0.00 C ATOM 0 H ALA A 89 -4.131 9.580 -2.327 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.946 12.209 -2.736 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -5.173 12.186 -0.252 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -5.609 10.594 -0.917 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -4.019 10.835 -0.155 1.00 0.00 H new ATOM 838 N GLU A 90 -1.945 12.203 -1.430 1.00 0.00 N ATOM 839 CA GLU A 90 -0.770 13.099 -1.258 1.00 0.00 C ATOM 840 C GLU A 90 -0.248 13.487 -2.638 1.00 0.00 C ATOM 841 O GLU A 90 -0.089 14.648 -2.960 1.00 0.00 O ATOM 842 CB GLU A 90 0.270 12.272 -0.501 1.00 0.00 C ATOM 843 CG GLU A 90 1.422 13.182 -0.067 1.00 0.00 C ATOM 844 CD GLU A 90 1.869 12.804 1.346 1.00 0.00 C ATOM 845 OE1 GLU A 90 1.311 13.345 2.287 1.00 0.00 O ATOM 846 OE2 GLU A 90 2.762 11.982 1.465 1.00 0.00 O ATOM 0 H GLU A 90 -1.806 11.238 -1.131 1.00 0.00 H new ATOM 0 HA GLU A 90 -1.009 14.015 -0.717 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -0.186 11.803 0.371 1.00 0.00 H new ATOM 0 HB3 GLU A 90 0.645 11.469 -1.136 1.00 0.00 H new ATOM 0 HG2 GLU A 90 2.257 13.086 -0.761 1.00 0.00 H new ATOM 0 HG3 GLU A 90 1.105 14.225 -0.092 1.00 0.00 H new ATOM 853 N ALA A 91 -0.006 12.518 -3.468 1.00 0.00 N ATOM 854 CA ALA A 91 0.475 12.829 -4.835 1.00 0.00 C ATOM 855 C ALA A 91 -0.506 13.796 -5.499 1.00 0.00 C ATOM 856 O ALA A 91 -0.115 14.728 -6.165 1.00 0.00 O ATOM 857 CB ALA A 91 0.496 11.487 -5.566 1.00 0.00 C ATOM 0 H ALA A 91 -0.120 11.526 -3.259 1.00 0.00 H new ATOM 0 HA ALA A 91 1.458 13.299 -4.845 1.00 0.00 H new ATOM 0 HB1 ALA A 91 0.843 11.635 -6.589 1.00 0.00 H new ATOM 0 HB2 ALA A 91 1.169 10.802 -5.050 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -0.509 11.065 -5.581 1.00 0.00 H new ATOM 863 N GLY A 92 -1.781 13.577 -5.310 1.00 0.00 N ATOM 864 CA GLY A 92 -2.804 14.475 -5.921 1.00 0.00 C ATOM 865 C GLY A 92 -2.607 15.910 -5.426 1.00 0.00 C ATOM 866 O GLY A 92 -2.461 16.829 -6.207 1.00 0.00 O ATOM 0 H GLY A 92 -2.159 12.809 -4.755 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -2.725 14.443 -7.008 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.805 14.127 -5.664 1.00 0.00 H new ATOM 870 N GLU A 93 -2.603 16.112 -4.137 1.00 0.00 N ATOM 871 CA GLU A 93 -2.415 17.494 -3.606 1.00 0.00 C ATOM 872 C GLU A 93 -1.103 18.075 -4.130 1.00 0.00 C ATOM 873 O GLU A 93 -0.871 19.268 -4.077 1.00 0.00 O ATOM 874 CB GLU A 93 -2.362 17.335 -2.084 1.00 0.00 C ATOM 875 CG GLU A 93 -1.073 16.616 -1.686 1.00 0.00 C ATOM 876 CD GLU A 93 -0.479 17.283 -0.442 1.00 0.00 C ATOM 877 OE1 GLU A 93 -0.033 18.412 -0.556 1.00 0.00 O ATOM 878 OE2 GLU A 93 -0.482 16.652 0.601 1.00 0.00 O ATOM 0 H GLU A 93 -2.721 15.385 -3.431 1.00 0.00 H new ATOM 0 HA GLU A 93 -3.213 18.170 -3.913 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.407 18.313 -1.605 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.227 16.770 -1.737 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.278 15.564 -1.485 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -0.357 16.650 -2.507 1.00 0.00 H new ATOM 885 N LEU A 94 -0.236 17.233 -4.622 1.00 0.00 N ATOM 886 CA LEU A 94 1.073 17.724 -5.138 1.00 0.00 C ATOM 887 C LEU A 94 0.958 18.159 -6.601 1.00 0.00 C ATOM 888 O LEU A 94 1.138 19.315 -6.923 1.00 0.00 O ATOM 889 CB LEU A 94 2.020 16.534 -5.010 1.00 0.00 C ATOM 890 CG LEU A 94 3.371 16.892 -5.625 1.00 0.00 C ATOM 891 CD1 LEU A 94 4.461 16.048 -4.967 1.00 0.00 C ATOM 892 CD2 LEU A 94 3.339 16.608 -7.131 1.00 0.00 C ATOM 0 H LEU A 94 -0.378 16.225 -4.689 1.00 0.00 H new ATOM 0 HA LEU A 94 1.424 18.594 -4.583 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.145 16.266 -3.961 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.598 15.664 -5.513 1.00 0.00 H new ATOM 0 HG LEU A 94 3.580 17.949 -5.463 1.00 0.00 H new ATOM 0 HD11 LEU A 94 5.428 16.299 -5.402 1.00 0.00 H new ATOM 0 HD12 LEU A 94 4.481 16.251 -3.896 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.252 14.991 -5.132 1.00 0.00 H new ATOM 0 HD21 LEU A 94 4.303 16.864 -7.570 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.133 15.551 -7.298 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.558 17.208 -7.598 1.00 0.00 H new ATOM 904 N LEU A 95 0.667 17.249 -7.495 1.00 0.00 N ATOM 905 CA LEU A 95 0.559 17.667 -8.934 1.00 0.00 C ATOM 906 C LEU A 95 -0.705 18.497 -9.139 1.00 0.00 C ATOM 907 O LEU A 95 -0.714 19.450 -9.893 1.00 0.00 O ATOM 908 CB LEU A 95 0.546 16.426 -9.852 1.00 0.00 C ATOM 909 CG LEU A 95 0.388 15.125 -9.083 1.00 0.00 C ATOM 910 CD1 LEU A 95 -1.019 15.063 -8.495 1.00 0.00 C ATOM 911 CD2 LEU A 95 0.591 13.964 -10.050 1.00 0.00 C ATOM 0 H LEU A 95 0.503 16.261 -7.304 1.00 0.00 H new ATOM 0 HA LEU A 95 1.425 18.276 -9.193 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -0.269 16.519 -10.570 1.00 0.00 H new ATOM 0 HB3 LEU A 95 1.473 16.394 -10.425 1.00 0.00 H new ATOM 0 HG LEU A 95 1.119 15.067 -8.277 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.141 14.132 -7.941 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.170 15.908 -7.823 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.752 15.105 -9.301 1.00 0.00 H new ATOM 0 HD21 LEU A 95 0.481 13.021 -9.515 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -0.152 14.019 -10.845 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.590 14.021 -10.483 1.00 0.00 H new ATOM 923 N GLY A 96 -1.769 18.156 -8.473 1.00 0.00 N ATOM 924 CA GLY A 96 -3.019 18.948 -8.634 1.00 0.00 C ATOM 925 C GLY A 96 -3.921 18.730 -7.423 1.00 0.00 C ATOM 926 O GLY A 96 -4.050 19.583 -6.567 1.00 0.00 O ATOM 0 H GLY A 96 -1.829 17.368 -7.828 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -2.780 20.007 -8.737 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.537 18.648 -9.545 1.00 0.00 H new ATOM 930 N LYS A 97 -4.540 17.589 -7.346 1.00 0.00 N ATOM 931 CA LYS A 97 -5.441 17.287 -6.194 1.00 0.00 C ATOM 932 C LYS A 97 -6.268 16.032 -6.505 1.00 0.00 C ATOM 933 O LYS A 97 -6.130 15.027 -5.837 1.00 0.00 O ATOM 934 CB LYS A 97 -6.328 18.532 -6.028 1.00 0.00 C ATOM 935 CG LYS A 97 -7.645 18.157 -5.343 1.00 0.00 C ATOM 936 CD LYS A 97 -7.933 19.157 -4.222 1.00 0.00 C ATOM 937 CE LYS A 97 -6.943 18.934 -3.073 1.00 0.00 C ATOM 938 NZ LYS A 97 -5.866 19.946 -3.279 1.00 0.00 N ATOM 0 H LYS A 97 -4.462 16.843 -8.037 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.896 17.080 -5.273 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -5.804 19.284 -5.438 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.530 18.976 -7.003 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.459 18.161 -6.068 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.583 17.147 -4.938 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -7.847 20.176 -4.598 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.955 19.035 -3.865 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -7.427 19.066 -2.105 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -6.540 17.921 -3.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -4.974 19.462 -3.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -6.128 20.577 -4.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -5.745 20.506 -2.411 1.00 0.00 H new ATOM 952 N PRO A 98 -7.091 16.117 -7.522 1.00 0.00 N ATOM 953 CA PRO A 98 -7.917 14.952 -7.918 1.00 0.00 C ATOM 954 C PRO A 98 -7.029 13.889 -8.567 1.00 0.00 C ATOM 955 O PRO A 98 -7.410 12.742 -8.695 1.00 0.00 O ATOM 956 CB PRO A 98 -8.902 15.532 -8.928 1.00 0.00 C ATOM 957 CG PRO A 98 -8.214 16.737 -9.481 1.00 0.00 C ATOM 958 CD PRO A 98 -7.335 17.280 -8.384 1.00 0.00 C ATOM 0 HA PRO A 98 -8.420 14.470 -7.080 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -9.133 14.813 -9.714 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -9.846 15.798 -8.452 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -7.621 16.475 -10.357 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -8.941 17.485 -9.800 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -6.405 17.686 -8.781 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -7.827 18.086 -7.839 1.00 0.00 H new ATOM 966 N PHE A 99 -5.837 14.254 -8.968 1.00 0.00 N ATOM 967 CA PHE A 99 -4.937 13.253 -9.590 1.00 0.00 C ATOM 968 C PHE A 99 -4.895 12.007 -8.716 1.00 0.00 C ATOM 969 O PHE A 99 -5.032 10.895 -9.186 1.00 0.00 O ATOM 970 CB PHE A 99 -3.562 13.905 -9.629 1.00 0.00 C ATOM 971 CG PHE A 99 -2.517 12.833 -9.830 1.00 0.00 C ATOM 972 CD1 PHE A 99 -2.095 12.050 -8.746 1.00 0.00 C ATOM 973 CD2 PHE A 99 -1.982 12.616 -11.101 1.00 0.00 C ATOM 974 CE1 PHE A 99 -1.134 11.051 -8.939 1.00 0.00 C ATOM 975 CE2 PHE A 99 -1.021 11.617 -11.295 1.00 0.00 C ATOM 976 CZ PHE A 99 -0.596 10.835 -10.213 1.00 0.00 C ATOM 0 H PHE A 99 -5.456 15.197 -8.890 1.00 0.00 H new ATOM 0 HA PHE A 99 -5.270 12.960 -10.586 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -3.514 14.635 -10.437 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -3.374 14.445 -8.701 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -2.511 12.218 -7.764 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -2.310 13.219 -11.935 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -0.808 10.447 -8.105 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -0.607 11.449 -12.278 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.147 10.065 -10.362 1.00 0.00 H new ATOM 986 N SER A 100 -4.691 12.210 -7.442 1.00 0.00 N ATOM 987 CA SER A 100 -4.620 11.075 -6.482 1.00 0.00 C ATOM 988 C SER A 100 -5.534 9.934 -6.924 1.00 0.00 C ATOM 989 O SER A 100 -5.098 8.830 -7.186 1.00 0.00 O ATOM 990 CB SER A 100 -5.110 11.661 -5.158 1.00 0.00 C ATOM 991 OG SER A 100 -5.545 10.608 -4.308 1.00 0.00 O ATOM 0 H SER A 100 -4.569 13.131 -7.021 1.00 0.00 H new ATOM 0 HA SER A 100 -3.615 10.660 -6.411 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.309 12.223 -4.678 1.00 0.00 H new ATOM 0 HB3 SER A 100 -5.927 12.360 -5.337 1.00 0.00 H new ATOM 0 HG SER A 100 -6.267 10.931 -3.730 1.00 0.00 H new ATOM 997 N VAL A 101 -6.801 10.188 -6.994 1.00 0.00 N ATOM 998 CA VAL A 101 -7.742 9.114 -7.388 1.00 0.00 C ATOM 999 C VAL A 101 -7.836 8.935 -8.906 1.00 0.00 C ATOM 1000 O VAL A 101 -7.642 7.851 -9.415 1.00 0.00 O ATOM 1001 CB VAL A 101 -9.048 9.534 -6.792 1.00 0.00 C ATOM 1002 CG1 VAL A 101 -10.195 8.775 -7.456 1.00 0.00 C ATOM 1003 CG2 VAL A 101 -9.018 9.235 -5.295 1.00 0.00 C ATOM 0 H VAL A 101 -7.228 11.093 -6.796 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.414 8.138 -7.029 1.00 0.00 H new ATOM 0 HB VAL A 101 -9.203 10.601 -6.953 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -11.142 9.088 -7.015 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -10.203 8.990 -8.524 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -10.060 7.704 -7.303 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -9.964 9.536 -4.845 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -8.866 8.167 -5.140 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -8.203 9.789 -4.830 1.00 0.00 H new ATOM 1013 N TYR A 102 -8.126 9.970 -9.639 1.00 0.00 N ATOM 1014 CA TYR A 102 -8.218 9.807 -11.118 1.00 0.00 C ATOM 1015 C TYR A 102 -7.005 9.010 -11.606 1.00 0.00 C ATOM 1016 O TYR A 102 -7.063 8.267 -12.576 1.00 0.00 O ATOM 1017 CB TYR A 102 -8.186 11.234 -11.670 1.00 0.00 C ATOM 1018 CG TYR A 102 -9.203 11.385 -12.779 1.00 0.00 C ATOM 1019 CD1 TYR A 102 -10.524 11.738 -12.476 1.00 0.00 C ATOM 1020 CD2 TYR A 102 -8.820 11.187 -14.111 1.00 0.00 C ATOM 1021 CE1 TYR A 102 -11.461 11.892 -13.505 1.00 0.00 C ATOM 1022 CE2 TYR A 102 -9.758 11.340 -15.139 1.00 0.00 C ATOM 1023 CZ TYR A 102 -11.078 11.693 -14.837 1.00 0.00 C ATOM 1024 OH TYR A 102 -12.001 11.847 -15.851 1.00 0.00 O ATOM 0 H TYR A 102 -8.302 10.911 -9.287 1.00 0.00 H new ATOM 0 HA TYR A 102 -9.113 9.274 -11.438 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -8.398 11.946 -10.872 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -7.189 11.464 -12.046 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -10.820 11.891 -11.449 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.801 10.916 -14.345 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -12.480 12.164 -13.271 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -9.463 11.185 -16.166 1.00 0.00 H new ATOM 0 HH TYR A 102 -11.571 11.673 -16.714 1.00 0.00 H new ATOM 1034 N ASP A 103 -5.909 9.141 -10.915 1.00 0.00 N ATOM 1035 CA ASP A 103 -4.688 8.396 -11.309 1.00 0.00 C ATOM 1036 C ASP A 103 -4.762 6.977 -10.763 1.00 0.00 C ATOM 1037 O ASP A 103 -4.351 6.034 -11.408 1.00 0.00 O ATOM 1038 CB ASP A 103 -3.529 9.161 -10.668 1.00 0.00 C ATOM 1039 CG ASP A 103 -2.207 8.684 -11.272 1.00 0.00 C ATOM 1040 OD1 ASP A 103 -2.099 8.685 -12.488 1.00 0.00 O ATOM 1041 OD2 ASP A 103 -1.326 8.328 -10.508 1.00 0.00 O ATOM 0 H ASP A 103 -5.808 9.735 -10.092 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.570 8.323 -12.390 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -3.651 10.232 -10.832 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -3.527 9.002 -9.590 1.00 0.00 H new ATOM 1046 N LEU A 104 -5.294 6.809 -9.584 1.00 0.00 N ATOM 1047 CA LEU A 104 -5.391 5.439 -9.028 1.00 0.00 C ATOM 1048 C LEU A 104 -6.411 4.634 -9.837 1.00 0.00 C ATOM 1049 O LEU A 104 -6.384 3.428 -9.850 1.00 0.00 O ATOM 1050 CB LEU A 104 -5.815 5.623 -7.559 1.00 0.00 C ATOM 1051 CG LEU A 104 -7.339 5.581 -7.410 1.00 0.00 C ATOM 1052 CD1 LEU A 104 -7.834 4.140 -7.527 1.00 0.00 C ATOM 1053 CD2 LEU A 104 -7.721 6.130 -6.037 1.00 0.00 C ATOM 0 H LEU A 104 -5.660 7.554 -8.991 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.454 4.885 -9.082 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.366 4.840 -6.948 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.437 6.575 -7.186 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.795 6.183 -8.196 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.919 4.118 -7.420 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.557 3.738 -8.502 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.380 3.534 -6.743 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -8.805 6.103 -5.923 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -7.259 5.520 -5.260 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.372 7.159 -5.946 1.00 0.00 H new ATOM 1065 N LEU A 105 -7.307 5.290 -10.522 1.00 0.00 N ATOM 1066 CA LEU A 105 -8.313 4.536 -11.326 1.00 0.00 C ATOM 1067 C LEU A 105 -7.757 4.223 -12.717 1.00 0.00 C ATOM 1068 O LEU A 105 -8.130 3.247 -13.336 1.00 0.00 O ATOM 1069 CB LEU A 105 -9.527 5.460 -11.432 1.00 0.00 C ATOM 1070 CG LEU A 105 -9.975 5.879 -10.034 1.00 0.00 C ATOM 1071 CD1 LEU A 105 -10.540 7.299 -10.083 1.00 0.00 C ATOM 1072 CD2 LEU A 105 -11.056 4.919 -9.535 1.00 0.00 C ATOM 0 H LEU A 105 -7.387 6.306 -10.561 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.570 3.583 -10.863 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -9.276 6.340 -12.024 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -10.341 4.950 -11.948 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.122 5.850 -9.356 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -10.860 7.598 -9.085 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -9.771 7.985 -10.438 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -11.393 7.328 -10.761 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -11.376 5.218 -8.537 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -11.909 4.947 -10.213 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -10.655 3.906 -9.499 1.00 0.00 H new ATOM 1084 N ILE A 106 -6.863 5.035 -13.212 1.00 0.00 N ATOM 1085 CA ILE A 106 -6.288 4.768 -14.556 1.00 0.00 C ATOM 1086 C ILE A 106 -4.947 4.046 -14.416 1.00 0.00 C ATOM 1087 O ILE A 106 -4.545 3.293 -15.280 1.00 0.00 O ATOM 1088 CB ILE A 106 -6.114 6.137 -15.202 1.00 0.00 C ATOM 1089 CG1 ILE A 106 -5.949 5.972 -16.715 1.00 0.00 C ATOM 1090 CG2 ILE A 106 -4.877 6.796 -14.628 1.00 0.00 C ATOM 1091 CD1 ILE A 106 -7.236 6.404 -17.421 1.00 0.00 C ATOM 0 H ILE A 106 -6.508 5.869 -12.744 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.928 4.126 -15.162 1.00 0.00 H new ATOM 0 HB ILE A 106 -6.990 6.754 -15.002 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.110 6.572 -17.067 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -5.721 4.933 -16.955 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.743 7.777 -15.084 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.992 6.909 -13.550 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.005 6.177 -14.837 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -7.117 6.286 -18.498 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -8.065 5.785 -17.077 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -7.444 7.449 -17.191 1.00 0.00 H new ATOM 1103 N ASN A 107 -4.251 4.268 -13.333 1.00 0.00 N ATOM 1104 CA ASN A 107 -2.942 3.587 -13.156 1.00 0.00 C ATOM 1105 C ASN A 107 -3.139 2.217 -12.500 1.00 0.00 C ATOM 1106 O ASN A 107 -2.398 1.293 -12.757 1.00 0.00 O ATOM 1107 CB ASN A 107 -2.093 4.536 -12.289 1.00 0.00 C ATOM 1108 CG ASN A 107 -2.415 4.388 -10.794 1.00 0.00 C ATOM 1109 OD1 ASN A 107 -2.616 3.299 -10.296 1.00 0.00 O ATOM 1110 ND2 ASN A 107 -2.441 5.456 -10.044 1.00 0.00 N ATOM 0 H ASN A 107 -4.531 4.886 -12.571 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.443 3.391 -14.105 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -1.035 4.331 -12.455 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.270 5.566 -12.598 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.629 5.373 -9.045 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.273 6.373 -10.457 1.00 0.00 H new ATOM 1117 N VAL A 108 -4.143 2.057 -11.674 1.00 0.00 N ATOM 1118 CA VAL A 108 -4.364 0.724 -11.031 1.00 0.00 C ATOM 1119 C VAL A 108 -4.754 -0.331 -12.077 1.00 0.00 C ATOM 1120 O VAL A 108 -4.973 -1.480 -11.753 1.00 0.00 O ATOM 1121 CB VAL A 108 -5.503 0.942 -10.039 1.00 0.00 C ATOM 1122 CG1 VAL A 108 -6.818 1.126 -10.802 1.00 0.00 C ATOM 1123 CG2 VAL A 108 -5.617 -0.269 -9.117 1.00 0.00 C ATOM 0 H VAL A 108 -4.813 2.783 -11.419 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.461 0.357 -10.543 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.299 1.833 -9.445 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.631 1.282 -10.093 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.739 1.992 -11.460 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.021 0.236 -11.397 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -6.431 -0.112 -8.409 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -5.819 -1.160 -9.711 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.682 -0.401 -8.572 1.00 0.00 H new ATOM 1133 N SER A 109 -4.843 0.062 -13.324 1.00 0.00 N ATOM 1134 CA SER A 109 -5.210 -0.880 -14.419 1.00 0.00 C ATOM 1135 C SER A 109 -4.765 -2.305 -14.142 1.00 0.00 C ATOM 1136 O SER A 109 -5.436 -3.248 -14.512 1.00 0.00 O ATOM 1137 CB SER A 109 -4.474 -0.329 -15.639 1.00 0.00 C ATOM 1138 OG SER A 109 -3.812 0.885 -15.296 1.00 0.00 O ATOM 0 H SER A 109 -4.672 1.019 -13.632 1.00 0.00 H new ATOM 0 HA SER A 109 -6.291 -0.937 -14.545 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.750 -1.060 -15.999 1.00 0.00 H new ATOM 0 HB3 SER A 109 -5.179 -0.152 -16.451 1.00 0.00 H new ATOM 0 HG SER A 109 -4.405 1.644 -15.478 1.00 0.00 H new ATOM 1144 N SER A 110 -3.664 -2.492 -13.495 1.00 0.00 N ATOM 1145 CA SER A 110 -3.237 -3.888 -13.208 1.00 0.00 C ATOM 1146 C SER A 110 -3.925 -4.381 -11.940 1.00 0.00 C ATOM 1147 O SER A 110 -3.372 -5.151 -11.182 1.00 0.00 O ATOM 1148 CB SER A 110 -1.730 -3.833 -13.014 1.00 0.00 C ATOM 1149 OG SER A 110 -1.435 -3.146 -11.805 1.00 0.00 O ATOM 0 H SER A 110 -3.044 -1.757 -13.154 1.00 0.00 H new ATOM 0 HA SER A 110 -3.503 -4.572 -14.014 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.319 -4.842 -12.981 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.262 -3.325 -13.857 1.00 0.00 H new ATOM 0 HG SER A 110 -2.165 -2.527 -11.594 1.00 0.00 H new ATOM 1155 N THR A 111 -5.135 -3.947 -11.705 1.00 0.00 N ATOM 1156 CA THR A 111 -5.847 -4.406 -10.483 1.00 0.00 C ATOM 1157 C THR A 111 -6.757 -5.581 -10.841 1.00 0.00 C ATOM 1158 O THR A 111 -7.904 -5.642 -10.444 1.00 0.00 O ATOM 1159 CB THR A 111 -6.667 -3.208 -10.027 1.00 0.00 C ATOM 1160 OG1 THR A 111 -7.172 -3.446 -8.721 1.00 0.00 O ATOM 1161 CG2 THR A 111 -7.821 -3.001 -10.995 1.00 0.00 C ATOM 0 H THR A 111 -5.654 -3.302 -12.301 1.00 0.00 H new ATOM 0 HA THR A 111 -5.169 -4.745 -9.700 1.00 0.00 H new ATOM 0 HB THR A 111 -6.040 -2.316 -10.009 1.00 0.00 H new ATOM 0 HG1 THR A 111 -7.001 -4.378 -8.469 1.00 0.00 H new ATOM 0 HG21 THR A 111 -8.414 -2.144 -10.676 1.00 0.00 H new ATOM 0 HG22 THR A 111 -7.428 -2.818 -11.995 1.00 0.00 H new ATOM 0 HG23 THR A 111 -8.449 -3.892 -11.009 1.00 0.00 H new ATOM 1169 N VAL A 112 -6.254 -6.500 -11.612 1.00 0.00 N ATOM 1170 CA VAL A 112 -7.078 -7.668 -12.037 1.00 0.00 C ATOM 1171 C VAL A 112 -7.524 -8.497 -10.825 1.00 0.00 C ATOM 1172 O VAL A 112 -8.682 -8.837 -10.690 1.00 0.00 O ATOM 1173 CB VAL A 112 -6.165 -8.475 -12.976 1.00 0.00 C ATOM 1174 CG1 VAL A 112 -5.367 -9.528 -12.195 1.00 0.00 C ATOM 1175 CG2 VAL A 112 -7.024 -9.173 -14.033 1.00 0.00 C ATOM 0 H VAL A 112 -5.299 -6.494 -11.971 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.998 -7.365 -12.537 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.462 -7.791 -13.451 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.730 -10.085 -12.882 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -4.749 -9.034 -11.446 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -6.055 -10.214 -11.702 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -6.383 -9.747 -14.702 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -7.730 -9.844 -13.543 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -7.572 -8.426 -14.608 1.00 0.00 H new ATOM 1185 N GLY A 113 -6.619 -8.826 -9.947 1.00 0.00 N ATOM 1186 CA GLY A 113 -7.007 -9.632 -8.758 1.00 0.00 C ATOM 1187 C GLY A 113 -8.106 -8.901 -7.988 1.00 0.00 C ATOM 1188 O GLY A 113 -9.267 -9.251 -8.057 1.00 0.00 O ATOM 0 H GLY A 113 -5.632 -8.573 -10.001 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -7.359 -10.615 -9.070 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -6.142 -9.792 -8.115 1.00 0.00 H new ATOM 1192 N ARG A 114 -7.744 -7.892 -7.246 1.00 0.00 N ATOM 1193 CA ARG A 114 -8.734 -7.140 -6.466 1.00 0.00 C ATOM 1194 C ARG A 114 -8.201 -5.742 -6.148 1.00 0.00 C ATOM 1195 O ARG A 114 -7.201 -5.322 -6.687 1.00 0.00 O ATOM 1196 CB ARG A 114 -8.886 -7.959 -5.209 1.00 0.00 C ATOM 1197 CG ARG A 114 -10.285 -7.761 -4.622 1.00 0.00 C ATOM 1198 CD ARG A 114 -10.171 -7.229 -3.191 1.00 0.00 C ATOM 1199 NE ARG A 114 -11.367 -7.766 -2.486 1.00 0.00 N ATOM 1200 CZ ARG A 114 -12.565 -7.450 -2.897 1.00 0.00 C ATOM 1201 NH1 ARG A 114 -13.112 -6.329 -2.514 1.00 0.00 N ATOM 1202 NH2 ARG A 114 -13.218 -8.257 -3.689 1.00 0.00 N ATOM 0 H ARG A 114 -6.784 -7.560 -7.153 1.00 0.00 H new ATOM 0 HA ARG A 114 -9.679 -6.995 -6.989 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -8.721 -9.014 -5.430 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -8.131 -7.664 -4.480 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -10.853 -7.062 -5.236 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -10.830 -8.705 -4.627 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -9.249 -7.565 -2.717 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -10.159 -6.139 -3.174 1.00 0.00 H new ATOM 0 HE ARG A 114 -11.250 -8.381 -1.681 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -12.603 -5.699 -1.893 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -14.048 -6.082 -2.835 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -12.792 -9.135 -3.987 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -14.154 -8.010 -4.010 1.00 0.00 H new ATOM 1216 N ALA A 115 -8.855 -5.016 -5.280 1.00 0.00 N ATOM 1217 CA ALA A 115 -8.362 -3.649 -4.947 1.00 0.00 C ATOM 1218 C ALA A 115 -9.125 -3.064 -3.757 1.00 0.00 C ATOM 1219 O ALA A 115 -10.067 -2.314 -3.923 1.00 0.00 O ATOM 1220 CB ALA A 115 -8.622 -2.819 -6.203 1.00 0.00 C ATOM 0 H ALA A 115 -9.702 -5.308 -4.792 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.309 -3.658 -4.665 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -8.286 -1.795 -6.039 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -8.077 -3.250 -7.043 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -9.689 -2.819 -6.425 1.00 0.00 H new ATOM 1226 N TYR A 116 -8.715 -3.373 -2.557 1.00 0.00 N ATOM 1227 CA TYR A 116 -9.415 -2.796 -1.375 1.00 0.00 C ATOM 1228 C TYR A 116 -9.104 -1.302 -1.314 1.00 0.00 C ATOM 1229 O TYR A 116 -8.006 -0.899 -0.983 1.00 0.00 O ATOM 1230 CB TYR A 116 -8.846 -3.526 -0.155 1.00 0.00 C ATOM 1231 CG TYR A 116 -9.781 -3.349 1.019 1.00 0.00 C ATOM 1232 CD1 TYR A 116 -9.944 -2.084 1.599 1.00 0.00 C ATOM 1233 CD2 TYR A 116 -10.484 -4.448 1.529 1.00 0.00 C ATOM 1234 CE1 TYR A 116 -10.809 -1.919 2.687 1.00 0.00 C ATOM 1235 CE2 TYR A 116 -11.349 -4.281 2.619 1.00 0.00 C ATOM 1236 CZ TYR A 116 -11.512 -3.017 3.198 1.00 0.00 C ATOM 1237 OH TYR A 116 -12.364 -2.853 4.271 1.00 0.00 O ATOM 0 H TYR A 116 -7.934 -3.994 -2.345 1.00 0.00 H new ATOM 0 HA TYR A 116 -10.498 -2.914 -1.420 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -8.721 -4.586 -0.378 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -7.859 -3.133 0.090 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -9.402 -1.236 1.207 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -10.360 -5.423 1.083 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -10.934 -0.943 3.133 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -11.890 -5.128 3.013 1.00 0.00 H new ATOM 0 HH TYR A 116 -12.773 -3.714 4.499 1.00 0.00 H new ATOM 1247 N THR A 117 -10.050 -0.478 -1.664 1.00 0.00 N ATOM 1248 CA THR A 117 -9.795 0.989 -1.660 1.00 0.00 C ATOM 1249 C THR A 117 -9.878 1.553 -0.243 1.00 0.00 C ATOM 1250 O THR A 117 -10.654 1.103 0.576 1.00 0.00 O ATOM 1251 CB THR A 117 -10.898 1.581 -2.538 1.00 0.00 C ATOM 1252 OG1 THR A 117 -10.619 1.297 -3.902 1.00 0.00 O ATOM 1253 CG2 THR A 117 -10.963 3.094 -2.332 1.00 0.00 C ATOM 0 H THR A 117 -10.988 -0.756 -1.952 1.00 0.00 H new ATOM 0 HA THR A 117 -8.798 1.230 -2.029 1.00 0.00 H new ATOM 0 HB THR A 117 -11.856 1.140 -2.263 1.00 0.00 H new ATOM 0 HG1 THR A 117 -11.326 1.674 -4.466 1.00 0.00 H new ATOM 0 HG21 THR A 117 -11.750 3.513 -2.959 1.00 0.00 H new ATOM 0 HG22 THR A 117 -11.179 3.310 -1.286 1.00 0.00 H new ATOM 0 HG23 THR A 117 -10.006 3.540 -2.604 1.00 0.00 H new ATOM 1261 N LEU A 118 -9.076 2.541 0.046 1.00 0.00 N ATOM 1262 CA LEU A 118 -9.095 3.149 1.404 1.00 0.00 C ATOM 1263 C LEU A 118 -9.357 4.639 1.309 1.00 0.00 C ATOM 1264 O LEU A 118 -8.653 5.435 1.895 1.00 0.00 O ATOM 1265 CB LEU A 118 -7.712 2.875 1.996 1.00 0.00 C ATOM 1266 CG LEU A 118 -7.865 2.457 3.460 1.00 0.00 C ATOM 1267 CD1 LEU A 118 -8.720 3.489 4.198 1.00 0.00 C ATOM 1268 CD2 LEU A 118 -8.547 1.089 3.531 1.00 0.00 C ATOM 0 H LEU A 118 -8.406 2.954 -0.603 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.884 2.730 2.028 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -7.211 2.089 1.431 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -7.089 3.766 1.923 1.00 0.00 H new ATOM 0 HG LEU A 118 -6.881 2.399 3.926 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -8.829 3.192 5.241 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -8.237 4.465 4.147 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -9.704 3.547 3.732 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -8.656 0.791 4.574 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -9.531 1.148 3.065 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -7.940 0.352 3.004 1.00 0.00 H new ATOM 1280 N GLY A 119 -10.379 5.019 0.586 1.00 0.00 N ATOM 1281 CA GLY A 119 -10.723 6.464 0.458 1.00 0.00 C ATOM 1282 C GLY A 119 -9.591 7.238 -0.204 1.00 0.00 C ATOM 1283 O GLY A 119 -9.771 7.901 -1.206 1.00 0.00 O ATOM 0 H GLY A 119 -10.993 4.384 0.076 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -11.635 6.574 -0.129 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -10.926 6.882 1.444 1.00 0.00 H new ATOM 1287 N THR A 120 -8.438 7.175 0.370 1.00 0.00 N ATOM 1288 CA THR A 120 -7.277 7.926 -0.188 1.00 0.00 C ATOM 1289 C THR A 120 -6.219 6.976 -0.760 1.00 0.00 C ATOM 1290 O THR A 120 -5.337 7.390 -1.486 1.00 0.00 O ATOM 1291 CB THR A 120 -6.708 8.705 0.999 1.00 0.00 C ATOM 1292 OG1 THR A 120 -5.454 9.262 0.637 1.00 0.00 O ATOM 1293 CG2 THR A 120 -6.524 7.765 2.191 1.00 0.00 C ATOM 0 H THR A 120 -8.238 6.633 1.211 1.00 0.00 H new ATOM 0 HA THR A 120 -7.577 8.576 -1.010 1.00 0.00 H new ATOM 0 HB THR A 120 -7.398 9.503 1.274 1.00 0.00 H new ATOM 0 HG1 THR A 120 -5.088 9.763 1.395 1.00 0.00 H new ATOM 0 HG21 THR A 120 -6.118 8.323 3.035 1.00 0.00 H new ATOM 0 HG22 THR A 120 -7.487 7.336 2.468 1.00 0.00 H new ATOM 0 HG23 THR A 120 -5.835 6.965 1.920 1.00 0.00 H new ATOM 1301 N LYS A 121 -6.282 5.712 -0.440 1.00 0.00 N ATOM 1302 CA LYS A 121 -5.251 4.771 -0.983 1.00 0.00 C ATOM 1303 C LYS A 121 -5.873 3.410 -1.302 1.00 0.00 C ATOM 1304 O LYS A 121 -6.822 2.995 -0.670 1.00 0.00 O ATOM 1305 CB LYS A 121 -4.207 4.639 0.131 1.00 0.00 C ATOM 1306 CG LYS A 121 -4.898 4.419 1.481 1.00 0.00 C ATOM 1307 CD LYS A 121 -3.940 4.809 2.607 1.00 0.00 C ATOM 1308 CE LYS A 121 -3.635 3.584 3.470 1.00 0.00 C ATOM 1309 NZ LYS A 121 -2.169 3.366 3.321 1.00 0.00 N ATOM 0 H LYS A 121 -6.989 5.292 0.163 1.00 0.00 H new ATOM 0 HA LYS A 121 -4.815 5.137 -1.912 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.539 3.805 -0.084 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.592 5.538 0.171 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -5.808 5.016 1.539 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -5.195 3.375 1.585 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.017 5.211 2.189 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.382 5.596 3.218 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -3.905 3.757 4.512 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -4.200 2.714 3.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -1.882 2.541 3.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.943 3.197 2.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -1.657 4.208 3.654 1.00 0.00 H new ATOM 1323 N PHE A 122 -5.344 2.697 -2.270 1.00 0.00 N ATOM 1324 CA PHE A 122 -5.930 1.363 -2.585 1.00 0.00 C ATOM 1325 C PHE A 122 -4.863 0.274 -2.519 1.00 0.00 C ATOM 1326 O PHE A 122 -3.677 0.545 -2.518 1.00 0.00 O ATOM 1327 CB PHE A 122 -6.575 1.479 -3.986 1.00 0.00 C ATOM 1328 CG PHE A 122 -5.567 1.488 -5.136 1.00 0.00 C ATOM 1329 CD1 PHE A 122 -4.647 0.437 -5.319 1.00 0.00 C ATOM 1330 CD2 PHE A 122 -5.602 2.541 -6.069 1.00 0.00 C ATOM 1331 CE1 PHE A 122 -3.777 0.450 -6.417 1.00 0.00 C ATOM 1332 CE2 PHE A 122 -4.725 2.548 -7.161 1.00 0.00 C ATOM 1333 CZ PHE A 122 -3.815 1.502 -7.337 1.00 0.00 C ATOM 0 H PHE A 122 -4.548 2.977 -2.843 1.00 0.00 H new ATOM 0 HA PHE A 122 -6.687 1.076 -1.855 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -7.264 0.647 -4.127 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -7.167 2.394 -4.028 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.612 -0.379 -4.613 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -6.309 3.348 -5.942 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -3.073 -0.357 -6.554 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -4.752 3.363 -7.869 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.142 1.506 -8.182 1.00 0.00 H new ATOM 1343 N THR A 123 -5.281 -0.962 -2.457 1.00 0.00 N ATOM 1344 CA THR A 123 -4.318 -2.074 -2.383 1.00 0.00 C ATOM 1345 C THR A 123 -4.851 -3.275 -3.166 1.00 0.00 C ATOM 1346 O THR A 123 -5.994 -3.663 -3.023 1.00 0.00 O ATOM 1347 CB THR A 123 -4.189 -2.394 -0.887 1.00 0.00 C ATOM 1348 OG1 THR A 123 -2.972 -3.083 -0.652 1.00 0.00 O ATOM 1349 CG2 THR A 123 -5.364 -3.264 -0.435 1.00 0.00 C ATOM 0 H THR A 123 -6.262 -1.241 -2.455 1.00 0.00 H new ATOM 0 HA THR A 123 -3.350 -1.823 -2.817 1.00 0.00 H new ATOM 0 HB THR A 123 -4.196 -1.462 -0.322 1.00 0.00 H new ATOM 0 HG1 THR A 123 -2.598 -3.387 -1.505 1.00 0.00 H new ATOM 0 HG21 THR A 123 -5.265 -3.486 0.627 1.00 0.00 H new ATOM 0 HG22 THR A 123 -6.299 -2.731 -0.608 1.00 0.00 H new ATOM 0 HG23 THR A 123 -5.367 -4.195 -1.002 1.00 0.00 H new ATOM 1357 N ILE A 124 -4.039 -3.858 -4.001 1.00 0.00 N ATOM 1358 CA ILE A 124 -4.510 -5.023 -4.801 1.00 0.00 C ATOM 1359 C ILE A 124 -3.993 -6.335 -4.202 1.00 0.00 C ATOM 1360 O ILE A 124 -3.059 -6.352 -3.423 1.00 0.00 O ATOM 1361 CB ILE A 124 -3.919 -4.809 -6.196 1.00 0.00 C ATOM 1362 CG1 ILE A 124 -4.685 -3.697 -6.920 1.00 0.00 C ATOM 1363 CG2 ILE A 124 -4.037 -6.105 -6.999 1.00 0.00 C ATOM 1364 CD1 ILE A 124 -4.412 -2.352 -6.248 1.00 0.00 C ATOM 0 H ILE A 124 -3.071 -3.580 -4.165 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.598 -5.092 -4.818 1.00 0.00 H new ATOM 0 HB ILE A 124 -2.871 -4.524 -6.103 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.383 -3.658 -7.967 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.754 -3.911 -6.904 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -3.617 -5.956 -7.994 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -3.492 -6.899 -6.490 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.087 -6.384 -7.087 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -4.960 -1.567 -6.769 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -4.736 -2.392 -5.208 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.344 -2.136 -6.287 1.00 0.00 H new ATOM 1376 N THR A 125 -4.590 -7.437 -4.570 1.00 0.00 N ATOM 1377 CA THR A 125 -4.135 -8.754 -4.039 1.00 0.00 C ATOM 1378 C THR A 125 -4.455 -9.860 -5.050 1.00 0.00 C ATOM 1379 O THR A 125 -4.920 -9.597 -6.142 1.00 0.00 O ATOM 1380 CB THR A 125 -4.921 -8.957 -2.742 1.00 0.00 C ATOM 1381 OG1 THR A 125 -4.677 -10.264 -2.240 1.00 0.00 O ATOM 1382 CG2 THR A 125 -6.414 -8.782 -3.014 1.00 0.00 C ATOM 0 H THR A 125 -5.376 -7.481 -5.218 1.00 0.00 H new ATOM 0 HA THR A 125 -3.060 -8.784 -3.863 1.00 0.00 H new ATOM 0 HB THR A 125 -4.601 -8.220 -2.005 1.00 0.00 H new ATOM 0 HG1 THR A 125 -5.179 -10.394 -1.408 1.00 0.00 H new ATOM 0 HG21 THR A 125 -6.972 -8.927 -2.089 1.00 0.00 H new ATOM 0 HG22 THR A 125 -6.599 -7.778 -3.396 1.00 0.00 H new ATOM 0 HG23 THR A 125 -6.738 -9.516 -3.752 1.00 0.00 H new ATOM 1390 N SER A 126 -4.208 -11.094 -4.705 1.00 0.00 N ATOM 1391 CA SER A 126 -4.496 -12.203 -5.661 1.00 0.00 C ATOM 1392 C SER A 126 -5.708 -13.013 -5.200 1.00 0.00 C ATOM 1393 O SER A 126 -6.625 -13.259 -5.955 1.00 0.00 O ATOM 1394 CB SER A 126 -3.243 -13.074 -5.649 1.00 0.00 C ATOM 1395 OG SER A 126 -3.509 -14.284 -6.345 1.00 0.00 O ATOM 0 H SER A 126 -3.821 -11.383 -3.807 1.00 0.00 H new ATOM 0 HA SER A 126 -4.728 -11.828 -6.658 1.00 0.00 H new ATOM 0 HB2 SER A 126 -2.413 -12.545 -6.118 1.00 0.00 H new ATOM 0 HB3 SER A 126 -2.944 -13.289 -4.623 1.00 0.00 H new ATOM 0 HG SER A 126 -3.849 -14.955 -5.717 1.00 0.00 H new