USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=15 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 Set 1.1: A 125 THR OG1 : rot 180:sc= 0.0782 USER MOD Set 1.2: A 126 SER OG : rot 140:sc= 0.0476 USER MOD Single : A 36 ASN : amide:sc= -1.58! C(o=-1.6!,f=-4.1!) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 165:sc= 1.04 (180deg=0.899) USER MOD Single : A 45 SER OG : rot 180:sc= -0.0312 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 165:sc= 0.529 (180deg=0.392) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -2.96! C(o=-3!,f=-5.9!) USER MOD Single : A 66 SER OG : rot 180:sc= -1.41! 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot -85:sc= -2.94! USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -11.1! C(o=-11!,f=-15!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -33:sc= 0.0583 USER MOD Single : A 111 THR OG1 : rot 114:sc= 0.388! 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= 0.0446 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 12 N ASN A 36 -1.717 -16.498 -7.259 1.00 0.00 N ATOM 13 CA ASN A 36 -1.320 -15.317 -6.440 1.00 0.00 C ATOM 14 C ASN A 36 -0.560 -14.306 -7.295 1.00 0.00 C ATOM 15 O ASN A 36 -0.785 -13.115 -7.218 1.00 0.00 O ATOM 16 CB ASN A 36 -0.403 -15.877 -5.354 1.00 0.00 C ATOM 17 CG ASN A 36 0.744 -16.661 -5.995 1.00 0.00 C ATOM 18 OD1 ASN A 36 0.593 -17.218 -7.064 1.00 0.00 O ATOM 19 ND2 ASN A 36 1.894 -16.729 -5.381 1.00 0.00 N ATOM 0 HA ASN A 36 -2.186 -14.800 -6.025 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -0.005 -15.064 -4.747 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -0.970 -16.526 -4.686 1.00 0.00 H new ATOM 0 HD21 ASN A 36 2.665 -17.250 -5.799 1.00 0.00 H new ATOM 0 HD22 ASN A 36 2.021 -16.261 -4.483 1.00 0.00 H new ATOM 26 N ALA A 37 0.350 -14.783 -8.095 1.00 0.00 N ATOM 27 CA ALA A 37 1.157 -13.888 -8.959 1.00 0.00 C ATOM 28 C ALA A 37 0.330 -12.693 -9.449 1.00 0.00 C ATOM 29 O ALA A 37 -0.525 -12.826 -10.302 1.00 0.00 O ATOM 30 CB ALA A 37 1.575 -14.772 -10.128 1.00 0.00 C ATOM 0 H ALA A 37 0.571 -15.775 -8.186 1.00 0.00 H new ATOM 0 HA ALA A 37 2.009 -13.462 -8.429 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.180 -14.192 -10.825 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.157 -15.615 -9.757 1.00 0.00 H new ATOM 0 HB3 ALA A 37 0.687 -15.142 -10.640 1.00 0.00 H new ATOM 36 N VAL A 38 0.583 -11.528 -8.918 1.00 0.00 N ATOM 37 CA VAL A 38 -0.179 -10.323 -9.355 1.00 0.00 C ATOM 38 C VAL A 38 0.799 -9.231 -9.792 1.00 0.00 C ATOM 39 O VAL A 38 1.906 -9.149 -9.299 1.00 0.00 O ATOM 40 CB VAL A 38 -0.972 -9.886 -8.122 1.00 0.00 C ATOM 41 CG1 VAL A 38 -0.023 -9.726 -6.935 1.00 0.00 C ATOM 42 CG2 VAL A 38 -1.662 -8.549 -8.405 1.00 0.00 C ATOM 0 H VAL A 38 1.286 -11.358 -8.199 1.00 0.00 H new ATOM 0 HA VAL A 38 -0.836 -10.522 -10.201 1.00 0.00 H new ATOM 0 HB VAL A 38 -1.723 -10.641 -7.889 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.588 -9.415 -6.057 1.00 0.00 H new ATOM 0 HG12 VAL A 38 0.469 -10.677 -6.732 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.728 -8.972 -7.169 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -2.227 -8.238 -7.526 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.911 -7.794 -8.639 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.340 -8.661 -9.251 1.00 0.00 H new ATOM 52 N VAL A 39 0.412 -8.397 -10.718 1.00 0.00 N ATOM 53 CA VAL A 39 1.341 -7.326 -11.181 1.00 0.00 C ATOM 54 C VAL A 39 0.923 -5.963 -10.637 1.00 0.00 C ATOM 55 O VAL A 39 -0.246 -5.635 -10.575 1.00 0.00 O ATOM 56 CB VAL A 39 1.232 -7.319 -12.707 1.00 0.00 C ATOM 57 CG1 VAL A 39 -0.196 -6.947 -13.117 1.00 0.00 C ATOM 58 CG2 VAL A 39 2.201 -6.277 -13.278 1.00 0.00 C ATOM 0 H VAL A 39 -0.501 -8.410 -11.172 1.00 0.00 H new ATOM 0 HA VAL A 39 2.357 -7.515 -10.834 1.00 0.00 H new ATOM 0 HB VAL A 39 1.479 -8.308 -13.092 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.273 -6.942 -14.204 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.894 -7.677 -12.707 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.439 -5.957 -12.732 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.127 -6.269 -14.365 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.946 -5.291 -12.889 1.00 0.00 H new ATOM 0 HG23 VAL A 39 3.220 -6.529 -12.986 1.00 0.00 H new ATOM 68 N LEU A 40 1.876 -5.148 -10.288 1.00 0.00 N ATOM 69 CA LEU A 40 1.551 -3.787 -9.804 1.00 0.00 C ATOM 70 C LEU A 40 1.797 -2.843 -10.979 1.00 0.00 C ATOM 71 O LEU A 40 2.463 -3.215 -11.921 1.00 0.00 O ATOM 72 CB LEU A 40 2.526 -3.535 -8.652 1.00 0.00 C ATOM 73 CG LEU A 40 2.674 -2.035 -8.407 1.00 0.00 C ATOM 74 CD1 LEU A 40 1.444 -1.517 -7.659 1.00 0.00 C ATOM 75 CD2 LEU A 40 3.925 -1.788 -7.562 1.00 0.00 C ATOM 0 H LEU A 40 2.871 -5.371 -10.319 1.00 0.00 H new ATOM 0 HA LEU A 40 0.526 -3.650 -9.458 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.166 -4.025 -7.747 1.00 0.00 H new ATOM 0 HB3 LEU A 40 3.497 -3.971 -8.886 1.00 0.00 H new ATOM 0 HG LEU A 40 2.764 -1.513 -9.360 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.549 -0.446 -7.484 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.551 -1.701 -8.256 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.355 -2.034 -6.704 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.038 -0.719 -7.383 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.829 -2.308 -6.609 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.801 -2.161 -8.092 1.00 0.00 H new ATOM 87 N VAL A 41 1.273 -1.652 -10.966 1.00 0.00 N ATOM 88 CA VAL A 41 1.492 -0.760 -12.137 1.00 0.00 C ATOM 89 C VAL A 41 1.120 0.690 -11.820 1.00 0.00 C ATOM 90 O VAL A 41 0.050 0.979 -11.321 1.00 0.00 O ATOM 91 CB VAL A 41 0.548 -1.314 -13.222 1.00 0.00 C ATOM 92 CG1 VAL A 41 0.188 -0.222 -14.223 1.00 0.00 C ATOM 93 CG2 VAL A 41 1.203 -2.484 -13.960 1.00 0.00 C ATOM 0 H VAL A 41 0.711 -1.261 -10.209 1.00 0.00 H new ATOM 0 HA VAL A 41 2.539 -0.748 -12.440 1.00 0.00 H new ATOM 0 HB VAL A 41 -0.360 -1.665 -12.731 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -0.479 -0.630 -14.982 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.310 0.597 -13.704 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.096 0.149 -14.699 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.521 -2.861 -14.722 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.124 -2.145 -14.434 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.431 -3.280 -13.251 1.00 0.00 H new ATOM 103 N LEU A 42 1.981 1.602 -12.162 1.00 0.00 N ATOM 104 CA LEU A 42 1.691 3.027 -11.957 1.00 0.00 C ATOM 105 C LEU A 42 2.269 3.812 -13.136 1.00 0.00 C ATOM 106 O LEU A 42 2.727 3.237 -14.103 1.00 0.00 O ATOM 107 CB LEU A 42 2.376 3.414 -10.658 1.00 0.00 C ATOM 108 CG LEU A 42 1.341 3.419 -9.542 1.00 0.00 C ATOM 109 CD1 LEU A 42 1.955 2.817 -8.280 1.00 0.00 C ATOM 110 CD2 LEU A 42 0.903 4.861 -9.277 1.00 0.00 C ATOM 0 H LEU A 42 2.889 1.407 -12.583 1.00 0.00 H new ATOM 0 HA LEU A 42 0.623 3.238 -11.900 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.176 2.710 -10.428 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.835 4.398 -10.752 1.00 0.00 H new ATOM 0 HG LEU A 42 0.474 2.825 -9.832 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.216 2.819 -7.479 1.00 0.00 H new ATOM 0 HD12 LEU A 42 2.269 1.793 -8.481 1.00 0.00 H new ATOM 0 HD13 LEU A 42 2.819 3.409 -7.978 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.161 4.875 -8.479 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.767 5.455 -8.980 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.468 5.282 -10.184 1.00 0.00 H new ATOM 122 N MET A 43 2.267 5.109 -13.073 1.00 0.00 N ATOM 123 CA MET A 43 2.837 5.895 -14.210 1.00 0.00 C ATOM 124 C MET A 43 4.272 6.321 -13.882 1.00 0.00 C ATOM 125 O MET A 43 4.644 6.454 -12.733 1.00 0.00 O ATOM 126 CB MET A 43 1.921 7.112 -14.360 1.00 0.00 C ATOM 127 CG MET A 43 2.222 8.127 -13.254 1.00 0.00 C ATOM 128 SD MET A 43 0.719 9.058 -12.865 1.00 0.00 S ATOM 129 CE MET A 43 1.453 10.184 -11.654 1.00 0.00 C ATOM 0 H MET A 43 1.902 5.660 -12.296 1.00 0.00 H new ATOM 0 HA MET A 43 2.883 5.318 -15.134 1.00 0.00 H new ATOM 0 HB2 MET A 43 2.068 7.571 -15.338 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.877 6.802 -14.307 1.00 0.00 H new ATOM 0 HG2 MET A 43 2.586 7.614 -12.364 1.00 0.00 H new ATOM 0 HG3 MET A 43 3.011 8.807 -13.575 1.00 0.00 H new ATOM 0 HE1 MET A 43 0.687 10.861 -11.276 1.00 0.00 H new ATOM 0 HE2 MET A 43 1.869 9.608 -10.827 1.00 0.00 H new ATOM 0 HE3 MET A 43 2.246 10.762 -12.128 1.00 0.00 H new ATOM 139 N LYS A 44 5.083 6.523 -14.885 1.00 0.00 N ATOM 140 CA LYS A 44 6.498 6.927 -14.636 1.00 0.00 C ATOM 141 C LYS A 44 6.565 8.157 -13.728 1.00 0.00 C ATOM 142 O LYS A 44 6.478 9.280 -14.182 1.00 0.00 O ATOM 143 CB LYS A 44 7.068 7.252 -16.017 1.00 0.00 C ATOM 144 CG LYS A 44 7.869 6.055 -16.533 1.00 0.00 C ATOM 145 CD LYS A 44 9.045 5.782 -15.593 1.00 0.00 C ATOM 146 CE LYS A 44 10.353 6.172 -16.285 1.00 0.00 C ATOM 147 NZ LYS A 44 10.777 4.948 -17.020 1.00 0.00 N ATOM 0 H LYS A 44 4.827 6.426 -15.868 1.00 0.00 H new ATOM 0 HA LYS A 44 7.059 6.140 -14.133 1.00 0.00 H new ATOM 0 HB2 LYS A 44 6.260 7.488 -16.709 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.707 8.133 -15.960 1.00 0.00 H new ATOM 0 HG2 LYS A 44 7.228 5.175 -16.596 1.00 0.00 H new ATOM 0 HG3 LYS A 44 8.234 6.256 -17.540 1.00 0.00 H new ATOM 0 HD2 LYS A 44 8.926 6.350 -14.670 1.00 0.00 H new ATOM 0 HD3 LYS A 44 9.067 4.728 -15.318 1.00 0.00 H new ATOM 0 HE2 LYS A 44 10.205 7.010 -16.966 1.00 0.00 H new ATOM 0 HE3 LYS A 44 11.107 6.479 -15.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 11.511 5.196 -17.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 11.158 4.253 -16.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 9.958 4.539 -17.514 1.00 0.00 H new ATOM 161 N SER A 45 6.738 7.955 -12.449 1.00 0.00 N ATOM 162 CA SER A 45 6.830 9.120 -11.523 1.00 0.00 C ATOM 163 C SER A 45 8.180 9.815 -11.717 1.00 0.00 C ATOM 164 O SER A 45 8.329 10.679 -12.556 1.00 0.00 O ATOM 165 CB SER A 45 6.723 8.524 -10.120 1.00 0.00 C ATOM 166 OG SER A 45 6.944 9.547 -9.157 1.00 0.00 O ATOM 0 H SER A 45 6.819 7.039 -12.008 1.00 0.00 H new ATOM 0 HA SER A 45 6.053 9.863 -11.700 1.00 0.00 H new ATOM 0 HB2 SER A 45 5.738 8.079 -9.975 1.00 0.00 H new ATOM 0 HB3 SER A 45 7.455 7.726 -9.994 1.00 0.00 H new ATOM 0 HG SER A 45 6.874 9.168 -8.256 1.00 0.00 H new ATOM 172 N ASP A 46 9.169 9.437 -10.954 1.00 0.00 N ATOM 173 CA ASP A 46 10.508 10.070 -11.107 1.00 0.00 C ATOM 174 C ASP A 46 11.602 9.150 -10.547 1.00 0.00 C ATOM 175 O ASP A 46 12.393 8.594 -11.280 1.00 0.00 O ATOM 176 CB ASP A 46 10.428 11.367 -10.303 1.00 0.00 C ATOM 177 CG ASP A 46 11.604 12.272 -10.675 1.00 0.00 C ATOM 178 OD1 ASP A 46 12.630 11.744 -11.073 1.00 0.00 O ATOM 179 OD2 ASP A 46 11.458 13.478 -10.557 1.00 0.00 O ATOM 0 H ASP A 46 9.107 8.718 -10.233 1.00 0.00 H new ATOM 0 HA ASP A 46 10.759 10.255 -12.151 1.00 0.00 H new ATOM 0 HB2 ASP A 46 9.486 11.876 -10.506 1.00 0.00 H new ATOM 0 HB3 ASP A 46 10.448 11.147 -9.236 1.00 0.00 H new ATOM 184 N GLU A 47 11.651 8.992 -9.253 1.00 0.00 N ATOM 185 CA GLU A 47 12.694 8.117 -8.641 1.00 0.00 C ATOM 186 C GLU A 47 12.133 6.724 -8.380 1.00 0.00 C ATOM 187 O GLU A 47 12.450 6.109 -7.391 1.00 0.00 O ATOM 188 CB GLU A 47 13.054 8.789 -7.316 1.00 0.00 C ATOM 189 CG GLU A 47 13.110 10.303 -7.507 1.00 0.00 C ATOM 190 CD GLU A 47 14.334 10.870 -6.785 1.00 0.00 C ATOM 191 OE1 GLU A 47 15.150 10.083 -6.337 1.00 0.00 O ATOM 192 OE2 GLU A 47 14.432 12.083 -6.693 1.00 0.00 O ATOM 0 H GLU A 47 11.012 9.432 -8.590 1.00 0.00 H new ATOM 0 HA GLU A 47 13.559 8.001 -9.294 1.00 0.00 H new ATOM 0 HB2 GLU A 47 12.315 8.535 -6.556 1.00 0.00 H new ATOM 0 HB3 GLU A 47 14.017 8.422 -6.960 1.00 0.00 H new ATOM 0 HG2 GLU A 47 13.159 10.543 -8.569 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.201 10.762 -7.118 1.00 0.00 H new ATOM 199 N ILE A 48 11.287 6.228 -9.235 1.00 0.00 N ATOM 200 CA ILE A 48 10.701 4.891 -9.001 1.00 0.00 C ATOM 201 C ILE A 48 11.772 3.834 -8.833 1.00 0.00 C ATOM 202 O ILE A 48 11.911 3.249 -7.780 1.00 0.00 O ATOM 203 CB ILE A 48 9.801 4.618 -10.174 1.00 0.00 C ATOM 204 CG1 ILE A 48 10.324 5.242 -11.467 1.00 0.00 C ATOM 205 CG2 ILE A 48 8.442 5.202 -9.826 1.00 0.00 C ATOM 206 CD1 ILE A 48 9.502 6.484 -11.771 1.00 0.00 C ATOM 0 H ILE A 48 10.978 6.695 -10.087 1.00 0.00 H new ATOM 0 HA ILE A 48 10.133 4.863 -8.071 1.00 0.00 H new ATOM 0 HB ILE A 48 9.750 3.544 -10.354 1.00 0.00 H new ATOM 0 HG12 ILE A 48 11.378 5.501 -11.363 1.00 0.00 H new ATOM 0 HG13 ILE A 48 10.251 4.529 -12.288 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.750 5.029 -10.650 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.060 4.723 -8.924 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.540 6.274 -9.654 1.00 0.00 H new ATOM 0 HD11 ILE A 48 9.862 6.942 -12.692 1.00 0.00 H new ATOM 0 HD12 ILE A 48 8.454 6.207 -11.889 1.00 0.00 H new ATOM 0 HD13 ILE A 48 9.599 7.194 -10.950 1.00 0.00 H new ATOM 218 N ASP A 49 12.535 3.583 -9.836 1.00 0.00 N ATOM 219 CA ASP A 49 13.604 2.559 -9.677 1.00 0.00 C ATOM 220 C ASP A 49 14.324 2.800 -8.344 1.00 0.00 C ATOM 221 O ASP A 49 14.725 1.877 -7.659 1.00 0.00 O ATOM 222 CB ASP A 49 14.556 2.765 -10.856 1.00 0.00 C ATOM 223 CG ASP A 49 14.687 1.458 -11.639 1.00 0.00 C ATOM 224 OD1 ASP A 49 13.753 0.671 -11.601 1.00 0.00 O ATOM 225 OD2 ASP A 49 15.717 1.262 -12.262 1.00 0.00 O ATOM 0 H ASP A 49 12.477 4.028 -10.752 1.00 0.00 H new ATOM 0 HA ASP A 49 13.215 1.541 -9.668 1.00 0.00 H new ATOM 0 HB2 ASP A 49 14.181 3.555 -11.506 1.00 0.00 H new ATOM 0 HB3 ASP A 49 15.534 3.086 -10.496 1.00 0.00 H new ATOM 230 N ALA A 50 14.459 4.044 -7.961 1.00 0.00 N ATOM 231 CA ALA A 50 15.127 4.368 -6.667 1.00 0.00 C ATOM 232 C ALA A 50 14.171 4.133 -5.504 1.00 0.00 C ATOM 233 O ALA A 50 14.510 3.465 -4.546 1.00 0.00 O ATOM 234 CB ALA A 50 15.505 5.848 -6.768 1.00 0.00 C ATOM 0 H ALA A 50 14.133 4.852 -8.492 1.00 0.00 H new ATOM 0 HA ALA A 50 16.000 3.740 -6.488 1.00 0.00 H new ATOM 0 HB1 ALA A 50 16.002 6.160 -5.850 1.00 0.00 H new ATOM 0 HB2 ALA A 50 16.178 5.995 -7.613 1.00 0.00 H new ATOM 0 HB3 ALA A 50 14.604 6.444 -6.913 1.00 0.00 H new ATOM 240 N ILE A 51 12.977 4.651 -5.565 1.00 0.00 N ATOM 241 CA ILE A 51 12.047 4.418 -4.469 1.00 0.00 C ATOM 242 C ILE A 51 11.590 2.970 -4.509 1.00 0.00 C ATOM 243 O ILE A 51 11.665 2.299 -3.530 1.00 0.00 O ATOM 244 CB ILE A 51 10.928 5.399 -4.710 1.00 0.00 C ATOM 245 CG1 ILE A 51 10.286 5.160 -6.060 1.00 0.00 C ATOM 246 CG2 ILE A 51 11.476 6.828 -4.642 1.00 0.00 C ATOM 247 CD1 ILE A 51 9.751 6.485 -6.627 1.00 0.00 C ATOM 0 H ILE A 51 12.621 5.222 -6.332 1.00 0.00 H new ATOM 0 HA ILE A 51 12.474 4.569 -3.478 1.00 0.00 H new ATOM 0 HB ILE A 51 10.170 5.260 -3.939 1.00 0.00 H new ATOM 0 HG12 ILE A 51 11.014 4.728 -6.747 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.473 4.441 -5.963 1.00 0.00 H new ATOM 0 HG21 ILE A 51 10.666 7.537 -4.816 1.00 0.00 H new ATOM 0 HG22 ILE A 51 11.908 7.006 -3.657 1.00 0.00 H new ATOM 0 HG23 ILE A 51 12.244 6.960 -5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 51 9.290 6.305 -7.598 1.00 0.00 H new ATOM 0 HD12 ILE A 51 9.009 6.900 -5.945 1.00 0.00 H new ATOM 0 HD13 ILE A 51 10.574 7.191 -6.740 1.00 0.00 H new ATOM 259 N ILE A 52 11.177 2.446 -5.631 1.00 0.00 N ATOM 260 CA ILE A 52 10.799 1.004 -5.643 1.00 0.00 C ATOM 261 C ILE A 52 11.896 0.227 -4.932 1.00 0.00 C ATOM 262 O ILE A 52 11.655 -0.671 -4.160 1.00 0.00 O ATOM 263 CB ILE A 52 10.769 0.602 -7.098 1.00 0.00 C ATOM 264 CG1 ILE A 52 9.706 1.408 -7.840 1.00 0.00 C ATOM 265 CG2 ILE A 52 10.435 -0.884 -7.184 1.00 0.00 C ATOM 266 CD1 ILE A 52 8.371 1.257 -7.114 1.00 0.00 C ATOM 0 H ILE A 52 11.086 2.939 -6.519 1.00 0.00 H new ATOM 0 HA ILE A 52 9.843 0.814 -5.155 1.00 0.00 H new ATOM 0 HB ILE A 52 11.739 0.797 -7.555 1.00 0.00 H new ATOM 0 HG12 ILE A 52 9.993 2.458 -7.885 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.617 1.057 -8.868 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.409 -1.191 -8.229 1.00 0.00 H new ATOM 0 HG22 ILE A 52 11.195 -1.459 -6.655 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.461 -1.065 -6.729 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.605 1.830 -7.637 1.00 0.00 H new ATOM 0 HD12 ILE A 52 8.086 0.205 -7.092 1.00 0.00 H new ATOM 0 HD13 ILE A 52 8.468 1.628 -6.094 1.00 0.00 H new ATOM 278 N GLU A 53 13.113 0.587 -5.181 1.00 0.00 N ATOM 279 CA GLU A 53 14.227 -0.114 -4.515 1.00 0.00 C ATOM 280 C GLU A 53 14.139 0.057 -2.996 1.00 0.00 C ATOM 281 O GLU A 53 13.989 -0.901 -2.263 1.00 0.00 O ATOM 282 CB GLU A 53 15.483 0.561 -5.052 1.00 0.00 C ATOM 283 CG GLU A 53 16.713 -0.261 -4.661 1.00 0.00 C ATOM 284 CD GLU A 53 17.920 0.666 -4.518 1.00 0.00 C ATOM 285 OE1 GLU A 53 18.340 1.220 -5.520 1.00 0.00 O ATOM 286 OE2 GLU A 53 18.406 0.807 -3.407 1.00 0.00 O ATOM 0 H GLU A 53 13.384 1.337 -5.817 1.00 0.00 H new ATOM 0 HA GLU A 53 14.215 -1.186 -4.711 1.00 0.00 H new ATOM 0 HB2 GLU A 53 15.424 0.653 -6.137 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.565 1.571 -4.651 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.530 -0.785 -3.723 1.00 0.00 H new ATOM 0 HG3 GLU A 53 16.912 -1.020 -5.417 1.00 0.00 H new ATOM 293 N ASP A 54 14.233 1.271 -2.521 1.00 0.00 N ATOM 294 CA ASP A 54 14.182 1.503 -1.038 1.00 0.00 C ATOM 295 C ASP A 54 12.747 1.487 -0.515 1.00 0.00 C ATOM 296 O ASP A 54 12.504 1.455 0.676 1.00 0.00 O ATOM 297 CB ASP A 54 14.785 2.888 -0.855 1.00 0.00 C ATOM 298 CG ASP A 54 14.786 3.259 0.630 1.00 0.00 C ATOM 299 OD1 ASP A 54 14.892 2.357 1.445 1.00 0.00 O ATOM 300 OD2 ASP A 54 14.681 4.437 0.926 1.00 0.00 O ATOM 0 H ASP A 54 14.342 2.111 -3.089 1.00 0.00 H new ATOM 0 HA ASP A 54 14.714 0.725 -0.490 1.00 0.00 H new ATOM 0 HB2 ASP A 54 15.803 2.906 -1.245 1.00 0.00 H new ATOM 0 HB3 ASP A 54 14.213 3.622 -1.423 1.00 0.00 H new ATOM 305 N ILE A 55 11.807 1.537 -1.397 1.00 0.00 N ATOM 306 CA ILE A 55 10.377 1.558 -0.989 1.00 0.00 C ATOM 307 C ILE A 55 9.718 0.208 -1.265 1.00 0.00 C ATOM 308 O ILE A 55 8.809 -0.211 -0.576 1.00 0.00 O ATOM 309 CB ILE A 55 9.766 2.667 -1.857 1.00 0.00 C ATOM 310 CG1 ILE A 55 8.662 3.381 -1.097 1.00 0.00 C ATOM 311 CG2 ILE A 55 9.164 2.074 -3.116 1.00 0.00 C ATOM 312 CD1 ILE A 55 9.252 4.101 0.116 1.00 0.00 C ATOM 0 H ILE A 55 11.964 1.565 -2.404 1.00 0.00 H new ATOM 0 HA ILE A 55 10.239 1.741 0.077 1.00 0.00 H new ATOM 0 HB ILE A 55 10.559 3.369 -2.114 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.163 4.097 -1.750 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.907 2.664 -0.774 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.734 2.870 -3.723 1.00 0.00 H new ATOM 0 HG22 ILE A 55 9.941 1.563 -3.685 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.384 1.362 -2.846 1.00 0.00 H new ATOM 0 HD11 ILE A 55 8.456 4.612 0.658 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.731 3.375 0.773 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.990 4.830 -0.217 1.00 0.00 H new ATOM 324 N VAL A 56 10.142 -0.447 -2.303 1.00 0.00 N ATOM 325 CA VAL A 56 9.513 -1.737 -2.670 1.00 0.00 C ATOM 326 C VAL A 56 10.497 -2.917 -2.580 1.00 0.00 C ATOM 327 O VAL A 56 10.152 -3.964 -2.069 1.00 0.00 O ATOM 328 CB VAL A 56 9.030 -1.503 -4.094 1.00 0.00 C ATOM 329 CG1 VAL A 56 8.775 -2.837 -4.778 1.00 0.00 C ATOM 330 CG2 VAL A 56 7.734 -0.693 -4.038 1.00 0.00 C ATOM 0 H VAL A 56 10.900 -0.143 -2.915 1.00 0.00 H new ATOM 0 HA VAL A 56 8.707 -2.015 -1.991 1.00 0.00 H new ATOM 0 HB VAL A 56 9.786 -0.960 -4.660 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.429 -2.663 -5.797 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.698 -3.416 -4.802 1.00 0.00 H new ATOM 0 HG13 VAL A 56 8.014 -3.389 -4.226 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.372 -0.515 -5.051 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.982 -1.248 -3.476 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.923 0.262 -3.547 1.00 0.00 H new ATOM 340 N LEU A 57 11.709 -2.783 -3.057 1.00 0.00 N ATOM 341 CA LEU A 57 12.647 -3.942 -2.958 1.00 0.00 C ATOM 342 C LEU A 57 12.902 -4.249 -1.483 1.00 0.00 C ATOM 343 O LEU A 57 13.033 -5.387 -1.085 1.00 0.00 O ATOM 344 CB LEU A 57 13.932 -3.505 -3.672 1.00 0.00 C ATOM 345 CG LEU A 57 15.139 -4.234 -3.075 1.00 0.00 C ATOM 346 CD1 LEU A 57 16.284 -4.243 -4.087 1.00 0.00 C ATOM 347 CD2 LEU A 57 15.589 -3.508 -1.805 1.00 0.00 C ATOM 0 H LEU A 57 12.083 -1.944 -3.500 1.00 0.00 H new ATOM 0 HA LEU A 57 12.250 -4.848 -3.415 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.857 -3.722 -4.738 1.00 0.00 H new ATOM 0 HB3 LEU A 57 14.063 -2.427 -3.574 1.00 0.00 H new ATOM 0 HG LEU A 57 14.862 -5.260 -2.833 1.00 0.00 H new ATOM 0 HD11 LEU A 57 17.142 -4.762 -3.661 1.00 0.00 H new ATOM 0 HD12 LEU A 57 15.964 -4.756 -4.994 1.00 0.00 H new ATOM 0 HD13 LEU A 57 16.564 -3.218 -4.329 1.00 0.00 H new ATOM 0 HD21 LEU A 57 16.448 -4.024 -1.376 1.00 0.00 H new ATOM 0 HD22 LEU A 57 15.866 -2.483 -2.051 1.00 0.00 H new ATOM 0 HD23 LEU A 57 14.773 -3.500 -1.082 1.00 0.00 H new ATOM 359 N LYS A 58 12.960 -3.236 -0.671 1.00 0.00 N ATOM 360 CA LYS A 58 13.187 -3.449 0.785 1.00 0.00 C ATOM 361 C LYS A 58 11.840 -3.489 1.507 1.00 0.00 C ATOM 362 O LYS A 58 11.575 -4.359 2.310 1.00 0.00 O ATOM 363 CB LYS A 58 13.994 -2.235 1.237 1.00 0.00 C ATOM 364 CG LYS A 58 14.884 -2.623 2.420 1.00 0.00 C ATOM 365 CD LYS A 58 16.355 -2.494 2.018 1.00 0.00 C ATOM 366 CE LYS A 58 17.132 -3.717 2.510 1.00 0.00 C ATOM 367 NZ LYS A 58 17.750 -3.288 3.796 1.00 0.00 N ATOM 0 H LYS A 58 12.859 -2.261 -0.953 1.00 0.00 H new ATOM 0 HA LYS A 58 13.704 -4.384 1.000 1.00 0.00 H new ATOM 0 HB2 LYS A 58 14.606 -1.865 0.414 1.00 0.00 H new ATOM 0 HB3 LYS A 58 13.323 -1.425 1.524 1.00 0.00 H new ATOM 0 HG2 LYS A 58 14.672 -1.980 3.274 1.00 0.00 H new ATOM 0 HG3 LYS A 58 14.669 -3.646 2.730 1.00 0.00 H new ATOM 0 HD2 LYS A 58 16.440 -2.409 0.935 1.00 0.00 H new ATOM 0 HD3 LYS A 58 16.780 -1.585 2.444 1.00 0.00 H new ATOM 0 HE2 LYS A 58 16.472 -4.572 2.655 1.00 0.00 H new ATOM 0 HE3 LYS A 58 17.891 -4.019 1.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 18.301 -4.074 4.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 18.378 -2.477 3.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 17.003 -3.013 4.465 1.00 0.00 H new ATOM 381 N GLY A 59 10.990 -2.542 1.218 1.00 0.00 N ATOM 382 CA GLY A 59 9.653 -2.507 1.877 1.00 0.00 C ATOM 383 C GLY A 59 8.705 -3.491 1.185 1.00 0.00 C ATOM 384 O GLY A 59 7.988 -4.231 1.830 1.00 0.00 O ATOM 0 H GLY A 59 11.164 -1.789 0.552 1.00 0.00 H new ATOM 0 HA2 GLY A 59 9.751 -2.764 2.932 1.00 0.00 H new ATOM 0 HA3 GLY A 59 9.242 -1.499 1.831 1.00 0.00 H new ATOM 388 N GLY A 60 8.686 -3.502 -0.122 1.00 0.00 N ATOM 389 CA GLY A 60 7.776 -4.433 -0.846 1.00 0.00 C ATOM 390 C GLY A 60 8.246 -5.879 -0.658 1.00 0.00 C ATOM 391 O GLY A 60 7.486 -6.729 -0.244 1.00 0.00 O ATOM 0 H GLY A 60 9.261 -2.906 -0.718 1.00 0.00 H new ATOM 0 HA2 GLY A 60 6.758 -4.322 -0.474 1.00 0.00 H new ATOM 0 HA3 GLY A 60 7.756 -4.184 -1.907 1.00 0.00 H new ATOM 395 N LYS A 61 9.491 -6.161 -0.956 1.00 0.00 N ATOM 396 CA LYS A 61 10.027 -7.558 -0.812 1.00 0.00 C ATOM 397 C LYS A 61 9.993 -8.064 0.642 1.00 0.00 C ATOM 398 O LYS A 61 10.499 -9.128 0.938 1.00 0.00 O ATOM 399 CB LYS A 61 11.476 -7.471 -1.288 1.00 0.00 C ATOM 400 CG LYS A 61 11.951 -8.856 -1.727 1.00 0.00 C ATOM 401 CD LYS A 61 13.459 -8.821 -1.990 1.00 0.00 C ATOM 402 CE LYS A 61 14.213 -8.981 -0.667 1.00 0.00 C ATOM 403 NZ LYS A 61 14.929 -7.690 -0.475 1.00 0.00 N ATOM 0 H LYS A 61 10.168 -5.478 -1.297 1.00 0.00 H new ATOM 0 HA LYS A 61 9.420 -8.259 -1.384 1.00 0.00 H new ATOM 0 HB2 LYS A 61 11.556 -6.767 -2.117 1.00 0.00 H new ATOM 0 HB3 LYS A 61 12.111 -7.094 -0.487 1.00 0.00 H new ATOM 0 HG2 LYS A 61 11.723 -9.591 -0.955 1.00 0.00 H new ATOM 0 HG3 LYS A 61 11.421 -9.165 -2.628 1.00 0.00 H new ATOM 0 HD2 LYS A 61 13.737 -9.619 -2.678 1.00 0.00 H new ATOM 0 HD3 LYS A 61 13.734 -7.880 -2.466 1.00 0.00 H new ATOM 0 HE2 LYS A 61 13.527 -9.179 0.157 1.00 0.00 H new ATOM 0 HE3 LYS A 61 14.911 -9.817 -0.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 15.257 -7.618 0.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 15.747 -7.648 -1.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 14.284 -6.901 -0.684 1.00 0.00 H new ATOM 417 N ALA A 62 9.410 -7.333 1.550 1.00 0.00 N ATOM 418 CA ALA A 62 9.364 -7.800 2.956 1.00 0.00 C ATOM 419 C ALA A 62 8.800 -9.215 2.986 1.00 0.00 C ATOM 420 O ALA A 62 9.470 -10.167 3.334 1.00 0.00 O ATOM 421 CB ALA A 62 8.423 -6.830 3.668 1.00 0.00 C ATOM 0 H ALA A 62 8.964 -6.432 1.376 1.00 0.00 H new ATOM 0 HA ALA A 62 10.345 -7.822 3.431 1.00 0.00 H new ATOM 0 HB1 ALA A 62 8.337 -7.111 4.718 1.00 0.00 H new ATOM 0 HB2 ALA A 62 8.820 -5.818 3.595 1.00 0.00 H new ATOM 0 HB3 ALA A 62 7.439 -6.868 3.200 1.00 0.00 H new ATOM 427 N LYS A 63 7.574 -9.350 2.583 1.00 0.00 N ATOM 428 CA LYS A 63 6.935 -10.694 2.529 1.00 0.00 C ATOM 429 C LYS A 63 7.051 -11.193 1.094 1.00 0.00 C ATOM 430 O LYS A 63 6.953 -12.369 0.804 1.00 0.00 O ATOM 431 CB LYS A 63 5.462 -10.477 2.895 1.00 0.00 C ATOM 432 CG LYS A 63 5.328 -9.394 3.969 1.00 0.00 C ATOM 433 CD LYS A 63 3.917 -8.814 3.923 1.00 0.00 C ATOM 434 CE LYS A 63 3.866 -7.717 2.858 1.00 0.00 C ATOM 435 NZ LYS A 63 3.060 -6.623 3.469 1.00 0.00 N ATOM 0 H LYS A 63 6.977 -8.579 2.284 1.00 0.00 H new ATOM 0 HA LYS A 63 7.395 -11.417 3.202 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.900 -10.188 2.007 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.030 -11.410 3.256 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.529 -9.815 4.954 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.063 -8.607 3.803 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.195 -9.597 3.692 1.00 0.00 H new ATOM 0 HD3 LYS A 63 3.645 -8.407 4.897 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.867 -7.372 2.599 1.00 0.00 H new ATOM 0 HE3 LYS A 63 3.406 -8.080 1.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 2.981 -5.833 2.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 2.110 -6.979 3.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.526 -6.292 4.338 1.00 0.00 H new ATOM 449 N ASN A 64 7.264 -10.271 0.201 1.00 0.00 N ATOM 450 CA ASN A 64 7.401 -10.598 -1.244 1.00 0.00 C ATOM 451 C ASN A 64 8.696 -11.378 -1.499 1.00 0.00 C ATOM 452 O ASN A 64 9.770 -10.946 -1.131 1.00 0.00 O ATOM 453 CB ASN A 64 7.461 -9.222 -1.906 1.00 0.00 C ATOM 454 CG ASN A 64 6.119 -8.907 -2.572 1.00 0.00 C ATOM 455 OD1 ASN A 64 5.390 -9.803 -2.949 1.00 0.00 O ATOM 456 ND2 ASN A 64 5.760 -7.663 -2.733 1.00 0.00 N ATOM 0 H ASN A 64 7.351 -9.278 0.418 1.00 0.00 H new ATOM 0 HA ASN A 64 6.592 -11.222 -1.624 1.00 0.00 H new ATOM 0 HB2 ASN A 64 7.696 -8.461 -1.162 1.00 0.00 H new ATOM 0 HB3 ASN A 64 8.259 -9.200 -2.648 1.00 0.00 H new ATOM 0 HD21 ASN A 64 4.868 -7.443 -3.175 1.00 0.00 H new ATOM 0 HD22 ASN A 64 6.372 -6.911 -2.417 1.00 0.00 H new ATOM 463 N PRO A 65 8.537 -12.511 -2.125 1.00 0.00 N ATOM 464 CA PRO A 65 9.683 -13.396 -2.451 1.00 0.00 C ATOM 465 C PRO A 65 10.641 -12.719 -3.439 1.00 0.00 C ATOM 466 O PRO A 65 11.846 -12.792 -3.298 1.00 0.00 O ATOM 467 CB PRO A 65 8.999 -14.603 -3.093 1.00 0.00 C ATOM 468 CG PRO A 65 7.719 -14.065 -3.615 1.00 0.00 C ATOM 469 CD PRO A 65 7.276 -13.088 -2.592 1.00 0.00 C ATOM 0 HA PRO A 65 10.293 -13.651 -1.585 1.00 0.00 H new ATOM 0 HB2 PRO A 65 9.608 -15.027 -3.892 1.00 0.00 H new ATOM 0 HB3 PRO A 65 8.830 -15.397 -2.366 1.00 0.00 H new ATOM 0 HG2 PRO A 65 7.857 -13.588 -4.585 1.00 0.00 H new ATOM 0 HG3 PRO A 65 6.983 -14.857 -3.751 1.00 0.00 H new ATOM 0 HD2 PRO A 65 6.617 -12.330 -3.016 1.00 0.00 H new ATOM 0 HD3 PRO A 65 6.728 -13.571 -1.783 1.00 0.00 H new ATOM 477 N SER A 66 10.117 -12.057 -4.438 1.00 0.00 N ATOM 478 CA SER A 66 10.991 -11.376 -5.428 1.00 0.00 C ATOM 479 C SER A 66 10.139 -10.652 -6.438 1.00 0.00 C ATOM 480 O SER A 66 9.403 -11.225 -7.217 1.00 0.00 O ATOM 481 CB SER A 66 11.822 -12.464 -6.091 1.00 0.00 C ATOM 482 OG SER A 66 11.374 -13.742 -5.656 1.00 0.00 O ATOM 0 H SER A 66 9.116 -11.961 -4.608 1.00 0.00 H new ATOM 0 HA SER A 66 11.639 -10.636 -4.958 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.739 -12.389 -7.175 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.875 -12.333 -5.842 1.00 0.00 H new ATOM 0 HG SER A 66 11.910 -14.440 -6.086 1.00 0.00 H new ATOM 488 N ILE A 67 10.207 -9.378 -6.350 1.00 0.00 N ATOM 489 CA ILE A 67 9.402 -8.499 -7.188 1.00 0.00 C ATOM 490 C ILE A 67 10.235 -7.881 -8.310 1.00 0.00 C ATOM 491 O ILE A 67 11.400 -7.578 -8.140 1.00 0.00 O ATOM 492 CB ILE A 67 8.970 -7.464 -6.163 1.00 0.00 C ATOM 493 CG1 ILE A 67 7.781 -8.005 -5.353 1.00 0.00 C ATOM 494 CG2 ILE A 67 8.576 -6.157 -6.856 1.00 0.00 C ATOM 495 CD1 ILE A 67 8.000 -9.495 -5.037 1.00 0.00 C ATOM 0 H ILE A 67 10.819 -8.888 -5.698 1.00 0.00 H new ATOM 0 HA ILE A 67 8.579 -8.987 -7.710 1.00 0.00 H new ATOM 0 HB ILE A 67 9.805 -7.263 -5.492 1.00 0.00 H new ATOM 0 HG12 ILE A 67 7.673 -7.440 -4.427 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.857 -7.875 -5.916 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.269 -5.426 -6.108 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.429 -5.769 -7.413 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.749 -6.343 -7.541 1.00 0.00 H new ATOM 0 HD11 ILE A 67 7.154 -9.873 -4.463 1.00 0.00 H new ATOM 0 HD12 ILE A 67 8.086 -10.055 -5.968 1.00 0.00 H new ATOM 0 HD13 ILE A 67 8.915 -9.613 -4.456 1.00 0.00 H new ATOM 507 N VAL A 68 9.645 -7.680 -9.455 1.00 0.00 N ATOM 508 CA VAL A 68 10.416 -7.064 -10.579 1.00 0.00 C ATOM 509 C VAL A 68 9.918 -5.642 -10.839 1.00 0.00 C ATOM 510 O VAL A 68 8.737 -5.367 -10.762 1.00 0.00 O ATOM 511 CB VAL A 68 10.177 -7.954 -11.809 1.00 0.00 C ATOM 512 CG1 VAL A 68 8.859 -7.575 -12.490 1.00 0.00 C ATOM 513 CG2 VAL A 68 11.322 -7.750 -12.804 1.00 0.00 C ATOM 0 H VAL A 68 8.674 -7.911 -9.663 1.00 0.00 H new ATOM 0 HA VAL A 68 11.479 -6.999 -10.346 1.00 0.00 H new ATOM 0 HB VAL A 68 10.131 -8.995 -11.490 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.702 -8.213 -13.360 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.035 -7.709 -11.789 1.00 0.00 H new ATOM 0 HG13 VAL A 68 8.900 -6.533 -12.807 1.00 0.00 H new ATOM 0 HG21 VAL A 68 11.159 -8.378 -13.680 1.00 0.00 H new ATOM 0 HG22 VAL A 68 11.357 -6.704 -13.109 1.00 0.00 H new ATOM 0 HG23 VAL A 68 12.266 -8.022 -12.333 1.00 0.00 H new ATOM 523 N VAL A 69 10.802 -4.740 -11.154 1.00 0.00 N ATOM 524 CA VAL A 69 10.360 -3.346 -11.426 1.00 0.00 C ATOM 525 C VAL A 69 10.486 -3.039 -12.920 1.00 0.00 C ATOM 526 O VAL A 69 11.560 -3.058 -13.487 1.00 0.00 O ATOM 527 CB VAL A 69 11.286 -2.451 -10.605 1.00 0.00 C ATOM 528 CG1 VAL A 69 10.812 -0.998 -10.704 1.00 0.00 C ATOM 529 CG2 VAL A 69 11.252 -2.895 -9.141 1.00 0.00 C ATOM 0 H VAL A 69 11.805 -4.905 -11.235 1.00 0.00 H new ATOM 0 HA VAL A 69 9.316 -3.187 -11.155 1.00 0.00 H new ATOM 0 HB VAL A 69 12.303 -2.530 -10.989 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.473 -0.359 -10.118 1.00 0.00 H new ATOM 0 HG12 VAL A 69 10.830 -0.680 -11.746 1.00 0.00 H new ATOM 0 HG13 VAL A 69 9.796 -0.920 -10.318 1.00 0.00 H new ATOM 0 HG21 VAL A 69 11.912 -2.258 -8.552 1.00 0.00 H new ATOM 0 HG22 VAL A 69 10.234 -2.814 -8.760 1.00 0.00 H new ATOM 0 HG23 VAL A 69 11.586 -3.930 -9.067 1.00 0.00 H new ATOM 539 N GLU A 70 9.385 -2.767 -13.556 1.00 0.00 N ATOM 540 CA GLU A 70 9.402 -2.467 -15.016 1.00 0.00 C ATOM 541 C GLU A 70 9.370 -0.952 -15.253 1.00 0.00 C ATOM 542 O GLU A 70 8.317 -0.346 -15.294 1.00 0.00 O ATOM 543 CB GLU A 70 8.120 -3.102 -15.565 1.00 0.00 C ATOM 544 CG GLU A 70 7.835 -4.433 -14.865 1.00 0.00 C ATOM 545 CD GLU A 70 9.030 -5.373 -15.038 1.00 0.00 C ATOM 546 OE1 GLU A 70 10.112 -5.010 -14.606 1.00 0.00 O ATOM 547 OE2 GLU A 70 8.843 -6.440 -15.599 1.00 0.00 O ATOM 0 H GLU A 70 8.462 -2.739 -13.124 1.00 0.00 H new ATOM 0 HA GLU A 70 10.300 -2.852 -15.499 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.280 -2.422 -15.421 1.00 0.00 H new ATOM 0 HB3 GLU A 70 8.219 -3.263 -16.638 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.643 -4.264 -13.805 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.937 -4.890 -15.282 1.00 0.00 H new ATOM 554 N ASP A 71 10.507 -0.337 -15.421 1.00 0.00 N ATOM 555 CA ASP A 71 10.523 1.135 -15.667 1.00 0.00 C ATOM 556 C ASP A 71 10.481 1.410 -17.174 1.00 0.00 C ATOM 557 O ASP A 71 11.503 1.517 -17.823 1.00 0.00 O ATOM 558 CB ASP A 71 11.839 1.629 -15.063 1.00 0.00 C ATOM 559 CG ASP A 71 11.594 2.119 -13.634 1.00 0.00 C ATOM 560 OD1 ASP A 71 10.460 2.043 -13.189 1.00 0.00 O ATOM 561 OD2 ASP A 71 12.544 2.563 -13.009 1.00 0.00 O ATOM 0 H ASP A 71 11.423 -0.786 -15.399 1.00 0.00 H new ATOM 0 HA ASP A 71 9.665 1.640 -15.224 1.00 0.00 H new ATOM 0 HB2 ASP A 71 12.575 0.825 -15.062 1.00 0.00 H new ATOM 0 HB3 ASP A 71 12.249 2.436 -15.670 1.00 0.00 H new ATOM 566 N LYS A 72 9.306 1.515 -17.735 1.00 0.00 N ATOM 567 CA LYS A 72 9.198 1.770 -19.202 1.00 0.00 C ATOM 568 C LYS A 72 9.200 3.272 -19.491 1.00 0.00 C ATOM 569 O LYS A 72 9.026 4.086 -18.604 1.00 0.00 O ATOM 570 CB LYS A 72 7.862 1.151 -19.611 1.00 0.00 C ATOM 571 CG LYS A 72 8.107 -0.210 -20.265 1.00 0.00 C ATOM 572 CD LYS A 72 6.772 -0.938 -20.446 1.00 0.00 C ATOM 573 CE LYS A 72 6.555 -1.247 -21.928 1.00 0.00 C ATOM 574 NZ LYS A 72 5.464 -0.327 -22.356 1.00 0.00 N ATOM 0 H LYS A 72 8.417 1.435 -17.242 1.00 0.00 H new ATOM 0 HA LYS A 72 10.037 1.345 -19.753 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.220 1.036 -18.738 1.00 0.00 H new ATOM 0 HB3 LYS A 72 7.341 1.811 -20.305 1.00 0.00 H new ATOM 0 HG2 LYS A 72 8.595 -0.079 -21.231 1.00 0.00 H new ATOM 0 HG3 LYS A 72 8.778 -0.807 -19.647 1.00 0.00 H new ATOM 0 HD2 LYS A 72 6.768 -1.861 -19.867 1.00 0.00 H new ATOM 0 HD3 LYS A 72 5.956 -0.322 -20.069 1.00 0.00 H new ATOM 0 HE2 LYS A 72 7.464 -1.076 -22.504 1.00 0.00 H new ATOM 0 HE3 LYS A 72 6.274 -2.290 -22.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 5.257 -0.479 -23.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 4.609 -0.517 -21.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 5.763 0.658 -22.209 1.00 0.00 H new ATOM 588 N ALA A 73 9.394 3.641 -20.732 1.00 0.00 N ATOM 589 CA ALA A 73 9.409 5.088 -21.101 1.00 0.00 C ATOM 590 C ALA A 73 8.353 5.855 -20.303 1.00 0.00 C ATOM 591 O ALA A 73 8.659 6.788 -19.587 1.00 0.00 O ATOM 592 CB ALA A 73 9.080 5.116 -22.593 1.00 0.00 C ATOM 0 H ALA A 73 9.543 2.998 -21.509 1.00 0.00 H new ATOM 0 HA ALA A 73 10.368 5.558 -20.884 1.00 0.00 H new ATOM 0 HB1 ALA A 73 9.071 6.148 -22.944 1.00 0.00 H new ATOM 0 HB2 ALA A 73 9.834 4.552 -23.142 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.100 4.668 -22.758 1.00 0.00 H new ATOM 598 N GLY A 74 7.111 5.469 -20.415 1.00 0.00 N ATOM 599 CA GLY A 74 6.045 6.179 -19.656 1.00 0.00 C ATOM 600 C GLY A 74 5.158 5.162 -18.956 1.00 0.00 C ATOM 601 O GLY A 74 3.950 5.172 -19.077 1.00 0.00 O ATOM 0 H GLY A 74 6.790 4.695 -20.997 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.492 6.852 -18.924 1.00 0.00 H new ATOM 0 HA3 GLY A 74 5.450 6.793 -20.332 1.00 0.00 H new ATOM 605 N PHE A 75 5.764 4.288 -18.221 1.00 0.00 N ATOM 606 CA PHE A 75 4.987 3.250 -17.488 1.00 0.00 C ATOM 607 C PHE A 75 5.820 2.688 -16.335 1.00 0.00 C ATOM 608 O PHE A 75 6.713 1.887 -16.528 1.00 0.00 O ATOM 609 CB PHE A 75 4.701 2.158 -18.521 1.00 0.00 C ATOM 610 CG PHE A 75 3.593 2.603 -19.445 1.00 0.00 C ATOM 611 CD1 PHE A 75 2.255 2.439 -19.065 1.00 0.00 C ATOM 612 CD2 PHE A 75 3.903 3.175 -20.686 1.00 0.00 C ATOM 613 CE1 PHE A 75 1.228 2.848 -19.925 1.00 0.00 C ATOM 614 CE2 PHE A 75 2.876 3.581 -21.545 1.00 0.00 C ATOM 615 CZ PHE A 75 1.539 3.419 -21.165 1.00 0.00 C ATOM 0 H PHE A 75 6.775 4.242 -18.091 1.00 0.00 H new ATOM 0 HA PHE A 75 4.070 3.651 -17.057 1.00 0.00 H new ATOM 0 HB2 PHE A 75 5.602 1.944 -19.096 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.417 1.234 -18.017 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.015 1.997 -18.109 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.935 3.302 -20.979 1.00 0.00 H new ATOM 0 HE1 PHE A 75 0.196 2.723 -19.632 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.115 4.020 -22.502 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.747 3.734 -21.828 1.00 0.00 H new ATOM 625 N TRP A 76 5.522 3.102 -15.140 1.00 0.00 N ATOM 626 CA TRP A 76 6.270 2.605 -13.952 1.00 0.00 C ATOM 627 C TRP A 76 5.566 1.351 -13.421 1.00 0.00 C ATOM 628 O TRP A 76 4.822 1.398 -12.462 1.00 0.00 O ATOM 629 CB TRP A 76 6.186 3.784 -12.977 1.00 0.00 C ATOM 630 CG TRP A 76 6.495 3.368 -11.592 1.00 0.00 C ATOM 631 CD1 TRP A 76 7.423 2.467 -11.238 1.00 0.00 C ATOM 632 CD2 TRP A 76 5.916 3.872 -10.361 1.00 0.00 C ATOM 633 NE1 TRP A 76 7.432 2.359 -9.872 1.00 0.00 N ATOM 634 CE2 TRP A 76 6.517 3.203 -9.280 1.00 0.00 C ATOM 635 CE3 TRP A 76 4.933 4.828 -10.089 1.00 0.00 C ATOM 636 CZ2 TRP A 76 6.153 3.474 -7.962 1.00 0.00 C ATOM 637 CZ3 TRP A 76 4.561 5.112 -8.769 1.00 0.00 C ATOM 638 CH2 TRP A 76 5.169 4.433 -7.703 1.00 0.00 C ATOM 0 H TRP A 76 4.783 3.773 -14.930 1.00 0.00 H new ATOM 0 HA TRP A 76 7.304 2.315 -14.140 1.00 0.00 H new ATOM 0 HB2 TRP A 76 6.882 4.564 -13.287 1.00 0.00 H new ATOM 0 HB3 TRP A 76 5.186 4.216 -13.013 1.00 0.00 H new ATOM 0 HD1 TRP A 76 8.058 1.918 -11.917 1.00 0.00 H new ATOM 0 HE1 TRP A 76 8.044 1.728 -9.354 1.00 0.00 H new ATOM 0 HE3 TRP A 76 4.456 5.352 -10.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 6.627 2.947 -7.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 3.804 5.856 -8.571 1.00 0.00 H new ATOM 0 HH2 TRP A 76 4.878 4.650 -6.686 1.00 0.00 H new ATOM 649 N TRP A 77 5.771 0.231 -14.077 1.00 0.00 N ATOM 650 CA TRP A 77 5.085 -1.030 -13.659 1.00 0.00 C ATOM 651 C TRP A 77 6.003 -1.952 -12.863 1.00 0.00 C ATOM 652 O TRP A 77 7.170 -2.069 -13.149 1.00 0.00 O ATOM 653 CB TRP A 77 4.719 -1.717 -14.976 1.00 0.00 C ATOM 654 CG TRP A 77 3.549 -1.028 -15.595 1.00 0.00 C ATOM 655 CD1 TRP A 77 3.313 0.302 -15.537 1.00 0.00 C ATOM 656 CD2 TRP A 77 2.455 -1.605 -16.363 1.00 0.00 C ATOM 657 NE1 TRP A 77 2.138 0.574 -16.208 1.00 0.00 N ATOM 658 CE2 TRP A 77 1.573 -0.566 -16.736 1.00 0.00 C ATOM 659 CE3 TRP A 77 2.142 -2.917 -16.763 1.00 0.00 C ATOM 660 CZ2 TRP A 77 0.419 -0.816 -17.478 1.00 0.00 C ATOM 661 CZ3 TRP A 77 0.980 -3.174 -17.510 1.00 0.00 C ATOM 662 CH2 TRP A 77 0.120 -2.123 -17.868 1.00 0.00 C ATOM 0 H TRP A 77 6.386 0.139 -14.886 1.00 0.00 H new ATOM 0 HA TRP A 77 4.232 -0.812 -13.017 1.00 0.00 H new ATOM 0 HB2 TRP A 77 5.569 -1.694 -15.658 1.00 0.00 H new ATOM 0 HB3 TRP A 77 4.482 -2.766 -14.797 1.00 0.00 H new ATOM 0 HD1 TRP A 77 3.941 1.031 -15.046 1.00 0.00 H new ATOM 0 HE1 TRP A 77 1.736 1.507 -16.302 1.00 0.00 H new ATOM 0 HE3 TRP A 77 2.799 -3.731 -16.494 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -0.239 -0.004 -17.749 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 0.747 -4.185 -17.810 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -0.771 -2.325 -18.444 1.00 0.00 H new ATOM 673 N ILE A 78 5.471 -2.639 -11.887 1.00 0.00 N ATOM 674 CA ILE A 78 6.303 -3.591 -11.105 1.00 0.00 C ATOM 675 C ILE A 78 5.521 -4.879 -10.867 1.00 0.00 C ATOM 676 O ILE A 78 4.338 -4.861 -10.590 1.00 0.00 O ATOM 677 CB ILE A 78 6.609 -2.888 -9.791 1.00 0.00 C ATOM 678 CG1 ILE A 78 7.750 -1.907 -10.031 1.00 0.00 C ATOM 679 CG2 ILE A 78 7.028 -3.914 -8.734 1.00 0.00 C ATOM 680 CD1 ILE A 78 7.300 -0.510 -9.640 1.00 0.00 C ATOM 0 H ILE A 78 4.494 -2.580 -11.599 1.00 0.00 H new ATOM 0 HA ILE A 78 7.221 -3.863 -11.625 1.00 0.00 H new ATOM 0 HB ILE A 78 5.724 -2.362 -9.434 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.623 -2.197 -9.447 1.00 0.00 H new ATOM 0 HG13 ILE A 78 8.047 -1.926 -11.080 1.00 0.00 H new ATOM 0 HG21 ILE A 78 7.245 -3.402 -7.796 1.00 0.00 H new ATOM 0 HG22 ILE A 78 6.219 -4.628 -8.579 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.918 -4.443 -9.073 1.00 0.00 H new ATOM 0 HD11 ILE A 78 8.114 0.195 -9.810 1.00 0.00 H new ATOM 0 HD12 ILE A 78 6.439 -0.223 -10.243 1.00 0.00 H new ATOM 0 HD13 ILE A 78 7.024 -0.498 -8.586 1.00 0.00 H new ATOM 692 N LYS A 79 6.174 -5.994 -10.975 1.00 0.00 N ATOM 693 CA LYS A 79 5.471 -7.289 -10.756 1.00 0.00 C ATOM 694 C LYS A 79 5.804 -7.839 -9.366 1.00 0.00 C ATOM 695 O LYS A 79 6.945 -7.852 -8.948 1.00 0.00 O ATOM 696 CB LYS A 79 5.968 -8.214 -11.884 1.00 0.00 C ATOM 697 CG LYS A 79 6.863 -9.323 -11.321 1.00 0.00 C ATOM 698 CD LYS A 79 7.274 -10.277 -12.443 1.00 0.00 C ATOM 699 CE LYS A 79 6.601 -11.633 -12.228 1.00 0.00 C ATOM 700 NZ LYS A 79 7.212 -12.530 -13.246 1.00 0.00 N ATOM 0 H LYS A 79 7.165 -6.070 -11.205 1.00 0.00 H new ATOM 0 HA LYS A 79 4.386 -7.192 -10.787 1.00 0.00 H new ATOM 0 HB2 LYS A 79 5.116 -8.655 -12.401 1.00 0.00 H new ATOM 0 HB3 LYS A 79 6.522 -7.632 -12.621 1.00 0.00 H new ATOM 0 HG2 LYS A 79 7.749 -8.888 -10.858 1.00 0.00 H new ATOM 0 HG3 LYS A 79 6.333 -9.870 -10.542 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.986 -9.865 -13.410 1.00 0.00 H new ATOM 0 HD3 LYS A 79 8.358 -10.394 -12.457 1.00 0.00 H new ATOM 0 HE2 LYS A 79 6.775 -12.005 -11.218 1.00 0.00 H new ATOM 0 HE3 LYS A 79 5.521 -11.563 -12.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.801 -13.481 -13.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 7.024 -12.154 -14.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 8.239 -12.582 -13.091 1.00 0.00 H new ATOM 714 N ALA A 80 4.819 -8.300 -8.652 1.00 0.00 N ATOM 715 CA ALA A 80 5.091 -8.853 -7.301 1.00 0.00 C ATOM 716 C ALA A 80 4.345 -10.180 -7.116 1.00 0.00 C ATOM 717 O ALA A 80 3.241 -10.352 -7.596 1.00 0.00 O ATOM 718 CB ALA A 80 4.571 -7.795 -6.324 1.00 0.00 C ATOM 0 H ALA A 80 3.842 -8.318 -8.944 1.00 0.00 H new ATOM 0 HA ALA A 80 6.149 -9.061 -7.143 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.737 -8.132 -5.301 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.101 -6.857 -6.488 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.504 -7.642 -6.487 1.00 0.00 H new ATOM 724 N ASP A 81 4.935 -11.121 -6.427 1.00 0.00 N ATOM 725 CA ASP A 81 4.251 -12.431 -6.219 1.00 0.00 C ATOM 726 C ASP A 81 3.513 -12.432 -4.879 1.00 0.00 C ATOM 727 O ASP A 81 3.653 -13.336 -4.079 1.00 0.00 O ATOM 728 CB ASP A 81 5.368 -13.478 -6.217 1.00 0.00 C ATOM 729 CG ASP A 81 5.653 -13.929 -7.651 1.00 0.00 C ATOM 730 OD1 ASP A 81 4.980 -14.838 -8.110 1.00 0.00 O ATOM 731 OD2 ASP A 81 6.540 -13.360 -8.264 1.00 0.00 O ATOM 0 H ASP A 81 5.858 -11.040 -6.001 1.00 0.00 H new ATOM 0 HA ASP A 81 3.511 -12.634 -6.993 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.270 -13.060 -5.770 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.077 -14.333 -5.607 1.00 0.00 H new ATOM 736 N GLY A 82 2.729 -11.425 -4.634 1.00 0.00 N ATOM 737 CA GLY A 82 1.983 -11.352 -3.364 1.00 0.00 C ATOM 738 C GLY A 82 0.980 -10.201 -3.424 1.00 0.00 C ATOM 739 O GLY A 82 0.755 -9.614 -4.463 1.00 0.00 O ATOM 0 H GLY A 82 2.575 -10.643 -5.270 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.462 -12.292 -3.182 1.00 0.00 H new ATOM 0 HA3 GLY A 82 2.673 -11.204 -2.533 1.00 0.00 H new ATOM 743 N ALA A 83 0.381 -9.867 -2.314 1.00 0.00 N ATOM 744 CA ALA A 83 -0.601 -8.746 -2.307 1.00 0.00 C ATOM 745 C ALA A 83 0.135 -7.415 -2.476 1.00 0.00 C ATOM 746 O ALA A 83 1.224 -7.233 -1.971 1.00 0.00 O ATOM 747 CB ALA A 83 -1.276 -8.818 -0.937 1.00 0.00 C ATOM 0 H ALA A 83 0.529 -10.321 -1.413 1.00 0.00 H new ATOM 0 HA ALA A 83 -1.326 -8.819 -3.118 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -2.016 -8.022 -0.854 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.768 -9.784 -0.824 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.526 -8.700 -0.155 1.00 0.00 H new ATOM 753 N ILE A 84 -0.449 -6.484 -3.179 1.00 0.00 N ATOM 754 CA ILE A 84 0.232 -5.169 -3.372 1.00 0.00 C ATOM 755 C ILE A 84 -0.699 -4.034 -2.947 1.00 0.00 C ATOM 756 O ILE A 84 -1.899 -4.204 -2.860 1.00 0.00 O ATOM 757 CB ILE A 84 0.540 -5.097 -4.867 1.00 0.00 C ATOM 758 CG1 ILE A 84 1.367 -3.846 -5.152 1.00 0.00 C ATOM 759 CG2 ILE A 84 -0.760 -5.037 -5.663 1.00 0.00 C ATOM 760 CD1 ILE A 84 2.829 -4.139 -4.835 1.00 0.00 C ATOM 0 H ILE A 84 -1.361 -6.574 -3.626 1.00 0.00 H new ATOM 0 HA ILE A 84 1.138 -5.074 -2.773 1.00 0.00 H new ATOM 0 HB ILE A 84 1.100 -5.985 -5.162 1.00 0.00 H new ATOM 0 HG12 ILE A 84 1.259 -3.552 -6.196 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.010 -3.012 -4.548 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -0.533 -4.986 -6.728 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -1.352 -5.930 -5.461 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.326 -4.153 -5.370 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.430 -3.252 -5.035 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.926 -4.413 -3.785 1.00 0.00 H new ATOM 0 HD13 ILE A 84 3.179 -4.962 -5.458 1.00 0.00 H new ATOM 772 N GLU A 85 -0.160 -2.877 -2.662 1.00 0.00 N ATOM 773 CA GLU A 85 -1.018 -1.761 -2.230 1.00 0.00 C ATOM 774 C GLU A 85 -0.853 -0.534 -3.132 1.00 0.00 C ATOM 775 O GLU A 85 0.191 -0.306 -3.712 1.00 0.00 O ATOM 776 CB GLU A 85 -0.572 -1.440 -0.805 1.00 0.00 C ATOM 777 CG GLU A 85 -0.459 -2.736 0.000 1.00 0.00 C ATOM 778 CD GLU A 85 0.202 -2.443 1.347 1.00 0.00 C ATOM 779 OE1 GLU A 85 0.231 -1.285 1.732 1.00 0.00 O ATOM 780 OE2 GLU A 85 0.670 -3.381 1.971 1.00 0.00 O ATOM 0 H GLU A 85 0.837 -2.668 -2.713 1.00 0.00 H new ATOM 0 HA GLU A 85 -2.072 -2.033 -2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.388 -0.925 -0.821 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -1.287 -0.767 -0.332 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.448 -3.168 0.154 1.00 0.00 H new ATOM 0 HG3 GLU A 85 0.127 -3.470 -0.553 1.00 0.00 H new ATOM 787 N ILE A 86 -1.883 0.265 -3.240 1.00 0.00 N ATOM 788 CA ILE A 86 -1.816 1.476 -4.069 1.00 0.00 C ATOM 789 C ILE A 86 -2.101 2.705 -3.193 1.00 0.00 C ATOM 790 O ILE A 86 -2.556 2.584 -2.069 1.00 0.00 O ATOM 791 CB ILE A 86 -2.899 1.280 -5.133 1.00 0.00 C ATOM 792 CG1 ILE A 86 -2.272 0.613 -6.351 1.00 0.00 C ATOM 793 CG2 ILE A 86 -3.520 2.632 -5.521 1.00 0.00 C ATOM 794 CD1 ILE A 86 -1.875 1.686 -7.331 1.00 0.00 C ATOM 0 H ILE A 86 -2.778 0.115 -2.775 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.839 1.634 -4.526 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.693 0.647 -4.737 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.401 0.028 -6.056 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -2.979 -0.077 -6.811 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.288 2.476 -6.278 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.967 3.093 -4.640 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -2.745 3.287 -5.920 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.424 1.227 -8.210 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -2.758 2.251 -7.629 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -1.155 2.358 -6.863 1.00 0.00 H new ATOM 806 N ASP A 87 -1.857 3.878 -3.695 1.00 0.00 N ATOM 807 CA ASP A 87 -2.135 5.097 -2.887 1.00 0.00 C ATOM 808 C ASP A 87 -2.917 6.099 -3.714 1.00 0.00 C ATOM 809 O ASP A 87 -3.169 5.893 -4.884 1.00 0.00 O ATOM 810 CB ASP A 87 -0.774 5.692 -2.564 1.00 0.00 C ATOM 811 CG ASP A 87 0.043 4.693 -1.742 1.00 0.00 C ATOM 812 OD1 ASP A 87 -0.398 4.347 -0.659 1.00 0.00 O ATOM 813 OD2 ASP A 87 1.096 4.292 -2.210 1.00 0.00 O ATOM 0 H ASP A 87 -1.478 4.048 -4.627 1.00 0.00 H new ATOM 0 HA ASP A 87 -2.713 4.859 -1.994 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -0.246 5.938 -3.485 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.895 6.622 -2.008 1.00 0.00 H new ATOM 818 N ALA A 88 -3.284 7.197 -3.128 1.00 0.00 N ATOM 819 CA ALA A 88 -4.022 8.211 -3.913 1.00 0.00 C ATOM 820 C ALA A 88 -3.766 9.620 -3.369 1.00 0.00 C ATOM 821 O ALA A 88 -3.446 10.543 -4.094 1.00 0.00 O ATOM 822 CB ALA A 88 -5.502 7.837 -3.778 1.00 0.00 C ATOM 0 H ALA A 88 -3.107 7.434 -2.152 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.701 8.221 -4.955 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.110 8.549 -4.337 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.661 6.834 -4.174 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.789 7.862 -2.727 1.00 0.00 H new ATOM 828 N ALA A 89 -3.916 9.790 -2.098 1.00 0.00 N ATOM 829 CA ALA A 89 -3.700 11.128 -1.488 1.00 0.00 C ATOM 830 C ALA A 89 -2.377 11.745 -1.960 1.00 0.00 C ATOM 831 O ALA A 89 -2.323 12.895 -2.367 1.00 0.00 O ATOM 832 CB ALA A 89 -3.665 10.837 -0.002 1.00 0.00 C ATOM 0 H ALA A 89 -4.182 9.055 -1.443 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.472 11.847 -1.762 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -3.509 11.766 0.547 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -4.611 10.390 0.304 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -2.850 10.146 0.214 1.00 0.00 H new ATOM 838 N GLU A 90 -1.312 10.995 -1.927 1.00 0.00 N ATOM 839 CA GLU A 90 -0.013 11.559 -2.396 1.00 0.00 C ATOM 840 C GLU A 90 -0.259 12.221 -3.745 1.00 0.00 C ATOM 841 O GLU A 90 0.221 13.302 -4.038 1.00 0.00 O ATOM 842 CB GLU A 90 0.929 10.363 -2.545 1.00 0.00 C ATOM 843 CG GLU A 90 0.841 9.472 -1.304 1.00 0.00 C ATOM 844 CD GLU A 90 2.207 8.838 -1.039 1.00 0.00 C ATOM 845 OE1 GLU A 90 3.105 9.061 -1.834 1.00 0.00 O ATOM 846 OE2 GLU A 90 2.332 8.141 -0.046 1.00 0.00 O ATOM 0 H GLU A 90 -1.282 10.029 -1.601 1.00 0.00 H new ATOM 0 HA GLU A 90 0.411 12.297 -1.715 1.00 0.00 H new ATOM 0 HB2 GLU A 90 0.665 9.790 -3.434 1.00 0.00 H new ATOM 0 HB3 GLU A 90 1.953 10.711 -2.682 1.00 0.00 H new ATOM 0 HG2 GLU A 90 0.527 10.060 -0.442 1.00 0.00 H new ATOM 0 HG3 GLU A 90 0.090 8.696 -1.452 1.00 0.00 H new ATOM 853 N ALA A 91 -1.047 11.581 -4.552 1.00 0.00 N ATOM 854 CA ALA A 91 -1.396 12.149 -5.875 1.00 0.00 C ATOM 855 C ALA A 91 -1.930 13.564 -5.680 1.00 0.00 C ATOM 856 O ALA A 91 -1.589 14.484 -6.397 1.00 0.00 O ATOM 857 CB ALA A 91 -2.519 11.237 -6.377 1.00 0.00 C ATOM 0 H ALA A 91 -1.470 10.676 -4.348 1.00 0.00 H new ATOM 0 HA ALA A 91 -0.553 12.200 -6.564 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -2.851 11.575 -7.359 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -2.151 10.214 -6.451 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.356 11.272 -5.679 1.00 0.00 H new ATOM 863 N GLY A 92 -2.797 13.723 -4.715 1.00 0.00 N ATOM 864 CA GLY A 92 -3.412 15.062 -4.458 1.00 0.00 C ATOM 865 C GLY A 92 -2.313 16.097 -4.340 1.00 0.00 C ATOM 866 O GLY A 92 -2.413 17.201 -4.839 1.00 0.00 O ATOM 0 H GLY A 92 -3.108 12.980 -4.090 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.091 15.326 -5.269 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.003 15.035 -3.543 1.00 0.00 H new ATOM 870 N GLU A 93 -1.259 15.732 -3.693 1.00 0.00 N ATOM 871 CA GLU A 93 -0.117 16.677 -3.538 1.00 0.00 C ATOM 872 C GLU A 93 0.478 16.964 -4.912 1.00 0.00 C ATOM 873 O GLU A 93 0.960 18.046 -5.183 1.00 0.00 O ATOM 874 CB GLU A 93 0.891 15.958 -2.640 1.00 0.00 C ATOM 875 CG GLU A 93 0.144 15.249 -1.511 1.00 0.00 C ATOM 876 CD GLU A 93 0.890 15.444 -0.189 1.00 0.00 C ATOM 877 OE1 GLU A 93 2.068 15.129 -0.144 1.00 0.00 O ATOM 878 OE2 GLU A 93 0.270 15.902 0.757 1.00 0.00 O ATOM 0 H GLU A 93 -1.129 14.818 -3.259 1.00 0.00 H new ATOM 0 HA GLU A 93 -0.412 17.632 -3.102 1.00 0.00 H new ATOM 0 HB2 GLU A 93 1.464 15.236 -3.222 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.603 16.673 -2.228 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -0.868 15.644 -1.429 1.00 0.00 H new ATOM 0 HG3 GLU A 93 0.054 14.186 -1.734 1.00 0.00 H new ATOM 885 N LEU A 94 0.432 15.999 -5.789 1.00 0.00 N ATOM 886 CA LEU A 94 0.976 16.209 -7.159 1.00 0.00 C ATOM 887 C LEU A 94 0.069 17.164 -7.944 1.00 0.00 C ATOM 888 O LEU A 94 0.468 18.250 -8.314 1.00 0.00 O ATOM 889 CB LEU A 94 0.974 14.822 -7.806 1.00 0.00 C ATOM 890 CG LEU A 94 1.980 14.769 -8.965 1.00 0.00 C ATOM 891 CD1 LEU A 94 1.557 13.681 -9.952 1.00 0.00 C ATOM 892 CD2 LEU A 94 2.020 16.118 -9.694 1.00 0.00 C ATOM 0 H LEU A 94 0.041 15.073 -5.615 1.00 0.00 H new ATOM 0 HA LEU A 94 1.973 16.650 -7.144 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.227 14.067 -7.062 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.025 14.586 -8.173 1.00 0.00 H new ATOM 0 HG LEU A 94 2.970 14.548 -8.565 1.00 0.00 H new ATOM 0 HD11 LEU A 94 2.269 13.641 -10.776 1.00 0.00 H new ATOM 0 HD12 LEU A 94 1.535 12.717 -9.444 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.564 13.908 -10.341 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.737 16.068 -10.514 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.031 16.347 -10.091 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.321 16.900 -8.996 1.00 0.00 H new ATOM 904 N LEU A 95 -1.151 16.765 -8.204 1.00 0.00 N ATOM 905 CA LEU A 95 -2.080 17.661 -8.973 1.00 0.00 C ATOM 906 C LEU A 95 -3.161 18.239 -8.048 1.00 0.00 C ATOM 907 O LEU A 95 -3.669 19.320 -8.277 1.00 0.00 O ATOM 908 CB LEU A 95 -2.719 16.824 -10.094 1.00 0.00 C ATOM 909 CG LEU A 95 -2.287 15.363 -10.015 1.00 0.00 C ATOM 910 CD1 LEU A 95 -3.100 14.670 -8.928 1.00 0.00 C ATOM 911 CD2 LEU A 95 -2.541 14.697 -11.365 1.00 0.00 C ATOM 0 H LEU A 95 -1.545 15.867 -7.922 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.529 18.501 -9.397 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.805 16.888 -10.024 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.438 17.236 -11.063 1.00 0.00 H new ATOM 0 HG LEU A 95 -1.226 15.291 -9.775 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -2.801 13.624 -8.861 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.921 15.161 -7.971 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.160 14.729 -9.173 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.235 13.652 -11.318 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.603 14.754 -11.605 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -1.967 15.209 -12.137 1.00 0.00 H new ATOM 923 N GLY A 96 -3.497 17.544 -6.993 1.00 0.00 N ATOM 924 CA GLY A 96 -4.522 18.072 -6.039 1.00 0.00 C ATOM 925 C GLY A 96 -5.917 18.184 -6.687 1.00 0.00 C ATOM 926 O GLY A 96 -6.480 19.258 -6.764 1.00 0.00 O ATOM 0 H GLY A 96 -3.107 16.634 -6.749 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.578 17.417 -5.170 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.210 19.053 -5.679 1.00 0.00 H new ATOM 930 N LYS A 97 -6.496 17.078 -7.099 1.00 0.00 N ATOM 931 CA LYS A 97 -7.889 17.110 -7.696 1.00 0.00 C ATOM 932 C LYS A 97 -8.186 15.813 -8.477 1.00 0.00 C ATOM 933 O LYS A 97 -8.986 15.016 -8.028 1.00 0.00 O ATOM 934 CB LYS A 97 -7.969 18.349 -8.590 1.00 0.00 C ATOM 935 CG LYS A 97 -8.851 19.398 -7.901 1.00 0.00 C ATOM 936 CD LYS A 97 -8.591 20.783 -8.501 1.00 0.00 C ATOM 937 CE LYS A 97 -9.547 21.799 -7.866 1.00 0.00 C ATOM 938 NZ LYS A 97 -9.021 23.134 -8.270 1.00 0.00 N ATOM 0 H LYS A 97 -6.071 16.152 -7.051 1.00 0.00 H new ATOM 0 HA LYS A 97 -8.646 17.168 -6.914 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.972 18.752 -8.767 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.384 18.086 -9.563 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -9.902 19.134 -8.018 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.644 19.412 -6.831 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -7.557 21.080 -8.325 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.735 20.757 -9.581 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.568 21.654 -8.220 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -9.568 21.696 -6.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.626 23.880 -7.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -8.051 23.247 -7.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -9.019 23.207 -9.307 1.00 0.00 H new ATOM 952 N PRO A 98 -7.514 15.601 -9.593 1.00 0.00 N ATOM 953 CA PRO A 98 -7.704 14.336 -10.353 1.00 0.00 C ATOM 954 C PRO A 98 -6.750 13.298 -9.759 1.00 0.00 C ATOM 955 O PRO A 98 -6.576 12.205 -10.253 1.00 0.00 O ATOM 956 CB PRO A 98 -7.270 14.696 -11.761 1.00 0.00 C ATOM 957 CG PRO A 98 -6.304 15.835 -11.605 1.00 0.00 C ATOM 958 CD PRO A 98 -6.539 16.479 -10.256 1.00 0.00 C ATOM 0 HA PRO A 98 -8.718 13.936 -10.324 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -6.799 13.847 -12.255 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -8.124 14.987 -12.373 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -5.278 15.475 -11.680 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -6.445 16.564 -12.403 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -5.614 16.549 -9.683 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -6.926 17.493 -10.362 1.00 0.00 H new ATOM 966 N PHE A 99 -6.123 13.678 -8.698 1.00 0.00 N ATOM 967 CA PHE A 99 -5.159 12.822 -7.997 1.00 0.00 C ATOM 968 C PHE A 99 -5.729 11.449 -7.647 1.00 0.00 C ATOM 969 O PHE A 99 -6.299 10.776 -8.476 1.00 0.00 O ATOM 970 CB PHE A 99 -4.890 13.629 -6.737 1.00 0.00 C ATOM 971 CG PHE A 99 -6.061 13.541 -5.768 1.00 0.00 C ATOM 972 CD1 PHE A 99 -7.379 13.644 -6.220 1.00 0.00 C ATOM 973 CD2 PHE A 99 -5.811 13.332 -4.407 1.00 0.00 C ATOM 974 CE1 PHE A 99 -8.438 13.546 -5.315 1.00 0.00 C ATOM 975 CE2 PHE A 99 -6.865 13.234 -3.503 1.00 0.00 C ATOM 976 CZ PHE A 99 -8.184 13.341 -3.954 1.00 0.00 C ATOM 0 H PHE A 99 -6.249 14.595 -8.270 1.00 0.00 H new ATOM 0 HA PHE A 99 -4.277 12.599 -8.597 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -3.985 13.262 -6.253 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.710 14.671 -7.001 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.579 13.799 -7.270 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -4.793 13.246 -4.056 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -9.456 13.629 -5.666 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -6.664 13.075 -2.454 1.00 0.00 H new ATOM 0 HZ PHE A 99 -9.004 13.266 -3.255 1.00 0.00 H new ATOM 986 N SER A 100 -5.533 11.050 -6.412 1.00 0.00 N ATOM 987 CA SER A 100 -5.997 9.746 -5.887 1.00 0.00 C ATOM 988 C SER A 100 -6.866 8.971 -6.868 1.00 0.00 C ATOM 989 O SER A 100 -6.618 7.823 -7.177 1.00 0.00 O ATOM 990 CB SER A 100 -6.837 10.123 -4.673 1.00 0.00 C ATOM 991 OG SER A 100 -7.823 11.066 -5.064 1.00 0.00 O ATOM 0 H SER A 100 -5.042 11.615 -5.719 1.00 0.00 H new ATOM 0 HA SER A 100 -5.148 9.096 -5.675 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.311 9.236 -4.254 1.00 0.00 H new ATOM 0 HB3 SER A 100 -6.203 10.544 -3.893 1.00 0.00 H new ATOM 0 HG SER A 100 -7.442 11.969 -5.035 1.00 0.00 H new ATOM 997 N VAL A 101 -7.912 9.588 -7.308 1.00 0.00 N ATOM 998 CA VAL A 101 -8.860 8.909 -8.221 1.00 0.00 C ATOM 999 C VAL A 101 -8.454 9.005 -9.684 1.00 0.00 C ATOM 1000 O VAL A 101 -8.083 8.023 -10.291 1.00 0.00 O ATOM 1001 CB VAL A 101 -10.166 9.589 -7.987 1.00 0.00 C ATOM 1002 CG1 VAL A 101 -11.271 8.613 -8.364 1.00 0.00 C ATOM 1003 CG2 VAL A 101 -10.290 9.979 -6.507 1.00 0.00 C ATOM 0 H VAL A 101 -8.157 10.550 -7.072 1.00 0.00 H new ATOM 0 HA VAL A 101 -8.894 7.839 -8.015 1.00 0.00 H new ATOM 0 HB VAL A 101 -10.240 10.495 -8.588 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -12.242 9.082 -8.203 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -11.170 8.337 -9.414 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -11.194 7.719 -7.745 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -11.246 10.476 -6.340 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -10.234 9.083 -5.889 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -9.478 10.656 -6.240 1.00 0.00 H new ATOM 1013 N TYR A 102 -8.502 10.153 -10.285 1.00 0.00 N ATOM 1014 CA TYR A 102 -8.086 10.184 -11.708 1.00 0.00 C ATOM 1015 C TYR A 102 -6.666 9.634 -11.748 1.00 0.00 C ATOM 1016 O TYR A 102 -6.244 8.978 -12.688 1.00 0.00 O ATOM 1017 CB TYR A 102 -8.147 11.650 -12.139 1.00 0.00 C ATOM 1018 CG TYR A 102 -9.257 11.838 -13.140 1.00 0.00 C ATOM 1019 CD1 TYR A 102 -9.138 11.318 -14.434 1.00 0.00 C ATOM 1020 CD2 TYR A 102 -10.409 12.539 -12.770 1.00 0.00 C ATOM 1021 CE1 TYR A 102 -10.173 11.502 -15.359 1.00 0.00 C ATOM 1022 CE2 TYR A 102 -11.444 12.723 -13.692 1.00 0.00 C ATOM 1023 CZ TYR A 102 -11.327 12.204 -14.987 1.00 0.00 C ATOM 1024 OH TYR A 102 -12.346 12.387 -15.899 1.00 0.00 O ATOM 0 H TYR A 102 -8.798 11.039 -9.875 1.00 0.00 H new ATOM 0 HA TYR A 102 -8.713 9.593 -12.376 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -8.315 12.288 -11.271 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -7.195 11.951 -12.576 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -8.249 10.775 -14.719 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -10.499 12.939 -11.771 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -10.082 11.103 -16.358 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -12.333 13.265 -13.405 1.00 0.00 H new ATOM 0 HH TYR A 102 -13.073 12.893 -15.480 1.00 0.00 H new ATOM 1034 N ASP A 103 -5.946 9.862 -10.683 1.00 0.00 N ATOM 1035 CA ASP A 103 -4.565 9.342 -10.584 1.00 0.00 C ATOM 1036 C ASP A 103 -4.606 7.822 -10.512 1.00 0.00 C ATOM 1037 O ASP A 103 -3.811 7.152 -11.137 1.00 0.00 O ATOM 1038 CB ASP A 103 -3.998 9.931 -9.292 1.00 0.00 C ATOM 1039 CG ASP A 103 -2.509 9.592 -9.191 1.00 0.00 C ATOM 1040 OD1 ASP A 103 -1.770 9.991 -10.075 1.00 0.00 O ATOM 1041 OD2 ASP A 103 -2.135 8.941 -8.230 1.00 0.00 O ATOM 0 H ASP A 103 -6.265 10.393 -9.872 1.00 0.00 H new ATOM 0 HA ASP A 103 -3.951 9.614 -11.443 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -4.138 11.012 -9.280 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -4.533 9.530 -8.431 1.00 0.00 H new ATOM 1046 N LEU A 104 -5.534 7.254 -9.777 1.00 0.00 N ATOM 1047 CA LEU A 104 -5.576 5.770 -9.732 1.00 0.00 C ATOM 1048 C LEU A 104 -6.345 5.259 -10.950 1.00 0.00 C ATOM 1049 O LEU A 104 -5.947 4.320 -11.595 1.00 0.00 O ATOM 1050 CB LEU A 104 -6.245 5.382 -8.398 1.00 0.00 C ATOM 1051 CG LEU A 104 -7.746 5.686 -8.415 1.00 0.00 C ATOM 1052 CD1 LEU A 104 -8.479 4.628 -9.237 1.00 0.00 C ATOM 1053 CD2 LEU A 104 -8.286 5.661 -6.983 1.00 0.00 C ATOM 0 H LEU A 104 -6.240 7.741 -9.225 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.584 5.319 -9.773 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.090 4.320 -8.207 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.772 5.926 -7.580 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.906 6.669 -8.857 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.546 4.849 -9.246 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -8.099 4.633 -10.259 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -8.316 3.646 -8.794 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.354 5.877 -6.993 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.119 4.675 -6.548 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.769 6.413 -6.386 1.00 0.00 H new ATOM 1065 N LEU A 105 -7.419 5.888 -11.306 1.00 0.00 N ATOM 1066 CA LEU A 105 -8.161 5.420 -12.507 1.00 0.00 C ATOM 1067 C LEU A 105 -7.215 5.348 -13.714 1.00 0.00 C ATOM 1068 O LEU A 105 -7.508 4.711 -14.705 1.00 0.00 O ATOM 1069 CB LEU A 105 -9.251 6.460 -12.725 1.00 0.00 C ATOM 1070 CG LEU A 105 -10.482 6.057 -11.919 1.00 0.00 C ATOM 1071 CD1 LEU A 105 -10.870 7.195 -10.973 1.00 0.00 C ATOM 1072 CD2 LEU A 105 -11.633 5.764 -12.875 1.00 0.00 C ATOM 0 H LEU A 105 -7.816 6.697 -10.828 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.580 4.422 -12.379 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -8.901 7.444 -12.414 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -9.499 6.530 -13.784 1.00 0.00 H new ATOM 0 HG LEU A 105 -10.262 5.165 -11.332 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -11.750 6.906 -10.398 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -10.043 7.401 -10.293 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -11.094 8.090 -11.553 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -12.516 5.475 -12.304 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -11.855 6.656 -13.461 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -11.352 4.951 -13.544 1.00 0.00 H new ATOM 1084 N ILE A 106 -6.077 5.992 -13.638 1.00 0.00 N ATOM 1085 CA ILE A 106 -5.119 5.949 -14.777 1.00 0.00 C ATOM 1086 C ILE A 106 -3.894 5.095 -14.404 1.00 0.00 C ATOM 1087 O ILE A 106 -3.252 4.515 -15.257 1.00 0.00 O ATOM 1088 CB ILE A 106 -4.744 7.415 -15.017 1.00 0.00 C ATOM 1089 CG1 ILE A 106 -5.566 7.963 -16.186 1.00 0.00 C ATOM 1090 CG2 ILE A 106 -3.257 7.545 -15.351 1.00 0.00 C ATOM 1091 CD1 ILE A 106 -5.205 9.431 -16.422 1.00 0.00 C ATOM 0 H ILE A 106 -5.773 6.544 -12.836 1.00 0.00 H new ATOM 0 HA ILE A 106 -5.538 5.494 -15.675 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.953 7.980 -14.109 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.370 7.380 -17.086 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.630 7.870 -15.971 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.012 8.594 -15.518 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.663 7.161 -14.522 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.035 6.973 -16.252 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.791 9.820 -17.255 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.423 10.008 -15.524 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -4.144 9.512 -16.656 1.00 0.00 H new ATOM 1103 N ASN A 107 -3.561 5.021 -13.141 1.00 0.00 N ATOM 1104 CA ASN A 107 -2.373 4.215 -12.730 1.00 0.00 C ATOM 1105 C ASN A 107 -2.801 3.010 -11.880 1.00 0.00 C ATOM 1106 O ASN A 107 -1.985 2.209 -11.469 1.00 0.00 O ATOM 1107 CB ASN A 107 -1.496 5.190 -11.920 1.00 0.00 C ATOM 1108 CG ASN A 107 -1.733 5.023 -10.414 1.00 0.00 C ATOM 1109 OD1 ASN A 107 -1.441 3.985 -9.852 1.00 0.00 O ATOM 1110 ND2 ASN A 107 -2.248 6.006 -9.736 1.00 0.00 N ATOM 0 H ASN A 107 -4.058 5.482 -12.379 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.836 3.803 -13.584 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -0.445 5.014 -12.148 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.719 6.215 -12.215 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.407 5.906 -8.733 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.493 6.877 -10.207 1.00 0.00 H new ATOM 1117 N VAL A 108 -4.065 2.887 -11.598 1.00 0.00 N ATOM 1118 CA VAL A 108 -4.528 1.748 -10.759 1.00 0.00 C ATOM 1119 C VAL A 108 -4.690 0.488 -11.605 1.00 0.00 C ATOM 1120 O VAL A 108 -4.879 -0.594 -11.086 1.00 0.00 O ATOM 1121 CB VAL A 108 -5.879 2.185 -10.181 1.00 0.00 C ATOM 1122 CG1 VAL A 108 -6.976 2.035 -11.244 1.00 0.00 C ATOM 1123 CG2 VAL A 108 -6.228 1.310 -8.978 1.00 0.00 C ATOM 0 H VAL A 108 -4.798 3.524 -11.911 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.811 1.510 -9.973 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.811 3.228 -9.873 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.933 2.347 -10.826 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.736 2.658 -12.105 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -7.040 0.993 -11.557 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -7.189 1.622 -8.568 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -6.288 0.268 -9.291 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.457 1.416 -8.215 1.00 0.00 H new ATOM 1133 N SER A 109 -4.615 0.608 -12.903 1.00 0.00 N ATOM 1134 CA SER A 109 -4.764 -0.610 -13.764 1.00 0.00 C ATOM 1135 C SER A 109 -3.969 -1.775 -13.178 1.00 0.00 C ATOM 1136 O SER A 109 -4.234 -2.926 -13.461 1.00 0.00 O ATOM 1137 CB SER A 109 -4.218 -0.221 -15.137 1.00 0.00 C ATOM 1138 OG SER A 109 -4.866 -0.998 -16.135 1.00 0.00 O ATOM 0 H SER A 109 -4.459 1.483 -13.403 1.00 0.00 H new ATOM 0 HA SER A 109 -5.803 -0.934 -13.827 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.385 0.840 -15.320 1.00 0.00 H new ATOM 0 HB3 SER A 109 -3.141 -0.386 -15.173 1.00 0.00 H new ATOM 0 HG SER A 109 -4.520 -0.751 -17.018 1.00 0.00 H new ATOM 1144 N SER A 110 -3.007 -1.487 -12.355 1.00 0.00 N ATOM 1145 CA SER A 110 -2.195 -2.562 -11.728 1.00 0.00 C ATOM 1146 C SER A 110 -3.061 -3.609 -11.034 1.00 0.00 C ATOM 1147 O SER A 110 -2.560 -4.615 -10.574 1.00 0.00 O ATOM 1148 CB SER A 110 -1.377 -1.836 -10.675 1.00 0.00 C ATOM 1149 OG SER A 110 -2.247 -1.352 -9.660 1.00 0.00 O ATOM 0 H SER A 110 -2.744 -0.539 -12.085 1.00 0.00 H new ATOM 0 HA SER A 110 -1.604 -3.092 -12.475 1.00 0.00 H new ATOM 0 HB2 SER A 110 -0.636 -2.509 -10.245 1.00 0.00 H new ATOM 0 HB3 SER A 110 -0.831 -1.008 -11.128 1.00 0.00 H new ATOM 0 HG SER A 110 -3.109 -1.108 -10.057 1.00 0.00 H new ATOM 1155 N THR A 111 -4.341 -3.399 -10.918 1.00 0.00 N ATOM 1156 CA THR A 111 -5.157 -4.425 -10.211 1.00 0.00 C ATOM 1157 C THR A 111 -6.077 -5.161 -11.183 1.00 0.00 C ATOM 1158 O THR A 111 -5.750 -6.226 -11.662 1.00 0.00 O ATOM 1159 CB THR A 111 -5.984 -3.690 -9.146 1.00 0.00 C ATOM 1160 OG1 THR A 111 -7.254 -4.316 -9.030 1.00 0.00 O ATOM 1161 CG2 THR A 111 -6.179 -2.224 -9.523 1.00 0.00 C ATOM 0 H THR A 111 -4.847 -2.587 -11.270 1.00 0.00 H new ATOM 0 HA THR A 111 -4.509 -5.174 -9.755 1.00 0.00 H new ATOM 0 HB THR A 111 -5.450 -3.736 -8.197 1.00 0.00 H new ATOM 0 HG1 THR A 111 -7.335 -4.730 -8.145 1.00 0.00 H new ATOM 0 HG21 THR A 111 -6.768 -1.725 -8.753 1.00 0.00 H new ATOM 0 HG22 THR A 111 -5.207 -1.738 -9.608 1.00 0.00 H new ATOM 0 HG23 THR A 111 -6.702 -2.160 -10.477 1.00 0.00 H new ATOM 1169 N VAL A 112 -7.231 -4.602 -11.457 1.00 0.00 N ATOM 1170 CA VAL A 112 -8.211 -5.254 -12.386 1.00 0.00 C ATOM 1171 C VAL A 112 -8.993 -6.356 -11.650 1.00 0.00 C ATOM 1172 O VAL A 112 -10.008 -6.825 -12.124 1.00 0.00 O ATOM 1173 CB VAL A 112 -7.381 -5.816 -13.561 1.00 0.00 C ATOM 1174 CG1 VAL A 112 -7.201 -7.335 -13.435 1.00 0.00 C ATOM 1175 CG2 VAL A 112 -8.097 -5.507 -14.877 1.00 0.00 C ATOM 0 H VAL A 112 -7.541 -3.710 -11.072 1.00 0.00 H new ATOM 0 HA VAL A 112 -8.957 -4.549 -12.754 1.00 0.00 H new ATOM 0 HB VAL A 112 -6.397 -5.347 -13.542 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -6.613 -7.703 -14.276 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -6.684 -7.564 -12.503 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -8.178 -7.819 -13.436 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -7.515 -5.902 -15.709 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -9.083 -5.971 -14.872 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.204 -4.428 -14.988 1.00 0.00 H new ATOM 1185 N GLY A 113 -8.538 -6.762 -10.495 1.00 0.00 N ATOM 1186 CA GLY A 113 -9.265 -7.820 -9.738 1.00 0.00 C ATOM 1187 C GLY A 113 -9.800 -7.218 -8.439 1.00 0.00 C ATOM 1188 O GLY A 113 -10.975 -6.935 -8.309 1.00 0.00 O ATOM 0 H GLY A 113 -7.695 -6.407 -10.044 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -10.086 -8.216 -10.336 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -8.598 -8.654 -9.521 1.00 0.00 H new ATOM 1192 N ARG A 114 -8.941 -7.006 -7.481 1.00 0.00 N ATOM 1193 CA ARG A 114 -9.376 -6.416 -6.206 1.00 0.00 C ATOM 1194 C ARG A 114 -8.718 -5.048 -6.025 1.00 0.00 C ATOM 1195 O ARG A 114 -7.641 -4.802 -6.527 1.00 0.00 O ATOM 1196 CB ARG A 114 -8.916 -7.393 -5.132 1.00 0.00 C ATOM 1197 CG ARG A 114 -9.563 -7.028 -3.796 1.00 0.00 C ATOM 1198 CD ARG A 114 -11.060 -7.335 -3.858 1.00 0.00 C ATOM 1199 NE ARG A 114 -11.690 -6.343 -2.946 1.00 0.00 N ATOM 1200 CZ ARG A 114 -12.989 -6.245 -2.886 1.00 0.00 C ATOM 1201 NH1 ARG A 114 -13.674 -7.093 -2.169 1.00 0.00 N ATOM 1202 NH2 ARG A 114 -13.603 -5.301 -3.547 1.00 0.00 N ATOM 0 H ARG A 114 -7.946 -7.223 -7.538 1.00 0.00 H new ATOM 0 HA ARG A 114 -10.454 -6.261 -6.161 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -9.186 -8.411 -5.412 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -7.830 -7.365 -5.041 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -9.098 -7.592 -2.988 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -9.406 -5.971 -3.579 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -11.442 -7.237 -4.874 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -11.268 -8.356 -3.537 1.00 0.00 H new ATOM 0 HE ARG A 114 -11.106 -5.739 -2.367 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -13.193 -7.832 -1.656 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -14.690 -7.017 -2.122 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -13.067 -4.641 -4.110 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -14.619 -5.224 -3.500 1.00 0.00 H new ATOM 1216 N ALA A 115 -9.356 -4.154 -5.324 1.00 0.00 N ATOM 1217 CA ALA A 115 -8.762 -2.800 -5.128 1.00 0.00 C ATOM 1218 C ALA A 115 -9.491 -2.063 -4.001 1.00 0.00 C ATOM 1219 O ALA A 115 -10.177 -1.087 -4.228 1.00 0.00 O ATOM 1220 CB ALA A 115 -8.983 -2.087 -6.464 1.00 0.00 C ATOM 0 H ALA A 115 -10.262 -4.300 -4.878 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.709 -2.841 -4.851 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -8.574 -1.078 -6.410 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -8.481 -2.639 -7.259 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -10.051 -2.035 -6.676 1.00 0.00 H new ATOM 1226 N TYR A 116 -9.347 -2.521 -2.789 1.00 0.00 N ATOM 1227 CA TYR A 116 -10.037 -1.843 -1.654 1.00 0.00 C ATOM 1228 C TYR A 116 -9.409 -0.470 -1.408 1.00 0.00 C ATOM 1229 O TYR A 116 -8.218 -0.349 -1.197 1.00 0.00 O ATOM 1230 CB TYR A 116 -9.811 -2.760 -0.451 1.00 0.00 C ATOM 1231 CG TYR A 116 -11.092 -2.889 0.338 1.00 0.00 C ATOM 1232 CD1 TYR A 116 -12.129 -3.697 -0.141 1.00 0.00 C ATOM 1233 CD2 TYR A 116 -11.240 -2.204 1.550 1.00 0.00 C ATOM 1234 CE1 TYR A 116 -13.314 -3.821 0.593 1.00 0.00 C ATOM 1235 CE2 TYR A 116 -12.426 -2.327 2.284 1.00 0.00 C ATOM 1236 CZ TYR A 116 -13.463 -3.136 1.805 1.00 0.00 C ATOM 1237 OH TYR A 116 -14.631 -3.259 2.529 1.00 0.00 O ATOM 0 H TYR A 116 -8.784 -3.332 -2.535 1.00 0.00 H new ATOM 0 HA TYR A 116 -11.097 -1.680 -1.847 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -9.479 -3.742 -0.787 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -9.021 -2.357 0.183 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -12.015 -4.225 -1.076 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -10.439 -1.580 1.919 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -14.114 -4.446 0.224 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -12.541 -1.798 3.219 1.00 0.00 H new ATOM 0 HH TYR A 116 -14.569 -2.719 3.345 1.00 0.00 H new ATOM 1247 N THR A 117 -10.200 0.568 -1.438 1.00 0.00 N ATOM 1248 CA THR A 117 -9.645 1.932 -1.210 1.00 0.00 C ATOM 1249 C THR A 117 -9.789 2.326 0.261 1.00 0.00 C ATOM 1250 O THR A 117 -10.843 2.188 0.850 1.00 0.00 O ATOM 1251 CB THR A 117 -10.474 2.854 -2.095 1.00 0.00 C ATOM 1252 OG1 THR A 117 -10.101 4.205 -1.854 1.00 0.00 O ATOM 1253 CG2 THR A 117 -11.944 2.660 -1.765 1.00 0.00 C ATOM 0 H THR A 117 -11.205 0.530 -1.610 1.00 0.00 H new ATOM 0 HA THR A 117 -8.583 1.987 -1.449 1.00 0.00 H new ATOM 0 HB THR A 117 -10.299 2.619 -3.145 1.00 0.00 H new ATOM 0 HG1 THR A 117 -10.633 4.798 -2.425 1.00 0.00 H new ATOM 0 HG21 THR A 117 -12.547 3.315 -2.393 1.00 0.00 H new ATOM 0 HG22 THR A 117 -12.224 1.623 -1.949 1.00 0.00 H new ATOM 0 HG23 THR A 117 -12.117 2.902 -0.716 1.00 0.00 H new ATOM 1261 N LEU A 118 -8.738 2.815 0.857 1.00 0.00 N ATOM 1262 CA LEU A 118 -8.812 3.218 2.290 1.00 0.00 C ATOM 1263 C LEU A 118 -8.980 4.721 2.410 1.00 0.00 C ATOM 1264 O LEU A 118 -8.315 5.360 3.200 1.00 0.00 O ATOM 1265 CB LEU A 118 -7.483 2.775 2.901 1.00 0.00 C ATOM 1266 CG LEU A 118 -7.726 2.242 4.313 1.00 0.00 C ATOM 1267 CD1 LEU A 118 -7.372 0.755 4.366 1.00 0.00 C ATOM 1268 CD2 LEU A 118 -6.850 3.013 5.304 1.00 0.00 C ATOM 0 H LEU A 118 -7.830 2.953 0.414 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.663 2.765 2.798 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -7.025 2.003 2.283 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -6.787 3.613 2.932 1.00 0.00 H new ATOM 0 HG LEU A 118 -8.776 2.373 4.577 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -7.545 0.375 5.373 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -7.995 0.207 3.659 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -6.323 0.621 4.104 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -7.021 2.635 6.312 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -5.800 2.881 5.041 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -7.104 4.072 5.266 1.00 0.00 H new ATOM 1280 N GLY A 119 -9.863 5.297 1.639 1.00 0.00 N ATOM 1281 CA GLY A 119 -10.066 6.769 1.719 1.00 0.00 C ATOM 1282 C GLY A 119 -8.820 7.471 1.208 1.00 0.00 C ATOM 1283 O GLY A 119 -8.851 8.234 0.263 1.00 0.00 O ATOM 0 H GLY A 119 -10.450 4.812 0.960 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -10.932 7.062 1.126 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -10.269 7.065 2.748 1.00 0.00 H new ATOM 1287 N THR A 120 -7.723 7.207 1.838 1.00 0.00 N ATOM 1288 CA THR A 120 -6.439 7.838 1.424 1.00 0.00 C ATOM 1289 C THR A 120 -5.463 6.773 0.917 1.00 0.00 C ATOM 1290 O THR A 120 -4.428 7.082 0.362 1.00 0.00 O ATOM 1291 CB THR A 120 -5.897 8.498 2.693 1.00 0.00 C ATOM 1292 OG1 THR A 120 -6.405 7.816 3.832 1.00 0.00 O ATOM 1293 CG2 THR A 120 -6.334 9.964 2.739 1.00 0.00 C ATOM 0 H THR A 120 -7.653 6.573 2.634 1.00 0.00 H new ATOM 0 HA THR A 120 -6.574 8.555 0.614 1.00 0.00 H new ATOM 0 HB THR A 120 -4.808 8.447 2.691 1.00 0.00 H new ATOM 0 HG1 THR A 120 -6.058 8.236 4.647 1.00 0.00 H new ATOM 0 HG21 THR A 120 -5.946 10.431 3.644 1.00 0.00 H new ATOM 0 HG22 THR A 120 -5.945 10.487 1.865 1.00 0.00 H new ATOM 0 HG23 THR A 120 -7.423 10.019 2.740 1.00 0.00 H new ATOM 1301 N LYS A 121 -5.777 5.519 1.108 1.00 0.00 N ATOM 1302 CA LYS A 121 -4.849 4.447 0.638 1.00 0.00 C ATOM 1303 C LYS A 121 -5.536 3.525 -0.375 1.00 0.00 C ATOM 1304 O LYS A 121 -6.601 3.820 -0.882 1.00 0.00 O ATOM 1305 CB LYS A 121 -4.470 3.673 1.892 1.00 0.00 C ATOM 1306 CG LYS A 121 -2.965 3.395 1.896 1.00 0.00 C ATOM 1307 CD LYS A 121 -2.675 2.154 2.747 1.00 0.00 C ATOM 1308 CE LYS A 121 -1.162 1.990 2.915 1.00 0.00 C ATOM 1309 NZ LYS A 121 -0.836 2.681 4.197 1.00 0.00 N ATOM 0 H LYS A 121 -6.628 5.192 1.565 1.00 0.00 H new ATOM 0 HA LYS A 121 -3.979 4.864 0.131 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -4.746 4.243 2.779 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -5.022 2.734 1.932 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -2.611 3.241 0.877 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -2.427 4.255 2.294 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.151 2.250 3.723 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -3.097 1.268 2.272 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -0.881 0.937 2.952 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -0.622 2.435 2.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 0.185 2.610 4.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.107 3.683 4.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -1.359 2.232 4.976 1.00 0.00 H new ATOM 1323 N PHE A 122 -4.916 2.417 -0.684 1.00 0.00 N ATOM 1324 CA PHE A 122 -5.504 1.474 -1.681 1.00 0.00 C ATOM 1325 C PHE A 122 -5.079 0.033 -1.371 1.00 0.00 C ATOM 1326 O PHE A 122 -4.028 -0.200 -0.805 1.00 0.00 O ATOM 1327 CB PHE A 122 -4.878 1.920 -2.992 1.00 0.00 C ATOM 1328 CG PHE A 122 -5.798 1.638 -4.153 1.00 0.00 C ATOM 1329 CD1 PHE A 122 -6.023 0.320 -4.560 1.00 0.00 C ATOM 1330 CD2 PHE A 122 -6.428 2.695 -4.819 1.00 0.00 C ATOM 1331 CE1 PHE A 122 -6.883 0.058 -5.629 1.00 0.00 C ATOM 1332 CE2 PHE A 122 -7.288 2.431 -5.892 1.00 0.00 C ATOM 1333 CZ PHE A 122 -7.517 1.112 -6.296 1.00 0.00 C ATOM 0 H PHE A 122 -4.024 2.123 -0.287 1.00 0.00 H new ATOM 0 HA PHE A 122 -6.594 1.488 -1.688 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.657 2.986 -2.949 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -3.930 1.403 -3.141 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -5.532 -0.495 -4.049 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -6.251 3.713 -4.506 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -7.059 -0.961 -5.942 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -7.774 3.246 -6.407 1.00 0.00 H new ATOM 0 HZ PHE A 122 -8.182 0.907 -7.122 1.00 0.00 H new ATOM 1343 N THR A 123 -5.866 -0.940 -1.759 1.00 0.00 N ATOM 1344 CA THR A 123 -5.492 -2.340 -1.504 1.00 0.00 C ATOM 1345 C THR A 123 -5.904 -3.215 -2.696 1.00 0.00 C ATOM 1346 O THR A 123 -7.073 -3.376 -2.984 1.00 0.00 O ATOM 1347 CB THR A 123 -6.244 -2.727 -0.217 1.00 0.00 C ATOM 1348 OG1 THR A 123 -5.326 -2.761 0.864 1.00 0.00 O ATOM 1349 CG2 THR A 123 -6.897 -4.106 -0.365 1.00 0.00 C ATOM 0 H THR A 123 -6.754 -0.811 -2.243 1.00 0.00 H new ATOM 0 HA THR A 123 -4.418 -2.478 -1.383 1.00 0.00 H new ATOM 0 HB THR A 123 -7.023 -1.988 -0.030 1.00 0.00 H new ATOM 0 HG1 THR A 123 -5.799 -3.005 1.687 1.00 0.00 H new ATOM 0 HG21 THR A 123 -7.423 -4.360 0.555 1.00 0.00 H new ATOM 0 HG22 THR A 123 -7.605 -4.086 -1.194 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.128 -4.853 -0.562 1.00 0.00 H new ATOM 1357 N ILE A 124 -4.954 -3.790 -3.378 1.00 0.00 N ATOM 1358 CA ILE A 124 -5.297 -4.662 -4.533 1.00 0.00 C ATOM 1359 C ILE A 124 -4.658 -6.037 -4.338 1.00 0.00 C ATOM 1360 O ILE A 124 -3.634 -6.172 -3.692 1.00 0.00 O ATOM 1361 CB ILE A 124 -4.720 -3.959 -5.760 1.00 0.00 C ATOM 1362 CG1 ILE A 124 -3.279 -3.530 -5.466 1.00 0.00 C ATOM 1363 CG2 ILE A 124 -5.573 -2.735 -6.104 1.00 0.00 C ATOM 1364 CD1 ILE A 124 -3.252 -2.165 -4.771 1.00 0.00 C ATOM 0 H ILE A 124 -3.957 -3.694 -3.186 1.00 0.00 H new ATOM 0 HA ILE A 124 -6.371 -4.816 -4.638 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.726 -4.642 -6.610 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -2.794 -4.275 -4.835 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.712 -3.482 -6.395 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.158 -2.237 -6.980 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.594 -3.051 -6.317 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.575 -2.044 -5.261 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.219 -1.879 -4.571 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.717 -1.419 -5.416 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.800 -2.224 -3.831 1.00 0.00 H new ATOM 1376 N THR A 125 -5.253 -7.059 -4.879 1.00 0.00 N ATOM 1377 CA THR A 125 -4.682 -8.423 -4.710 1.00 0.00 C ATOM 1378 C THR A 125 -4.712 -9.178 -6.039 1.00 0.00 C ATOM 1379 O THR A 125 -4.945 -8.605 -7.085 1.00 0.00 O ATOM 1380 CB THR A 125 -5.586 -9.092 -3.672 1.00 0.00 C ATOM 1381 OG1 THR A 125 -4.945 -10.258 -3.174 1.00 0.00 O ATOM 1382 CG2 THR A 125 -6.917 -9.472 -4.319 1.00 0.00 C ATOM 0 H THR A 125 -6.109 -7.011 -5.431 1.00 0.00 H new ATOM 0 HA THR A 125 -3.640 -8.408 -4.391 1.00 0.00 H new ATOM 0 HB THR A 125 -5.773 -8.400 -2.850 1.00 0.00 H new ATOM 0 HG1 THR A 125 -5.520 -10.688 -2.508 1.00 0.00 H new ATOM 0 HG21 THR A 125 -7.559 -9.948 -3.578 1.00 0.00 H new ATOM 0 HG22 THR A 125 -7.406 -8.575 -4.700 1.00 0.00 H new ATOM 0 HG23 THR A 125 -6.737 -10.164 -5.142 1.00 0.00 H new ATOM 1390 N SER A 126 -4.467 -10.458 -6.009 1.00 0.00 N ATOM 1391 CA SER A 126 -4.468 -11.244 -7.272 1.00 0.00 C ATOM 1392 C SER A 126 -5.907 -11.542 -7.715 1.00 0.00 C ATOM 1393 O SER A 126 -6.608 -10.673 -8.193 1.00 0.00 O ATOM 1394 CB SER A 126 -3.714 -12.530 -6.931 1.00 0.00 C ATOM 1395 OG SER A 126 -4.250 -13.094 -5.739 1.00 0.00 O ATOM 0 H SER A 126 -4.266 -10.993 -5.164 1.00 0.00 H new ATOM 0 HA SER A 126 -4.000 -10.709 -8.098 1.00 0.00 H new ATOM 0 HB2 SER A 126 -3.798 -13.242 -7.752 1.00 0.00 H new ATOM 0 HB3 SER A 126 -2.653 -12.318 -6.800 1.00 0.00 H new ATOM 0 HG SER A 126 -4.298 -14.068 -5.831 1.00 0.00 H new