USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 804 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 9 ASN : amide:sc= -0.03 K(o=-0.66,f=-6!) USER MOD Set 1.2: A 38 ASN : amide:sc= -0.63 K(o=-0.66,f=-7.3!) USER MOD Single : A 17 ASN : amide:sc= -0.262 K(o=-0.26,f=-2.3!) USER MOD Single : A 19 GLN : amide:sc=-0.00931 X(o=-0.0093,f=0.053) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -31:sc= -0.132 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 MET CE :methyl 146:sc= -6.29! (180deg=-7.35!) USER MOD Single : A 37 THR OG1 : rot -160:sc= -0.139 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 160:sc= -0.0384 USER MOD Single : A 48 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot -79:sc= 0.334 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -0.174 X(o=-0.17,f=0) USER MOD Single : A 106 GLN : amide:sc= -0.172 K(o=-0.17,f=-1.7!) USER MOD Single : A 109 ASN : amide:sc= 1.25 K(o=1.2,f=-0.66) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 HIS : no HE2:sc= -3.27! C(o=-3.3!,f=-6.5!) USER MOD Single : A 118 GLN : amide:sc= -1.08 X(o=-1.1,f=-1.1) USER MOD Single : A 119 ASN : amide:sc= -0.0542 K(o=-0.054,f=-1.6!) USER MOD Single : A 122 CYS SG : rot 110:sc= -3.54 USER MOD Single : A 124 HIS : +bothHN:sc= -5.57! C(o=-5.6!,f=-6.6!) USER MOD Single : A 125 MET CE :methyl -154:sc= -0.0545 (180deg=-0.442) USER MOD Single : A 128 GLN : amide:sc= -1.28 K(o=-1.3,f=-2!) USER MOD ----------------------------------------------------------------- ATOM 77 N ASN A 9 -20.876 -11.975 -12.073 1.00 0.00 N ATOM 78 CA ASN A 9 -20.750 -11.026 -10.980 1.00 0.00 C ATOM 79 C ASN A 9 -19.418 -10.283 -11.106 1.00 0.00 C ATOM 80 O ASN A 9 -18.530 -10.714 -11.840 1.00 0.00 O ATOM 81 CB ASN A 9 -20.768 -11.738 -9.627 1.00 0.00 C ATOM 82 CG ASN A 9 -21.972 -12.677 -9.517 1.00 0.00 C ATOM 83 OD1 ASN A 9 -23.117 -12.276 -9.641 1.00 0.00 O ATOM 84 ND2 ASN A 9 -21.649 -13.945 -9.279 1.00 0.00 N ATOM 0 HA ASN A 9 -21.592 -10.335 -11.035 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -19.847 -12.306 -9.499 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -20.803 -11.001 -8.825 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -22.381 -14.650 -9.189 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -20.669 -14.213 -9.186 1.00 0.00 H new ATOM 91 N PHE A 10 -19.321 -9.180 -10.378 1.00 0.00 N ATOM 92 CA PHE A 10 -18.112 -8.374 -10.399 1.00 0.00 C ATOM 93 C PHE A 10 -17.862 -7.726 -9.036 1.00 0.00 C ATOM 94 O PHE A 10 -18.728 -7.033 -8.506 1.00 0.00 O ATOM 95 CB PHE A 10 -18.326 -7.275 -11.441 1.00 0.00 C ATOM 96 CG PHE A 10 -19.068 -6.047 -10.908 1.00 0.00 C ATOM 97 CD1 PHE A 10 -20.426 -6.003 -10.948 1.00 0.00 C ATOM 98 CD2 PHE A 10 -18.368 -5.001 -10.393 1.00 0.00 C ATOM 99 CE1 PHE A 10 -21.114 -4.864 -10.453 1.00 0.00 C ATOM 100 CE2 PHE A 10 -19.056 -3.862 -9.898 1.00 0.00 C ATOM 101 CZ PHE A 10 -20.415 -3.817 -9.939 1.00 0.00 C ATOM 0 H PHE A 10 -20.060 -8.826 -9.770 1.00 0.00 H new ATOM 0 HA PHE A 10 -17.252 -8.999 -10.638 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -17.356 -6.961 -11.827 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -18.885 -7.688 -12.280 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -20.982 -6.834 -11.356 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.289 -5.037 -10.361 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -22.193 -4.829 -10.485 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -18.500 -3.031 -9.489 1.00 0.00 H new ATOM 0 HZ PHE A 10 -20.938 -2.950 -9.564 1.00 0.00 H new ATOM 111 N LEU A 11 -16.673 -7.976 -8.507 1.00 0.00 N ATOM 112 CA LEU A 11 -16.297 -7.426 -7.216 1.00 0.00 C ATOM 113 C LEU A 11 -14.941 -6.728 -7.339 1.00 0.00 C ATOM 114 O LEU A 11 -13.910 -7.386 -7.467 1.00 0.00 O ATOM 115 CB LEU A 11 -16.334 -8.513 -6.140 1.00 0.00 C ATOM 116 CG LEU A 11 -15.737 -8.133 -4.783 1.00 0.00 C ATOM 117 CD1 LEU A 11 -16.782 -7.457 -3.894 1.00 0.00 C ATOM 118 CD2 LEU A 11 -15.106 -9.350 -4.102 1.00 0.00 C ATOM 0 H LEU A 11 -15.957 -8.552 -8.950 1.00 0.00 H new ATOM 0 HA LEU A 11 -17.017 -6.671 -6.899 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -17.371 -8.811 -5.988 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -15.803 -9.387 -6.516 1.00 0.00 H new ATOM 0 HG LEU A 11 -14.940 -7.408 -4.951 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -16.332 -7.197 -2.936 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -17.144 -6.552 -4.382 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -17.616 -8.139 -3.730 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.689 -9.053 -3.140 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -15.867 -10.115 -3.947 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -14.312 -9.749 -4.733 1.00 0.00 H new ATOM 130 N GLU A 12 -14.987 -5.405 -7.296 1.00 0.00 N ATOM 131 CA GLU A 12 -13.775 -4.610 -7.400 1.00 0.00 C ATOM 132 C GLU A 12 -13.839 -3.415 -6.447 1.00 0.00 C ATOM 133 O GLU A 12 -14.911 -3.067 -5.953 1.00 0.00 O ATOM 134 CB GLU A 12 -13.544 -4.150 -8.841 1.00 0.00 C ATOM 135 CG GLU A 12 -14.829 -3.585 -9.449 1.00 0.00 C ATOM 136 CD GLU A 12 -14.542 -2.869 -10.770 1.00 0.00 C ATOM 137 OE1 GLU A 12 -13.409 -2.359 -10.905 1.00 0.00 O ATOM 138 OE2 GLU A 12 -15.463 -2.848 -11.616 1.00 0.00 O ATOM 0 H GLU A 12 -15.845 -4.863 -7.191 1.00 0.00 H new ATOM 0 HA GLU A 12 -12.929 -5.234 -7.112 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -12.762 -3.390 -8.863 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -13.191 -4.988 -9.442 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.542 -4.392 -9.616 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -15.292 -2.891 -8.748 1.00 0.00 H new ATOM 145 N ILE A 13 -12.678 -2.820 -6.216 1.00 0.00 N ATOM 146 CA ILE A 13 -12.589 -1.672 -5.330 1.00 0.00 C ATOM 147 C ILE A 13 -11.768 -0.573 -6.007 1.00 0.00 C ATOM 148 O ILE A 13 -10.941 -0.856 -6.873 1.00 0.00 O ATOM 149 CB ILE A 13 -12.046 -2.091 -3.962 1.00 0.00 C ATOM 150 CG1 ILE A 13 -13.047 -2.982 -3.225 1.00 0.00 C ATOM 151 CG2 ILE A 13 -11.647 -0.869 -3.133 1.00 0.00 C ATOM 152 CD1 ILE A 13 -12.393 -4.294 -2.784 1.00 0.00 C ATOM 0 H ILE A 13 -11.791 -3.111 -6.627 1.00 0.00 H new ATOM 0 HA ILE A 13 -13.580 -1.260 -5.141 1.00 0.00 H new ATOM 0 HB ILE A 13 -11.144 -2.682 -4.119 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -13.436 -2.455 -2.354 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -13.896 -3.195 -3.874 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -11.264 -1.195 -2.166 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -10.874 -0.309 -3.659 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -12.518 -0.231 -2.983 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -13.127 -4.909 -2.262 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -12.027 -4.830 -3.659 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -11.559 -4.078 -2.116 1.00 0.00 H new ATOM 164 N ASP A 14 -12.024 0.657 -5.587 1.00 0.00 N ATOM 165 CA ASP A 14 -11.318 1.800 -6.143 1.00 0.00 C ATOM 166 C ASP A 14 -10.649 2.580 -5.010 1.00 0.00 C ATOM 167 O ASP A 14 -11.206 2.699 -3.919 1.00 0.00 O ATOM 168 CB ASP A 14 -12.282 2.745 -6.863 1.00 0.00 C ATOM 169 CG ASP A 14 -12.665 2.319 -8.282 1.00 0.00 C ATOM 170 OD1 ASP A 14 -11.798 2.463 -9.171 1.00 0.00 O ATOM 171 OD2 ASP A 14 -13.816 1.860 -8.446 1.00 0.00 O ATOM 0 H ASP A 14 -12.710 0.888 -4.868 1.00 0.00 H new ATOM 0 HA ASP A 14 -10.580 1.428 -6.853 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -13.191 2.834 -6.269 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -11.831 3.736 -6.907 1.00 0.00 H new ATOM 176 N ILE A 15 -9.464 3.092 -5.306 1.00 0.00 N ATOM 177 CA ILE A 15 -8.713 3.858 -4.326 1.00 0.00 C ATOM 178 C ILE A 15 -8.139 5.110 -4.994 1.00 0.00 C ATOM 179 O ILE A 15 -7.151 5.031 -5.722 1.00 0.00 O ATOM 180 CB ILE A 15 -7.655 2.979 -3.656 1.00 0.00 C ATOM 181 CG1 ILE A 15 -8.273 1.683 -3.129 1.00 0.00 C ATOM 182 CG2 ILE A 15 -6.917 3.750 -2.559 1.00 0.00 C ATOM 183 CD1 ILE A 15 -7.433 1.097 -1.992 1.00 0.00 C ATOM 0 H ILE A 15 -9.005 2.991 -6.211 1.00 0.00 H new ATOM 0 HA ILE A 15 -9.368 4.196 -3.524 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.916 2.701 -4.407 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -9.286 1.877 -2.775 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -8.351 0.958 -3.939 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -6.171 3.103 -2.099 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -6.424 4.620 -2.994 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.630 4.077 -1.802 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -7.895 0.176 -1.636 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -6.428 0.882 -2.355 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -7.377 1.815 -1.174 1.00 0.00 H new ATOM 195 N PHE A 16 -8.784 6.235 -4.723 1.00 0.00 N ATOM 196 CA PHE A 16 -8.350 7.501 -5.288 1.00 0.00 C ATOM 197 C PHE A 16 -8.731 8.668 -4.375 1.00 0.00 C ATOM 198 O PHE A 16 -9.225 8.460 -3.268 1.00 0.00 O ATOM 199 CB PHE A 16 -9.069 7.662 -6.629 1.00 0.00 C ATOM 200 CG PHE A 16 -10.587 7.815 -6.507 1.00 0.00 C ATOM 201 CD1 PHE A 16 -11.130 9.040 -6.276 1.00 0.00 C ATOM 202 CD2 PHE A 16 -11.392 6.726 -6.629 1.00 0.00 C ATOM 203 CE1 PHE A 16 -12.539 9.182 -6.163 1.00 0.00 C ATOM 204 CE2 PHE A 16 -12.800 6.868 -6.515 1.00 0.00 C ATOM 205 CZ PHE A 16 -13.344 8.093 -6.285 1.00 0.00 C ATOM 0 H PHE A 16 -9.604 6.296 -4.119 1.00 0.00 H new ATOM 0 HA PHE A 16 -7.266 7.505 -5.404 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -8.666 8.535 -7.143 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.850 6.796 -7.253 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.490 9.905 -6.178 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -10.960 5.753 -6.813 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -12.971 10.155 -5.980 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.439 6.003 -6.611 1.00 0.00 H new ATOM 0 HZ PHE A 16 -14.415 8.201 -6.199 1.00 0.00 H new ATOM 215 N ASN A 17 -8.488 9.871 -4.873 1.00 0.00 N ATOM 216 CA ASN A 17 -8.799 11.072 -4.117 1.00 0.00 C ATOM 217 C ASN A 17 -7.904 11.135 -2.877 1.00 0.00 C ATOM 218 O ASN A 17 -8.398 11.160 -1.751 1.00 0.00 O ATOM 219 CB ASN A 17 -10.255 11.065 -3.648 1.00 0.00 C ATOM 220 CG ASN A 17 -10.903 12.436 -3.852 1.00 0.00 C ATOM 221 OD1 ASN A 17 -10.263 13.405 -4.227 1.00 0.00 O ATOM 222 ND2 ASN A 17 -12.206 12.464 -3.585 1.00 0.00 N ATOM 0 H ASN A 17 -8.079 10.040 -5.792 1.00 0.00 H new ATOM 0 HA ASN A 17 -8.633 11.932 -4.766 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -10.815 10.309 -4.199 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -10.300 10.791 -2.594 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -12.730 13.333 -3.691 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -12.681 11.617 -3.275 1.00 0.00 H new ATOM 229 N PRO A 18 -6.569 11.161 -3.134 1.00 0.00 N ATOM 230 CA PRO A 18 -5.600 11.220 -2.052 1.00 0.00 C ATOM 231 C PRO A 18 -5.545 12.623 -1.443 1.00 0.00 C ATOM 232 O PRO A 18 -4.929 13.525 -2.008 1.00 0.00 O ATOM 233 CB PRO A 18 -4.283 10.793 -2.680 1.00 0.00 C ATOM 234 CG PRO A 18 -4.463 10.958 -4.180 1.00 0.00 C ATOM 235 CD PRO A 18 -5.948 11.133 -4.455 1.00 0.00 C ATOM 0 HA PRO A 18 -5.859 10.567 -1.219 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -3.459 11.407 -2.316 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -4.046 9.760 -2.426 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -3.904 11.822 -4.539 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -4.077 10.087 -4.709 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -6.143 12.054 -5.004 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -6.338 10.314 -5.059 1.00 0.00 H new ATOM 243 N GLN A 19 -6.197 12.762 -0.298 1.00 0.00 N ATOM 244 CA GLN A 19 -6.230 14.039 0.395 1.00 0.00 C ATOM 245 C GLN A 19 -5.314 14.002 1.620 1.00 0.00 C ATOM 246 O GLN A 19 -5.259 12.997 2.328 1.00 0.00 O ATOM 247 CB GLN A 19 -7.660 14.411 0.790 1.00 0.00 C ATOM 248 CG GLN A 19 -8.125 13.597 1.999 1.00 0.00 C ATOM 249 CD GLN A 19 -9.529 13.032 1.773 1.00 0.00 C ATOM 250 OE1 GLN A 19 -9.757 12.191 0.919 1.00 0.00 O ATOM 251 NE2 GLN A 19 -10.453 13.540 2.583 1.00 0.00 N ATOM 0 H GLN A 19 -6.707 12.011 0.167 1.00 0.00 H new ATOM 0 HA GLN A 19 -5.864 14.809 -0.284 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.712 15.475 1.022 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -8.331 14.235 -0.051 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.426 12.781 2.183 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.121 14.227 2.889 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -10.193 14.242 3.276 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -11.421 13.228 2.511 1.00 0.00 H new ATOM 260 N THR A 20 -4.618 15.109 1.833 1.00 0.00 N ATOM 261 CA THR A 20 -3.708 15.216 2.960 1.00 0.00 C ATOM 262 C THR A 20 -4.435 15.785 4.180 1.00 0.00 C ATOM 263 O THR A 20 -5.380 16.560 4.039 1.00 0.00 O ATOM 264 CB THR A 20 -2.508 16.058 2.521 1.00 0.00 C ATOM 265 OG1 THR A 20 -2.139 15.505 1.260 1.00 0.00 O ATOM 266 CG2 THR A 20 -1.279 15.830 3.402 1.00 0.00 C ATOM 0 H THR A 20 -4.666 15.940 1.244 1.00 0.00 H new ATOM 0 HA THR A 20 -3.341 14.236 3.266 1.00 0.00 H new ATOM 0 HB THR A 20 -2.778 17.114 2.542 1.00 0.00 H new ATOM 0 HG1 THR A 20 -1.369 15.993 0.902 1.00 0.00 H new ATOM 0 HG21 THR A 20 -0.457 16.451 3.047 1.00 0.00 H new ATOM 0 HG22 THR A 20 -1.516 16.095 4.432 1.00 0.00 H new ATOM 0 HG23 THR A 20 -0.987 14.781 3.355 1.00 0.00 H new ATOM 412 N THR A 30 -4.921 10.071 3.059 1.00 0.00 N ATOM 413 CA THR A 30 -5.946 9.042 3.055 1.00 0.00 C ATOM 414 C THR A 30 -6.300 8.648 1.619 1.00 0.00 C ATOM 415 O THR A 30 -5.707 9.155 0.668 1.00 0.00 O ATOM 416 CB THR A 30 -7.142 9.563 3.854 1.00 0.00 C ATOM 417 OG1 THR A 30 -7.284 10.915 3.426 1.00 0.00 O ATOM 418 CG2 THR A 30 -6.843 9.675 5.350 1.00 0.00 C ATOM 0 HA THR A 30 -5.591 8.128 3.532 1.00 0.00 H new ATOM 0 HB THR A 30 -7.995 8.901 3.703 1.00 0.00 H new ATOM 0 HG1 THR A 30 -6.404 11.280 3.196 1.00 0.00 H new ATOM 0 HG21 THR A 30 -7.725 10.049 5.870 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.579 8.693 5.743 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.011 10.363 5.504 1.00 0.00 H new ATOM 426 N TYR A 31 -7.265 7.747 1.507 1.00 0.00 N ATOM 427 CA TYR A 31 -7.705 7.280 0.204 1.00 0.00 C ATOM 428 C TYR A 31 -9.178 6.866 0.238 1.00 0.00 C ATOM 429 O TYR A 31 -9.633 6.256 1.204 1.00 0.00 O ATOM 430 CB TYR A 31 -6.850 6.052 -0.114 1.00 0.00 C ATOM 431 CG TYR A 31 -5.371 6.366 -0.347 1.00 0.00 C ATOM 432 CD1 TYR A 31 -4.968 6.952 -1.530 1.00 0.00 C ATOM 433 CD2 TYR A 31 -4.440 6.065 0.627 1.00 0.00 C ATOM 434 CE1 TYR A 31 -3.575 7.248 -1.748 1.00 0.00 C ATOM 435 CE2 TYR A 31 -3.048 6.361 0.408 1.00 0.00 C ATOM 436 CZ TYR A 31 -2.684 6.938 -0.769 1.00 0.00 C ATOM 437 OH TYR A 31 -1.370 7.218 -0.976 1.00 0.00 O ATOM 0 H TYR A 31 -7.754 7.328 2.298 1.00 0.00 H new ATOM 0 HA TYR A 31 -7.600 8.068 -0.542 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -6.935 5.341 0.708 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -7.251 5.563 -1.002 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -5.696 7.188 -2.292 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -4.756 5.608 1.553 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -3.246 7.706 -2.669 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -2.309 6.130 1.161 1.00 0.00 H new ATOM 0 HH TYR A 31 -0.850 6.944 -0.192 1.00 0.00 H new ATOM 447 N GLU A 32 -9.882 7.215 -0.829 1.00 0.00 N ATOM 448 CA GLU A 32 -11.294 6.887 -0.933 1.00 0.00 C ATOM 449 C GLU A 32 -11.471 5.411 -1.295 1.00 0.00 C ATOM 450 O GLU A 32 -11.411 5.044 -2.467 1.00 0.00 O ATOM 451 CB GLU A 32 -11.992 7.789 -1.953 1.00 0.00 C ATOM 452 CG GLU A 32 -12.485 9.080 -1.297 1.00 0.00 C ATOM 453 CD GLU A 32 -13.993 9.252 -1.490 1.00 0.00 C ATOM 454 OE1 GLU A 32 -14.740 8.502 -0.825 1.00 0.00 O ATOM 455 OE2 GLU A 32 -14.365 10.130 -2.299 1.00 0.00 O ATOM 0 H GLU A 32 -9.501 7.721 -1.629 1.00 0.00 H new ATOM 0 HA GLU A 32 -11.760 7.061 0.037 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -11.303 8.029 -2.763 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -12.834 7.258 -2.397 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -12.251 9.064 -0.233 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -11.960 9.934 -1.726 1.00 0.00 H new ATOM 462 N VAL A 33 -11.686 4.605 -0.266 1.00 0.00 N ATOM 463 CA VAL A 33 -11.873 3.177 -0.460 1.00 0.00 C ATOM 464 C VAL A 33 -13.317 2.909 -0.888 1.00 0.00 C ATOM 465 O VAL A 33 -14.193 2.718 -0.045 1.00 0.00 O ATOM 466 CB VAL A 33 -11.475 2.420 0.809 1.00 0.00 C ATOM 467 CG1 VAL A 33 -11.549 0.907 0.590 1.00 0.00 C ATOM 468 CG2 VAL A 33 -10.082 2.838 1.282 1.00 0.00 C ATOM 0 H VAL A 33 -11.735 4.914 0.705 1.00 0.00 H new ATOM 0 HA VAL A 33 -11.225 2.812 -1.257 1.00 0.00 H new ATOM 0 HB VAL A 33 -12.187 2.681 1.592 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -11.261 0.392 1.507 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -12.568 0.628 0.321 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -10.871 0.622 -0.214 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -9.823 2.285 2.185 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -9.352 2.620 0.502 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.076 3.907 1.496 1.00 0.00 H new ATOM 478 N ARG A 34 -13.522 2.904 -2.197 1.00 0.00 N ATOM 479 CA ARG A 34 -14.845 2.663 -2.747 1.00 0.00 C ATOM 480 C ARG A 34 -14.915 1.267 -3.368 1.00 0.00 C ATOM 481 O ARG A 34 -14.069 0.903 -4.184 1.00 0.00 O ATOM 482 CB ARG A 34 -15.198 3.705 -3.810 1.00 0.00 C ATOM 483 CG ARG A 34 -16.613 4.247 -3.598 1.00 0.00 C ATOM 484 CD ARG A 34 -16.728 5.689 -4.098 1.00 0.00 C ATOM 485 NE ARG A 34 -17.905 5.824 -4.985 1.00 0.00 N ATOM 486 CZ ARG A 34 -18.428 6.997 -5.366 1.00 0.00 C ATOM 487 NH1 ARG A 34 -17.882 8.144 -4.939 1.00 0.00 N ATOM 488 NH2 ARG A 34 -19.497 7.024 -6.173 1.00 0.00 N ATOM 0 H ARG A 34 -12.794 3.063 -2.893 1.00 0.00 H new ATOM 0 HA ARG A 34 -15.562 2.737 -1.930 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -14.481 4.525 -3.772 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -15.120 3.259 -4.802 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -17.330 3.617 -4.125 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -16.868 4.204 -2.539 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -16.820 6.370 -3.252 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -15.823 5.970 -4.636 1.00 0.00 H new ATOM 0 HE ARG A 34 -18.346 4.970 -5.328 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -17.068 8.124 -4.324 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -18.280 9.037 -5.229 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -19.913 6.151 -6.498 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -19.895 7.917 -6.463 1.00 0.00 H new ATOM 502 N MET A 35 -15.932 0.522 -2.959 1.00 0.00 N ATOM 503 CA MET A 35 -16.123 -0.826 -3.466 1.00 0.00 C ATOM 504 C MET A 35 -17.417 -0.929 -4.276 1.00 0.00 C ATOM 505 O MET A 35 -18.347 -0.151 -4.068 1.00 0.00 O ATOM 506 CB MET A 35 -16.175 -1.809 -2.294 1.00 0.00 C ATOM 507 CG MET A 35 -16.480 -3.227 -2.782 1.00 0.00 C ATOM 508 SD MET A 35 -18.246 -3.466 -2.897 1.00 0.00 S ATOM 509 CE MET A 35 -18.522 -4.447 -1.432 1.00 0.00 C ATOM 0 H MET A 35 -16.632 0.827 -2.283 1.00 0.00 H new ATOM 0 HA MET A 35 -15.286 -1.070 -4.121 1.00 0.00 H new ATOM 0 HB2 MET A 35 -15.222 -1.800 -1.764 1.00 0.00 H new ATOM 0 HB3 MET A 35 -16.938 -1.493 -1.583 1.00 0.00 H new ATOM 0 HG2 MET A 35 -16.018 -3.393 -3.755 1.00 0.00 H new ATOM 0 HG3 MET A 35 -16.050 -3.957 -2.096 1.00 0.00 H new ATOM 0 HE1 MET A 35 -19.495 -4.201 -1.007 1.00 0.00 H new ATOM 0 HE2 MET A 35 -18.497 -5.505 -1.693 1.00 0.00 H new ATOM 0 HE3 MET A 35 -17.743 -4.235 -0.700 1.00 0.00 H new ATOM 519 N ARG A 36 -17.435 -1.895 -5.183 1.00 0.00 N ATOM 520 CA ARG A 36 -18.599 -2.109 -6.026 1.00 0.00 C ATOM 521 C ARG A 36 -18.812 -3.605 -6.266 1.00 0.00 C ATOM 522 O ARG A 36 -17.965 -4.269 -6.861 1.00 0.00 O ATOM 523 CB ARG A 36 -18.442 -1.400 -7.373 1.00 0.00 C ATOM 524 CG ARG A 36 -18.617 0.112 -7.220 1.00 0.00 C ATOM 525 CD ARG A 36 -17.264 0.805 -7.045 1.00 0.00 C ATOM 526 NE ARG A 36 -16.916 1.554 -8.273 1.00 0.00 N ATOM 527 CZ ARG A 36 -17.543 2.668 -8.677 1.00 0.00 C ATOM 528 NH1 ARG A 36 -18.552 3.169 -7.952 1.00 0.00 N ATOM 529 NH2 ARG A 36 -17.159 3.281 -9.805 1.00 0.00 N ATOM 0 H ARG A 36 -16.662 -2.538 -5.352 1.00 0.00 H new ATOM 0 HA ARG A 36 -19.464 -1.694 -5.509 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -17.458 -1.616 -7.789 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -19.178 -1.785 -8.079 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -19.125 0.514 -8.097 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -19.252 0.323 -6.360 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -17.302 1.484 -6.193 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -16.493 0.066 -6.829 1.00 0.00 H new ATOM 0 HE ARG A 36 -16.151 1.201 -8.848 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -18.843 2.703 -7.093 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -19.029 4.017 -8.259 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -16.390 2.900 -10.356 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -17.636 4.129 -10.113 1.00 0.00 H new ATOM 543 N THR A 37 -19.949 -4.092 -5.790 1.00 0.00 N ATOM 544 CA THR A 37 -20.284 -5.497 -5.945 1.00 0.00 C ATOM 545 C THR A 37 -21.798 -5.673 -6.076 1.00 0.00 C ATOM 546 O THR A 37 -22.557 -4.732 -5.852 1.00 0.00 O ATOM 547 CB THR A 37 -19.683 -6.260 -4.763 1.00 0.00 C ATOM 548 OG1 THR A 37 -19.750 -7.627 -5.161 1.00 0.00 O ATOM 549 CG2 THR A 37 -20.565 -6.192 -3.514 1.00 0.00 C ATOM 0 H THR A 37 -20.650 -3.538 -5.297 1.00 0.00 H new ATOM 0 HA THR A 37 -19.861 -5.906 -6.863 1.00 0.00 H new ATOM 0 HB THR A 37 -18.697 -5.856 -4.534 1.00 0.00 H new ATOM 0 HG1 THR A 37 -19.688 -8.202 -4.369 1.00 0.00 H new ATOM 0 HG21 THR A 37 -20.093 -6.749 -2.705 1.00 0.00 H new ATOM 0 HG22 THR A 37 -20.691 -5.152 -3.213 1.00 0.00 H new ATOM 0 HG23 THR A 37 -21.540 -6.627 -3.733 1.00 0.00 H new ATOM 557 N ASN A 38 -22.192 -6.885 -6.438 1.00 0.00 N ATOM 558 CA ASN A 38 -23.602 -7.196 -6.602 1.00 0.00 C ATOM 559 C ASN A 38 -23.921 -8.498 -5.863 1.00 0.00 C ATOM 560 O ASN A 38 -25.018 -9.038 -5.996 1.00 0.00 O ATOM 561 CB ASN A 38 -23.956 -7.391 -8.077 1.00 0.00 C ATOM 562 CG ASN A 38 -23.395 -8.712 -8.606 1.00 0.00 C ATOM 563 OD1 ASN A 38 -22.456 -9.277 -8.069 1.00 0.00 O ATOM 564 ND2 ASN A 38 -24.020 -9.172 -9.686 1.00 0.00 N ATOM 0 H ASN A 38 -21.559 -7.664 -6.622 1.00 0.00 H new ATOM 0 HA ASN A 38 -24.180 -6.364 -6.200 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -25.039 -7.377 -8.200 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -23.558 -6.562 -8.663 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -23.720 -10.047 -10.115 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -24.800 -8.649 -10.085 1.00 0.00 H new ATOM 571 N LEU A 39 -22.943 -8.964 -5.101 1.00 0.00 N ATOM 572 CA LEU A 39 -23.106 -10.192 -4.341 1.00 0.00 C ATOM 573 C LEU A 39 -23.941 -9.906 -3.092 1.00 0.00 C ATOM 574 O LEU A 39 -23.967 -8.778 -2.602 1.00 0.00 O ATOM 575 CB LEU A 39 -21.744 -10.820 -4.040 1.00 0.00 C ATOM 576 CG LEU A 39 -20.767 -10.899 -5.215 1.00 0.00 C ATOM 577 CD1 LEU A 39 -19.390 -11.381 -4.752 1.00 0.00 C ATOM 578 CD2 LEU A 39 -21.331 -11.769 -6.340 1.00 0.00 C ATOM 0 H LEU A 39 -22.034 -8.513 -4.993 1.00 0.00 H new ATOM 0 HA LEU A 39 -23.651 -10.933 -4.926 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -21.273 -10.250 -3.239 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -21.907 -11.829 -3.661 1.00 0.00 H new ATOM 0 HG LEU A 39 -20.637 -9.895 -5.619 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -18.715 -11.428 -5.606 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -18.991 -10.687 -4.012 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -19.482 -12.372 -4.307 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -20.617 -11.808 -7.163 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -21.509 -12.777 -5.966 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -22.269 -11.342 -6.694 1.00 0.00 H new ATOM 590 N PRO A 40 -24.621 -10.976 -2.599 1.00 0.00 N ATOM 591 CA PRO A 40 -25.455 -10.851 -1.415 1.00 0.00 C ATOM 592 C PRO A 40 -24.601 -10.766 -0.149 1.00 0.00 C ATOM 593 O PRO A 40 -24.927 -10.023 0.776 1.00 0.00 O ATOM 594 CB PRO A 40 -26.360 -12.072 -1.441 1.00 0.00 C ATOM 595 CG PRO A 40 -25.689 -13.068 -2.374 1.00 0.00 C ATOM 596 CD PRO A 40 -24.614 -12.326 -3.152 1.00 0.00 C ATOM 0 HA PRO A 40 -26.045 -9.935 -1.411 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -26.479 -12.491 -0.442 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -27.356 -11.812 -1.798 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -25.251 -13.889 -1.806 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -26.419 -13.506 -3.054 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -23.639 -12.799 -3.030 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -24.833 -12.318 -4.220 1.00 0.00 H new ATOM 604 N ILE A 41 -23.524 -11.538 -0.147 1.00 0.00 N ATOM 605 CA ILE A 41 -22.621 -11.560 0.991 1.00 0.00 C ATOM 606 C ILE A 41 -22.464 -10.140 1.539 1.00 0.00 C ATOM 607 O ILE A 41 -22.495 -9.931 2.750 1.00 0.00 O ATOM 608 CB ILE A 41 -21.296 -12.223 0.610 1.00 0.00 C ATOM 609 CG1 ILE A 41 -20.399 -11.252 -0.162 1.00 0.00 C ATOM 610 CG2 ILE A 41 -21.534 -13.521 -0.163 1.00 0.00 C ATOM 611 CD1 ILE A 41 -18.982 -11.811 -0.305 1.00 0.00 C ATOM 0 H ILE A 41 -23.257 -12.153 -0.916 1.00 0.00 H new ATOM 0 HA ILE A 41 -23.035 -12.168 1.795 1.00 0.00 H new ATOM 0 HB ILE A 41 -20.770 -12.487 1.528 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -20.822 -11.067 -1.149 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -20.365 -10.293 0.355 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -20.576 -13.972 -0.421 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -22.105 -14.213 0.455 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -22.091 -13.305 -1.075 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -18.365 -11.102 -0.857 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -18.553 -11.972 0.684 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -19.017 -12.758 -0.844 1.00 0.00 H new ATOM 623 N PHE A 42 -22.297 -9.200 0.619 1.00 0.00 N ATOM 624 CA PHE A 42 -22.135 -7.806 0.995 1.00 0.00 C ATOM 625 C PHE A 42 -23.492 -7.141 1.233 1.00 0.00 C ATOM 626 O PHE A 42 -24.413 -7.297 0.433 1.00 0.00 O ATOM 627 CB PHE A 42 -21.435 -7.107 -0.172 1.00 0.00 C ATOM 628 CG PHE A 42 -19.968 -7.505 -0.347 1.00 0.00 C ATOM 629 CD1 PHE A 42 -19.646 -8.620 -1.056 1.00 0.00 C ATOM 630 CD2 PHE A 42 -18.986 -6.744 0.207 1.00 0.00 C ATOM 631 CE1 PHE A 42 -18.285 -8.990 -1.219 1.00 0.00 C ATOM 632 CE2 PHE A 42 -17.625 -7.114 0.044 1.00 0.00 C ATOM 633 CZ PHE A 42 -17.303 -8.229 -0.665 1.00 0.00 C ATOM 0 H PHE A 42 -22.270 -9.377 -0.385 1.00 0.00 H new ATOM 0 HA PHE A 42 -21.559 -7.734 1.917 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -21.974 -7.332 -1.092 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -21.493 -6.029 -0.024 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -20.426 -9.224 -1.495 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -19.241 -5.859 0.771 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -18.030 -9.875 -1.783 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -16.845 -6.510 0.483 1.00 0.00 H new ATOM 0 HZ PHE A 42 -16.268 -8.510 -0.788 1.00 0.00 H new ATOM 643 N LYS A 43 -23.572 -6.413 2.338 1.00 0.00 N ATOM 644 CA LYS A 43 -24.801 -5.723 2.691 1.00 0.00 C ATOM 645 C LYS A 43 -25.008 -4.541 1.743 1.00 0.00 C ATOM 646 O LYS A 43 -25.948 -4.534 0.949 1.00 0.00 O ATOM 647 CB LYS A 43 -24.789 -5.331 4.170 1.00 0.00 C ATOM 648 CG LYS A 43 -26.212 -5.184 4.710 1.00 0.00 C ATOM 649 CD LYS A 43 -26.205 -4.986 6.227 1.00 0.00 C ATOM 650 CE LYS A 43 -25.063 -4.062 6.654 1.00 0.00 C ATOM 651 NZ LYS A 43 -25.051 -3.899 8.125 1.00 0.00 N ATOM 0 H LYS A 43 -22.806 -6.286 3.000 1.00 0.00 H new ATOM 0 HA LYS A 43 -25.658 -6.385 2.567 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -24.254 -6.086 4.746 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -24.249 -4.392 4.297 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -26.701 -4.335 4.231 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -26.794 -6.071 4.458 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -27.158 -4.564 6.547 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -26.101 -5.951 6.723 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -24.110 -4.473 6.320 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -25.176 -3.089 6.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -24.270 -3.269 8.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -25.954 -3.486 8.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -24.921 -4.827 8.576 1.00 0.00 H new ATOM 665 N LEU A 44 -24.115 -3.569 1.856 1.00 0.00 N ATOM 666 CA LEU A 44 -24.188 -2.384 1.018 1.00 0.00 C ATOM 667 C LEU A 44 -23.659 -2.718 -0.378 1.00 0.00 C ATOM 668 O LEU A 44 -22.807 -3.592 -0.530 1.00 0.00 O ATOM 669 CB LEU A 44 -23.467 -1.211 1.685 1.00 0.00 C ATOM 670 CG LEU A 44 -23.730 -1.025 3.180 1.00 0.00 C ATOM 671 CD1 LEU A 44 -23.169 0.311 3.673 1.00 0.00 C ATOM 672 CD2 LEU A 44 -25.219 -1.173 3.498 1.00 0.00 C ATOM 0 H LEU A 44 -23.337 -3.578 2.515 1.00 0.00 H new ATOM 0 HA LEU A 44 -25.223 -2.065 0.899 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -22.395 -1.339 1.538 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -23.752 -0.294 1.169 1.00 0.00 H new ATOM 0 HG LEU A 44 -23.206 -1.814 3.719 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -23.369 0.419 4.739 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -22.093 0.339 3.501 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -23.645 1.128 3.130 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -25.378 -1.036 4.568 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -25.785 -0.421 2.948 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -25.556 -2.167 3.205 1.00 0.00 H new ATOM 684 N LYS A 45 -24.186 -2.005 -1.362 1.00 0.00 N ATOM 685 CA LYS A 45 -23.778 -2.215 -2.741 1.00 0.00 C ATOM 686 C LYS A 45 -22.602 -1.291 -3.066 1.00 0.00 C ATOM 687 O LYS A 45 -21.705 -1.664 -3.820 1.00 0.00 O ATOM 688 CB LYS A 45 -24.970 -2.049 -3.684 1.00 0.00 C ATOM 689 CG LYS A 45 -26.173 -2.858 -3.196 1.00 0.00 C ATOM 690 CD LYS A 45 -26.028 -4.335 -3.569 1.00 0.00 C ATOM 691 CE LYS A 45 -26.423 -4.573 -5.028 1.00 0.00 C ATOM 692 NZ LYS A 45 -27.891 -4.709 -5.153 1.00 0.00 N ATOM 0 H LYS A 45 -24.892 -1.281 -1.232 1.00 0.00 H new ATOM 0 HA LYS A 45 -23.429 -3.238 -2.884 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -25.240 -0.995 -3.753 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -24.692 -2.373 -4.687 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -26.267 -2.760 -2.115 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -27.087 -2.457 -3.633 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -24.998 -4.654 -3.411 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -26.654 -4.942 -2.915 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -26.075 -3.744 -5.645 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -25.936 -5.474 -5.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -28.141 -4.870 -6.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -28.215 -5.514 -4.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -28.350 -3.838 -4.817 1.00 0.00 H new ATOM 706 N GLU A 46 -22.647 -0.102 -2.482 1.00 0.00 N ATOM 707 CA GLU A 46 -21.597 0.878 -2.701 1.00 0.00 C ATOM 708 C GLU A 46 -21.395 1.729 -1.445 1.00 0.00 C ATOM 709 O GLU A 46 -22.357 2.244 -0.878 1.00 0.00 O ATOM 710 CB GLU A 46 -21.911 1.757 -3.913 1.00 0.00 C ATOM 711 CG GLU A 46 -21.123 1.299 -5.142 1.00 0.00 C ATOM 712 CD GLU A 46 -22.035 1.177 -6.364 1.00 0.00 C ATOM 713 OE1 GLU A 46 -22.669 2.199 -6.703 1.00 0.00 O ATOM 714 OE2 GLU A 46 -22.077 0.064 -6.932 1.00 0.00 O ATOM 0 H GLU A 46 -23.394 0.204 -1.858 1.00 0.00 H new ATOM 0 HA GLU A 46 -20.669 0.346 -2.910 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -22.979 1.719 -4.127 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -21.667 2.795 -3.687 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -20.323 2.009 -5.351 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -20.651 0.338 -4.938 1.00 0.00 H new ATOM 721 N SER A 47 -20.137 1.849 -1.046 1.00 0.00 N ATOM 722 CA SER A 47 -19.796 2.628 0.132 1.00 0.00 C ATOM 723 C SER A 47 -18.362 3.147 0.020 1.00 0.00 C ATOM 724 O SER A 47 -17.586 2.665 -0.804 1.00 0.00 O ATOM 725 CB SER A 47 -19.962 1.798 1.407 1.00 0.00 C ATOM 726 OG SER A 47 -19.780 2.584 2.582 1.00 0.00 O ATOM 0 H SER A 47 -19.341 1.419 -1.518 1.00 0.00 H new ATOM 0 HA SER A 47 -20.478 3.476 0.190 1.00 0.00 H new ATOM 0 HB2 SER A 47 -20.955 1.349 1.421 1.00 0.00 H new ATOM 0 HB3 SER A 47 -19.242 0.979 1.403 1.00 0.00 H new ATOM 0 HG SER A 47 -20.195 2.131 3.346 1.00 0.00 H new ATOM 732 N CYS A 48 -18.052 4.124 0.860 1.00 0.00 N ATOM 733 CA CYS A 48 -16.725 4.714 0.865 1.00 0.00 C ATOM 734 C CYS A 48 -16.268 4.856 2.318 1.00 0.00 C ATOM 735 O CYS A 48 -17.092 4.914 3.229 1.00 0.00 O ATOM 736 CB CYS A 48 -16.698 6.053 0.125 1.00 0.00 C ATOM 737 SG CYS A 48 -17.610 7.316 1.083 1.00 0.00 S ATOM 0 H CYS A 48 -18.698 4.522 1.542 1.00 0.00 H new ATOM 0 HA CYS A 48 -16.033 4.064 0.329 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -15.667 6.374 -0.026 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -17.145 5.941 -0.863 1.00 0.00 H new ATOM 0 HG CYS A 48 -17.579 8.449 0.447 1.00 0.00 H new ATOM 743 N VAL A 49 -14.955 4.909 2.490 1.00 0.00 N ATOM 744 CA VAL A 49 -14.379 5.043 3.817 1.00 0.00 C ATOM 745 C VAL A 49 -12.962 5.610 3.698 1.00 0.00 C ATOM 746 O VAL A 49 -12.308 5.445 2.670 1.00 0.00 O ATOM 747 CB VAL A 49 -14.426 3.699 4.547 1.00 0.00 C ATOM 748 CG1 VAL A 49 -15.867 3.301 4.871 1.00 0.00 C ATOM 749 CG2 VAL A 49 -13.726 2.609 3.733 1.00 0.00 C ATOM 0 H VAL A 49 -14.274 4.862 1.732 1.00 0.00 H new ATOM 0 HA VAL A 49 -14.960 5.743 4.417 1.00 0.00 H new ATOM 0 HB VAL A 49 -13.890 3.810 5.489 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -15.872 2.342 5.390 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -16.320 4.061 5.508 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -16.438 3.216 3.946 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -13.773 1.664 4.274 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -14.222 2.500 2.768 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -12.683 2.885 3.576 1.00 0.00 H new ATOM 759 N ARG A 50 -12.530 6.266 4.765 1.00 0.00 N ATOM 760 CA ARG A 50 -11.204 6.858 4.793 1.00 0.00 C ATOM 761 C ARG A 50 -10.312 6.114 5.789 1.00 0.00 C ATOM 762 O ARG A 50 -10.714 5.867 6.925 1.00 0.00 O ATOM 763 CB ARG A 50 -11.268 8.336 5.183 1.00 0.00 C ATOM 764 CG ARG A 50 -9.943 8.802 5.789 1.00 0.00 C ATOM 765 CD ARG A 50 -9.995 8.762 7.318 1.00 0.00 C ATOM 766 NE ARG A 50 -10.506 10.049 7.840 1.00 0.00 N ATOM 767 CZ ARG A 50 -10.356 10.458 9.107 1.00 0.00 C ATOM 768 NH1 ARG A 50 -9.710 9.684 9.989 1.00 0.00 N ATOM 769 NH2 ARG A 50 -10.853 11.642 9.492 1.00 0.00 N ATOM 0 H ARG A 50 -13.075 6.400 5.617 1.00 0.00 H new ATOM 0 HA ARG A 50 -10.784 6.776 3.791 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -11.502 8.938 4.305 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -12.074 8.492 5.900 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -9.132 8.166 5.432 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -9.723 9.816 5.455 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -10.638 7.946 7.647 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -9.001 8.566 7.719 1.00 0.00 H new ATOM 0 HE ARG A 50 -11.003 10.663 7.195 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -9.332 8.783 9.696 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.596 9.996 10.953 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -11.345 12.231 8.820 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -10.739 11.954 10.457 1.00 0.00 H new ATOM 783 N ARG A 51 -9.117 5.776 5.327 1.00 0.00 N ATOM 784 CA ARG A 51 -8.164 5.065 6.163 1.00 0.00 C ATOM 785 C ARG A 51 -6.748 5.223 5.606 1.00 0.00 C ATOM 786 O ARG A 51 -6.569 5.653 4.467 1.00 0.00 O ATOM 787 CB ARG A 51 -8.509 3.577 6.247 1.00 0.00 C ATOM 788 CG ARG A 51 -8.277 3.040 7.661 1.00 0.00 C ATOM 789 CD ARG A 51 -9.603 2.854 8.401 1.00 0.00 C ATOM 790 NE ARG A 51 -9.378 2.115 9.663 1.00 0.00 N ATOM 791 CZ ARG A 51 -9.006 0.829 9.724 1.00 0.00 C ATOM 792 NH1 ARG A 51 -8.814 0.132 8.596 1.00 0.00 N ATOM 793 NH2 ARG A 51 -8.826 0.239 10.914 1.00 0.00 N ATOM 0 H ARG A 51 -8.787 5.981 4.384 1.00 0.00 H new ATOM 0 HA ARG A 51 -8.214 5.495 7.163 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -9.550 3.425 5.962 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -7.899 3.018 5.537 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -7.748 2.088 7.610 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -7.640 3.729 8.216 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -10.050 3.825 8.613 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -10.307 2.310 7.772 1.00 0.00 H new ATOM 0 HE ARG A 51 -9.515 2.616 10.541 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -8.951 0.580 7.690 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -8.531 -0.847 8.643 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -8.972 0.769 11.773 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -8.543 -0.740 10.960 1.00 0.00 H new ATOM 807 N ARG A 52 -5.778 4.867 6.435 1.00 0.00 N ATOM 808 CA ARG A 52 -4.383 4.964 6.039 1.00 0.00 C ATOM 809 C ARG A 52 -3.944 3.684 5.324 1.00 0.00 C ATOM 810 O ARG A 52 -4.736 2.758 5.159 1.00 0.00 O ATOM 811 CB ARG A 52 -3.481 5.196 7.254 1.00 0.00 C ATOM 812 CG ARG A 52 -3.369 6.688 7.576 1.00 0.00 C ATOM 813 CD ARG A 52 -2.635 6.909 8.900 1.00 0.00 C ATOM 814 NE ARG A 52 -3.386 6.278 10.007 1.00 0.00 N ATOM 815 CZ ARG A 52 -3.228 5.004 10.392 1.00 0.00 C ATOM 816 NH1 ARG A 52 -2.345 4.218 9.762 1.00 0.00 N ATOM 817 NH2 ARG A 52 -3.954 4.516 11.408 1.00 0.00 N ATOM 0 H ARG A 52 -5.930 4.511 7.379 1.00 0.00 H new ATOM 0 HA ARG A 52 -4.288 5.813 5.362 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -3.882 4.663 8.116 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -2.490 4.787 7.059 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -2.838 7.198 6.772 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.365 7.128 7.630 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.632 6.487 8.844 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.522 7.977 9.089 1.00 0.00 H new ATOM 0 HE ARG A 52 -4.067 6.848 10.509 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -1.793 4.589 8.989 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -2.225 3.248 10.055 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -4.626 5.114 11.888 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -3.834 3.546 11.701 1.00 0.00 H new ATOM 831 N TYR A 53 -2.682 3.674 4.920 1.00 0.00 N ATOM 832 CA TYR A 53 -2.128 2.523 4.226 1.00 0.00 C ATOM 833 C TYR A 53 -2.067 1.304 5.149 1.00 0.00 C ATOM 834 O TYR A 53 -2.477 0.210 4.765 1.00 0.00 O ATOM 835 CB TYR A 53 -0.705 2.917 3.826 1.00 0.00 C ATOM 836 CG TYR A 53 0.206 1.728 3.516 1.00 0.00 C ATOM 837 CD1 TYR A 53 0.941 1.140 4.526 1.00 0.00 C ATOM 838 CD2 TYR A 53 0.293 1.242 2.227 1.00 0.00 C ATOM 839 CE1 TYR A 53 1.799 0.021 4.234 1.00 0.00 C ATOM 840 CE2 TYR A 53 1.150 0.122 1.936 1.00 0.00 C ATOM 841 CZ TYR A 53 1.861 -0.433 2.954 1.00 0.00 C ATOM 842 OH TYR A 53 2.671 -1.490 2.678 1.00 0.00 O ATOM 0 H TYR A 53 -2.028 4.444 5.060 1.00 0.00 H new ATOM 0 HA TYR A 53 -2.745 2.258 3.368 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -0.751 3.564 2.950 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -0.261 3.502 4.632 1.00 0.00 H new ATOM 0 HD1 TYR A 53 0.872 1.519 5.535 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.282 1.702 1.437 1.00 0.00 H new ATOM 0 HE1 TYR A 53 2.380 -0.447 5.015 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.226 -0.269 0.932 1.00 0.00 H new ATOM 0 HH TYR A 53 3.600 -1.183 2.616 1.00 0.00 H new ATOM 852 N SER A 54 -1.551 1.535 6.347 1.00 0.00 N ATOM 853 CA SER A 54 -1.431 0.469 7.328 1.00 0.00 C ATOM 854 C SER A 54 -2.767 -0.262 7.472 1.00 0.00 C ATOM 855 O SER A 54 -2.806 -1.408 7.919 1.00 0.00 O ATOM 856 CB SER A 54 -0.975 1.015 8.682 1.00 0.00 C ATOM 857 OG SER A 54 0.179 1.842 8.563 1.00 0.00 O ATOM 0 H SER A 54 -1.211 2.444 6.661 1.00 0.00 H new ATOM 0 HA SER A 54 -0.675 -0.234 6.978 1.00 0.00 H new ATOM 0 HB2 SER A 54 -1.786 1.587 9.134 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.758 0.184 9.353 1.00 0.00 H new ATOM 0 HG SER A 54 0.438 2.172 9.449 1.00 0.00 H new ATOM 863 N ASP A 55 -3.829 0.430 7.087 1.00 0.00 N ATOM 864 CA ASP A 55 -5.163 -0.140 7.168 1.00 0.00 C ATOM 865 C ASP A 55 -5.151 -1.544 6.562 1.00 0.00 C ATOM 866 O ASP A 55 -5.836 -2.441 7.052 1.00 0.00 O ATOM 867 CB ASP A 55 -6.171 0.704 6.385 1.00 0.00 C ATOM 868 CG ASP A 55 -6.073 0.582 4.863 1.00 0.00 C ATOM 869 OD1 ASP A 55 -4.928 0.452 4.377 1.00 0.00 O ATOM 870 OD2 ASP A 55 -7.144 0.622 4.220 1.00 0.00 O ATOM 0 H ASP A 55 -3.793 1.380 6.718 1.00 0.00 H new ATOM 0 HA ASP A 55 -5.454 -0.168 8.218 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -7.177 0.420 6.693 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -6.037 1.750 6.660 1.00 0.00 H new ATOM 875 N PHE A 56 -4.366 -1.692 5.505 1.00 0.00 N ATOM 876 CA PHE A 56 -4.256 -2.972 4.827 1.00 0.00 C ATOM 877 C PHE A 56 -3.374 -3.938 5.619 1.00 0.00 C ATOM 878 O PHE A 56 -3.520 -5.154 5.506 1.00 0.00 O ATOM 879 CB PHE A 56 -3.606 -2.704 3.468 1.00 0.00 C ATOM 880 CG PHE A 56 -4.508 -1.956 2.484 1.00 0.00 C ATOM 881 CD1 PHE A 56 -5.562 -2.592 1.908 1.00 0.00 C ATOM 882 CD2 PHE A 56 -4.254 -0.653 2.185 1.00 0.00 C ATOM 883 CE1 PHE A 56 -6.399 -1.898 0.994 1.00 0.00 C ATOM 884 CE2 PHE A 56 -5.091 0.042 1.272 1.00 0.00 C ATOM 885 CZ PHE A 56 -6.145 -0.595 0.696 1.00 0.00 C ATOM 0 H PHE A 56 -3.800 -0.946 5.101 1.00 0.00 H new ATOM 0 HA PHE A 56 -5.242 -3.424 4.724 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -2.694 -2.127 3.620 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -3.311 -3.655 3.024 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -5.763 -3.626 2.145 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -3.416 -0.147 2.642 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -7.236 -2.404 0.536 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -4.890 1.076 1.035 1.00 0.00 H new ATOM 0 HZ PHE A 56 -6.781 -0.066 0.001 1.00 0.00 H new ATOM 895 N GLU A 57 -2.476 -3.361 6.404 1.00 0.00 N ATOM 896 CA GLU A 57 -1.570 -4.155 7.215 1.00 0.00 C ATOM 897 C GLU A 57 -2.329 -4.816 8.368 1.00 0.00 C ATOM 898 O GLU A 57 -1.898 -5.841 8.894 1.00 0.00 O ATOM 899 CB GLU A 57 -0.412 -3.303 7.739 1.00 0.00 C ATOM 900 CG GLU A 57 0.658 -3.110 6.661 1.00 0.00 C ATOM 901 CD GLU A 57 2.029 -2.855 7.290 1.00 0.00 C ATOM 902 OE1 GLU A 57 2.662 -3.853 7.696 1.00 0.00 O ATOM 903 OE2 GLU A 57 2.413 -1.667 7.349 1.00 0.00 O ATOM 0 H GLU A 57 -2.357 -2.352 6.495 1.00 0.00 H new ATOM 0 HA GLU A 57 -1.146 -4.939 6.588 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -0.787 -2.332 8.062 1.00 0.00 H new ATOM 0 HB3 GLU A 57 0.030 -3.781 8.613 1.00 0.00 H new ATOM 0 HG2 GLU A 57 0.704 -3.995 6.026 1.00 0.00 H new ATOM 0 HG3 GLU A 57 0.386 -2.272 6.020 1.00 0.00 H new ATOM 910 N TRP A 58 -3.446 -4.201 8.727 1.00 0.00 N ATOM 911 CA TRP A 58 -4.270 -4.716 9.808 1.00 0.00 C ATOM 912 C TRP A 58 -5.298 -5.675 9.204 1.00 0.00 C ATOM 913 O TRP A 58 -5.619 -6.702 9.799 1.00 0.00 O ATOM 914 CB TRP A 58 -4.910 -3.575 10.601 1.00 0.00 C ATOM 915 CG TRP A 58 -5.799 -4.042 11.755 1.00 0.00 C ATOM 916 CD1 TRP A 58 -5.506 -4.072 13.063 1.00 0.00 C ATOM 917 CD2 TRP A 58 -7.147 -4.547 11.653 1.00 0.00 C ATOM 918 NE1 TRP A 58 -6.561 -4.558 13.807 1.00 0.00 N ATOM 919 CE2 TRP A 58 -7.591 -4.856 12.922 1.00 0.00 C ATOM 920 CE3 TRP A 58 -7.964 -4.737 10.524 1.00 0.00 C ATOM 921 CZ2 TRP A 58 -8.866 -5.373 13.184 1.00 0.00 C ATOM 922 CZ3 TRP A 58 -9.235 -5.255 10.802 1.00 0.00 C ATOM 923 CH2 TRP A 58 -9.697 -5.571 12.075 1.00 0.00 C ATOM 0 H TRP A 58 -3.800 -3.351 8.289 1.00 0.00 H new ATOM 0 HA TRP A 58 -3.663 -5.265 10.527 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -4.122 -2.936 10.999 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -5.504 -2.963 9.922 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -4.562 -3.755 13.482 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -6.582 -4.677 14.820 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -7.637 -4.502 9.522 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -9.191 -5.606 14.187 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -9.903 -5.421 9.970 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -10.693 -5.968 12.208 1.00 0.00 H new ATOM 934 N LEU A 59 -5.785 -5.305 8.028 1.00 0.00 N ATOM 935 CA LEU A 59 -6.770 -6.119 7.337 1.00 0.00 C ATOM 936 C LEU A 59 -6.141 -7.462 6.961 1.00 0.00 C ATOM 937 O LEU A 59 -6.668 -8.518 7.309 1.00 0.00 O ATOM 938 CB LEU A 59 -7.353 -5.358 6.145 1.00 0.00 C ATOM 939 CG LEU A 59 -7.613 -6.184 4.883 1.00 0.00 C ATOM 940 CD1 LEU A 59 -8.793 -7.136 5.085 1.00 0.00 C ATOM 941 CD2 LEU A 59 -7.808 -5.278 3.666 1.00 0.00 C ATOM 0 H LEU A 59 -5.516 -4.453 7.537 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.614 -6.334 7.992 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -8.292 -4.901 6.456 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.672 -4.546 5.890 1.00 0.00 H new ATOM 0 HG LEU A 59 -6.734 -6.798 4.689 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -8.957 -7.711 4.174 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -8.575 -7.816 5.909 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -9.689 -6.561 5.317 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -7.991 -5.890 2.783 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -8.661 -4.620 3.835 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.911 -4.678 3.512 1.00 0.00 H new ATOM 953 N LYS A 60 -5.024 -7.379 6.254 1.00 0.00 N ATOM 954 CA LYS A 60 -4.318 -8.575 5.826 1.00 0.00 C ATOM 955 C LYS A 60 -4.194 -9.539 7.008 1.00 0.00 C ATOM 956 O LYS A 60 -4.741 -10.640 6.975 1.00 0.00 O ATOM 957 CB LYS A 60 -2.976 -8.206 5.191 1.00 0.00 C ATOM 958 CG LYS A 60 -1.949 -9.322 5.392 1.00 0.00 C ATOM 959 CD LYS A 60 -0.598 -8.941 4.783 1.00 0.00 C ATOM 960 CE LYS A 60 -0.206 -9.911 3.667 1.00 0.00 C ATOM 961 NZ LYS A 60 0.500 -11.086 4.224 1.00 0.00 N ATOM 0 H LYS A 60 -4.590 -6.502 5.967 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.881 -9.092 5.049 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -3.113 -8.020 4.126 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -2.604 -7.281 5.631 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -1.828 -9.522 6.457 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -2.312 -10.242 4.934 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -0.647 -7.927 4.387 1.00 0.00 H new ATOM 0 HD3 LYS A 60 0.168 -8.944 5.558 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -1.097 -10.236 3.130 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.434 -9.404 2.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 0.759 -11.734 3.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 1.361 -10.773 4.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -0.123 -11.579 4.896 1.00 0.00 H new ATOM 975 N ASN A 61 -3.473 -9.089 8.024 1.00 0.00 N ATOM 976 CA ASN A 61 -3.271 -9.898 9.214 1.00 0.00 C ATOM 977 C ASN A 61 -4.607 -10.508 9.644 1.00 0.00 C ATOM 978 O ASN A 61 -4.692 -11.708 9.901 1.00 0.00 O ATOM 979 CB ASN A 61 -2.743 -9.051 10.373 1.00 0.00 C ATOM 980 CG ASN A 61 -2.029 -9.922 11.409 1.00 0.00 C ATOM 981 OD1 ASN A 61 -2.585 -10.306 12.425 1.00 0.00 O ATOM 982 ND2 ASN A 61 -0.769 -10.212 11.096 1.00 0.00 N ATOM 0 H ASN A 61 -3.021 -8.175 8.048 1.00 0.00 H new ATOM 0 HA ASN A 61 -2.544 -10.674 8.974 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.056 -8.296 9.992 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -3.569 -8.521 10.846 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.207 -10.788 11.723 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -0.364 -9.858 10.229 1.00 0.00 H new ATOM 989 N GLU A 62 -5.617 -9.653 9.709 1.00 0.00 N ATOM 990 CA GLU A 62 -6.945 -10.092 10.104 1.00 0.00 C ATOM 991 C GLU A 62 -7.317 -11.381 9.369 1.00 0.00 C ATOM 992 O GLU A 62 -8.086 -12.193 9.883 1.00 0.00 O ATOM 993 CB GLU A 62 -7.982 -8.997 9.850 1.00 0.00 C ATOM 994 CG GLU A 62 -8.588 -8.500 11.165 1.00 0.00 C ATOM 995 CD GLU A 62 -9.174 -9.661 11.971 1.00 0.00 C ATOM 996 OE1 GLU A 62 -9.604 -10.641 11.325 1.00 0.00 O ATOM 997 OE2 GLU A 62 -9.179 -9.542 13.216 1.00 0.00 O ATOM 0 H GLU A 62 -5.543 -8.659 9.495 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.936 -10.297 11.175 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.516 -8.165 9.323 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.771 -9.381 9.204 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.823 -7.993 11.754 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.367 -7.767 10.957 1.00 0.00 H new ATOM 1004 N LEU A 63 -6.755 -11.530 8.178 1.00 0.00 N ATOM 1005 CA LEU A 63 -7.019 -12.706 7.368 1.00 0.00 C ATOM 1006 C LEU A 63 -6.077 -13.835 7.793 1.00 0.00 C ATOM 1007 O LEU A 63 -6.505 -14.977 7.956 1.00 0.00 O ATOM 1008 CB LEU A 63 -6.933 -12.362 5.880 1.00 0.00 C ATOM 1009 CG LEU A 63 -7.933 -11.319 5.374 1.00 0.00 C ATOM 1010 CD1 LEU A 63 -7.602 -10.893 3.942 1.00 0.00 C ATOM 1011 CD2 LEU A 63 -9.369 -11.829 5.503 1.00 0.00 C ATOM 0 H LEU A 63 -6.118 -10.855 7.755 1.00 0.00 H new ATOM 0 HA LEU A 63 -8.037 -13.060 7.532 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.926 -12.004 5.668 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -7.073 -13.278 5.307 1.00 0.00 H new ATOM 0 HG LEU A 63 -7.849 -10.432 6.002 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.327 -10.152 3.606 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.602 -10.461 3.913 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -7.641 -11.762 3.286 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -10.059 -11.069 5.137 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -9.486 -12.739 4.915 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -9.587 -12.043 6.549 1.00 0.00 H new ATOM 1023 N GLU A 64 -4.813 -13.476 7.960 1.00 0.00 N ATOM 1024 CA GLU A 64 -3.807 -14.444 8.363 1.00 0.00 C ATOM 1025 C GLU A 64 -4.170 -15.053 9.719 1.00 0.00 C ATOM 1026 O GLU A 64 -3.633 -16.092 10.101 1.00 0.00 O ATOM 1027 CB GLU A 64 -2.417 -13.806 8.404 1.00 0.00 C ATOM 1028 CG GLU A 64 -2.000 -13.314 7.017 1.00 0.00 C ATOM 1029 CD GLU A 64 -0.587 -13.788 6.669 1.00 0.00 C ATOM 1030 OE1 GLU A 64 0.363 -13.194 7.222 1.00 0.00 O ATOM 1031 OE2 GLU A 64 -0.490 -14.734 5.857 1.00 0.00 O ATOM 0 H GLU A 64 -4.462 -12.528 7.824 1.00 0.00 H new ATOM 0 HA GLU A 64 -3.782 -15.243 7.622 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -2.416 -12.972 9.105 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -1.690 -14.531 8.770 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -2.705 -13.680 6.270 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -2.040 -12.225 6.986 1.00 0.00 H new ATOM 1107 N ILE A 69 -5.453 -17.442 5.551 1.00 0.00 N ATOM 1108 CA ILE A 69 -5.985 -17.130 4.235 1.00 0.00 C ATOM 1109 C ILE A 69 -4.850 -16.634 3.337 1.00 0.00 C ATOM 1110 O ILE A 69 -3.872 -16.066 3.821 1.00 0.00 O ATOM 1111 CB ILE A 69 -7.153 -16.148 4.348 1.00 0.00 C ATOM 1112 CG1 ILE A 69 -8.455 -16.882 4.677 1.00 0.00 C ATOM 1113 CG2 ILE A 69 -7.278 -15.298 3.083 1.00 0.00 C ATOM 1114 CD1 ILE A 69 -9.639 -15.913 4.697 1.00 0.00 C ATOM 0 HA ILE A 69 -6.396 -18.025 3.768 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.949 -15.467 5.174 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -8.633 -17.664 3.939 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -8.365 -17.373 5.646 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -8.116 -14.609 3.189 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.359 -14.732 2.933 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -7.449 -15.947 2.224 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -10.552 -16.459 4.933 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -9.469 -15.146 5.453 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -9.740 -15.442 3.719 1.00 0.00 H new ATOM 1126 N VAL A 70 -5.017 -16.868 2.043 1.00 0.00 N ATOM 1127 CA VAL A 70 -4.019 -16.453 1.072 1.00 0.00 C ATOM 1128 C VAL A 70 -4.151 -14.949 0.824 1.00 0.00 C ATOM 1129 O VAL A 70 -5.108 -14.502 0.193 1.00 0.00 O ATOM 1130 CB VAL A 70 -4.154 -17.284 -0.205 1.00 0.00 C ATOM 1131 CG1 VAL A 70 -3.214 -16.769 -1.297 1.00 0.00 C ATOM 1132 CG2 VAL A 70 -3.906 -18.767 0.077 1.00 0.00 C ATOM 0 H VAL A 70 -5.829 -17.340 1.645 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.015 -16.633 1.455 1.00 0.00 H new ATOM 0 HB VAL A 70 -5.177 -17.178 -0.566 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -3.330 -17.378 -2.194 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -3.458 -15.732 -1.528 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.183 -16.830 -0.948 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -4.008 -19.335 -0.848 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -2.900 -18.898 0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -4.633 -19.125 0.805 1.00 0.00 H new ATOM 1142 N VAL A 71 -3.176 -14.210 1.331 1.00 0.00 N ATOM 1143 CA VAL A 71 -3.171 -12.766 1.172 1.00 0.00 C ATOM 1144 C VAL A 71 -1.921 -12.347 0.396 1.00 0.00 C ATOM 1145 O VAL A 71 -0.825 -12.836 0.666 1.00 0.00 O ATOM 1146 CB VAL A 71 -3.280 -12.088 2.540 1.00 0.00 C ATOM 1147 CG1 VAL A 71 -3.614 -10.602 2.390 1.00 0.00 C ATOM 1148 CG2 VAL A 71 -4.310 -12.796 3.422 1.00 0.00 C ATOM 0 H VAL A 71 -2.383 -14.584 1.853 1.00 0.00 H new ATOM 0 HA VAL A 71 -4.037 -12.443 0.594 1.00 0.00 H new ATOM 0 HB VAL A 71 -2.310 -12.165 3.031 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.686 -10.144 3.376 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.829 -10.109 1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.566 -10.494 1.870 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.368 -12.294 4.388 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -5.286 -12.765 2.938 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -4.011 -13.834 3.569 1.00 0.00 H new ATOM 1158 N PRO A 72 -2.133 -11.422 -0.579 1.00 0.00 N ATOM 1159 CA PRO A 72 -1.036 -10.932 -1.397 1.00 0.00 C ATOM 1160 C PRO A 72 -0.161 -9.954 -0.611 1.00 0.00 C ATOM 1161 O PRO A 72 -0.564 -9.463 0.442 1.00 0.00 O ATOM 1162 CB PRO A 72 -1.701 -10.295 -2.606 1.00 0.00 C ATOM 1163 CG PRO A 72 -3.144 -10.038 -2.201 1.00 0.00 C ATOM 1164 CD PRO A 72 -3.417 -10.821 -0.927 1.00 0.00 C ATOM 0 HA PRO A 72 -0.354 -11.725 -1.706 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -1.202 -9.366 -2.882 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -1.650 -10.954 -3.472 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -3.311 -8.973 -2.038 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -3.824 -10.349 -2.994 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -3.778 -10.169 -0.131 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.181 -11.582 -1.086 1.00 0.00 H new ATOM 1172 N PRO A 73 1.052 -9.693 -1.168 1.00 0.00 N ATOM 1173 CA PRO A 73 1.988 -8.782 -0.531 1.00 0.00 C ATOM 1174 C PRO A 73 1.551 -7.328 -0.717 1.00 0.00 C ATOM 1175 O PRO A 73 0.937 -6.986 -1.726 1.00 0.00 O ATOM 1176 CB PRO A 73 3.332 -9.086 -1.173 1.00 0.00 C ATOM 1177 CG PRO A 73 3.019 -9.823 -2.466 1.00 0.00 C ATOM 1178 CD PRO A 73 1.563 -10.256 -2.414 1.00 0.00 C ATOM 0 HA PRO A 73 2.038 -8.918 0.549 1.00 0.00 H new ATOM 0 HB2 PRO A 73 3.887 -8.169 -1.371 1.00 0.00 H new ATOM 0 HB3 PRO A 73 3.950 -9.697 -0.515 1.00 0.00 H new ATOM 0 HG2 PRO A 73 3.195 -9.177 -3.326 1.00 0.00 H new ATOM 0 HG3 PRO A 73 3.671 -10.689 -2.579 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.008 -9.882 -3.274 1.00 0.00 H new ATOM 0 HD3 PRO A 73 1.473 -11.342 -2.424 1.00 0.00 H new ATOM 1186 N LEU A 74 1.886 -6.512 0.271 1.00 0.00 N ATOM 1187 CA LEU A 74 1.536 -5.102 0.228 1.00 0.00 C ATOM 1188 C LEU A 74 2.623 -4.334 -0.526 1.00 0.00 C ATOM 1189 O LEU A 74 3.797 -4.696 -0.469 1.00 0.00 O ATOM 1190 CB LEU A 74 1.275 -4.572 1.639 1.00 0.00 C ATOM 1191 CG LEU A 74 -0.081 -4.931 2.250 1.00 0.00 C ATOM 1192 CD1 LEU A 74 0.010 -5.017 3.775 1.00 0.00 C ATOM 1193 CD2 LEU A 74 -1.165 -3.950 1.796 1.00 0.00 C ATOM 0 H LEU A 74 2.396 -6.800 1.106 1.00 0.00 H new ATOM 0 HA LEU A 74 0.605 -4.957 -0.320 1.00 0.00 H new ATOM 0 HB2 LEU A 74 2.059 -4.947 2.297 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.367 -3.486 1.621 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.367 -5.918 1.888 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.967 -5.273 4.184 1.00 0.00 H new ATOM 0 HD12 LEU A 74 0.733 -5.784 4.054 1.00 0.00 H new ATOM 0 HD13 LEU A 74 0.330 -4.055 4.175 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -2.119 -4.228 2.245 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.897 -2.941 2.109 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.252 -3.981 0.710 1.00 0.00 H new ATOM 1205 N PRO A 75 2.181 -3.259 -1.234 1.00 0.00 N ATOM 1206 CA PRO A 75 3.103 -2.437 -1.998 1.00 0.00 C ATOM 1207 C PRO A 75 3.927 -1.535 -1.077 1.00 0.00 C ATOM 1208 O PRO A 75 3.533 -0.405 -0.793 1.00 0.00 O ATOM 1209 CB PRO A 75 2.226 -1.656 -2.964 1.00 0.00 C ATOM 1210 CG PRO A 75 0.819 -1.721 -2.394 1.00 0.00 C ATOM 1211 CD PRO A 75 0.798 -2.801 -1.324 1.00 0.00 C ATOM 0 HA PRO A 75 3.842 -3.027 -2.539 1.00 0.00 H new ATOM 0 HB2 PRO A 75 2.565 -0.624 -3.052 1.00 0.00 H new ATOM 0 HB3 PRO A 75 2.263 -2.090 -3.963 1.00 0.00 H new ATOM 0 HG2 PRO A 75 0.534 -0.758 -1.970 1.00 0.00 H new ATOM 0 HG3 PRO A 75 0.099 -1.949 -3.180 1.00 0.00 H new ATOM 0 HD2 PRO A 75 0.448 -2.407 -0.370 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.128 -3.616 -1.597 1.00 0.00 H new ATOM 1219 N GLY A 76 5.056 -2.069 -0.634 1.00 0.00 N ATOM 1220 CA GLY A 76 5.939 -1.326 0.249 1.00 0.00 C ATOM 1221 C GLY A 76 6.160 -2.079 1.563 1.00 0.00 C ATOM 1222 O GLY A 76 5.202 -2.460 2.233 1.00 0.00 O ATOM 0 H GLY A 76 5.379 -3.007 -0.870 1.00 0.00 H new ATOM 0 HA2 GLY A 76 6.897 -1.159 -0.244 1.00 0.00 H new ATOM 0 HA3 GLY A 76 5.512 -0.345 0.455 1.00 0.00 H new ATOM 1512 N GLU A 94 2.875 13.002 -7.147 1.00 0.00 N ATOM 1513 CA GLU A 94 1.697 12.236 -7.519 1.00 0.00 C ATOM 1514 C GLU A 94 2.082 10.789 -7.834 1.00 0.00 C ATOM 1515 O GLU A 94 1.333 9.863 -7.528 1.00 0.00 O ATOM 1516 CB GLU A 94 0.976 12.882 -8.704 1.00 0.00 C ATOM 1517 CG GLU A 94 1.943 13.135 -9.863 1.00 0.00 C ATOM 1518 CD GLU A 94 1.360 14.145 -10.853 1.00 0.00 C ATOM 1519 OE1 GLU A 94 1.489 15.356 -10.572 1.00 0.00 O ATOM 1520 OE2 GLU A 94 0.798 13.683 -11.870 1.00 0.00 O ATOM 0 HA GLU A 94 1.008 12.232 -6.674 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.165 12.235 -9.037 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.525 13.823 -8.390 1.00 0.00 H new ATOM 0 HG2 GLU A 94 2.892 13.506 -9.475 1.00 0.00 H new ATOM 0 HG3 GLU A 94 2.154 12.197 -10.377 1.00 0.00 H new ATOM 1527 N SER A 95 3.250 10.640 -8.442 1.00 0.00 N ATOM 1528 CA SER A 95 3.744 9.322 -8.801 1.00 0.00 C ATOM 1529 C SER A 95 3.820 8.434 -7.558 1.00 0.00 C ATOM 1530 O SER A 95 3.155 7.402 -7.486 1.00 0.00 O ATOM 1531 CB SER A 95 5.115 9.411 -9.474 1.00 0.00 C ATOM 1532 OG SER A 95 5.103 8.857 -10.787 1.00 0.00 O ATOM 0 H SER A 95 3.868 11.411 -8.695 1.00 0.00 H new ATOM 0 HA SER A 95 3.048 8.880 -9.513 1.00 0.00 H new ATOM 0 HB2 SER A 95 5.427 10.454 -9.524 1.00 0.00 H new ATOM 0 HB3 SER A 95 5.852 8.886 -8.866 1.00 0.00 H new ATOM 0 HG SER A 95 5.996 8.935 -11.183 1.00 0.00 H new ATOM 1538 N PHE A 96 4.635 8.869 -6.608 1.00 0.00 N ATOM 1539 CA PHE A 96 4.807 8.127 -5.371 1.00 0.00 C ATOM 1540 C PHE A 96 3.459 7.649 -4.827 1.00 0.00 C ATOM 1541 O PHE A 96 3.321 6.493 -4.430 1.00 0.00 O ATOM 1542 CB PHE A 96 5.441 9.084 -4.360 1.00 0.00 C ATOM 1543 CG PHE A 96 5.537 8.517 -2.942 1.00 0.00 C ATOM 1544 CD1 PHE A 96 6.492 7.597 -2.641 1.00 0.00 C ATOM 1545 CD2 PHE A 96 4.667 8.932 -1.983 1.00 0.00 C ATOM 1546 CE1 PHE A 96 6.582 7.070 -1.325 1.00 0.00 C ATOM 1547 CE2 PHE A 96 4.756 8.406 -0.667 1.00 0.00 C ATOM 1548 CZ PHE A 96 5.712 7.486 -0.366 1.00 0.00 C ATOM 0 H PHE A 96 5.184 9.727 -6.670 1.00 0.00 H new ATOM 0 HA PHE A 96 5.430 7.250 -5.547 1.00 0.00 H new ATOM 0 HB2 PHE A 96 6.441 9.348 -4.703 1.00 0.00 H new ATOM 0 HB3 PHE A 96 4.859 10.005 -4.333 1.00 0.00 H new ATOM 0 HD1 PHE A 96 7.182 7.267 -3.403 1.00 0.00 H new ATOM 0 HD2 PHE A 96 3.908 9.662 -2.222 1.00 0.00 H new ATOM 0 HE1 PHE A 96 7.341 6.339 -1.086 1.00 0.00 H new ATOM 0 HE2 PHE A 96 4.065 8.736 0.095 1.00 0.00 H new ATOM 0 HZ PHE A 96 5.780 7.086 0.635 1.00 0.00 H new ATOM 1558 N ILE A 97 2.499 8.562 -4.827 1.00 0.00 N ATOM 1559 CA ILE A 97 1.167 8.248 -4.339 1.00 0.00 C ATOM 1560 C ILE A 97 0.527 7.202 -5.253 1.00 0.00 C ATOM 1561 O ILE A 97 0.203 6.101 -4.811 1.00 0.00 O ATOM 1562 CB ILE A 97 0.337 9.524 -4.188 1.00 0.00 C ATOM 1563 CG1 ILE A 97 0.714 10.277 -2.910 1.00 0.00 C ATOM 1564 CG2 ILE A 97 -1.160 9.215 -4.251 1.00 0.00 C ATOM 1565 CD1 ILE A 97 0.606 11.789 -3.112 1.00 0.00 C ATOM 0 H ILE A 97 2.617 9.520 -5.157 1.00 0.00 H new ATOM 0 HA ILE A 97 1.220 7.810 -3.342 1.00 0.00 H new ATOM 0 HB ILE A 97 0.566 10.181 -5.027 1.00 0.00 H new ATOM 0 HG12 ILE A 97 0.059 9.968 -2.095 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.731 10.017 -2.618 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.727 10.139 -4.141 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -1.397 8.756 -5.211 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -1.424 8.529 -3.446 1.00 0.00 H new ATOM 0 HD11 ILE A 97 0.879 12.300 -2.189 1.00 0.00 H new ATOM 0 HD12 ILE A 97 1.280 12.098 -3.911 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -0.418 12.048 -3.380 1.00 0.00 H new ATOM 1577 N GLU A 98 0.364 7.583 -6.512 1.00 0.00 N ATOM 1578 CA GLU A 98 -0.231 6.691 -7.492 1.00 0.00 C ATOM 1579 C GLU A 98 0.329 5.276 -7.333 1.00 0.00 C ATOM 1580 O GLU A 98 -0.429 4.314 -7.224 1.00 0.00 O ATOM 1581 CB GLU A 98 -0.009 7.212 -8.913 1.00 0.00 C ATOM 1582 CG GLU A 98 -1.342 7.439 -9.629 1.00 0.00 C ATOM 1583 CD GLU A 98 -1.198 8.484 -10.738 1.00 0.00 C ATOM 1584 OE1 GLU A 98 -0.577 8.138 -11.766 1.00 0.00 O ATOM 1585 OE2 GLU A 98 -1.714 9.604 -10.533 1.00 0.00 O ATOM 0 H GLU A 98 0.634 8.497 -6.875 1.00 0.00 H new ATOM 0 HA GLU A 98 -1.306 6.656 -7.316 1.00 0.00 H new ATOM 0 HB2 GLU A 98 0.553 8.146 -8.878 1.00 0.00 H new ATOM 0 HB3 GLU A 98 0.593 6.499 -9.476 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -1.695 6.499 -10.054 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -2.093 7.767 -8.911 1.00 0.00 H new ATOM 1592 N GLU A 99 1.651 5.196 -7.325 1.00 0.00 N ATOM 1593 CA GLU A 99 2.322 3.915 -7.181 1.00 0.00 C ATOM 1594 C GLU A 99 1.647 3.082 -6.089 1.00 0.00 C ATOM 1595 O GLU A 99 1.096 2.018 -6.366 1.00 0.00 O ATOM 1596 CB GLU A 99 3.810 4.105 -6.884 1.00 0.00 C ATOM 1597 CG GLU A 99 4.664 3.152 -7.722 1.00 0.00 C ATOM 1598 CD GLU A 99 5.599 2.328 -6.834 1.00 0.00 C ATOM 1599 OE1 GLU A 99 6.536 2.938 -6.277 1.00 0.00 O ATOM 1600 OE2 GLU A 99 5.354 1.106 -6.733 1.00 0.00 O ATOM 0 H GLU A 99 2.276 5.997 -7.416 1.00 0.00 H new ATOM 0 HA GLU A 99 2.240 3.376 -8.125 1.00 0.00 H new ATOM 0 HB2 GLU A 99 4.097 5.135 -7.093 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.998 3.931 -5.825 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.018 2.485 -8.293 1.00 0.00 H new ATOM 0 HG3 GLU A 99 5.250 3.722 -8.443 1.00 0.00 H new ATOM 1607 N ARG A 100 1.712 3.598 -4.870 1.00 0.00 N ATOM 1608 CA ARG A 100 1.115 2.916 -3.736 1.00 0.00 C ATOM 1609 C ARG A 100 -0.394 2.763 -3.943 1.00 0.00 C ATOM 1610 O ARG A 100 -0.953 1.695 -3.696 1.00 0.00 O ATOM 1611 CB ARG A 100 1.369 3.682 -2.436 1.00 0.00 C ATOM 1612 CG ARG A 100 1.102 2.796 -1.217 1.00 0.00 C ATOM 1613 CD ARG A 100 2.193 2.977 -0.159 1.00 0.00 C ATOM 1614 NE ARG A 100 1.684 3.809 0.955 1.00 0.00 N ATOM 1615 CZ ARG A 100 1.691 5.149 0.955 1.00 0.00 C ATOM 1616 NH1 ARG A 100 2.179 5.817 -0.099 1.00 0.00 N ATOM 1617 NH2 ARG A 100 1.209 5.821 2.010 1.00 0.00 N ATOM 0 H ARG A 100 2.170 4.481 -4.644 1.00 0.00 H new ATOM 0 HA ARG A 100 1.577 1.932 -3.661 1.00 0.00 H new ATOM 0 HB2 ARG A 100 2.400 4.036 -2.414 1.00 0.00 H new ATOM 0 HB3 ARG A 100 0.728 4.563 -2.397 1.00 0.00 H new ATOM 0 HG2 ARG A 100 0.131 3.043 -0.789 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.058 1.751 -1.525 1.00 0.00 H new ATOM 0 HD2 ARG A 100 2.511 2.005 0.218 1.00 0.00 H new ATOM 0 HD3 ARG A 100 3.069 3.448 -0.605 1.00 0.00 H new ATOM 0 HE ARG A 100 1.304 3.333 1.773 1.00 0.00 H new ATOM 0 HH11 ARG A 100 2.545 5.306 -0.902 1.00 0.00 H new ATOM 0 HH12 ARG A 100 2.184 6.837 -0.099 1.00 0.00 H new ATOM 0 HH21 ARG A 100 0.837 5.312 2.812 1.00 0.00 H new ATOM 0 HH22 ARG A 100 1.214 6.841 2.011 1.00 0.00 H new ATOM 1631 N ARG A 101 -1.010 3.845 -4.393 1.00 0.00 N ATOM 1632 CA ARG A 101 -2.442 3.845 -4.636 1.00 0.00 C ATOM 1633 C ARG A 101 -2.838 2.629 -5.476 1.00 0.00 C ATOM 1634 O ARG A 101 -3.511 1.723 -4.986 1.00 0.00 O ATOM 1635 CB ARG A 101 -2.878 5.120 -5.361 1.00 0.00 C ATOM 1636 CG ARG A 101 -4.260 5.575 -4.887 1.00 0.00 C ATOM 1637 CD ARG A 101 -4.585 6.976 -5.407 1.00 0.00 C ATOM 1638 NE ARG A 101 -5.250 6.885 -6.726 1.00 0.00 N ATOM 1639 CZ ARG A 101 -5.281 7.881 -7.622 1.00 0.00 C ATOM 1640 NH1 ARG A 101 -4.685 9.049 -7.346 1.00 0.00 N ATOM 1641 NH2 ARG A 101 -5.908 7.709 -8.794 1.00 0.00 N ATOM 0 H ARG A 101 -0.543 4.729 -4.596 1.00 0.00 H new ATOM 0 HA ARG A 101 -2.942 3.801 -3.668 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -2.150 5.911 -5.183 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -2.899 4.942 -6.436 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -5.017 4.871 -5.232 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -4.294 5.571 -3.798 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -5.232 7.494 -4.699 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -3.670 7.563 -5.491 1.00 0.00 H new ATOM 0 HE ARG A 101 -5.714 6.009 -6.968 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -4.208 9.180 -6.454 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -4.708 9.807 -8.028 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -6.362 6.820 -9.004 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -5.932 8.467 -9.476 1.00 0.00 H new ATOM 1655 N GLN A 102 -2.403 2.647 -6.728 1.00 0.00 N ATOM 1656 CA GLN A 102 -2.703 1.557 -7.640 1.00 0.00 C ATOM 1657 C GLN A 102 -2.305 0.218 -7.017 1.00 0.00 C ATOM 1658 O GLN A 102 -3.020 -0.773 -7.156 1.00 0.00 O ATOM 1659 CB GLN A 102 -2.009 1.763 -8.988 1.00 0.00 C ATOM 1660 CG GLN A 102 -2.884 2.585 -9.936 1.00 0.00 C ATOM 1661 CD GLN A 102 -2.233 2.707 -11.315 1.00 0.00 C ATOM 1662 OE1 GLN A 102 -2.194 1.772 -12.097 1.00 0.00 O ATOM 1663 NE2 GLN A 102 -1.725 3.910 -11.569 1.00 0.00 N ATOM 0 H GLN A 102 -1.845 3.400 -7.132 1.00 0.00 H new ATOM 0 HA GLN A 102 -3.778 1.546 -7.820 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -1.056 2.269 -8.836 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -1.788 0.795 -9.439 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -3.863 2.115 -10.032 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -3.047 3.578 -9.517 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -1.792 4.650 -10.870 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -1.269 4.093 -12.463 1.00 0.00 H new ATOM 1672 N GLY A 103 -1.164 0.231 -6.343 1.00 0.00 N ATOM 1673 CA GLY A 103 -0.662 -0.970 -5.698 1.00 0.00 C ATOM 1674 C GLY A 103 -1.707 -1.561 -4.749 1.00 0.00 C ATOM 1675 O GLY A 103 -2.095 -2.719 -4.891 1.00 0.00 O ATOM 0 H GLY A 103 -0.573 1.055 -6.230 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -0.394 -1.708 -6.454 1.00 0.00 H new ATOM 0 HA3 GLY A 103 0.247 -0.736 -5.144 1.00 0.00 H new ATOM 1679 N LEU A 104 -2.133 -0.737 -3.803 1.00 0.00 N ATOM 1680 CA LEU A 104 -3.126 -1.164 -2.831 1.00 0.00 C ATOM 1681 C LEU A 104 -4.393 -1.607 -3.564 1.00 0.00 C ATOM 1682 O LEU A 104 -4.787 -2.770 -3.483 1.00 0.00 O ATOM 1683 CB LEU A 104 -3.368 -0.064 -1.795 1.00 0.00 C ATOM 1684 CG LEU A 104 -2.309 0.070 -0.699 1.00 0.00 C ATOM 1685 CD1 LEU A 104 -2.551 1.321 0.148 1.00 0.00 C ATOM 1686 CD2 LEU A 104 -2.241 -1.197 0.156 1.00 0.00 C ATOM 0 H LEU A 104 -1.809 0.223 -3.689 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.764 -2.026 -2.270 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.444 0.889 -2.318 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.332 -0.245 -1.321 1.00 0.00 H new ATOM 0 HG LEU A 104 -1.337 0.188 -1.177 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.784 1.392 0.919 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.509 2.205 -0.488 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.533 1.258 0.617 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -1.480 -1.075 0.927 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.209 -1.372 0.625 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.985 -2.048 -0.475 1.00 0.00 H new ATOM 1698 N GLU A 105 -4.997 -0.658 -4.264 1.00 0.00 N ATOM 1699 CA GLU A 105 -6.212 -0.936 -5.011 1.00 0.00 C ATOM 1700 C GLU A 105 -6.124 -2.313 -5.673 1.00 0.00 C ATOM 1701 O GLU A 105 -7.075 -3.092 -5.623 1.00 0.00 O ATOM 1702 CB GLU A 105 -6.480 0.155 -6.049 1.00 0.00 C ATOM 1703 CG GLU A 105 -7.965 0.216 -6.410 1.00 0.00 C ATOM 1704 CD GLU A 105 -8.166 0.123 -7.924 1.00 0.00 C ATOM 1705 OE1 GLU A 105 -7.703 -0.886 -8.497 1.00 0.00 O ATOM 1706 OE2 GLU A 105 -8.779 1.064 -8.473 1.00 0.00 O ATOM 0 H GLU A 105 -4.667 0.305 -4.330 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.050 -0.942 -4.314 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.157 1.120 -5.659 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -5.892 -0.039 -6.946 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.496 -0.599 -5.918 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -8.395 1.146 -6.039 1.00 0.00 H new ATOM 1713 N GLN A 106 -4.974 -2.571 -6.278 1.00 0.00 N ATOM 1714 CA GLN A 106 -4.749 -3.840 -6.949 1.00 0.00 C ATOM 1715 C GLN A 106 -4.817 -4.992 -5.943 1.00 0.00 C ATOM 1716 O GLN A 106 -5.601 -5.924 -6.113 1.00 0.00 O ATOM 1717 CB GLN A 106 -3.412 -3.839 -7.691 1.00 0.00 C ATOM 1718 CG GLN A 106 -3.601 -3.459 -9.161 1.00 0.00 C ATOM 1719 CD GLN A 106 -3.792 -4.704 -10.030 1.00 0.00 C ATOM 1720 OE1 GLN A 106 -3.332 -5.789 -9.714 1.00 0.00 O ATOM 1721 NE2 GLN A 106 -4.495 -4.488 -11.138 1.00 0.00 N ATOM 0 H GLN A 106 -4.188 -1.923 -6.318 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.537 -3.982 -7.689 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -2.728 -3.136 -7.215 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -2.953 -4.825 -7.623 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -4.467 -2.804 -9.262 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -2.734 -2.898 -9.509 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -4.851 -3.554 -11.342 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -4.678 -5.256 -11.784 1.00 0.00 H new ATOM 1730 N PHE A 107 -3.984 -4.889 -4.917 1.00 0.00 N ATOM 1731 CA PHE A 107 -3.940 -5.910 -3.885 1.00 0.00 C ATOM 1732 C PHE A 107 -5.350 -6.299 -3.437 1.00 0.00 C ATOM 1733 O PHE A 107 -5.723 -7.469 -3.495 1.00 0.00 O ATOM 1734 CB PHE A 107 -3.187 -5.311 -2.695 1.00 0.00 C ATOM 1735 CG PHE A 107 -3.546 -5.942 -1.349 1.00 0.00 C ATOM 1736 CD1 PHE A 107 -4.591 -5.455 -0.627 1.00 0.00 C ATOM 1737 CD2 PHE A 107 -2.821 -6.991 -0.874 1.00 0.00 C ATOM 1738 CE1 PHE A 107 -4.924 -6.042 0.623 1.00 0.00 C ATOM 1739 CE2 PHE A 107 -3.155 -7.577 0.375 1.00 0.00 C ATOM 1740 CZ PHE A 107 -4.200 -7.090 1.097 1.00 0.00 C ATOM 0 H PHE A 107 -3.335 -4.114 -4.779 1.00 0.00 H new ATOM 0 HA PHE A 107 -3.450 -6.805 -4.268 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -2.116 -5.423 -2.863 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -3.393 -4.242 -2.649 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -5.167 -4.623 -1.004 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -1.991 -7.378 -1.447 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -5.753 -5.655 1.197 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -2.579 -8.409 0.752 1.00 0.00 H new ATOM 0 HZ PHE A 107 -4.454 -7.536 2.047 1.00 0.00 H new ATOM 1750 N ILE A 108 -6.096 -5.294 -2.999 1.00 0.00 N ATOM 1751 CA ILE A 108 -7.457 -5.517 -2.542 1.00 0.00 C ATOM 1752 C ILE A 108 -8.302 -6.041 -3.704 1.00 0.00 C ATOM 1753 O ILE A 108 -9.078 -6.981 -3.538 1.00 0.00 O ATOM 1754 CB ILE A 108 -8.019 -4.248 -1.896 1.00 0.00 C ATOM 1755 CG1 ILE A 108 -9.311 -4.547 -1.135 1.00 0.00 C ATOM 1756 CG2 ILE A 108 -8.208 -3.142 -2.936 1.00 0.00 C ATOM 1757 CD1 ILE A 108 -9.012 -5.025 0.288 1.00 0.00 C ATOM 0 H ILE A 108 -5.783 -4.324 -2.951 1.00 0.00 H new ATOM 0 HA ILE A 108 -7.477 -6.280 -1.764 1.00 0.00 H new ATOM 0 HB ILE A 108 -7.294 -3.884 -1.168 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -9.931 -3.651 -1.099 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.882 -5.309 -1.666 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -8.608 -2.251 -2.451 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -7.248 -2.905 -3.394 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -8.903 -3.480 -3.705 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -9.948 -5.231 0.807 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.412 -5.934 0.248 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.462 -4.251 0.824 1.00 0.00 H new ATOM 1769 N ASN A 109 -8.122 -5.411 -4.856 1.00 0.00 N ATOM 1770 CA ASN A 109 -8.859 -5.803 -6.046 1.00 0.00 C ATOM 1771 C ASN A 109 -8.779 -7.322 -6.213 1.00 0.00 C ATOM 1772 O ASN A 109 -9.745 -7.954 -6.637 1.00 0.00 O ATOM 1773 CB ASN A 109 -8.264 -5.158 -7.299 1.00 0.00 C ATOM 1774 CG ASN A 109 -9.184 -4.062 -7.841 1.00 0.00 C ATOM 1775 OD1 ASN A 109 -9.965 -4.268 -8.756 1.00 0.00 O ATOM 1776 ND2 ASN A 109 -9.049 -2.890 -7.229 1.00 0.00 N ATOM 0 H ASN A 109 -7.477 -4.632 -4.991 1.00 0.00 H new ATOM 0 HA ASN A 109 -9.892 -5.475 -5.927 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -7.287 -4.735 -7.066 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -8.108 -5.918 -8.064 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -9.618 -2.095 -7.519 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -8.376 -2.786 -6.470 1.00 0.00 H new ATOM 1783 N LYS A 110 -7.620 -7.863 -5.870 1.00 0.00 N ATOM 1784 CA LYS A 110 -7.402 -9.295 -5.976 1.00 0.00 C ATOM 1785 C LYS A 110 -7.843 -9.972 -4.677 1.00 0.00 C ATOM 1786 O LYS A 110 -8.482 -11.023 -4.706 1.00 0.00 O ATOM 1787 CB LYS A 110 -5.950 -9.589 -6.361 1.00 0.00 C ATOM 1788 CG LYS A 110 -5.845 -10.003 -7.830 1.00 0.00 C ATOM 1789 CD LYS A 110 -5.106 -11.335 -7.973 1.00 0.00 C ATOM 1790 CE LYS A 110 -3.592 -11.134 -7.888 1.00 0.00 C ATOM 1791 NZ LYS A 110 -2.988 -12.124 -6.968 1.00 0.00 N ATOM 0 H LYS A 110 -6.821 -7.335 -5.518 1.00 0.00 H new ATOM 0 HA LYS A 110 -8.011 -9.714 -6.777 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -5.337 -8.705 -6.184 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -5.555 -10.383 -5.727 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.843 -10.089 -8.259 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -5.321 -9.230 -8.393 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -5.430 -12.021 -7.190 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -5.362 -11.797 -8.927 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -3.150 -11.233 -8.879 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -3.372 -10.125 -7.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -1.960 -11.973 -6.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -3.397 -12.011 -6.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -3.182 -13.085 -7.316 1.00 0.00 H new ATOM 1805 N ILE A 111 -7.484 -9.342 -3.568 1.00 0.00 N ATOM 1806 CA ILE A 111 -7.835 -9.870 -2.261 1.00 0.00 C ATOM 1807 C ILE A 111 -9.349 -10.078 -2.189 1.00 0.00 C ATOM 1808 O ILE A 111 -9.816 -11.106 -1.700 1.00 0.00 O ATOM 1809 CB ILE A 111 -7.286 -8.969 -1.153 1.00 0.00 C ATOM 1810 CG1 ILE A 111 -6.456 -9.774 -0.152 1.00 0.00 C ATOM 1811 CG2 ILE A 111 -8.412 -8.191 -0.470 1.00 0.00 C ATOM 1812 CD1 ILE A 111 -7.285 -10.137 1.081 1.00 0.00 C ATOM 0 H ILE A 111 -6.954 -8.471 -3.548 1.00 0.00 H new ATOM 0 HA ILE A 111 -7.371 -10.844 -2.108 1.00 0.00 H new ATOM 0 HB ILE A 111 -6.619 -8.237 -1.608 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -6.088 -10.683 -0.627 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -5.583 -9.196 0.150 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -7.994 -7.559 0.313 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -8.922 -7.569 -1.205 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -9.123 -8.891 -0.031 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -6.671 -10.709 1.777 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -7.631 -9.225 1.568 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -8.144 -10.736 0.778 1.00 0.00 H new ATOM 1824 N ALA A 112 -10.075 -9.087 -2.684 1.00 0.00 N ATOM 1825 CA ALA A 112 -11.527 -9.148 -2.683 1.00 0.00 C ATOM 1826 C ALA A 112 -11.978 -10.447 -3.354 1.00 0.00 C ATOM 1827 O ALA A 112 -12.706 -11.238 -2.756 1.00 0.00 O ATOM 1828 CB ALA A 112 -12.091 -7.907 -3.376 1.00 0.00 C ATOM 0 H ALA A 112 -9.685 -8.236 -3.089 1.00 0.00 H new ATOM 0 HA ALA A 112 -11.911 -9.153 -1.663 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -13.180 -7.953 -3.375 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -11.765 -7.013 -2.844 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -11.730 -7.869 -4.404 1.00 0.00 H new ATOM 1834 N GLY A 113 -11.527 -10.627 -4.587 1.00 0.00 N ATOM 1835 CA GLY A 113 -11.876 -11.816 -5.345 1.00 0.00 C ATOM 1836 C GLY A 113 -11.862 -13.059 -4.453 1.00 0.00 C ATOM 1837 O GLY A 113 -12.761 -13.894 -4.533 1.00 0.00 O ATOM 0 H GLY A 113 -10.923 -9.969 -5.080 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -12.865 -11.692 -5.787 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -11.173 -11.946 -6.168 1.00 0.00 H new ATOM 1841 N HIS A 114 -10.832 -13.141 -3.624 1.00 0.00 N ATOM 1842 CA HIS A 114 -10.689 -14.268 -2.718 1.00 0.00 C ATOM 1843 C HIS A 114 -12.043 -14.589 -2.080 1.00 0.00 C ATOM 1844 O HIS A 114 -12.738 -13.691 -1.607 1.00 0.00 O ATOM 1845 CB HIS A 114 -9.595 -13.998 -1.683 1.00 0.00 C ATOM 1846 CG HIS A 114 -8.849 -15.235 -1.242 1.00 0.00 C ATOM 1847 ND1 HIS A 114 -9.333 -16.095 -0.271 1.00 0.00 N ATOM 1848 CD2 HIS A 114 -7.652 -15.746 -1.648 1.00 0.00 C ATOM 1849 CE1 HIS A 114 -8.457 -17.076 -0.109 1.00 0.00 C ATOM 1850 NE2 HIS A 114 -7.416 -16.858 -0.962 1.00 0.00 N ATOM 0 H HIS A 114 -10.089 -12.446 -3.561 1.00 0.00 H new ATOM 0 HA HIS A 114 -10.371 -15.149 -3.275 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -8.883 -13.286 -2.099 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -10.044 -13.526 -0.809 1.00 0.00 H new ATOM 0 HD1 HIS A 114 -10.213 -15.991 0.233 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -7.005 -15.319 -2.400 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -8.551 -17.904 0.579 1.00 0.00 H new ATOM 1858 N PRO A 115 -12.385 -15.905 -2.087 1.00 0.00 N ATOM 1859 CA PRO A 115 -13.642 -16.355 -1.515 1.00 0.00 C ATOM 1860 C PRO A 115 -13.584 -16.343 0.014 1.00 0.00 C ATOM 1861 O PRO A 115 -14.507 -15.862 0.669 1.00 0.00 O ATOM 1862 CB PRO A 115 -13.861 -17.744 -2.090 1.00 0.00 C ATOM 1863 CG PRO A 115 -12.503 -18.207 -2.591 1.00 0.00 C ATOM 1864 CD PRO A 115 -11.586 -16.996 -2.639 1.00 0.00 C ATOM 0 HA PRO A 115 -14.476 -15.699 -1.764 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -14.250 -18.424 -1.332 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -14.589 -17.721 -2.901 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -12.093 -18.971 -1.930 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -12.594 -18.656 -3.580 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -10.682 -17.160 -2.053 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -11.270 -16.779 -3.659 1.00 0.00 H new ATOM 1872 N LEU A 116 -12.491 -16.877 0.537 1.00 0.00 N ATOM 1873 CA LEU A 116 -12.300 -16.934 1.976 1.00 0.00 C ATOM 1874 C LEU A 116 -12.429 -15.526 2.559 1.00 0.00 C ATOM 1875 O LEU A 116 -12.944 -15.351 3.663 1.00 0.00 O ATOM 1876 CB LEU A 116 -10.976 -17.621 2.315 1.00 0.00 C ATOM 1877 CG LEU A 116 -10.724 -18.966 1.630 1.00 0.00 C ATOM 1878 CD1 LEU A 116 -9.637 -19.757 2.361 1.00 0.00 C ATOM 1879 CD2 LEU A 116 -12.021 -19.765 1.496 1.00 0.00 C ATOM 0 H LEU A 116 -11.728 -17.275 -0.010 1.00 0.00 H new ATOM 0 HA LEU A 116 -13.076 -17.544 2.439 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -10.162 -16.945 2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -10.933 -17.771 3.394 1.00 0.00 H new ATOM 0 HG LEU A 116 -10.360 -18.773 0.621 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -9.477 -20.709 1.854 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -8.709 -19.185 2.361 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -9.950 -19.941 3.389 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -11.813 -20.716 1.006 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -12.438 -19.950 2.486 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -12.737 -19.199 0.901 1.00 0.00 H new ATOM 1891 N ALA A 117 -11.953 -14.556 1.792 1.00 0.00 N ATOM 1892 CA ALA A 117 -12.009 -13.168 2.219 1.00 0.00 C ATOM 1893 C ALA A 117 -13.448 -12.661 2.104 1.00 0.00 C ATOM 1894 O ALA A 117 -13.953 -12.004 3.013 1.00 0.00 O ATOM 1895 CB ALA A 117 -11.030 -12.338 1.386 1.00 0.00 C ATOM 0 H ALA A 117 -11.527 -14.704 0.877 1.00 0.00 H new ATOM 0 HA ALA A 117 -11.709 -13.075 3.263 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -11.072 -11.297 1.706 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -10.019 -12.720 1.525 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -11.301 -12.405 0.332 1.00 0.00 H new ATOM 1901 N GLN A 118 -14.068 -12.986 0.979 1.00 0.00 N ATOM 1902 CA GLN A 118 -15.439 -12.572 0.733 1.00 0.00 C ATOM 1903 C GLN A 118 -16.337 -12.990 1.900 1.00 0.00 C ATOM 1904 O GLN A 118 -17.409 -12.421 2.097 1.00 0.00 O ATOM 1905 CB GLN A 118 -15.956 -13.143 -0.588 1.00 0.00 C ATOM 1906 CG GLN A 118 -15.505 -12.283 -1.771 1.00 0.00 C ATOM 1907 CD GLN A 118 -16.029 -12.850 -3.092 1.00 0.00 C ATOM 1908 OE1 GLN A 118 -16.996 -13.591 -3.139 1.00 0.00 O ATOM 1909 NE2 GLN A 118 -15.337 -12.462 -4.160 1.00 0.00 N ATOM 0 H GLN A 118 -13.646 -13.531 0.227 1.00 0.00 H new ATOM 0 HA GLN A 118 -15.461 -11.485 0.654 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -15.592 -14.162 -0.715 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -17.045 -13.194 -0.565 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -15.865 -11.262 -1.641 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -14.416 -12.237 -1.797 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -14.536 -11.839 -4.050 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -15.607 -12.787 -5.088 1.00 0.00 H new ATOM 1918 N ASN A 119 -15.865 -13.980 2.642 1.00 0.00 N ATOM 1919 CA ASN A 119 -16.612 -14.481 3.784 1.00 0.00 C ATOM 1920 C ASN A 119 -16.157 -13.747 5.047 1.00 0.00 C ATOM 1921 O ASN A 119 -16.961 -13.486 5.941 1.00 0.00 O ATOM 1922 CB ASN A 119 -16.364 -15.976 3.991 1.00 0.00 C ATOM 1923 CG ASN A 119 -17.566 -16.643 4.663 1.00 0.00 C ATOM 1924 OD1 ASN A 119 -18.546 -16.007 5.014 1.00 0.00 O ATOM 1925 ND2 ASN A 119 -17.437 -17.957 4.822 1.00 0.00 N ATOM 0 H ASN A 119 -14.975 -14.449 2.475 1.00 0.00 H new ATOM 0 HA ASN A 119 -17.672 -14.314 3.593 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -16.169 -16.452 3.030 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -15.474 -16.119 4.604 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -18.185 -18.494 5.261 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -16.590 -18.428 4.505 1.00 0.00 H new ATOM 1932 N GLU A 120 -14.870 -13.435 5.080 1.00 0.00 N ATOM 1933 CA GLU A 120 -14.299 -12.736 6.219 1.00 0.00 C ATOM 1934 C GLU A 120 -14.898 -11.333 6.336 1.00 0.00 C ATOM 1935 O GLU A 120 -14.793 -10.530 5.410 1.00 0.00 O ATOM 1936 CB GLU A 120 -12.774 -12.673 6.115 1.00 0.00 C ATOM 1937 CG GLU A 120 -12.147 -14.037 6.412 1.00 0.00 C ATOM 1938 CD GLU A 120 -12.355 -14.429 7.876 1.00 0.00 C ATOM 1939 OE1 GLU A 120 -12.137 -13.548 8.736 1.00 0.00 O ATOM 1940 OE2 GLU A 120 -12.727 -15.600 8.103 1.00 0.00 O ATOM 0 H GLU A 120 -14.206 -13.653 4.337 1.00 0.00 H new ATOM 0 HA GLU A 120 -14.547 -13.292 7.123 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -12.487 -12.347 5.115 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -12.389 -11.931 6.815 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -12.589 -14.793 5.763 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -11.081 -14.008 6.188 1.00 0.00 H new ATOM 1947 N ARG A 121 -15.514 -11.081 7.482 1.00 0.00 N ATOM 1948 CA ARG A 121 -16.130 -9.789 7.732 1.00 0.00 C ATOM 1949 C ARG A 121 -15.058 -8.704 7.853 1.00 0.00 C ATOM 1950 O ARG A 121 -15.305 -7.544 7.529 1.00 0.00 O ATOM 1951 CB ARG A 121 -16.965 -9.816 9.014 1.00 0.00 C ATOM 1952 CG ARG A 121 -18.425 -9.461 8.725 1.00 0.00 C ATOM 1953 CD ARG A 121 -18.660 -7.955 8.863 1.00 0.00 C ATOM 1954 NE ARG A 121 -20.035 -7.701 9.348 1.00 0.00 N ATOM 1955 CZ ARG A 121 -20.530 -6.480 9.595 1.00 0.00 C ATOM 1956 NH1 ARG A 121 -19.767 -5.396 9.405 1.00 0.00 N ATOM 1957 NH2 ARG A 121 -21.789 -6.344 10.033 1.00 0.00 N ATOM 0 H ARG A 121 -15.600 -11.750 8.247 1.00 0.00 H new ATOM 0 HA ARG A 121 -16.785 -9.565 6.890 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -16.911 -10.806 9.467 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -16.552 -9.112 9.736 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -18.689 -9.783 7.718 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -19.077 -9.999 9.413 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -17.936 -7.527 9.556 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -18.508 -7.465 7.901 1.00 0.00 H new ATOM 0 HE ARG A 121 -20.644 -8.505 9.504 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -18.808 -5.499 9.072 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -20.144 -4.467 9.593 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -22.370 -7.169 10.178 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -22.166 -5.415 10.221 1.00 0.00 H new ATOM 1971 N CYS A 122 -13.890 -9.120 8.321 1.00 0.00 N ATOM 1972 CA CYS A 122 -12.780 -8.198 8.488 1.00 0.00 C ATOM 1973 C CYS A 122 -12.593 -7.428 7.179 1.00 0.00 C ATOM 1974 O CYS A 122 -12.044 -6.327 7.176 1.00 0.00 O ATOM 1975 CB CYS A 122 -11.501 -8.924 8.911 1.00 0.00 C ATOM 1976 SG CYS A 122 -10.787 -9.817 7.482 1.00 0.00 S ATOM 0 H CYS A 122 -13.689 -10.083 8.590 1.00 0.00 H new ATOM 0 HA CYS A 122 -13.004 -7.496 9.292 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -10.778 -8.207 9.301 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -11.720 -9.625 9.716 1.00 0.00 H new ATOM 0 HG CYS A 122 -9.686 -9.233 7.111 1.00 0.00 H new ATOM 1982 N LEU A 123 -13.061 -8.037 6.100 1.00 0.00 N ATOM 1983 CA LEU A 123 -12.952 -7.422 4.788 1.00 0.00 C ATOM 1984 C LEU A 123 -14.048 -6.366 4.632 1.00 0.00 C ATOM 1985 O LEU A 123 -13.774 -5.236 4.230 1.00 0.00 O ATOM 1986 CB LEU A 123 -12.968 -8.491 3.692 1.00 0.00 C ATOM 1987 CG LEU A 123 -13.030 -7.975 2.253 1.00 0.00 C ATOM 1988 CD1 LEU A 123 -11.625 -7.744 1.693 1.00 0.00 C ATOM 1989 CD2 LEU A 123 -13.853 -8.914 1.369 1.00 0.00 C ATOM 0 H LEU A 123 -13.516 -8.950 6.107 1.00 0.00 H new ATOM 0 HA LEU A 123 -11.996 -6.908 4.687 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -12.074 -9.106 3.798 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -13.825 -9.143 3.860 1.00 0.00 H new ATOM 0 HG LEU A 123 -13.537 -7.010 2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -11.697 -7.377 0.669 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.105 -7.008 2.306 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.070 -8.682 1.704 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -13.881 -8.524 0.351 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -13.397 -9.904 1.366 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -14.868 -8.984 1.759 1.00 0.00 H new ATOM 2001 N HIS A 124 -15.267 -6.771 4.959 1.00 0.00 N ATOM 2002 CA HIS A 124 -16.405 -5.873 4.860 1.00 0.00 C ATOM 2003 C HIS A 124 -16.220 -4.702 5.827 1.00 0.00 C ATOM 2004 O HIS A 124 -16.251 -3.543 5.416 1.00 0.00 O ATOM 2005 CB HIS A 124 -17.715 -6.630 5.089 1.00 0.00 C ATOM 2006 CG HIS A 124 -17.950 -7.759 4.115 1.00 0.00 C ATOM 2007 ND1 HIS A 124 -18.733 -7.622 2.983 1.00 0.00 N ATOM 2008 CD2 HIS A 124 -17.497 -9.046 4.116 1.00 0.00 C ATOM 2009 CE1 HIS A 124 -18.744 -8.780 2.339 1.00 0.00 C ATOM 2010 NE2 HIS A 124 -17.978 -9.661 3.043 1.00 0.00 N ATOM 0 H HIS A 124 -15.491 -7.709 5.293 1.00 0.00 H new ATOM 0 HA HIS A 124 -16.462 -5.461 3.852 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -17.718 -7.031 6.102 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -18.545 -5.927 5.022 1.00 0.00 H new ATOM 0 HD1 HIS A 124 -19.219 -6.774 2.693 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -16.856 -9.489 4.863 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -19.268 -8.989 1.418 1.00 0.00 H new ATOM 0 HE2 HIS A 124 -17.803 -10.633 2.787 1.00 0.00 H new ATOM 2018 N MET A 125 -16.032 -5.045 7.093 1.00 0.00 N ATOM 2019 CA MET A 125 -15.842 -4.036 8.121 1.00 0.00 C ATOM 2020 C MET A 125 -14.721 -3.068 7.739 1.00 0.00 C ATOM 2021 O MET A 125 -14.687 -1.933 8.213 1.00 0.00 O ATOM 2022 CB MET A 125 -15.499 -4.718 9.447 1.00 0.00 C ATOM 2023 CG MET A 125 -16.092 -3.948 10.629 1.00 0.00 C ATOM 2024 SD MET A 125 -14.787 -3.384 11.708 1.00 0.00 S ATOM 2025 CE MET A 125 -14.181 -4.953 12.307 1.00 0.00 C ATOM 0 H MET A 125 -16.007 -6.007 7.430 1.00 0.00 H new ATOM 0 HA MET A 125 -16.767 -3.468 8.222 1.00 0.00 H new ATOM 0 HB2 MET A 125 -15.881 -5.739 9.445 1.00 0.00 H new ATOM 0 HB3 MET A 125 -14.417 -4.783 9.557 1.00 0.00 H new ATOM 0 HG2 MET A 125 -16.668 -3.097 10.267 1.00 0.00 H new ATOM 0 HG3 MET A 125 -16.781 -4.587 11.181 1.00 0.00 H new ATOM 0 HE1 MET A 125 -13.719 -4.815 13.284 1.00 0.00 H new ATOM 0 HE2 MET A 125 -15.011 -5.654 12.394 1.00 0.00 H new ATOM 0 HE3 MET A 125 -13.443 -5.348 11.609 1.00 0.00 H new ATOM 2035 N PHE A 126 -13.830 -3.552 6.886 1.00 0.00 N ATOM 2036 CA PHE A 126 -12.710 -2.743 6.435 1.00 0.00 C ATOM 2037 C PHE A 126 -13.106 -1.878 5.236 1.00 0.00 C ATOM 2038 O PHE A 126 -12.345 -1.008 4.816 1.00 0.00 O ATOM 2039 CB PHE A 126 -11.604 -3.710 6.007 1.00 0.00 C ATOM 2040 CG PHE A 126 -10.446 -3.042 5.264 1.00 0.00 C ATOM 2041 CD1 PHE A 126 -9.424 -2.478 5.962 1.00 0.00 C ATOM 2042 CD2 PHE A 126 -10.438 -3.011 3.904 1.00 0.00 C ATOM 2043 CE1 PHE A 126 -8.349 -1.858 5.272 1.00 0.00 C ATOM 2044 CE2 PHE A 126 -9.364 -2.390 3.214 1.00 0.00 C ATOM 2045 CZ PHE A 126 -8.342 -1.827 3.912 1.00 0.00 C ATOM 0 H PHE A 126 -13.861 -4.494 6.495 1.00 0.00 H new ATOM 0 HA PHE A 126 -12.384 -2.080 7.236 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -11.213 -4.213 6.892 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -12.036 -4.480 5.368 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -9.430 -2.502 7.042 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.249 -3.459 3.349 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -7.537 -1.411 5.827 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -9.359 -2.365 2.134 1.00 0.00 H new ATOM 0 HZ PHE A 126 -7.525 -1.355 3.387 1.00 0.00 H new ATOM 2055 N LEU A 127 -14.296 -2.148 4.720 1.00 0.00 N ATOM 2056 CA LEU A 127 -14.801 -1.405 3.578 1.00 0.00 C ATOM 2057 C LEU A 127 -15.916 -0.464 4.041 1.00 0.00 C ATOM 2058 O LEU A 127 -15.647 0.651 4.485 1.00 0.00 O ATOM 2059 CB LEU A 127 -15.228 -2.361 2.463 1.00 0.00 C ATOM 2060 CG LEU A 127 -14.125 -3.250 1.883 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -14.721 -4.432 1.116 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -13.162 -2.433 1.019 1.00 0.00 C ATOM 0 H LEU A 127 -14.925 -2.870 5.071 1.00 0.00 H new ATOM 0 HA LEU A 127 -14.015 -0.784 3.150 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -16.021 -3.003 2.846 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -15.658 -1.773 1.652 1.00 0.00 H new ATOM 0 HG LEU A 127 -13.546 -3.662 2.710 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -13.916 -5.048 0.714 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -15.334 -5.031 1.789 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.337 -4.061 0.297 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -12.388 -3.088 0.619 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -13.711 -1.975 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -12.700 -1.654 1.626 1.00 0.00 H new ATOM 2074 N GLN A 128 -17.143 -0.948 3.921 1.00 0.00 N ATOM 2075 CA GLN A 128 -18.299 -0.164 4.321 1.00 0.00 C ATOM 2076 C GLN A 128 -18.002 0.599 5.614 1.00 0.00 C ATOM 2077 O GLN A 128 -17.945 1.827 5.615 1.00 0.00 O ATOM 2078 CB GLN A 128 -19.535 -1.051 4.480 1.00 0.00 C ATOM 2079 CG GLN A 128 -19.917 -1.703 3.149 1.00 0.00 C ATOM 2080 CD GLN A 128 -20.634 -3.035 3.377 1.00 0.00 C ATOM 2081 OE1 GLN A 128 -20.697 -3.555 4.479 1.00 0.00 O ATOM 2082 NE2 GLN A 128 -21.169 -3.557 2.277 1.00 0.00 N ATOM 0 H GLN A 128 -17.362 -1.873 3.552 1.00 0.00 H new ATOM 0 HA GLN A 128 -18.511 0.561 3.535 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -19.340 -1.823 5.224 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -20.369 -0.455 4.850 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -20.562 -1.031 2.583 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -19.021 -1.866 2.549 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -21.080 -3.069 1.386 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -21.669 -4.445 2.325 1.00 0.00 H new ATOM 2091 N GLU A 129 -17.820 -0.162 6.683 1.00 0.00 N ATOM 2092 CA GLU A 129 -17.530 0.426 7.980 1.00 0.00 C ATOM 2093 C GLU A 129 -16.301 1.334 7.888 1.00 0.00 C ATOM 2094 O GLU A 129 -15.197 0.865 7.617 1.00 0.00 O ATOM 2095 CB GLU A 129 -17.332 -0.658 9.042 1.00 0.00 C ATOM 2096 CG GLU A 129 -18.676 -1.129 9.601 1.00 0.00 C ATOM 2097 CD GLU A 129 -18.880 -0.629 11.032 1.00 0.00 C ATOM 2098 OE1 GLU A 129 -19.106 0.591 11.181 1.00 0.00 O ATOM 2099 OE2 GLU A 129 -18.805 -1.479 11.946 1.00 0.00 O ATOM 0 H GLU A 129 -17.868 -1.181 6.678 1.00 0.00 H new ATOM 0 HA GLU A 129 -18.384 1.032 8.282 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -16.798 -1.504 8.609 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -16.713 -0.271 9.851 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -19.485 -0.767 8.967 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -18.720 -2.218 9.583 1.00 0.00 H new ATOM 2106 N GLU A 130 -16.535 2.617 8.118 1.00 0.00 N ATOM 2107 CA GLU A 130 -15.462 3.595 8.065 1.00 0.00 C ATOM 2108 C GLU A 130 -14.474 3.362 9.210 1.00 0.00 C ATOM 2109 O GLU A 130 -13.263 3.344 8.995 1.00 0.00 O ATOM 2110 CB GLU A 130 -16.017 5.021 8.101 1.00 0.00 C ATOM 2111 CG GLU A 130 -17.264 5.101 8.983 1.00 0.00 C ATOM 2112 CD GLU A 130 -18.538 5.030 8.138 1.00 0.00 C ATOM 2113 OE1 GLU A 130 -18.625 4.087 7.322 1.00 0.00 O ATOM 2114 OE2 GLU A 130 -19.396 5.919 8.328 1.00 0.00 O ATOM 0 H GLU A 130 -17.453 3.002 8.342 1.00 0.00 H new ATOM 0 HA GLU A 130 -14.930 3.471 7.122 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -15.255 5.702 8.480 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -16.261 5.346 7.090 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -17.256 4.285 9.705 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -17.252 6.030 9.552 1.00 0.00 H new ATOM 2121 N ALA A 131 -15.028 3.190 10.401 1.00 0.00 N ATOM 2122 CA ALA A 131 -14.211 2.959 11.580 1.00 0.00 C ATOM 2123 C ALA A 131 -14.236 1.469 11.929 1.00 0.00 C ATOM 2124 O ALA A 131 -15.306 0.882 12.082 1.00 0.00 O ATOM 2125 CB ALA A 131 -14.712 3.835 12.729 1.00 0.00 C ATOM 0 H ALA A 131 -16.033 3.206 10.575 1.00 0.00 H new ATOM 0 HA ALA A 131 -13.174 3.235 11.388 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -14.099 3.661 13.613 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -14.646 4.884 12.442 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -15.749 3.585 12.952 1.00 0.00 H new ATOM 2131 N ILE A 132 -13.045 0.900 12.044 1.00 0.00 N ATOM 2132 CA ILE A 132 -12.917 -0.509 12.372 1.00 0.00 C ATOM 2133 C ILE A 132 -12.824 -0.669 13.891 1.00 0.00 C ATOM 2134 O ILE A 132 -12.123 0.093 14.556 1.00 0.00 O ATOM 2135 CB ILE A 132 -11.743 -1.131 11.615 1.00 0.00 C ATOM 2136 CG1 ILE A 132 -12.139 -1.481 10.179 1.00 0.00 C ATOM 2137 CG2 ILE A 132 -11.185 -2.342 12.366 1.00 0.00 C ATOM 2138 CD1 ILE A 132 -10.903 -1.744 9.317 1.00 0.00 C ATOM 0 H ILE A 132 -12.160 1.390 11.916 1.00 0.00 H new ATOM 0 HA ILE A 132 -13.801 -1.057 12.047 1.00 0.00 H new ATOM 0 HB ILE A 132 -10.945 -0.391 11.558 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -12.780 -2.362 10.180 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -12.719 -0.665 9.749 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -10.351 -2.765 11.806 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.839 -2.031 13.352 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -11.967 -3.094 12.476 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -11.213 -1.990 8.302 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -10.276 -0.853 9.299 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -10.338 -2.577 9.736 1.00 0.00 H new ATOM 2150 N ASP A 133 -13.539 -1.663 14.395 1.00 0.00 N ATOM 2151 CA ASP A 133 -13.546 -1.932 15.823 1.00 0.00 C ATOM 2152 C ASP A 133 -12.668 -3.151 16.112 1.00 0.00 C ATOM 2153 O ASP A 133 -13.176 -4.257 16.294 1.00 0.00 O ATOM 2154 CB ASP A 133 -14.960 -2.239 16.319 1.00 0.00 C ATOM 2155 CG ASP A 133 -15.062 -2.589 17.805 1.00 0.00 C ATOM 2156 OD1 ASP A 133 -14.726 -1.704 18.621 1.00 0.00 O ATOM 2157 OD2 ASP A 133 -15.473 -3.735 18.091 1.00 0.00 O ATOM 0 H ASP A 133 -14.118 -2.293 13.840 1.00 0.00 H new ATOM 0 HA ASP A 133 -13.169 -1.046 16.335 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -15.594 -1.375 16.120 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -15.361 -3.069 15.737 1.00 0.00 H new ATOM 2162 N ARG A 134 -11.366 -2.909 16.144 1.00 0.00 N ATOM 2163 CA ARG A 134 -10.413 -3.974 16.408 1.00 0.00 C ATOM 2164 C ARG A 134 -10.996 -4.972 17.409 1.00 0.00 C ATOM 2165 O ARG A 134 -11.804 -4.604 18.260 1.00 0.00 O ATOM 2166 CB ARG A 134 -9.101 -3.414 16.961 1.00 0.00 C ATOM 2167 CG ARG A 134 -8.424 -2.494 15.943 1.00 0.00 C ATOM 2168 CD ARG A 134 -8.157 -1.113 16.545 1.00 0.00 C ATOM 2169 NE ARG A 134 -7.776 -0.161 15.478 1.00 0.00 N ATOM 2170 CZ ARG A 134 -7.250 1.051 15.705 1.00 0.00 C ATOM 2171 NH1 ARG A 134 -7.040 1.466 16.962 1.00 0.00 N ATOM 2172 NH2 ARG A 134 -6.934 1.848 14.675 1.00 0.00 N ATOM 0 H ARG A 134 -10.948 -1.991 15.992 1.00 0.00 H new ATOM 0 HA ARG A 134 -10.210 -4.479 15.464 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -9.296 -2.863 17.881 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -8.431 -4.235 17.217 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -7.485 -2.939 15.613 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -9.056 -2.394 15.061 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -9.047 -0.755 17.063 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -7.361 -1.178 17.287 1.00 0.00 H new ATOM 0 HE ARG A 134 -7.923 -0.445 14.509 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -7.280 0.860 17.746 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -6.640 2.388 17.134 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -7.094 1.532 13.718 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -6.534 2.770 14.848 1.00 0.00 H new