USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 755 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 85 THR OG1 : rot 142:sc= 1.24 USER MOD Set 1.2: A 106 HIS : no HE2:sc= 0.9 K(o=2.1,f=-1.8) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0.493 K(o=0.49,f=-1.1) USER MOD Single : A 39 ASN : amide:sc= -4.02! C(o=-4!,f=-8.9!) USER MOD Single : A 43 THR OG1 : rot -67:sc= 1.23 USER MOD Single : A 49 THR OG1 : rot 86:sc= 1.2 USER MOD Single : A 52 SER OG : rot 70:sc= 0.0545 USER MOD Single : A 54 TYR OH : rot -49:sc= -1.07 USER MOD Single : A 63 SER OG : rot 177:sc= 1.01 USER MOD Single : A 72 GLN : amide:sc= -0.384 K(o=-0.38,f=-3.5!) USER MOD Single : A 76 TYR OH : rot -2:sc= 0.839 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot -33:sc= 0.364! USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 167:sc= -2.57! USER MOD Single : A 91 ASN : amide:sc= -1.69 K(o=-1.7,f=0) USER MOD Single : A 93 ASN : amide:sc=-0.00965 X(o=-0.0096,f=-0.13) USER MOD Single : A 96 LYS NZ :NH3+ -162:sc= 0.548 (180deg=-0.0432) USER MOD Single : A 103 LYS NZ :NH3+ -172:sc=-0.00611 (180deg=-0.0935) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : B 227 MET CE :methyl 166:sc= -0.0913 (180deg=-0.432) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 248 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 249 GLN : amide:sc= -1.23 K(o=-1.2,f=-0.23) USER MOD Single : B 250 ASN : amide:sc= 1.14 K(o=1.1,f=-0.21) USER MOD Single : B 253 ASN : amide:sc= -0.205 X(o=-0.2,f=-0.051) USER MOD ----------------------------------------------------------------- ATOM 101 N ALA A 31 3.730 8.830 5.140 1.00 0.00 N ATOM 102 CA ALA A 31 3.386 8.425 3.785 1.00 0.00 C ATOM 103 C ALA A 31 3.165 6.927 3.723 1.00 0.00 C ATOM 104 O ALA A 31 2.862 6.381 2.662 1.00 0.00 O ATOM 105 CB ALA A 31 4.494 8.820 2.810 1.00 0.00 C ATOM 0 HA ALA A 31 2.465 8.935 3.501 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.219 8.509 1.802 1.00 0.00 H new ATOM 0 HB2 ALA A 31 4.630 9.901 2.832 1.00 0.00 H new ATOM 0 HB3 ALA A 31 5.424 8.332 3.099 1.00 0.00 H new ATOM 111 N TYR A 32 3.316 6.274 4.856 1.00 0.00 N ATOM 112 CA TYR A 32 3.217 4.845 4.924 1.00 0.00 C ATOM 113 C TYR A 32 1.942 4.452 5.631 1.00 0.00 C ATOM 114 O TYR A 32 1.495 5.136 6.558 1.00 0.00 O ATOM 115 CB TYR A 32 4.412 4.262 5.690 1.00 0.00 C ATOM 116 CG TYR A 32 5.769 4.738 5.204 1.00 0.00 C ATOM 117 CD1 TYR A 32 6.053 4.858 3.848 1.00 0.00 C ATOM 118 CD2 TYR A 32 6.769 5.060 6.108 1.00 0.00 C ATOM 119 CE1 TYR A 32 7.283 5.283 3.418 1.00 0.00 C ATOM 120 CE2 TYR A 32 8.005 5.486 5.677 1.00 0.00 C ATOM 121 CZ TYR A 32 8.254 5.596 4.331 1.00 0.00 C ATOM 122 OH TYR A 32 9.486 6.029 3.887 1.00 0.00 O ATOM 0 H TYR A 32 3.510 6.725 5.750 1.00 0.00 H new ATOM 0 HA TYR A 32 3.213 4.451 3.908 1.00 0.00 H new ATOM 0 HB2 TYR A 32 4.309 4.516 6.745 1.00 0.00 H new ATOM 0 HB3 TYR A 32 4.376 3.175 5.619 1.00 0.00 H new ATOM 0 HD1 TYR A 32 5.292 4.612 3.122 1.00 0.00 H new ATOM 0 HD2 TYR A 32 6.575 4.975 7.167 1.00 0.00 H new ATOM 0 HE1 TYR A 32 7.486 5.371 2.361 1.00 0.00 H new ATOM 0 HE2 TYR A 32 8.775 5.732 6.393 1.00 0.00 H new ATOM 0 HH TYR A 32 10.065 6.212 4.656 1.00 0.00 H new ATOM 132 N ILE A 33 1.362 3.369 5.201 1.00 0.00 N ATOM 133 CA ILE A 33 0.173 2.834 5.810 1.00 0.00 C ATOM 134 C ILE A 33 0.296 1.348 5.940 1.00 0.00 C ATOM 135 O ILE A 33 1.119 0.718 5.261 1.00 0.00 O ATOM 136 CB ILE A 33 -1.118 3.150 5.018 1.00 0.00 C ATOM 137 CG1 ILE A 33 -0.975 2.722 3.552 1.00 0.00 C ATOM 138 CG2 ILE A 33 -1.483 4.618 5.139 1.00 0.00 C ATOM 139 CD1 ILE A 33 -2.246 2.836 2.756 1.00 0.00 C ATOM 0 H ILE A 33 1.703 2.824 4.409 1.00 0.00 H new ATOM 0 HA ILE A 33 0.088 3.313 6.785 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.936 2.574 5.451 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.206 3.333 3.079 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.628 1.689 3.518 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.394 4.814 4.573 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.646 4.867 6.188 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.671 5.229 4.743 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -2.063 2.515 1.730 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -3.013 2.203 3.203 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -2.584 3.872 2.757 1.00 0.00 H new ATOM 151 N TYR A 34 -0.495 0.803 6.803 1.00 0.00 N ATOM 152 CA TYR A 34 -0.550 -0.591 7.026 1.00 0.00 C ATOM 153 C TYR A 34 -1.884 -1.103 6.566 1.00 0.00 C ATOM 154 O TYR A 34 -2.931 -0.591 6.980 1.00 0.00 O ATOM 155 CB TYR A 34 -0.338 -0.881 8.514 1.00 0.00 C ATOM 156 CG TYR A 34 -0.744 -2.256 8.959 1.00 0.00 C ATOM 157 CD1 TYR A 34 -0.008 -3.377 8.619 1.00 0.00 C ATOM 158 CD2 TYR A 34 -1.871 -2.416 9.732 1.00 0.00 C ATOM 159 CE1 TYR A 34 -0.395 -4.634 9.042 1.00 0.00 C ATOM 160 CE2 TYR A 34 -2.276 -3.654 10.162 1.00 0.00 C ATOM 161 CZ TYR A 34 -1.530 -4.774 9.812 1.00 0.00 C ATOM 162 OH TYR A 34 -1.913 -6.039 10.246 1.00 0.00 O ATOM 0 H TYR A 34 -1.138 1.338 7.387 1.00 0.00 H new ATOM 0 HA TYR A 34 0.236 -1.095 6.465 1.00 0.00 H new ATOM 0 HB2 TYR A 34 0.716 -0.736 8.750 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -0.898 -0.148 9.095 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.881 -3.268 8.015 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.450 -1.547 10.007 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.188 -5.502 8.771 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.165 -3.758 10.766 1.00 0.00 H new ATOM 0 HH TYR A 34 -2.732 -5.968 10.779 1.00 0.00 H new ATOM 172 N ILE A 35 -1.853 -2.052 5.694 1.00 0.00 N ATOM 173 CA ILE A 35 -3.047 -2.685 5.233 1.00 0.00 C ATOM 174 C ILE A 35 -3.063 -4.079 5.828 1.00 0.00 C ATOM 175 O ILE A 35 -2.080 -4.814 5.704 1.00 0.00 O ATOM 176 CB ILE A 35 -3.037 -2.817 3.700 1.00 0.00 C ATOM 177 CG1 ILE A 35 -2.674 -1.490 3.054 1.00 0.00 C ATOM 178 CG2 ILE A 35 -4.428 -3.230 3.235 1.00 0.00 C ATOM 179 CD1 ILE A 35 -2.019 -1.635 1.698 1.00 0.00 C ATOM 0 H ILE A 35 -0.996 -2.415 5.277 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.917 -2.097 5.527 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.298 -3.564 3.411 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.576 -0.887 2.950 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.002 -0.945 3.716 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.435 -3.327 2.149 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.694 -4.186 3.687 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.152 -2.473 3.536 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.788 -0.648 1.298 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.099 -2.210 1.798 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.698 -2.152 1.019 1.00 0.00 H new ATOM 191 N GLY A 36 -4.133 -4.429 6.463 1.00 0.00 N ATOM 192 CA GLY A 36 -4.251 -5.709 7.079 1.00 0.00 C ATOM 193 C GLY A 36 -5.532 -6.403 6.698 1.00 0.00 C ATOM 194 O GLY A 36 -6.488 -5.755 6.237 1.00 0.00 O ATOM 0 H GLY A 36 -4.953 -3.832 6.569 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.403 -6.330 6.790 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.209 -5.595 8.162 1.00 0.00 H new ATOM 198 N ASN A 37 -5.535 -7.712 6.897 1.00 0.00 N ATOM 199 CA ASN A 37 -6.649 -8.627 6.596 1.00 0.00 C ATOM 200 C ASN A 37 -6.826 -8.781 5.083 1.00 0.00 C ATOM 201 O ASN A 37 -7.937 -8.822 4.556 1.00 0.00 O ATOM 202 CB ASN A 37 -7.972 -8.213 7.285 1.00 0.00 C ATOM 203 CG ASN A 37 -9.029 -9.326 7.242 1.00 0.00 C ATOM 204 OD1 ASN A 37 -8.704 -10.525 7.254 1.00 0.00 O ATOM 205 ND2 ASN A 37 -10.277 -8.953 7.163 1.00 0.00 N ATOM 0 H ASN A 37 -4.729 -8.197 7.290 1.00 0.00 H new ATOM 0 HA ASN A 37 -6.385 -9.599 7.014 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -7.770 -7.948 8.323 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -8.368 -7.321 6.799 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -11.016 -9.654 7.109 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -10.513 -7.961 7.155 1.00 0.00 H new ATOM 212 N LEU A 38 -5.713 -8.885 4.390 1.00 0.00 N ATOM 213 CA LEU A 38 -5.730 -9.126 2.955 1.00 0.00 C ATOM 214 C LEU A 38 -6.215 -10.512 2.652 1.00 0.00 C ATOM 215 O LEU A 38 -6.063 -11.438 3.460 1.00 0.00 O ATOM 216 CB LEU A 38 -4.347 -8.942 2.289 1.00 0.00 C ATOM 217 CG LEU A 38 -3.967 -7.544 1.812 1.00 0.00 C ATOM 218 CD1 LEU A 38 -4.917 -7.076 0.728 1.00 0.00 C ATOM 219 CD2 LEU A 38 -3.959 -6.572 2.943 1.00 0.00 C ATOM 0 H LEU A 38 -4.780 -8.807 4.794 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.410 -8.380 2.543 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.588 -9.272 2.998 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.296 -9.614 1.432 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.959 -7.595 1.400 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.631 -6.077 0.400 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.871 -7.763 -0.117 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.933 -7.051 1.121 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.685 -5.584 2.572 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.951 -6.528 3.392 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.235 -6.892 3.693 1.00 0.00 H new ATOM 231 N ASN A 39 -6.795 -10.649 1.515 1.00 0.00 N ATOM 232 CA ASN A 39 -7.240 -11.922 1.026 1.00 0.00 C ATOM 233 C ASN A 39 -6.040 -12.567 0.362 1.00 0.00 C ATOM 234 O ASN A 39 -5.183 -11.858 -0.177 1.00 0.00 O ATOM 235 CB ASN A 39 -8.325 -11.704 -0.027 1.00 0.00 C ATOM 236 CG ASN A 39 -9.122 -12.951 -0.392 1.00 0.00 C ATOM 237 OD1 ASN A 39 -8.666 -14.081 -0.255 1.00 0.00 O ATOM 238 ND2 ASN A 39 -10.257 -12.743 -0.964 1.00 0.00 N ATOM 0 H ASN A 39 -6.981 -9.872 0.880 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.640 -12.540 1.830 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -9.015 -10.942 0.335 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -7.860 -11.310 -0.931 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -10.802 -13.530 -1.317 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -10.611 -11.792 -1.064 1.00 0.00 H new ATOM 245 N ARG A 40 -5.982 -13.873 0.381 1.00 0.00 N ATOM 246 CA ARG A 40 -4.908 -14.636 -0.240 1.00 0.00 C ATOM 247 C ARG A 40 -4.822 -14.342 -1.744 1.00 0.00 C ATOM 248 O ARG A 40 -3.773 -14.493 -2.359 1.00 0.00 O ATOM 249 CB ARG A 40 -5.107 -16.163 0.050 1.00 0.00 C ATOM 250 CG ARG A 40 -6.356 -16.816 -0.559 1.00 0.00 C ATOM 251 CD ARG A 40 -6.150 -17.115 -2.030 1.00 0.00 C ATOM 252 NE ARG A 40 -7.345 -17.603 -2.702 1.00 0.00 N ATOM 253 CZ ARG A 40 -7.379 -18.042 -3.962 1.00 0.00 C ATOM 254 NH1 ARG A 40 -6.257 -18.131 -4.668 1.00 0.00 N ATOM 255 NH2 ARG A 40 -8.534 -18.377 -4.517 1.00 0.00 N ATOM 0 H ARG A 40 -6.687 -14.455 0.834 1.00 0.00 H new ATOM 0 HA ARG A 40 -3.956 -14.331 0.194 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -4.230 -16.697 -0.315 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -5.140 -16.304 1.130 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.585 -17.738 -0.025 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -7.214 -16.155 -0.435 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -5.807 -16.210 -2.531 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -5.358 -17.856 -2.133 1.00 0.00 H new ATOM 0 HE ARG A 40 -8.217 -17.610 -2.173 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -5.367 -17.864 -4.247 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -6.286 -18.467 -5.631 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -9.399 -18.300 -3.981 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -8.559 -18.712 -5.480 1.00 0.00 H new ATOM 269 N GLU A 41 -5.943 -13.910 -2.315 1.00 0.00 N ATOM 270 CA GLU A 41 -6.036 -13.678 -3.740 1.00 0.00 C ATOM 271 C GLU A 41 -5.784 -12.219 -4.107 1.00 0.00 C ATOM 272 O GLU A 41 -5.826 -11.855 -5.281 1.00 0.00 O ATOM 273 CB GLU A 41 -7.394 -14.147 -4.271 1.00 0.00 C ATOM 274 CG GLU A 41 -8.583 -13.396 -3.733 1.00 0.00 C ATOM 275 CD GLU A 41 -9.875 -13.901 -4.316 1.00 0.00 C ATOM 276 OE1 GLU A 41 -10.182 -13.560 -5.478 1.00 0.00 O ATOM 277 OE2 GLU A 41 -10.591 -14.669 -3.636 1.00 0.00 O ATOM 0 H GLU A 41 -6.802 -13.714 -1.801 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.250 -14.264 -4.216 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -7.391 -14.062 -5.358 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.514 -15.204 -4.034 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -8.612 -13.492 -2.648 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -8.474 -12.335 -3.957 1.00 0.00 H new ATOM 284 N LEU A 42 -5.523 -11.393 -3.124 1.00 0.00 N ATOM 285 CA LEU A 42 -5.263 -10.002 -3.386 1.00 0.00 C ATOM 286 C LEU A 42 -3.799 -9.778 -3.614 1.00 0.00 C ATOM 287 O LEU A 42 -2.958 -10.112 -2.763 1.00 0.00 O ATOM 288 CB LEU A 42 -5.820 -9.090 -2.290 1.00 0.00 C ATOM 289 CG LEU A 42 -7.346 -8.937 -2.269 1.00 0.00 C ATOM 290 CD1 LEU A 42 -7.790 -8.089 -1.092 1.00 0.00 C ATOM 291 CD2 LEU A 42 -7.830 -8.319 -3.575 1.00 0.00 C ATOM 0 H LEU A 42 -5.485 -11.659 -2.140 1.00 0.00 H new ATOM 0 HA LEU A 42 -5.793 -9.731 -4.299 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -5.498 -9.475 -1.323 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -5.375 -8.101 -2.403 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.787 -9.928 -2.160 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.876 -7.996 -1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -7.473 -8.562 -0.163 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -7.340 -7.099 -1.167 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.915 -8.215 -3.548 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -7.375 -7.337 -3.704 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.547 -8.962 -4.409 1.00 0.00 H new ATOM 303 N THR A 43 -3.504 -9.254 -4.763 1.00 0.00 N ATOM 304 CA THR A 43 -2.159 -9.026 -5.183 1.00 0.00 C ATOM 305 C THR A 43 -1.850 -7.541 -5.174 1.00 0.00 C ATOM 306 O THR A 43 -2.751 -6.708 -4.927 1.00 0.00 O ATOM 307 CB THR A 43 -1.929 -9.588 -6.604 1.00 0.00 C ATOM 308 OG1 THR A 43 -2.820 -8.951 -7.540 1.00 0.00 O ATOM 309 CG2 THR A 43 -2.157 -11.089 -6.638 1.00 0.00 C ATOM 0 H THR A 43 -4.205 -8.968 -5.447 1.00 0.00 H new ATOM 0 HA THR A 43 -1.496 -9.538 -4.486 1.00 0.00 H new ATOM 0 HB THR A 43 -0.896 -9.382 -6.883 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.743 -9.213 -7.343 1.00 0.00 H new ATOM 0 HG21 THR A 43 -1.989 -11.460 -7.649 1.00 0.00 H new ATOM 0 HG22 THR A 43 -1.465 -11.578 -5.952 1.00 0.00 H new ATOM 0 HG23 THR A 43 -3.181 -11.308 -6.337 1.00 0.00 H new ATOM 317 N GLU A 44 -0.588 -7.206 -5.437 1.00 0.00 N ATOM 318 CA GLU A 44 -0.136 -5.821 -5.539 1.00 0.00 C ATOM 319 C GLU A 44 -0.974 -5.084 -6.568 1.00 0.00 C ATOM 320 O GLU A 44 -1.375 -3.963 -6.343 1.00 0.00 O ATOM 321 CB GLU A 44 1.318 -5.780 -5.982 1.00 0.00 C ATOM 322 CG GLU A 44 2.275 -6.458 -5.040 1.00 0.00 C ATOM 323 CD GLU A 44 3.633 -6.634 -5.645 1.00 0.00 C ATOM 324 OE1 GLU A 44 4.388 -5.658 -5.750 1.00 0.00 O ATOM 325 OE2 GLU A 44 3.973 -7.762 -6.048 1.00 0.00 O ATOM 0 H GLU A 44 0.153 -7.891 -5.586 1.00 0.00 H new ATOM 0 HA GLU A 44 -0.239 -5.348 -4.562 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.399 -6.249 -6.963 1.00 0.00 H new ATOM 0 HB3 GLU A 44 1.620 -4.739 -6.100 1.00 0.00 H new ATOM 0 HG2 GLU A 44 2.360 -5.871 -4.126 1.00 0.00 H new ATOM 0 HG3 GLU A 44 1.876 -7.432 -4.758 1.00 0.00 H new ATOM 332 N GLY A 45 -1.267 -5.760 -7.677 1.00 0.00 N ATOM 333 CA GLY A 45 -2.066 -5.179 -8.743 1.00 0.00 C ATOM 334 C GLY A 45 -3.451 -4.770 -8.281 1.00 0.00 C ATOM 335 O GLY A 45 -3.954 -3.701 -8.668 1.00 0.00 O ATOM 0 H GLY A 45 -0.959 -6.716 -7.857 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.549 -4.307 -9.145 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.157 -5.899 -9.557 1.00 0.00 H new ATOM 339 N ASP A 46 -4.063 -5.596 -7.435 1.00 0.00 N ATOM 340 CA ASP A 46 -5.392 -5.299 -6.910 1.00 0.00 C ATOM 341 C ASP A 46 -5.316 -4.095 -6.021 1.00 0.00 C ATOM 342 O ASP A 46 -6.065 -3.130 -6.194 1.00 0.00 O ATOM 343 CB ASP A 46 -5.965 -6.468 -6.093 1.00 0.00 C ATOM 344 CG ASP A 46 -6.198 -7.728 -6.879 1.00 0.00 C ATOM 345 OD1 ASP A 46 -7.285 -7.886 -7.468 1.00 0.00 O ATOM 346 OD2 ASP A 46 -5.312 -8.611 -6.898 1.00 0.00 O ATOM 0 H ASP A 46 -3.661 -6.472 -7.100 1.00 0.00 H new ATOM 0 HA ASP A 46 -6.048 -5.120 -7.762 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.283 -6.689 -5.272 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.909 -6.154 -5.647 1.00 0.00 H new ATOM 351 N ILE A 47 -4.364 -4.133 -5.106 1.00 0.00 N ATOM 352 CA ILE A 47 -4.151 -3.061 -4.159 1.00 0.00 C ATOM 353 C ILE A 47 -3.833 -1.759 -4.878 1.00 0.00 C ATOM 354 O ILE A 47 -4.450 -0.747 -4.617 1.00 0.00 O ATOM 355 CB ILE A 47 -3.032 -3.418 -3.131 1.00 0.00 C ATOM 356 CG1 ILE A 47 -3.497 -4.563 -2.217 1.00 0.00 C ATOM 357 CG2 ILE A 47 -2.601 -2.205 -2.313 1.00 0.00 C ATOM 358 CD1 ILE A 47 -2.503 -4.930 -1.139 1.00 0.00 C ATOM 0 H ILE A 47 -3.716 -4.913 -5.001 1.00 0.00 H new ATOM 0 HA ILE A 47 -5.077 -2.925 -3.601 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.158 -3.749 -3.691 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -4.439 -4.280 -1.747 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.697 -5.443 -2.828 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.821 -2.498 -1.610 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.217 -1.434 -2.981 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.457 -1.815 -1.763 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.904 -5.745 -0.536 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.567 -5.246 -1.600 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -2.320 -4.064 -0.503 1.00 0.00 H new ATOM 370 N LEU A 48 -2.941 -1.821 -5.838 1.00 0.00 N ATOM 371 CA LEU A 48 -2.514 -0.645 -6.575 1.00 0.00 C ATOM 372 C LEU A 48 -3.662 0.013 -7.284 1.00 0.00 C ATOM 373 O LEU A 48 -3.786 1.218 -7.241 1.00 0.00 O ATOM 374 CB LEU A 48 -1.422 -0.987 -7.576 1.00 0.00 C ATOM 375 CG LEU A 48 -0.024 -1.197 -7.012 1.00 0.00 C ATOM 376 CD1 LEU A 48 0.884 -1.749 -8.090 1.00 0.00 C ATOM 377 CD2 LEU A 48 0.539 0.121 -6.483 1.00 0.00 C ATOM 0 H LEU A 48 -2.488 -2.686 -6.134 1.00 0.00 H new ATOM 0 HA LEU A 48 -2.114 0.056 -5.843 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.716 -1.894 -8.105 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.375 -0.188 -8.316 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.080 -1.909 -6.188 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.884 -1.898 -7.682 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.491 -2.702 -8.444 1.00 0.00 H new ATOM 0 HD13 LEU A 48 0.932 -1.045 -8.921 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.539 -0.045 -6.083 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.589 0.847 -7.294 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.109 0.503 -5.694 1.00 0.00 H new ATOM 389 N THR A 49 -4.516 -0.776 -7.892 1.00 0.00 N ATOM 390 CA THR A 49 -5.644 -0.241 -8.618 1.00 0.00 C ATOM 391 C THR A 49 -6.609 0.494 -7.682 1.00 0.00 C ATOM 392 O THR A 49 -7.004 1.637 -7.947 1.00 0.00 O ATOM 393 CB THR A 49 -6.393 -1.369 -9.334 1.00 0.00 C ATOM 394 OG1 THR A 49 -5.490 -2.063 -10.221 1.00 0.00 O ATOM 395 CG2 THR A 49 -7.561 -0.796 -10.113 1.00 0.00 C ATOM 0 H THR A 49 -4.451 -1.794 -7.898 1.00 0.00 H new ATOM 0 HA THR A 49 -5.261 0.470 -9.350 1.00 0.00 H new ATOM 0 HB THR A 49 -6.777 -2.075 -8.598 1.00 0.00 H new ATOM 0 HG1 THR A 49 -5.018 -2.764 -9.725 1.00 0.00 H new ATOM 0 HG21 THR A 49 -8.090 -1.602 -10.620 1.00 0.00 H new ATOM 0 HG22 THR A 49 -8.241 -0.289 -9.428 1.00 0.00 H new ATOM 0 HG23 THR A 49 -7.192 -0.084 -10.851 1.00 0.00 H new ATOM 403 N VAL A 50 -6.909 -0.136 -6.571 1.00 0.00 N ATOM 404 CA VAL A 50 -7.822 0.408 -5.591 1.00 0.00 C ATOM 405 C VAL A 50 -7.232 1.655 -4.938 1.00 0.00 C ATOM 406 O VAL A 50 -7.860 2.708 -4.888 1.00 0.00 O ATOM 407 CB VAL A 50 -8.142 -0.659 -4.520 1.00 0.00 C ATOM 408 CG1 VAL A 50 -9.014 -0.096 -3.429 1.00 0.00 C ATOM 409 CG2 VAL A 50 -8.806 -1.863 -5.162 1.00 0.00 C ATOM 0 H VAL A 50 -6.525 -1.047 -6.319 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.745 0.692 -6.095 1.00 0.00 H new ATOM 0 HB VAL A 50 -7.202 -0.973 -4.065 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.221 -0.872 -2.692 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -8.501 0.736 -2.946 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.952 0.256 -3.858 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.027 -2.608 -4.397 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.733 -1.553 -5.645 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.136 -2.294 -5.906 1.00 0.00 H new ATOM 419 N PHE A 51 -6.000 1.533 -4.511 1.00 0.00 N ATOM 420 CA PHE A 51 -5.285 2.572 -3.845 1.00 0.00 C ATOM 421 C PHE A 51 -5.039 3.776 -4.744 1.00 0.00 C ATOM 422 O PHE A 51 -4.901 4.896 -4.268 1.00 0.00 O ATOM 423 CB PHE A 51 -4.012 2.002 -3.229 1.00 0.00 C ATOM 424 CG PHE A 51 -4.274 1.207 -1.945 1.00 0.00 C ATOM 425 CD1 PHE A 51 -5.214 0.180 -1.902 1.00 0.00 C ATOM 426 CD2 PHE A 51 -3.595 1.503 -0.789 1.00 0.00 C ATOM 427 CE1 PHE A 51 -5.450 -0.524 -0.744 1.00 0.00 C ATOM 428 CE2 PHE A 51 -3.828 0.807 0.366 1.00 0.00 C ATOM 429 CZ PHE A 51 -4.753 -0.207 0.398 1.00 0.00 C ATOM 0 H PHE A 51 -5.457 0.677 -4.625 1.00 0.00 H new ATOM 0 HA PHE A 51 -5.900 2.959 -3.033 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -3.520 1.356 -3.956 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.323 2.818 -3.011 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -5.768 -0.068 -2.795 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -2.865 2.299 -0.791 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -6.179 -1.321 -0.732 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -3.279 1.058 1.261 1.00 0.00 H new ATOM 0 HZ PHE A 51 -4.932 -0.752 1.313 1.00 0.00 H new ATOM 439 N SER A 52 -5.061 3.550 -6.042 1.00 0.00 N ATOM 440 CA SER A 52 -4.914 4.613 -7.008 1.00 0.00 C ATOM 441 C SER A 52 -6.157 5.507 -7.087 1.00 0.00 C ATOM 442 O SER A 52 -6.064 6.645 -7.534 1.00 0.00 O ATOM 443 CB SER A 52 -4.573 4.061 -8.373 1.00 0.00 C ATOM 444 OG SER A 52 -3.285 3.494 -8.393 1.00 0.00 O ATOM 0 H SER A 52 -5.181 2.625 -6.454 1.00 0.00 H new ATOM 0 HA SER A 52 -4.088 5.236 -6.665 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.308 3.307 -8.656 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.632 4.858 -9.114 1.00 0.00 H new ATOM 0 HG SER A 52 -3.284 2.667 -7.868 1.00 0.00 H new ATOM 450 N GLU A 53 -7.308 5.020 -6.647 1.00 0.00 N ATOM 451 CA GLU A 53 -8.502 5.861 -6.650 1.00 0.00 C ATOM 452 C GLU A 53 -8.376 6.945 -5.553 1.00 0.00 C ATOM 453 O GLU A 53 -8.981 8.031 -5.637 1.00 0.00 O ATOM 454 CB GLU A 53 -9.796 5.016 -6.482 1.00 0.00 C ATOM 455 CG GLU A 53 -11.078 5.847 -6.533 1.00 0.00 C ATOM 456 CD GLU A 53 -12.363 5.041 -6.475 1.00 0.00 C ATOM 457 OE1 GLU A 53 -12.571 4.294 -5.504 1.00 0.00 O ATOM 458 OE2 GLU A 53 -13.223 5.203 -7.385 1.00 0.00 O ATOM 0 H GLU A 53 -7.443 4.073 -6.292 1.00 0.00 H new ATOM 0 HA GLU A 53 -8.581 6.356 -7.618 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -9.831 4.260 -7.266 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -9.753 4.486 -5.530 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -11.070 6.552 -5.702 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -11.076 6.436 -7.450 1.00 0.00 H new ATOM 465 N TYR A 54 -7.533 6.671 -4.566 1.00 0.00 N ATOM 466 CA TYR A 54 -7.329 7.574 -3.448 1.00 0.00 C ATOM 467 C TYR A 54 -6.181 8.535 -3.701 1.00 0.00 C ATOM 468 O TYR A 54 -6.127 9.627 -3.126 1.00 0.00 O ATOM 469 CB TYR A 54 -7.070 6.790 -2.193 1.00 0.00 C ATOM 470 CG TYR A 54 -8.172 5.824 -1.889 1.00 0.00 C ATOM 471 CD1 TYR A 54 -9.394 6.250 -1.404 1.00 0.00 C ATOM 472 CD2 TYR A 54 -7.979 4.488 -2.079 1.00 0.00 C ATOM 473 CE1 TYR A 54 -10.384 5.345 -1.114 1.00 0.00 C ATOM 474 CE2 TYR A 54 -8.955 3.578 -1.804 1.00 0.00 C ATOM 475 CZ TYR A 54 -10.155 4.006 -1.317 1.00 0.00 C ATOM 476 OH TYR A 54 -11.119 3.090 -1.007 1.00 0.00 O ATOM 0 H TYR A 54 -6.975 5.819 -4.520 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.238 8.164 -3.331 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.131 6.246 -2.294 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -6.951 7.478 -1.356 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -9.571 7.304 -1.252 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -7.028 4.142 -2.457 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -11.335 5.683 -0.729 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -8.780 2.525 -1.970 1.00 0.00 H new ATOM 0 HH TYR A 54 -11.456 3.263 -0.103 1.00 0.00 H new ATOM 486 N GLY A 55 -5.292 8.156 -4.577 1.00 0.00 N ATOM 487 CA GLY A 55 -4.168 8.979 -4.884 1.00 0.00 C ATOM 488 C GLY A 55 -3.178 8.239 -5.715 1.00 0.00 C ATOM 489 O GLY A 55 -3.494 7.191 -6.255 1.00 0.00 O ATOM 0 H GLY A 55 -5.330 7.276 -5.091 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.500 9.871 -5.415 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.695 9.315 -3.961 1.00 0.00 H new ATOM 493 N VAL A 56 -1.987 8.757 -5.800 1.00 0.00 N ATOM 494 CA VAL A 56 -0.961 8.168 -6.630 1.00 0.00 C ATOM 495 C VAL A 56 -0.003 7.309 -5.795 1.00 0.00 C ATOM 496 O VAL A 56 0.743 7.844 -4.954 1.00 0.00 O ATOM 497 CB VAL A 56 -0.156 9.262 -7.382 1.00 0.00 C ATOM 498 CG1 VAL A 56 0.890 8.647 -8.294 1.00 0.00 C ATOM 499 CG2 VAL A 56 -1.083 10.159 -8.176 1.00 0.00 C ATOM 0 H VAL A 56 -1.694 9.597 -5.300 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.460 7.532 -7.361 1.00 0.00 H new ATOM 0 HB VAL A 56 0.359 9.866 -6.635 1.00 0.00 H new ATOM 0 HG11 VAL A 56 1.437 9.439 -8.806 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.584 8.051 -7.701 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.401 8.009 -9.030 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -0.498 10.918 -8.695 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.631 9.562 -8.905 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.788 10.643 -7.500 1.00 0.00 H new ATOM 509 N PRO A 57 -0.039 5.977 -5.978 1.00 0.00 N ATOM 510 CA PRO A 57 0.877 5.061 -5.314 1.00 0.00 C ATOM 511 C PRO A 57 2.245 5.072 -6.003 1.00 0.00 C ATOM 512 O PRO A 57 2.336 5.209 -7.238 1.00 0.00 O ATOM 513 CB PRO A 57 0.200 3.701 -5.504 1.00 0.00 C ATOM 514 CG PRO A 57 -0.535 3.830 -6.782 1.00 0.00 C ATOM 515 CD PRO A 57 -0.994 5.254 -6.848 1.00 0.00 C ATOM 0 HA PRO A 57 1.058 5.316 -4.270 1.00 0.00 H new ATOM 0 HB2 PRO A 57 0.933 2.895 -5.547 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.475 3.475 -4.679 1.00 0.00 H new ATOM 0 HG2 PRO A 57 0.107 3.587 -7.628 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.382 3.144 -6.817 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -0.971 5.634 -7.869 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -2.019 5.360 -6.492 1.00 0.00 H new ATOM 523 N VAL A 58 3.297 4.990 -5.228 1.00 0.00 N ATOM 524 CA VAL A 58 4.635 4.977 -5.805 1.00 0.00 C ATOM 525 C VAL A 58 5.403 3.710 -5.446 1.00 0.00 C ATOM 526 O VAL A 58 6.426 3.403 -6.052 1.00 0.00 O ATOM 527 CB VAL A 58 5.465 6.229 -5.406 1.00 0.00 C ATOM 528 CG1 VAL A 58 4.831 7.496 -5.941 1.00 0.00 C ATOM 529 CG2 VAL A 58 5.617 6.322 -3.904 1.00 0.00 C ATOM 0 H VAL A 58 3.265 4.932 -4.210 1.00 0.00 H new ATOM 0 HA VAL A 58 4.490 4.997 -6.885 1.00 0.00 H new ATOM 0 HB VAL A 58 6.454 6.122 -5.851 1.00 0.00 H new ATOM 0 HG11 VAL A 58 5.433 8.356 -5.647 1.00 0.00 H new ATOM 0 HG12 VAL A 58 4.778 7.445 -7.029 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.826 7.600 -5.533 1.00 0.00 H new ATOM 0 HG21 VAL A 58 6.202 7.207 -3.652 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.632 6.394 -3.442 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.127 5.432 -3.534 1.00 0.00 H new ATOM 539 N ASP A 59 4.918 2.984 -4.454 1.00 0.00 N ATOM 540 CA ASP A 59 5.604 1.785 -3.974 1.00 0.00 C ATOM 541 C ASP A 59 4.635 0.968 -3.155 1.00 0.00 C ATOM 542 O ASP A 59 3.874 1.533 -2.349 1.00 0.00 O ATOM 543 CB ASP A 59 6.803 2.194 -3.106 1.00 0.00 C ATOM 544 CG ASP A 59 7.663 1.053 -2.596 1.00 0.00 C ATOM 545 OD1 ASP A 59 8.056 0.169 -3.381 1.00 0.00 O ATOM 546 OD2 ASP A 59 8.035 1.084 -1.410 1.00 0.00 O ATOM 0 H ASP A 59 4.051 3.200 -3.961 1.00 0.00 H new ATOM 0 HA ASP A 59 5.962 1.195 -4.818 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.433 2.870 -3.684 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.433 2.757 -2.249 1.00 0.00 H new ATOM 551 N VAL A 60 4.629 -0.319 -3.371 1.00 0.00 N ATOM 552 CA VAL A 60 3.755 -1.222 -2.656 1.00 0.00 C ATOM 553 C VAL A 60 4.495 -2.528 -2.414 1.00 0.00 C ATOM 554 O VAL A 60 5.245 -2.998 -3.276 1.00 0.00 O ATOM 555 CB VAL A 60 2.404 -1.489 -3.428 1.00 0.00 C ATOM 556 CG1 VAL A 60 2.638 -2.201 -4.738 1.00 0.00 C ATOM 557 CG2 VAL A 60 1.399 -2.263 -2.583 1.00 0.00 C ATOM 0 H VAL A 60 5.233 -0.779 -4.052 1.00 0.00 H new ATOM 0 HA VAL A 60 3.484 -0.758 -1.708 1.00 0.00 H new ATOM 0 HB VAL A 60 1.979 -0.508 -3.640 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.684 -2.366 -5.238 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.280 -1.592 -5.374 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.119 -3.161 -4.550 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.486 -2.422 -3.158 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.824 -3.227 -2.304 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.166 -1.695 -1.683 1.00 0.00 H new ATOM 567 N ILE A 61 4.365 -3.049 -1.236 1.00 0.00 N ATOM 568 CA ILE A 61 4.959 -4.307 -0.887 1.00 0.00 C ATOM 569 C ILE A 61 3.887 -5.261 -0.462 1.00 0.00 C ATOM 570 O ILE A 61 3.119 -4.969 0.472 1.00 0.00 O ATOM 571 CB ILE A 61 5.989 -4.150 0.251 1.00 0.00 C ATOM 572 CG1 ILE A 61 7.101 -3.216 -0.194 1.00 0.00 C ATOM 573 CG2 ILE A 61 6.566 -5.513 0.668 1.00 0.00 C ATOM 574 CD1 ILE A 61 8.040 -2.842 0.906 1.00 0.00 C ATOM 0 H ILE A 61 3.839 -2.612 -0.479 1.00 0.00 H new ATOM 0 HA ILE A 61 5.480 -4.692 -1.764 1.00 0.00 H new ATOM 0 HB ILE A 61 5.486 -3.723 1.119 1.00 0.00 H new ATOM 0 HG12 ILE A 61 7.665 -3.691 -0.997 1.00 0.00 H new ATOM 0 HG13 ILE A 61 6.660 -2.310 -0.608 1.00 0.00 H new ATOM 0 HG21 ILE A 61 7.289 -5.372 1.471 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.759 -6.159 1.015 1.00 0.00 H new ATOM 0 HG23 ILE A 61 7.059 -5.976 -0.187 1.00 0.00 H new ATOM 0 HD11 ILE A 61 8.808 -2.174 0.517 1.00 0.00 H new ATOM 0 HD12 ILE A 61 7.488 -2.338 1.700 1.00 0.00 H new ATOM 0 HD13 ILE A 61 8.509 -3.741 1.305 1.00 0.00 H new ATOM 586 N LEU A 62 3.797 -6.367 -1.140 1.00 0.00 N ATOM 587 CA LEU A 62 2.878 -7.377 -0.749 1.00 0.00 C ATOM 588 C LEU A 62 3.675 -8.404 -0.007 1.00 0.00 C ATOM 589 O LEU A 62 4.547 -9.062 -0.580 1.00 0.00 O ATOM 590 CB LEU A 62 2.216 -8.049 -1.946 1.00 0.00 C ATOM 591 CG LEU A 62 0.756 -8.517 -1.759 1.00 0.00 C ATOM 592 CD1 LEU A 62 0.535 -9.300 -0.470 1.00 0.00 C ATOM 593 CD2 LEU A 62 -0.171 -7.343 -1.836 1.00 0.00 C ATOM 0 H LEU A 62 4.353 -6.586 -1.967 1.00 0.00 H new ATOM 0 HA LEU A 62 2.084 -6.934 -0.147 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.246 -7.354 -2.786 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.817 -8.914 -2.226 1.00 0.00 H new ATOM 0 HG LEU A 62 0.537 -9.209 -2.572 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.511 -9.599 -0.401 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.167 -10.188 -0.471 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.791 -8.674 0.385 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.199 -7.681 -1.703 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.080 -6.629 -1.052 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.070 -6.863 -2.809 1.00 0.00 H new ATOM 605 N SER A 63 3.411 -8.520 1.234 1.00 0.00 N ATOM 606 CA SER A 63 4.067 -9.475 2.044 1.00 0.00 C ATOM 607 C SER A 63 3.430 -10.830 1.776 1.00 0.00 C ATOM 608 O SER A 63 2.219 -10.996 1.967 1.00 0.00 O ATOM 609 CB SER A 63 3.876 -9.066 3.482 1.00 0.00 C ATOM 610 OG SER A 63 4.223 -7.690 3.647 1.00 0.00 O ATOM 0 H SER A 63 2.725 -7.949 1.727 1.00 0.00 H new ATOM 0 HA SER A 63 5.134 -9.534 1.827 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.840 -9.227 3.780 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.495 -9.686 4.131 1.00 0.00 H new ATOM 0 HG SER A 63 4.045 -7.416 4.571 1.00 0.00 H new ATOM 616 N ARG A 64 4.193 -11.760 1.280 1.00 0.00 N ATOM 617 CA ARG A 64 3.681 -13.076 1.007 1.00 0.00 C ATOM 618 C ARG A 64 4.340 -14.084 1.906 1.00 0.00 C ATOM 619 O ARG A 64 5.478 -13.903 2.335 1.00 0.00 O ATOM 620 CB ARG A 64 3.865 -13.482 -0.457 1.00 0.00 C ATOM 621 CG ARG A 64 3.105 -12.639 -1.467 1.00 0.00 C ATOM 622 CD ARG A 64 3.309 -13.172 -2.876 1.00 0.00 C ATOM 623 NE ARG A 64 4.729 -13.205 -3.247 1.00 0.00 N ATOM 624 CZ ARG A 64 5.221 -13.639 -4.408 1.00 0.00 C ATOM 625 NH1 ARG A 64 4.410 -14.092 -5.357 1.00 0.00 N ATOM 626 NH2 ARG A 64 6.531 -13.614 -4.613 1.00 0.00 N ATOM 0 H ARG A 64 5.179 -11.632 1.054 1.00 0.00 H new ATOM 0 HA ARG A 64 2.609 -13.051 1.205 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.927 -13.438 -0.698 1.00 0.00 H new ATOM 0 HB3 ARG A 64 3.555 -14.521 -0.570 1.00 0.00 H new ATOM 0 HG2 ARG A 64 2.043 -12.640 -1.223 1.00 0.00 H new ATOM 0 HG3 ARG A 64 3.443 -11.604 -1.412 1.00 0.00 H new ATOM 0 HD2 ARG A 64 2.891 -14.176 -2.949 1.00 0.00 H new ATOM 0 HD3 ARG A 64 2.763 -12.548 -3.583 1.00 0.00 H new ATOM 0 HE ARG A 64 5.398 -12.866 -2.556 1.00 0.00 H new ATOM 0 HH11 ARG A 64 3.402 -14.110 -5.201 1.00 0.00 H new ATOM 0 HH12 ARG A 64 4.795 -14.422 -6.242 1.00 0.00 H new ATOM 0 HH21 ARG A 64 7.154 -13.265 -3.885 1.00 0.00 H new ATOM 0 HH22 ARG A 64 6.915 -13.944 -5.498 1.00 0.00 H new ATOM 728 N GLN A 72 0.425 -12.772 2.878 1.00 0.00 N ATOM 729 CA GLN A 72 0.488 -12.883 4.345 1.00 0.00 C ATOM 730 C GLN A 72 -0.713 -12.282 5.018 1.00 0.00 C ATOM 731 O GLN A 72 -0.892 -12.419 6.220 1.00 0.00 O ATOM 732 CB GLN A 72 1.730 -12.194 4.880 1.00 0.00 C ATOM 733 CG GLN A 72 2.987 -13.007 4.800 1.00 0.00 C ATOM 734 CD GLN A 72 3.037 -14.102 5.840 1.00 0.00 C ATOM 735 OE1 GLN A 72 2.014 -14.642 6.268 1.00 0.00 O ATOM 736 NE2 GLN A 72 4.208 -14.427 6.254 1.00 0.00 N ATOM 0 HA GLN A 72 0.515 -13.949 4.570 1.00 0.00 H new ATOM 0 HB2 GLN A 72 1.879 -11.266 4.328 1.00 0.00 H new ATOM 0 HB3 GLN A 72 1.557 -11.921 5.921 1.00 0.00 H new ATOM 0 HG2 GLN A 72 3.066 -13.450 3.807 1.00 0.00 H new ATOM 0 HG3 GLN A 72 3.848 -12.351 4.926 1.00 0.00 H new ATOM 0 HE21 GLN A 72 5.031 -13.958 5.876 1.00 0.00 H new ATOM 0 HE22 GLN A 72 4.315 -15.155 6.961 1.00 0.00 H new ATOM 745 N GLY A 73 -1.506 -11.588 4.266 1.00 0.00 N ATOM 746 CA GLY A 73 -2.663 -10.979 4.834 1.00 0.00 C ATOM 747 C GLY A 73 -2.426 -9.541 5.193 1.00 0.00 C ATOM 748 O GLY A 73 -3.303 -8.891 5.721 1.00 0.00 O ATOM 0 H GLY A 73 -1.375 -11.430 3.267 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.490 -11.044 4.127 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.961 -11.530 5.726 1.00 0.00 H new ATOM 752 N PHE A 74 -1.259 -9.033 4.895 1.00 0.00 N ATOM 753 CA PHE A 74 -0.967 -7.653 5.173 1.00 0.00 C ATOM 754 C PHE A 74 -0.060 -7.121 4.087 1.00 0.00 C ATOM 755 O PHE A 74 0.706 -7.894 3.478 1.00 0.00 O ATOM 756 CB PHE A 74 -0.330 -7.471 6.574 1.00 0.00 C ATOM 757 CG PHE A 74 1.085 -7.958 6.710 1.00 0.00 C ATOM 758 CD1 PHE A 74 1.364 -9.289 6.960 1.00 0.00 C ATOM 759 CD2 PHE A 74 2.135 -7.066 6.589 1.00 0.00 C ATOM 760 CE1 PHE A 74 2.672 -9.724 7.083 1.00 0.00 C ATOM 761 CE2 PHE A 74 3.436 -7.489 6.711 1.00 0.00 C ATOM 762 CZ PHE A 74 3.708 -8.822 6.956 1.00 0.00 C ATOM 0 H PHE A 74 -0.497 -9.554 4.461 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.899 -7.087 5.182 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.358 -6.412 6.832 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.947 -7.993 7.305 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.554 -9.996 7.060 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.929 -6.023 6.396 1.00 0.00 H new ATOM 0 HE1 PHE A 74 2.881 -10.766 7.278 1.00 0.00 H new ATOM 0 HE2 PHE A 74 4.246 -6.781 6.616 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.731 -9.157 7.048 1.00 0.00 H new ATOM 772 N ALA A 75 -0.141 -5.850 3.831 1.00 0.00 N ATOM 773 CA ALA A 75 0.657 -5.236 2.812 1.00 0.00 C ATOM 774 C ALA A 75 0.962 -3.792 3.172 1.00 0.00 C ATOM 775 O ALA A 75 0.387 -3.241 4.122 1.00 0.00 O ATOM 776 CB ALA A 75 -0.053 -5.319 1.481 1.00 0.00 C ATOM 0 H ALA A 75 -0.763 -5.208 4.323 1.00 0.00 H new ATOM 0 HA ALA A 75 1.604 -5.771 2.735 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.560 -4.850 0.712 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.222 -6.365 1.223 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -1.011 -4.802 1.547 1.00 0.00 H new ATOM 782 N TYR A 76 1.845 -3.195 2.418 1.00 0.00 N ATOM 783 CA TYR A 76 2.285 -1.831 2.624 1.00 0.00 C ATOM 784 C TYR A 76 2.233 -1.083 1.313 1.00 0.00 C ATOM 785 O TYR A 76 2.584 -1.641 0.286 1.00 0.00 O ATOM 786 CB TYR A 76 3.726 -1.856 3.190 1.00 0.00 C ATOM 787 CG TYR A 76 4.608 -0.665 2.833 1.00 0.00 C ATOM 788 CD1 TYR A 76 4.600 0.511 3.565 1.00 0.00 C ATOM 789 CD2 TYR A 76 5.466 -0.751 1.753 1.00 0.00 C ATOM 790 CE1 TYR A 76 5.439 1.563 3.211 1.00 0.00 C ATOM 791 CE2 TYR A 76 6.298 0.276 1.401 1.00 0.00 C ATOM 792 CZ TYR A 76 6.291 1.426 2.121 1.00 0.00 C ATOM 793 OH TYR A 76 7.142 2.450 1.756 1.00 0.00 O ATOM 0 H TYR A 76 2.293 -3.650 1.622 1.00 0.00 H new ATOM 0 HA TYR A 76 1.633 -1.322 3.334 1.00 0.00 H new ATOM 0 HB2 TYR A 76 3.667 -1.926 4.276 1.00 0.00 H new ATOM 0 HB3 TYR A 76 4.217 -2.764 2.839 1.00 0.00 H new ATOM 0 HD1 TYR A 76 3.940 0.612 4.414 1.00 0.00 H new ATOM 0 HD2 TYR A 76 5.480 -1.659 1.168 1.00 0.00 H new ATOM 0 HE1 TYR A 76 5.428 2.481 3.780 1.00 0.00 H new ATOM 0 HE2 TYR A 76 6.958 0.172 0.553 1.00 0.00 H new ATOM 0 HH TYR A 76 6.998 3.220 2.344 1.00 0.00 H new ATOM 803 N LEU A 77 1.808 0.154 1.349 1.00 0.00 N ATOM 804 CA LEU A 77 1.772 0.986 0.167 1.00 0.00 C ATOM 805 C LEU A 77 2.038 2.425 0.582 1.00 0.00 C ATOM 806 O LEU A 77 1.614 2.846 1.652 1.00 0.00 O ATOM 807 CB LEU A 77 0.420 0.821 -0.601 1.00 0.00 C ATOM 808 CG LEU A 77 0.304 1.512 -1.989 1.00 0.00 C ATOM 809 CD1 LEU A 77 -0.720 0.810 -2.851 1.00 0.00 C ATOM 810 CD2 LEU A 77 -0.126 2.951 -1.844 1.00 0.00 C ATOM 0 H LEU A 77 1.477 0.615 2.196 1.00 0.00 H new ATOM 0 HA LEU A 77 2.548 0.676 -0.533 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.237 -0.245 -0.738 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.379 1.203 0.035 1.00 0.00 H new ATOM 0 HG LEU A 77 1.289 1.462 -2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.786 1.309 -3.818 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.422 -0.228 -2.998 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.692 0.842 -2.360 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.199 3.410 -2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.097 2.993 -1.351 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.608 3.491 -1.246 1.00 0.00 H new ATOM 822 N LYS A 78 2.796 3.135 -0.217 1.00 0.00 N ATOM 823 CA LYS A 78 3.092 4.525 0.042 1.00 0.00 C ATOM 824 C LYS A 78 2.683 5.361 -1.154 1.00 0.00 C ATOM 825 O LYS A 78 2.790 4.917 -2.327 1.00 0.00 O ATOM 826 CB LYS A 78 4.572 4.781 0.374 1.00 0.00 C ATOM 827 CG LYS A 78 5.519 4.443 -0.735 1.00 0.00 C ATOM 828 CD LYS A 78 6.890 5.092 -0.564 1.00 0.00 C ATOM 829 CE LYS A 78 6.816 6.621 -0.651 1.00 0.00 C ATOM 830 NZ LYS A 78 8.151 7.242 -0.786 1.00 0.00 N ATOM 0 H LYS A 78 3.226 2.767 -1.066 1.00 0.00 H new ATOM 0 HA LYS A 78 2.520 4.811 0.925 1.00 0.00 H new ATOM 0 HB2 LYS A 78 4.697 5.832 0.635 1.00 0.00 H new ATOM 0 HB3 LYS A 78 4.841 4.199 1.256 1.00 0.00 H new ATOM 0 HG2 LYS A 78 5.639 3.361 -0.786 1.00 0.00 H new ATOM 0 HG3 LYS A 78 5.088 4.761 -1.684 1.00 0.00 H new ATOM 0 HD2 LYS A 78 7.310 4.804 0.400 1.00 0.00 H new ATOM 0 HD3 LYS A 78 7.567 4.717 -1.332 1.00 0.00 H new ATOM 0 HE2 LYS A 78 6.198 6.904 -1.503 1.00 0.00 H new ATOM 0 HE3 LYS A 78 6.326 7.010 0.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 8.049 8.276 -0.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 8.734 6.995 0.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 8.610 6.893 -1.651 1.00 0.00 H new ATOM 844 N TYR A 79 2.210 6.537 -0.881 1.00 0.00 N ATOM 845 CA TYR A 79 1.747 7.430 -1.914 1.00 0.00 C ATOM 846 C TYR A 79 2.712 8.559 -2.119 1.00 0.00 C ATOM 847 O TYR A 79 3.591 8.808 -1.284 1.00 0.00 O ATOM 848 CB TYR A 79 0.396 8.023 -1.568 1.00 0.00 C ATOM 849 CG TYR A 79 -0.728 7.047 -1.472 1.00 0.00 C ATOM 850 CD1 TYR A 79 -0.870 6.250 -0.364 1.00 0.00 C ATOM 851 CD2 TYR A 79 -1.669 6.948 -2.476 1.00 0.00 C ATOM 852 CE1 TYR A 79 -1.908 5.381 -0.245 1.00 0.00 C ATOM 853 CE2 TYR A 79 -2.725 6.088 -2.364 1.00 0.00 C ATOM 854 CZ TYR A 79 -2.838 5.305 -1.246 1.00 0.00 C ATOM 855 OH TYR A 79 -3.886 4.465 -1.121 1.00 0.00 O ATOM 0 H TYR A 79 2.131 6.912 0.064 1.00 0.00 H new ATOM 0 HA TYR A 79 1.664 6.838 -2.825 1.00 0.00 H new ATOM 0 HB2 TYR A 79 0.482 8.547 -0.616 1.00 0.00 H new ATOM 0 HB3 TYR A 79 0.143 8.769 -2.321 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -0.141 6.315 0.430 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.570 7.558 -3.362 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -1.998 4.756 0.631 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -3.463 6.026 -3.150 1.00 0.00 H new ATOM 0 HH TYR A 79 -3.610 3.670 -0.618 1.00 0.00 H new ATOM 865 N GLU A 80 2.539 9.236 -3.228 1.00 0.00 N ATOM 866 CA GLU A 80 3.325 10.401 -3.564 1.00 0.00 C ATOM 867 C GLU A 80 2.806 11.615 -2.763 1.00 0.00 C ATOM 868 O GLU A 80 3.553 12.566 -2.473 1.00 0.00 O ATOM 869 CB GLU A 80 3.223 10.660 -5.073 1.00 0.00 C ATOM 870 CG GLU A 80 4.127 11.757 -5.597 1.00 0.00 C ATOM 871 CD GLU A 80 3.988 11.959 -7.082 1.00 0.00 C ATOM 872 OE1 GLU A 80 3.132 12.759 -7.507 1.00 0.00 O ATOM 873 OE2 GLU A 80 4.758 11.351 -7.858 1.00 0.00 O ATOM 0 H GLU A 80 1.841 8.992 -3.931 1.00 0.00 H new ATOM 0 HA GLU A 80 4.372 10.237 -3.307 1.00 0.00 H new ATOM 0 HB2 GLU A 80 3.455 9.735 -5.602 1.00 0.00 H new ATOM 0 HB3 GLU A 80 2.191 10.915 -5.314 1.00 0.00 H new ATOM 0 HG2 GLU A 80 3.895 12.690 -5.084 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.163 11.513 -5.362 1.00 0.00 H new ATOM 880 N ASP A 81 1.536 11.564 -2.384 1.00 0.00 N ATOM 881 CA ASP A 81 0.923 12.636 -1.632 1.00 0.00 C ATOM 882 C ASP A 81 0.351 12.045 -0.355 1.00 0.00 C ATOM 883 O ASP A 81 -0.349 11.035 -0.407 1.00 0.00 O ATOM 884 CB ASP A 81 -0.197 13.289 -2.447 1.00 0.00 C ATOM 885 CG ASP A 81 -0.596 14.641 -1.904 1.00 0.00 C ATOM 886 OD1 ASP A 81 -1.105 14.735 -0.769 1.00 0.00 O ATOM 887 OD2 ASP A 81 -0.375 15.657 -2.599 1.00 0.00 O ATOM 0 H ASP A 81 0.912 10.784 -2.590 1.00 0.00 H new ATOM 0 HA ASP A 81 1.665 13.400 -1.402 1.00 0.00 H new ATOM 0 HB2 ASP A 81 0.128 13.398 -3.482 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.067 12.633 -2.453 1.00 0.00 H new ATOM 892 N GLN A 82 0.651 12.646 0.776 1.00 0.00 N ATOM 893 CA GLN A 82 0.204 12.131 2.079 1.00 0.00 C ATOM 894 C GLN A 82 -1.306 12.263 2.292 1.00 0.00 C ATOM 895 O GLN A 82 -1.883 11.571 3.111 1.00 0.00 O ATOM 896 CB GLN A 82 0.952 12.782 3.212 1.00 0.00 C ATOM 897 CG GLN A 82 2.446 12.605 3.141 1.00 0.00 C ATOM 898 CD GLN A 82 3.103 13.140 4.356 1.00 0.00 C ATOM 899 OE1 GLN A 82 3.400 14.314 4.428 1.00 0.00 O ATOM 900 NE2 GLN A 82 3.427 12.287 5.269 1.00 0.00 N ATOM 0 H GLN A 82 1.207 13.500 0.833 1.00 0.00 H new ATOM 0 HA GLN A 82 0.432 11.065 2.072 1.00 0.00 H new ATOM 0 HB2 GLN A 82 0.723 13.848 3.221 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.592 12.371 4.155 1.00 0.00 H new ATOM 0 HG2 GLN A 82 2.685 11.547 3.030 1.00 0.00 H new ATOM 0 HG3 GLN A 82 2.835 13.114 2.259 1.00 0.00 H new ATOM 0 HE21 GLN A 82 3.158 11.308 5.171 1.00 0.00 H new ATOM 0 HE22 GLN A 82 3.952 12.592 6.089 1.00 0.00 H new ATOM 909 N ARG A 83 -1.935 13.150 1.558 1.00 0.00 N ATOM 910 CA ARG A 83 -3.384 13.333 1.626 1.00 0.00 C ATOM 911 C ARG A 83 -4.095 12.065 1.164 1.00 0.00 C ATOM 912 O ARG A 83 -5.186 11.731 1.601 1.00 0.00 O ATOM 913 CB ARG A 83 -3.822 14.537 0.826 1.00 0.00 C ATOM 914 CG ARG A 83 -3.312 15.851 1.379 1.00 0.00 C ATOM 915 CD ARG A 83 -3.601 16.995 0.432 1.00 0.00 C ATOM 916 NE ARG A 83 -2.885 16.843 -0.839 1.00 0.00 N ATOM 917 CZ ARG A 83 -3.122 17.548 -1.948 1.00 0.00 C ATOM 918 NH1 ARG A 83 -4.093 18.445 -1.976 1.00 0.00 N ATOM 919 NH2 ARG A 83 -2.378 17.352 -3.014 1.00 0.00 N ATOM 0 H ARG A 83 -1.467 13.769 0.895 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.661 13.521 2.663 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.475 14.426 -0.201 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -4.911 14.564 0.794 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -3.779 16.048 2.344 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.238 15.783 1.553 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.673 17.047 0.241 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.314 17.936 0.901 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.146 16.141 -0.879 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.666 18.602 -1.147 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.269 18.980 -2.826 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -1.625 16.665 -2.991 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.554 17.887 -3.864 1.00 0.00 H new ATOM 933 N SER A 84 -3.481 11.412 0.247 1.00 0.00 N ATOM 934 CA SER A 84 -3.964 10.192 -0.303 1.00 0.00 C ATOM 935 C SER A 84 -4.032 9.067 0.746 1.00 0.00 C ATOM 936 O SER A 84 -4.954 8.258 0.713 1.00 0.00 O ATOM 937 CB SER A 84 -3.101 9.809 -1.465 1.00 0.00 C ATOM 938 OG SER A 84 -3.128 10.815 -2.441 1.00 0.00 O ATOM 0 H SER A 84 -2.597 11.720 -0.158 1.00 0.00 H new ATOM 0 HA SER A 84 -4.988 10.343 -0.646 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.077 9.646 -1.129 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.450 8.869 -1.892 1.00 0.00 H new ATOM 0 HG SER A 84 -2.411 10.659 -3.091 1.00 0.00 H new ATOM 944 N THR A 85 -3.061 9.010 1.673 1.00 0.00 N ATOM 945 CA THR A 85 -3.040 7.927 2.651 1.00 0.00 C ATOM 946 C THR A 85 -4.267 8.006 3.567 1.00 0.00 C ATOM 947 O THR A 85 -4.945 7.015 3.780 1.00 0.00 O ATOM 948 CB THR A 85 -1.743 7.919 3.508 1.00 0.00 C ATOM 949 OG1 THR A 85 -1.618 9.120 4.240 1.00 0.00 O ATOM 950 CG2 THR A 85 -0.518 7.756 2.652 1.00 0.00 C ATOM 0 H THR A 85 -2.302 9.686 1.760 1.00 0.00 H new ATOM 0 HA THR A 85 -3.063 6.995 2.086 1.00 0.00 H new ATOM 0 HB THR A 85 -1.821 7.073 4.190 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.260 8.924 5.131 1.00 0.00 H new ATOM 0 HG21 THR A 85 0.370 7.755 3.284 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.577 6.814 2.108 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.457 8.581 1.943 1.00 0.00 H new ATOM 958 N ILE A 86 -4.577 9.212 4.042 1.00 0.00 N ATOM 959 CA ILE A 86 -5.757 9.437 4.878 1.00 0.00 C ATOM 960 C ILE A 86 -7.036 9.147 4.109 1.00 0.00 C ATOM 961 O ILE A 86 -7.964 8.539 4.651 1.00 0.00 O ATOM 962 CB ILE A 86 -5.771 10.854 5.536 1.00 0.00 C ATOM 963 CG1 ILE A 86 -5.447 11.930 4.499 1.00 0.00 C ATOM 964 CG2 ILE A 86 -4.800 10.907 6.694 1.00 0.00 C ATOM 965 CD1 ILE A 86 -5.192 13.305 5.049 1.00 0.00 C ATOM 0 H ILE A 86 -4.026 10.051 3.862 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.702 8.728 5.704 1.00 0.00 H new ATOM 0 HB ILE A 86 -6.771 11.049 5.923 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -4.568 11.614 3.936 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -6.274 11.989 3.792 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.822 11.901 7.142 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.084 10.166 7.441 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.793 10.693 6.335 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -4.972 13.990 4.230 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -6.075 13.652 5.585 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -4.343 13.272 5.732 1.00 0.00 H new ATOM 977 N LEU A 87 -7.064 9.537 2.831 1.00 0.00 N ATOM 978 CA LEU A 87 -8.207 9.221 1.960 1.00 0.00 C ATOM 979 C LEU A 87 -8.400 7.715 1.837 1.00 0.00 C ATOM 980 O LEU A 87 -9.523 7.206 1.954 1.00 0.00 O ATOM 981 CB LEU A 87 -8.014 9.812 0.550 1.00 0.00 C ATOM 982 CG LEU A 87 -8.339 11.292 0.361 1.00 0.00 C ATOM 983 CD1 LEU A 87 -7.892 11.748 -1.025 1.00 0.00 C ATOM 984 CD2 LEU A 87 -9.843 11.498 0.505 1.00 0.00 C ATOM 0 H LEU A 87 -6.319 10.066 2.378 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.090 9.665 2.420 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.976 9.654 0.257 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.631 9.240 -0.143 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.814 11.877 1.116 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.127 12.805 -1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.817 11.600 -1.128 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.413 11.166 -1.785 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.080 12.553 0.371 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.365 10.910 -0.250 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.161 11.178 1.497 1.00 0.00 H new ATOM 996 N ALA A 88 -7.301 7.006 1.659 1.00 0.00 N ATOM 997 CA ALA A 88 -7.349 5.575 1.499 1.00 0.00 C ATOM 998 C ALA A 88 -7.696 4.880 2.795 1.00 0.00 C ATOM 999 O ALA A 88 -8.591 4.065 2.822 1.00 0.00 O ATOM 1000 CB ALA A 88 -6.049 5.052 0.912 1.00 0.00 C ATOM 0 H ALA A 88 -6.363 7.405 1.622 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.148 5.346 0.794 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.110 3.969 0.801 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.881 5.508 -0.064 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.223 5.303 1.577 1.00 0.00 H new ATOM 1006 N VAL A 89 -7.039 5.262 3.881 1.00 0.00 N ATOM 1007 CA VAL A 89 -7.286 4.649 5.185 1.00 0.00 C ATOM 1008 C VAL A 89 -8.749 4.775 5.578 1.00 0.00 C ATOM 1009 O VAL A 89 -9.402 3.792 5.886 1.00 0.00 O ATOM 1010 CB VAL A 89 -6.400 5.273 6.315 1.00 0.00 C ATOM 1011 CG1 VAL A 89 -6.810 4.747 7.675 1.00 0.00 C ATOM 1012 CG2 VAL A 89 -4.935 4.968 6.089 1.00 0.00 C ATOM 0 H VAL A 89 -6.329 5.994 3.888 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.020 3.597 5.082 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.550 6.352 6.284 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.180 5.195 8.443 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.852 5.003 7.865 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.693 3.663 7.696 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.343 5.413 6.889 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.785 3.888 6.084 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.621 5.382 5.131 1.00 0.00 H new ATOM 1022 N ASP A 90 -9.262 5.964 5.454 1.00 0.00 N ATOM 1023 CA ASP A 90 -10.598 6.290 5.914 1.00 0.00 C ATOM 1024 C ASP A 90 -11.673 5.607 5.098 1.00 0.00 C ATOM 1025 O ASP A 90 -12.725 5.275 5.619 1.00 0.00 O ATOM 1026 CB ASP A 90 -10.815 7.797 5.884 1.00 0.00 C ATOM 1027 CG ASP A 90 -12.172 8.206 6.392 1.00 0.00 C ATOM 1028 OD1 ASP A 90 -12.315 8.451 7.610 1.00 0.00 O ATOM 1029 OD2 ASP A 90 -13.110 8.332 5.590 1.00 0.00 O ATOM 0 H ASP A 90 -8.768 6.748 5.028 1.00 0.00 H new ATOM 0 HA ASP A 90 -10.678 5.924 6.938 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -10.046 8.281 6.486 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -10.692 8.156 4.862 1.00 0.00 H new ATOM 1034 N ASN A 91 -11.413 5.394 3.828 1.00 0.00 N ATOM 1035 CA ASN A 91 -12.428 4.809 2.935 1.00 0.00 C ATOM 1036 C ASN A 91 -12.264 3.322 2.739 1.00 0.00 C ATOM 1037 O ASN A 91 -13.213 2.642 2.348 1.00 0.00 O ATOM 1038 CB ASN A 91 -12.490 5.506 1.575 1.00 0.00 C ATOM 1039 CG ASN A 91 -13.148 6.878 1.593 1.00 0.00 C ATOM 1040 OD1 ASN A 91 -13.773 7.289 0.615 1.00 0.00 O ATOM 1041 ND2 ASN A 91 -13.019 7.595 2.667 1.00 0.00 N ATOM 0 H ASN A 91 -10.523 5.609 3.379 1.00 0.00 H new ATOM 0 HA ASN A 91 -13.374 4.975 3.451 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -11.476 5.609 1.188 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -13.033 4.867 0.879 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.441 8.523 2.715 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -12.496 7.231 3.463 1.00 0.00 H new ATOM 1048 N LEU A 92 -11.089 2.821 2.995 1.00 0.00 N ATOM 1049 CA LEU A 92 -10.810 1.403 2.824 1.00 0.00 C ATOM 1050 C LEU A 92 -11.016 0.655 4.106 1.00 0.00 C ATOM 1051 O LEU A 92 -11.325 -0.539 4.093 1.00 0.00 O ATOM 1052 CB LEU A 92 -9.398 1.199 2.333 1.00 0.00 C ATOM 1053 CG LEU A 92 -9.163 1.307 0.852 1.00 0.00 C ATOM 1054 CD1 LEU A 92 -7.720 1.684 0.601 1.00 0.00 C ATOM 1055 CD2 LEU A 92 -9.459 -0.032 0.203 1.00 0.00 C ATOM 0 H LEU A 92 -10.296 3.370 3.326 1.00 0.00 H new ATOM 0 HA LEU A 92 -11.506 1.013 2.081 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.759 1.928 2.830 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.067 0.212 2.656 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.816 2.070 0.428 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -7.546 1.763 -0.472 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.507 2.642 1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -7.066 0.919 1.019 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.291 0.039 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -8.802 -0.793 0.624 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.497 -0.305 0.390 1.00 0.00 H new ATOM 1067 N ASN A 93 -10.823 1.342 5.223 1.00 0.00 N ATOM 1068 CA ASN A 93 -11.034 0.733 6.520 1.00 0.00 C ATOM 1069 C ASN A 93 -12.489 0.286 6.611 1.00 0.00 C ATOM 1070 O ASN A 93 -13.411 1.093 6.396 1.00 0.00 O ATOM 1071 CB ASN A 93 -10.776 1.783 7.608 1.00 0.00 C ATOM 1072 CG ASN A 93 -10.974 1.277 9.035 1.00 0.00 C ATOM 1073 OD1 ASN A 93 -12.090 1.224 9.542 1.00 0.00 O ATOM 1074 ND2 ASN A 93 -9.893 0.994 9.725 1.00 0.00 N ATOM 0 H ASN A 93 -10.522 2.316 5.253 1.00 0.00 H new ATOM 0 HA ASN A 93 -10.364 -0.117 6.652 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -9.755 2.152 7.505 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -11.440 2.631 7.441 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.970 0.723 10.705 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -8.976 1.045 9.281 1.00 0.00 H new ATOM 1081 N GLY A 94 -12.701 -0.970 6.898 1.00 0.00 N ATOM 1082 CA GLY A 94 -14.043 -1.467 7.056 1.00 0.00 C ATOM 1083 C GLY A 94 -14.709 -1.841 5.740 1.00 0.00 C ATOM 1084 O GLY A 94 -15.864 -2.299 5.730 1.00 0.00 O ATOM 0 H GLY A 94 -11.966 -1.666 7.027 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -14.024 -2.342 7.706 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.646 -0.710 7.557 1.00 0.00 H new ATOM 1088 N PHE A 95 -14.012 -1.653 4.632 1.00 0.00 N ATOM 1089 CA PHE A 95 -14.568 -2.011 3.350 1.00 0.00 C ATOM 1090 C PHE A 95 -14.304 -3.477 3.090 1.00 0.00 C ATOM 1091 O PHE A 95 -13.198 -3.962 3.312 1.00 0.00 O ATOM 1092 CB PHE A 95 -14.010 -1.141 2.209 1.00 0.00 C ATOM 1093 CG PHE A 95 -14.631 -1.467 0.877 1.00 0.00 C ATOM 1094 CD1 PHE A 95 -15.901 -1.037 0.578 1.00 0.00 C ATOM 1095 CD2 PHE A 95 -13.958 -2.223 -0.057 1.00 0.00 C ATOM 1096 CE1 PHE A 95 -16.496 -1.351 -0.625 1.00 0.00 C ATOM 1097 CE2 PHE A 95 -14.546 -2.539 -1.262 1.00 0.00 C ATOM 1098 CZ PHE A 95 -15.816 -2.104 -1.545 1.00 0.00 C ATOM 0 H PHE A 95 -13.072 -1.259 4.599 1.00 0.00 H new ATOM 0 HA PHE A 95 -15.642 -1.829 3.378 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -14.184 -0.090 2.440 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -12.931 -1.279 2.146 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -16.443 -0.442 1.298 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -12.959 -2.572 0.158 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -17.496 -1.004 -0.842 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -14.006 -3.131 -1.986 1.00 0.00 H new ATOM 0 HZ PHE A 95 -16.277 -2.354 -2.489 1.00 0.00 H new ATOM 1108 N LYS A 96 -15.308 -4.174 2.639 1.00 0.00 N ATOM 1109 CA LYS A 96 -15.194 -5.586 2.418 1.00 0.00 C ATOM 1110 C LYS A 96 -14.791 -5.887 0.988 1.00 0.00 C ATOM 1111 O LYS A 96 -15.485 -5.508 0.047 1.00 0.00 O ATOM 1112 CB LYS A 96 -16.505 -6.345 2.774 1.00 0.00 C ATOM 1113 CG LYS A 96 -16.933 -6.313 4.258 1.00 0.00 C ATOM 1114 CD LYS A 96 -17.456 -4.947 4.711 1.00 0.00 C ATOM 1115 CE LYS A 96 -17.821 -4.941 6.195 1.00 0.00 C ATOM 1116 NZ LYS A 96 -18.290 -3.605 6.648 1.00 0.00 N ATOM 0 H LYS A 96 -16.223 -3.782 2.416 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.411 -5.942 3.087 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -17.315 -5.928 2.175 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -16.390 -7.386 2.474 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.707 -7.063 4.421 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.083 -6.593 4.880 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.699 -4.187 4.520 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -18.332 -4.679 4.120 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.600 -5.680 6.380 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.953 -5.239 6.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -18.236 -3.551 7.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.688 -2.866 6.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -19.274 -3.461 6.345 1.00 0.00 H new ATOM 1130 N ILE A 97 -13.653 -6.521 0.836 1.00 0.00 N ATOM 1131 CA ILE A 97 -13.201 -7.020 -0.443 1.00 0.00 C ATOM 1132 C ILE A 97 -13.011 -8.511 -0.245 1.00 0.00 C ATOM 1133 O ILE A 97 -12.540 -8.927 0.812 1.00 0.00 O ATOM 1134 CB ILE A 97 -11.824 -6.388 -0.870 1.00 0.00 C ATOM 1135 CG1 ILE A 97 -11.924 -4.863 -0.975 1.00 0.00 C ATOM 1136 CG2 ILE A 97 -11.331 -6.974 -2.189 1.00 0.00 C ATOM 1137 CD1 ILE A 97 -10.652 -4.171 -1.431 1.00 0.00 C ATOM 0 H ILE A 97 -13.008 -6.707 1.604 1.00 0.00 H new ATOM 0 HA ILE A 97 -13.921 -6.772 -1.223 1.00 0.00 H new ATOM 0 HB ILE A 97 -11.100 -6.634 -0.093 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -12.726 -4.613 -1.669 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -12.209 -4.464 -0.002 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -10.378 -6.517 -2.457 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -11.200 -8.051 -2.082 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -12.062 -6.773 -2.972 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -10.819 -3.095 -1.475 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -9.849 -4.385 -0.726 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -10.374 -4.536 -2.420 1.00 0.00 H new ATOM 1149 N GLY A 98 -13.366 -9.311 -1.234 1.00 0.00 N ATOM 1150 CA GLY A 98 -13.236 -10.759 -1.118 1.00 0.00 C ATOM 1151 C GLY A 98 -14.031 -11.333 0.052 1.00 0.00 C ATOM 1152 O GLY A 98 -13.713 -12.409 0.561 1.00 0.00 O ATOM 0 H GLY A 98 -13.745 -8.988 -2.124 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -13.574 -11.225 -2.044 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -12.184 -11.016 -0.997 1.00 0.00 H new ATOM 1156 N GLY A 99 -15.044 -10.599 0.490 1.00 0.00 N ATOM 1157 CA GLY A 99 -15.865 -11.030 1.601 1.00 0.00 C ATOM 1158 C GLY A 99 -15.255 -10.720 2.967 1.00 0.00 C ATOM 1159 O GLY A 99 -15.783 -11.152 3.989 1.00 0.00 O ATOM 0 H GLY A 99 -15.314 -9.701 0.089 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -16.840 -10.548 1.530 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -16.033 -12.104 1.523 1.00 0.00 H new ATOM 1163 N ARG A 100 -14.158 -9.981 2.997 1.00 0.00 N ATOM 1164 CA ARG A 100 -13.509 -9.634 4.255 1.00 0.00 C ATOM 1165 C ARG A 100 -13.247 -8.135 4.336 1.00 0.00 C ATOM 1166 O ARG A 100 -12.902 -7.507 3.337 1.00 0.00 O ATOM 1167 CB ARG A 100 -12.204 -10.441 4.451 1.00 0.00 C ATOM 1168 CG ARG A 100 -11.178 -10.307 3.322 1.00 0.00 C ATOM 1169 CD ARG A 100 -9.913 -11.091 3.625 1.00 0.00 C ATOM 1170 NE ARG A 100 -10.177 -12.523 3.797 1.00 0.00 N ATOM 1171 CZ ARG A 100 -9.337 -13.409 4.359 1.00 0.00 C ATOM 1172 NH1 ARG A 100 -8.123 -13.037 4.762 1.00 0.00 N ATOM 1173 NH2 ARG A 100 -9.714 -14.674 4.494 1.00 0.00 N ATOM 0 H ARG A 100 -13.697 -9.609 2.167 1.00 0.00 H new ATOM 0 HA ARG A 100 -14.186 -9.900 5.067 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -11.737 -10.125 5.384 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -12.461 -11.494 4.564 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -11.614 -10.663 2.389 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -10.930 -9.256 3.177 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -9.197 -10.950 2.815 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -9.451 -10.697 4.530 1.00 0.00 H new ATOM 0 HE ARG A 100 -11.073 -12.876 3.462 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -7.821 -12.070 4.646 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -7.495 -13.719 5.187 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -10.636 -14.968 4.172 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -9.082 -15.352 4.920 1.00 0.00 H new ATOM 1187 N ALA A 101 -13.431 -7.564 5.507 1.00 0.00 N ATOM 1188 CA ALA A 101 -13.229 -6.143 5.699 1.00 0.00 C ATOM 1189 C ALA A 101 -11.762 -5.810 5.849 1.00 0.00 C ATOM 1190 O ALA A 101 -11.069 -6.348 6.733 1.00 0.00 O ATOM 1191 CB ALA A 101 -14.011 -5.642 6.903 1.00 0.00 C ATOM 0 H ALA A 101 -13.722 -8.066 6.346 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.601 -5.636 4.808 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -13.843 -4.572 7.026 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -15.074 -5.827 6.749 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -13.677 -6.167 7.798 1.00 0.00 H new ATOM 1197 N LEU A 102 -11.291 -4.959 4.982 1.00 0.00 N ATOM 1198 CA LEU A 102 -9.936 -4.489 5.017 1.00 0.00 C ATOM 1199 C LEU A 102 -9.685 -3.612 6.206 1.00 0.00 C ATOM 1200 O LEU A 102 -10.547 -2.806 6.615 1.00 0.00 O ATOM 1201 CB LEU A 102 -9.565 -3.732 3.740 1.00 0.00 C ATOM 1202 CG LEU A 102 -8.881 -4.535 2.640 1.00 0.00 C ATOM 1203 CD1 LEU A 102 -8.624 -3.643 1.443 1.00 0.00 C ATOM 1204 CD2 LEU A 102 -7.564 -5.076 3.163 1.00 0.00 C ATOM 0 H LEU A 102 -11.845 -4.567 4.221 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.306 -5.375 5.094 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.475 -3.296 3.327 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.911 -2.904 4.014 1.00 0.00 H new ATOM 0 HG LEU A 102 -9.523 -5.363 2.339 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -8.135 -4.220 0.658 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -9.571 -3.253 1.070 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -7.981 -2.814 1.738 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.070 -5.651 2.380 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -6.923 -4.247 3.463 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.751 -5.719 4.023 1.00 0.00 H new ATOM 1216 N LYS A 103 -8.536 -3.764 6.774 1.00 0.00 N ATOM 1217 CA LYS A 103 -8.151 -2.943 7.852 1.00 0.00 C ATOM 1218 C LYS A 103 -6.995 -2.096 7.424 1.00 0.00 C ATOM 1219 O LYS A 103 -5.949 -2.604 7.098 1.00 0.00 O ATOM 1220 CB LYS A 103 -7.807 -3.770 9.096 1.00 0.00 C ATOM 1221 CG LYS A 103 -7.304 -2.950 10.292 1.00 0.00 C ATOM 1222 CD LYS A 103 -8.329 -1.926 10.766 1.00 0.00 C ATOM 1223 CE LYS A 103 -7.795 -1.099 11.930 1.00 0.00 C ATOM 1224 NZ LYS A 103 -7.532 -1.914 13.135 1.00 0.00 N ATOM 0 H LYS A 103 -7.845 -4.462 6.499 1.00 0.00 H new ATOM 0 HA LYS A 103 -8.987 -2.301 8.129 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -8.693 -4.327 9.402 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -7.046 -4.503 8.829 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.060 -3.623 11.114 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.383 -2.437 10.016 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -8.594 -1.266 9.940 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -9.242 -2.438 11.070 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -6.874 -0.601 11.625 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -8.514 -0.317 12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -7.302 -1.289 13.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -8.377 -2.474 13.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -6.732 -2.553 12.954 1.00 0.00 H new ATOM 1238 N ILE A 104 -7.190 -0.818 7.392 1.00 0.00 N ATOM 1239 CA ILE A 104 -6.122 0.068 7.025 1.00 0.00 C ATOM 1240 C ILE A 104 -5.847 0.917 8.223 1.00 0.00 C ATOM 1241 O ILE A 104 -6.800 1.352 8.897 1.00 0.00 O ATOM 1242 CB ILE A 104 -6.495 1.016 5.863 1.00 0.00 C ATOM 1243 CG1 ILE A 104 -7.413 0.341 4.844 1.00 0.00 C ATOM 1244 CG2 ILE A 104 -5.220 1.496 5.165 1.00 0.00 C ATOM 1245 CD1 ILE A 104 -6.838 -0.856 4.135 1.00 0.00 C ATOM 0 H ILE A 104 -8.074 -0.360 7.614 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.271 -0.531 6.700 1.00 0.00 H new ATOM 0 HB ILE A 104 -7.036 1.862 6.286 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.326 0.034 5.354 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -7.699 1.080 4.096 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -5.484 2.165 4.345 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -4.592 2.028 5.880 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -4.675 0.638 4.772 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -7.575 -1.254 3.437 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.943 -0.560 3.588 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -6.580 -1.622 4.866 1.00 0.00 H new ATOM 1257 N ASP A 105 -4.601 1.107 8.530 1.00 0.00 N ATOM 1258 CA ASP A 105 -4.220 1.919 9.655 1.00 0.00 C ATOM 1259 C ASP A 105 -2.951 2.673 9.302 1.00 0.00 C ATOM 1260 O ASP A 105 -2.170 2.207 8.465 1.00 0.00 O ATOM 1261 CB ASP A 105 -3.987 1.034 10.882 1.00 0.00 C ATOM 1262 CG ASP A 105 -3.967 1.829 12.174 1.00 0.00 C ATOM 1263 OD1 ASP A 105 -5.054 2.112 12.734 1.00 0.00 O ATOM 1264 OD2 ASP A 105 -2.897 2.202 12.647 1.00 0.00 O ATOM 0 H ASP A 105 -3.818 0.707 8.013 1.00 0.00 H new ATOM 0 HA ASP A 105 -5.014 2.628 9.889 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.771 0.279 10.936 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -3.041 0.504 10.770 1.00 0.00 H new ATOM 1269 N HIS A 106 -2.751 3.823 9.890 1.00 0.00 N ATOM 1270 CA HIS A 106 -1.541 4.590 9.652 1.00 0.00 C ATOM 1271 C HIS A 106 -0.406 4.048 10.489 1.00 0.00 C ATOM 1272 O HIS A 106 -0.575 3.756 11.671 1.00 0.00 O ATOM 1273 CB HIS A 106 -1.749 6.072 9.934 1.00 0.00 C ATOM 1274 CG HIS A 106 -1.843 6.912 8.704 1.00 0.00 C ATOM 1275 ND1 HIS A 106 -3.013 7.440 8.208 1.00 0.00 N ATOM 1276 CD2 HIS A 106 -0.863 7.344 7.876 1.00 0.00 C ATOM 1277 CE1 HIS A 106 -2.716 8.155 7.129 1.00 0.00 C ATOM 1278 NE2 HIS A 106 -1.421 8.131 6.880 1.00 0.00 N ATOM 0 H HIS A 106 -3.407 4.256 10.540 1.00 0.00 H new ATOM 0 HA HIS A 106 -1.286 4.489 8.597 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -2.661 6.197 10.518 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -0.925 6.435 10.548 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -3.945 7.306 8.600 1.00 0.00 H new ATOM 0 HD2 HIS A 106 0.187 7.112 7.975 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -3.442 8.688 6.532 1.00 0.00 H new ATOM 1286 N THR A 107 0.735 3.909 9.902 1.00 0.00 N ATOM 1287 CA THR A 107 1.846 3.348 10.592 1.00 0.00 C ATOM 1288 C THR A 107 3.104 3.897 9.949 1.00 0.00 C ATOM 1289 O THR A 107 3.021 4.543 8.908 1.00 0.00 O ATOM 1290 CB THR A 107 1.826 1.775 10.463 1.00 0.00 C ATOM 1291 OG1 THR A 107 2.716 1.167 11.418 1.00 0.00 O ATOM 1292 CG2 THR A 107 2.256 1.343 9.055 1.00 0.00 C ATOM 0 H THR A 107 0.923 4.179 8.937 1.00 0.00 H new ATOM 0 HA THR A 107 1.807 3.605 11.651 1.00 0.00 H new ATOM 0 HB THR A 107 0.805 1.447 10.657 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.685 0.192 11.320 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.236 0.255 8.986 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.572 1.766 8.320 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.267 1.700 8.858 1.00 0.00 H new ATOM 1300 N PHE A 108 4.233 3.705 10.557 1.00 0.00 N ATOM 1301 CA PHE A 108 5.445 3.998 9.875 1.00 0.00 C ATOM 1302 C PHE A 108 6.068 2.658 9.583 1.00 0.00 C ATOM 1303 O PHE A 108 6.457 1.932 10.502 1.00 0.00 O ATOM 1304 CB PHE A 108 6.392 4.833 10.751 1.00 0.00 C ATOM 1305 CG PHE A 108 5.795 6.105 11.288 1.00 0.00 C ATOM 1306 CD1 PHE A 108 5.596 7.196 10.465 1.00 0.00 C ATOM 1307 CD2 PHE A 108 5.437 6.204 12.620 1.00 0.00 C ATOM 1308 CE1 PHE A 108 5.053 8.364 10.958 1.00 0.00 C ATOM 1309 CE2 PHE A 108 4.894 7.367 13.120 1.00 0.00 C ATOM 1310 CZ PHE A 108 4.701 8.449 12.289 1.00 0.00 C ATOM 0 H PHE A 108 4.337 3.352 11.508 1.00 0.00 H new ATOM 0 HA PHE A 108 5.258 4.580 8.973 1.00 0.00 H new ATOM 0 HB2 PHE A 108 6.723 4.221 11.590 1.00 0.00 H new ATOM 0 HB3 PHE A 108 7.279 5.082 10.168 1.00 0.00 H new ATOM 0 HD1 PHE A 108 5.869 7.134 9.422 1.00 0.00 H new ATOM 0 HD2 PHE A 108 5.585 5.359 13.276 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.904 9.210 10.304 1.00 0.00 H new ATOM 0 HE2 PHE A 108 4.620 7.431 14.163 1.00 0.00 H new ATOM 0 HZ PHE A 108 4.275 9.362 12.679 1.00 0.00 H new ATOM 1320 N TYR A 109 6.103 2.291 8.346 1.00 0.00 N ATOM 1321 CA TYR A 109 6.698 1.044 7.974 1.00 0.00 C ATOM 1322 C TYR A 109 8.010 1.294 7.302 1.00 0.00 C ATOM 1323 O TYR A 109 8.092 2.141 6.415 1.00 0.00 O ATOM 1324 CB TYR A 109 5.761 0.206 7.083 1.00 0.00 C ATOM 1325 CG TYR A 109 6.352 -1.133 6.677 1.00 0.00 C ATOM 1326 CD1 TYR A 109 6.293 -2.229 7.527 1.00 0.00 C ATOM 1327 CD2 TYR A 109 6.998 -1.285 5.460 1.00 0.00 C ATOM 1328 CE1 TYR A 109 6.858 -3.437 7.169 1.00 0.00 C ATOM 1329 CE2 TYR A 109 7.568 -2.478 5.100 1.00 0.00 C ATOM 1330 CZ TYR A 109 7.498 -3.557 5.957 1.00 0.00 C ATOM 1331 OH TYR A 109 8.085 -4.759 5.603 1.00 0.00 O ATOM 0 H TYR A 109 5.726 2.836 7.570 1.00 0.00 H new ATOM 0 HA TYR A 109 6.871 0.461 8.879 1.00 0.00 H new ATOM 0 HB2 TYR A 109 4.824 0.035 7.613 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.520 0.775 6.185 1.00 0.00 H new ATOM 0 HD1 TYR A 109 5.798 -2.135 8.482 1.00 0.00 H new ATOM 0 HD2 TYR A 109 7.053 -0.446 4.782 1.00 0.00 H new ATOM 0 HE1 TYR A 109 6.798 -4.283 7.837 1.00 0.00 H new ATOM 0 HE2 TYR A 109 8.070 -2.573 4.149 1.00 0.00 H new ATOM 0 HH TYR A 109 8.493 -4.675 4.716 1.00 0.00 H new ATOM 1497 N ILE B 226 -7.031 15.359 -4.850 1.00 0.00 N ATOM 1498 CA ILE B 226 -5.832 14.670 -5.288 1.00 0.00 C ATOM 1499 C ILE B 226 -6.123 13.936 -6.580 1.00 0.00 C ATOM 1500 O ILE B 226 -7.156 13.273 -6.698 1.00 0.00 O ATOM 1501 CB ILE B 226 -5.276 13.641 -4.223 1.00 0.00 C ATOM 1502 CG1 ILE B 226 -4.764 14.329 -2.962 1.00 0.00 C ATOM 1503 CG2 ILE B 226 -4.198 12.742 -4.791 1.00 0.00 C ATOM 1504 CD1 ILE B 226 -5.825 14.640 -1.958 1.00 0.00 C ATOM 0 HA ILE B 226 -5.064 15.430 -5.428 1.00 0.00 H new ATOM 0 HB ILE B 226 -6.129 13.019 -3.952 1.00 0.00 H new ATOM 0 HG12 ILE B 226 -4.013 13.692 -2.494 1.00 0.00 H new ATOM 0 HG13 ILE B 226 -4.265 15.256 -3.245 1.00 0.00 H new ATOM 0 HG21 ILE B 226 -3.852 12.056 -4.018 1.00 0.00 H new ATOM 0 HG22 ILE B 226 -4.603 12.172 -5.627 1.00 0.00 H new ATOM 0 HG23 ILE B 226 -3.362 13.350 -5.137 1.00 0.00 H new ATOM 0 HD11 ILE B 226 -5.376 15.128 -1.093 1.00 0.00 H new ATOM 0 HD12 ILE B 226 -6.565 15.304 -2.405 1.00 0.00 H new ATOM 0 HD13 ILE B 226 -6.309 13.716 -1.642 1.00 0.00 H new ATOM 1516 N MET B 227 -5.245 14.084 -7.548 1.00 0.00 N ATOM 1517 CA MET B 227 -5.374 13.375 -8.805 1.00 0.00 C ATOM 1518 C MET B 227 -5.075 11.892 -8.583 1.00 0.00 C ATOM 1519 O MET B 227 -4.097 11.550 -7.902 1.00 0.00 O ATOM 1520 CB MET B 227 -4.436 13.964 -9.871 1.00 0.00 C ATOM 1521 CG MET B 227 -4.760 15.400 -10.251 1.00 0.00 C ATOM 1522 SD MET B 227 -3.562 16.124 -11.407 1.00 0.00 S ATOM 1523 CE MET B 227 -3.700 15.006 -12.809 1.00 0.00 C ATOM 0 H MET B 227 -4.429 14.693 -7.489 1.00 0.00 H new ATOM 0 HA MET B 227 -6.395 13.486 -9.169 1.00 0.00 H new ATOM 0 HB2 MET B 227 -3.411 13.918 -9.504 1.00 0.00 H new ATOM 0 HB3 MET B 227 -4.483 13.343 -10.765 1.00 0.00 H new ATOM 0 HG2 MET B 227 -5.753 15.435 -10.699 1.00 0.00 H new ATOM 0 HG3 MET B 227 -4.796 16.008 -9.347 1.00 0.00 H new ATOM 0 HE1 MET B 227 -3.221 15.453 -13.680 1.00 0.00 H new ATOM 0 HE2 MET B 227 -3.211 14.061 -12.571 1.00 0.00 H new ATOM 0 HE3 MET B 227 -4.752 14.825 -13.028 1.00 0.00 H new ATOM 1533 N PRO B 228 -5.920 11.005 -9.121 1.00 0.00 N ATOM 1534 CA PRO B 228 -5.787 9.550 -8.947 1.00 0.00 C ATOM 1535 C PRO B 228 -4.509 8.974 -9.573 1.00 0.00 C ATOM 1536 O PRO B 228 -3.879 9.593 -10.444 1.00 0.00 O ATOM 1537 CB PRO B 228 -7.023 8.992 -9.658 1.00 0.00 C ATOM 1538 CG PRO B 228 -7.418 10.054 -10.616 1.00 0.00 C ATOM 1539 CD PRO B 228 -7.091 11.346 -9.942 1.00 0.00 C ATOM 0 HA PRO B 228 -5.718 9.285 -7.892 1.00 0.00 H new ATOM 0 HB2 PRO B 228 -6.796 8.059 -10.173 1.00 0.00 H new ATOM 0 HB3 PRO B 228 -7.824 8.779 -8.951 1.00 0.00 H new ATOM 0 HG2 PRO B 228 -6.876 9.955 -11.557 1.00 0.00 H new ATOM 0 HG3 PRO B 228 -8.480 9.993 -10.852 1.00 0.00 H new ATOM 0 HD2 PRO B 228 -6.863 12.131 -10.663 1.00 0.00 H new ATOM 0 HD3 PRO B 228 -7.921 11.704 -9.332 1.00 0.00 H new ATOM 1547 N GLY B 229 -4.150 7.796 -9.123 1.00 0.00 N ATOM 1548 CA GLY B 229 -2.961 7.119 -9.569 1.00 0.00 C ATOM 1549 C GLY B 229 -3.108 6.482 -10.923 1.00 0.00 C ATOM 1550 O GLY B 229 -4.227 6.303 -11.433 1.00 0.00 O ATOM 0 H GLY B 229 -4.684 7.275 -8.427 1.00 0.00 H new ATOM 0 HA2 GLY B 229 -2.136 7.831 -9.598 1.00 0.00 H new ATOM 0 HA3 GLY B 229 -2.694 6.352 -8.842 1.00 0.00 H new ATOM 1554 N SER B 230 -1.995 6.083 -11.474 1.00 0.00 N ATOM 1555 CA SER B 230 -1.926 5.545 -12.804 1.00 0.00 C ATOM 1556 C SER B 230 -2.413 4.092 -12.852 1.00 0.00 C ATOM 1557 O SER B 230 -2.758 3.576 -13.907 1.00 0.00 O ATOM 1558 CB SER B 230 -0.480 5.624 -13.261 1.00 0.00 C ATOM 1559 OG SER B 230 0.061 6.912 -12.975 1.00 0.00 O ATOM 0 H SER B 230 -1.092 6.124 -11.001 1.00 0.00 H new ATOM 0 HA SER B 230 -2.576 6.122 -13.462 1.00 0.00 H new ATOM 0 HB2 SER B 230 0.109 4.856 -12.760 1.00 0.00 H new ATOM 0 HB3 SER B 230 -0.419 5.426 -14.331 1.00 0.00 H new ATOM 0 HG SER B 230 0.994 6.949 -13.273 1.00 0.00 H new ATOM 1565 N ARG B 231 -2.470 3.446 -11.704 1.00 0.00 N ATOM 1566 CA ARG B 231 -2.841 2.033 -11.650 1.00 0.00 C ATOM 1567 C ARG B 231 -4.350 1.869 -11.560 1.00 0.00 C ATOM 1568 O ARG B 231 -4.865 0.761 -11.514 1.00 0.00 O ATOM 1569 CB ARG B 231 -2.160 1.356 -10.457 1.00 0.00 C ATOM 1570 CG ARG B 231 -0.641 1.549 -10.384 1.00 0.00 C ATOM 1571 CD ARG B 231 0.146 0.791 -11.469 1.00 0.00 C ATOM 1572 NE ARG B 231 -0.227 1.174 -12.842 1.00 0.00 N ATOM 1573 CZ ARG B 231 0.451 2.029 -13.630 1.00 0.00 C ATOM 1574 NH1 ARG B 231 1.535 2.667 -13.168 1.00 0.00 N ATOM 1575 NH2 ARG B 231 0.020 2.261 -14.870 1.00 0.00 N ATOM 0 H ARG B 231 -2.267 3.868 -10.798 1.00 0.00 H new ATOM 0 HA ARG B 231 -2.504 1.555 -12.570 1.00 0.00 H new ATOM 0 HB2 ARG B 231 -2.605 1.739 -9.538 1.00 0.00 H new ATOM 0 HB3 ARG B 231 -2.374 0.288 -10.493 1.00 0.00 H new ATOM 0 HG2 ARG B 231 -0.417 2.613 -10.465 1.00 0.00 H new ATOM 0 HG3 ARG B 231 -0.292 1.224 -9.404 1.00 0.00 H new ATOM 0 HD2 ARG B 231 1.211 0.972 -11.327 1.00 0.00 H new ATOM 0 HD3 ARG B 231 -0.015 -0.280 -11.342 1.00 0.00 H new ATOM 0 HE ARG B 231 -1.073 0.755 -13.229 1.00 0.00 H new ATOM 0 HH11 ARG B 231 1.853 2.506 -12.212 1.00 0.00 H new ATOM 0 HH12 ARG B 231 2.043 3.313 -13.772 1.00 0.00 H new ATOM 0 HH21 ARG B 231 -0.818 1.792 -15.215 1.00 0.00 H new ATOM 0 HH22 ARG B 231 0.528 2.907 -15.474 1.00 0.00 H new ATOM 1589 N TRP B 232 -5.037 2.975 -11.537 1.00 0.00 N ATOM 1590 CA TRP B 232 -6.462 2.999 -11.414 1.00 0.00 C ATOM 1591 C TRP B 232 -7.150 2.649 -12.705 1.00 0.00 C ATOM 1592 O TRP B 232 -6.859 3.195 -13.781 1.00 0.00 O ATOM 1593 CB TRP B 232 -6.945 4.357 -10.878 1.00 0.00 C ATOM 1594 CG TRP B 232 -8.415 4.433 -10.566 1.00 0.00 C ATOM 1595 CD1 TRP B 232 -9.180 3.490 -9.934 1.00 0.00 C ATOM 1596 CD2 TRP B 232 -9.287 5.535 -10.825 1.00 0.00 C ATOM 1597 NE1 TRP B 232 -10.467 3.932 -9.817 1.00 0.00 N ATOM 1598 CE2 TRP B 232 -10.557 5.182 -10.340 1.00 0.00 C ATOM 1599 CE3 TRP B 232 -9.121 6.781 -11.421 1.00 0.00 C ATOM 1600 CZ2 TRP B 232 -11.645 6.026 -10.432 1.00 0.00 C ATOM 1601 CZ3 TRP B 232 -10.209 7.622 -11.511 1.00 0.00 C ATOM 1602 CH2 TRP B 232 -11.456 7.242 -11.016 1.00 0.00 C ATOM 0 H TRP B 232 -4.613 3.900 -11.605 1.00 0.00 H new ATOM 0 HA TRP B 232 -6.735 2.230 -10.691 1.00 0.00 H new ATOM 0 HB2 TRP B 232 -6.385 4.593 -9.973 1.00 0.00 H new ATOM 0 HB3 TRP B 232 -6.705 5.126 -11.612 1.00 0.00 H new ATOM 0 HD1 TRP B 232 -8.819 2.536 -9.580 1.00 0.00 H new ATOM 0 HE1 TRP B 232 -11.237 3.407 -9.403 1.00 0.00 H new ATOM 0 HE3 TRP B 232 -8.158 7.083 -11.806 1.00 0.00 H new ATOM 0 HZ2 TRP B 232 -12.613 5.732 -10.054 1.00 0.00 H new ATOM 0 HZ3 TRP B 232 -10.094 8.592 -11.973 1.00 0.00 H new ATOM 0 HH2 TRP B 232 -12.288 7.925 -11.097 1.00 0.00 H new ATOM 1613 N ASP B 233 -8.010 1.717 -12.559 1.00 0.00 N ATOM 1614 CA ASP B 233 -8.936 1.272 -13.531 1.00 0.00 C ATOM 1615 C ASP B 233 -10.247 1.469 -12.853 1.00 0.00 C ATOM 1616 O ASP B 233 -10.261 1.383 -11.653 1.00 0.00 O ATOM 1617 CB ASP B 233 -8.717 -0.208 -13.847 1.00 0.00 C ATOM 1618 CG ASP B 233 -9.769 -0.771 -14.768 1.00 0.00 C ATOM 1619 OD1 ASP B 233 -9.864 -0.334 -15.939 1.00 0.00 O ATOM 1620 OD2 ASP B 233 -10.505 -1.684 -14.348 1.00 0.00 O ATOM 0 H ASP B 233 -8.093 1.201 -11.683 1.00 0.00 H new ATOM 0 HA ASP B 233 -8.852 1.801 -14.481 1.00 0.00 H new ATOM 0 HB2 ASP B 233 -7.735 -0.336 -14.303 1.00 0.00 H new ATOM 0 HB3 ASP B 233 -8.713 -0.777 -12.917 1.00 0.00 H new ATOM 1625 N GLY B 234 -11.279 1.793 -13.619 1.00 0.00 N ATOM 1626 CA GLY B 234 -12.683 2.136 -13.199 1.00 0.00 C ATOM 1627 C GLY B 234 -13.337 1.235 -12.159 1.00 0.00 C ATOM 1628 O GLY B 234 -14.417 0.677 -12.358 1.00 0.00 O ATOM 0 H GLY B 234 -11.177 1.834 -14.633 1.00 0.00 H new ATOM 0 HA2 GLY B 234 -12.680 3.154 -12.810 1.00 0.00 H new ATOM 0 HA3 GLY B 234 -13.312 2.136 -14.089 1.00 0.00 H new ATOM 1714 N GLY B 240 -18.628 3.543 1.801 1.00 0.00 N ATOM 1715 CA GLY B 240 -19.930 4.102 1.794 1.00 0.00 C ATOM 1716 C GLY B 240 -20.779 3.314 0.844 1.00 0.00 C ATOM 1717 O GLY B 240 -21.382 3.852 -0.042 1.00 0.00 O ATOM 0 HA2 GLY B 240 -20.359 4.077 2.796 1.00 0.00 H new ATOM 0 HA3 GLY B 240 -19.892 5.148 1.490 1.00 0.00 H new ATOM 1721 N PHE B 241 -20.733 2.019 0.983 1.00 0.00 N ATOM 1722 CA PHE B 241 -21.501 1.123 0.143 1.00 0.00 C ATOM 1723 C PHE B 241 -22.974 1.063 0.536 1.00 0.00 C ATOM 1724 O PHE B 241 -23.846 0.918 -0.324 1.00 0.00 O ATOM 1725 CB PHE B 241 -20.852 -0.276 0.049 1.00 0.00 C ATOM 1726 CG PHE B 241 -20.440 -0.880 1.367 1.00 0.00 C ATOM 1727 CD1 PHE B 241 -21.338 -1.583 2.143 1.00 0.00 C ATOM 1728 CD2 PHE B 241 -19.144 -0.741 1.820 1.00 0.00 C ATOM 1729 CE1 PHE B 241 -20.951 -2.136 3.343 1.00 0.00 C ATOM 1730 CE2 PHE B 241 -18.747 -1.290 3.020 1.00 0.00 C ATOM 1731 CZ PHE B 241 -19.653 -1.990 3.782 1.00 0.00 C ATOM 0 H PHE B 241 -20.161 1.546 1.683 1.00 0.00 H new ATOM 0 HA PHE B 241 -21.481 1.545 -0.862 1.00 0.00 H new ATOM 0 HB2 PHE B 241 -21.553 -0.953 -0.440 1.00 0.00 H new ATOM 0 HB3 PHE B 241 -19.974 -0.209 -0.593 1.00 0.00 H new ATOM 0 HD1 PHE B 241 -22.357 -1.701 1.805 1.00 0.00 H new ATOM 0 HD2 PHE B 241 -18.429 -0.193 1.224 1.00 0.00 H new ATOM 0 HE1 PHE B 241 -21.665 -2.684 3.940 1.00 0.00 H new ATOM 0 HE2 PHE B 241 -17.729 -1.171 3.361 1.00 0.00 H new ATOM 0 HZ PHE B 241 -19.348 -2.424 4.723 1.00 0.00 H new ATOM 1741 N GLU B 242 -23.244 1.197 1.834 1.00 0.00 N ATOM 1742 CA GLU B 242 -24.605 1.099 2.372 1.00 0.00 C ATOM 1743 C GLU B 242 -25.527 2.171 1.799 1.00 0.00 C ATOM 1744 O GLU B 242 -26.647 1.886 1.363 1.00 0.00 O ATOM 1745 CB GLU B 242 -24.597 1.158 3.902 1.00 0.00 C ATOM 1746 CG GLU B 242 -24.060 2.442 4.523 1.00 0.00 C ATOM 1747 CD GLU B 242 -24.161 2.420 6.017 1.00 0.00 C ATOM 1748 OE1 GLU B 242 -25.240 2.749 6.553 1.00 0.00 O ATOM 1749 OE2 GLU B 242 -23.174 2.048 6.691 1.00 0.00 O ATOM 0 H GLU B 242 -22.531 1.376 2.541 1.00 0.00 H new ATOM 0 HA GLU B 242 -24.999 0.131 2.064 1.00 0.00 H new ATOM 0 HB2 GLU B 242 -25.617 1.007 4.256 1.00 0.00 H new ATOM 0 HB3 GLU B 242 -24.003 0.323 4.274 1.00 0.00 H new ATOM 0 HG2 GLU B 242 -23.019 2.580 4.231 1.00 0.00 H new ATOM 0 HG3 GLU B 242 -24.616 3.295 4.133 1.00 0.00 H new ATOM 1756 N GLU B 243 -25.021 3.381 1.763 1.00 0.00 N ATOM 1757 CA GLU B 243 -25.740 4.533 1.270 1.00 0.00 C ATOM 1758 C GLU B 243 -26.134 4.359 -0.177 1.00 0.00 C ATOM 1759 O GLU B 243 -27.175 4.807 -0.584 1.00 0.00 O ATOM 1760 CB GLU B 243 -24.914 5.792 1.446 1.00 0.00 C ATOM 1761 CG GLU B 243 -23.502 5.617 0.984 1.00 0.00 C ATOM 1762 CD GLU B 243 -22.762 6.910 0.837 1.00 0.00 C ATOM 1763 OE1 GLU B 243 -22.179 7.407 1.810 1.00 0.00 O ATOM 1764 OE2 GLU B 243 -22.741 7.460 -0.275 1.00 0.00 O ATOM 0 H GLU B 243 -24.077 3.597 2.083 1.00 0.00 H new ATOM 0 HA GLU B 243 -26.654 4.629 1.856 1.00 0.00 H new ATOM 0 HB2 GLU B 243 -25.377 6.608 0.890 1.00 0.00 H new ATOM 0 HB3 GLU B 243 -24.916 6.081 2.497 1.00 0.00 H new ATOM 0 HG2 GLU B 243 -22.971 4.981 1.693 1.00 0.00 H new ATOM 0 HG3 GLU B 243 -23.502 5.096 0.027 1.00 0.00 H new ATOM 1771 N LYS B 244 -25.287 3.697 -0.940 1.00 0.00 N ATOM 1772 CA LYS B 244 -25.520 3.473 -2.347 1.00 0.00 C ATOM 1773 C LYS B 244 -26.751 2.611 -2.526 1.00 0.00 C ATOM 1774 O LYS B 244 -27.596 2.890 -3.361 1.00 0.00 O ATOM 1775 CB LYS B 244 -24.315 2.782 -2.937 1.00 0.00 C ATOM 1776 CG LYS B 244 -23.009 3.470 -2.600 1.00 0.00 C ATOM 1777 CD LYS B 244 -22.871 4.822 -3.255 1.00 0.00 C ATOM 1778 CE LYS B 244 -21.557 5.480 -2.872 1.00 0.00 C ATOM 1779 NZ LYS B 244 -21.425 6.836 -3.436 1.00 0.00 N ATOM 0 H LYS B 244 -24.413 3.298 -0.596 1.00 0.00 H new ATOM 0 HA LYS B 244 -25.680 4.424 -2.855 1.00 0.00 H new ATOM 0 HB2 LYS B 244 -24.281 1.754 -2.576 1.00 0.00 H new ATOM 0 HB3 LYS B 244 -24.425 2.736 -4.020 1.00 0.00 H new ATOM 0 HG2 LYS B 244 -22.934 3.586 -1.519 1.00 0.00 H new ATOM 0 HG3 LYS B 244 -22.179 2.835 -2.911 1.00 0.00 H new ATOM 0 HD2 LYS B 244 -22.925 4.713 -4.338 1.00 0.00 H new ATOM 0 HD3 LYS B 244 -23.702 5.461 -2.957 1.00 0.00 H new ATOM 0 HE2 LYS B 244 -21.482 5.532 -1.786 1.00 0.00 H new ATOM 0 HE3 LYS B 244 -20.729 4.862 -3.219 1.00 0.00 H new ATOM 0 HZ1 LYS B 244 -20.513 7.245 -3.148 1.00 0.00 H new ATOM 0 HZ2 LYS B 244 -21.470 6.786 -4.474 1.00 0.00 H new ATOM 0 HZ3 LYS B 244 -22.199 7.435 -3.085 1.00 0.00 H new ATOM 1793 N TRP B 245 -26.868 1.587 -1.693 1.00 0.00 N ATOM 1794 CA TRP B 245 -28.014 0.694 -1.723 1.00 0.00 C ATOM 1795 C TRP B 245 -29.268 1.446 -1.312 1.00 0.00 C ATOM 1796 O TRP B 245 -30.333 1.278 -1.897 1.00 0.00 O ATOM 1797 CB TRP B 245 -27.785 -0.524 -0.829 1.00 0.00 C ATOM 1798 CG TRP B 245 -26.541 -1.271 -1.182 1.00 0.00 C ATOM 1799 CD1 TRP B 245 -25.994 -1.402 -2.423 1.00 0.00 C ATOM 1800 CD2 TRP B 245 -25.701 -2.013 -0.296 1.00 0.00 C ATOM 1801 NE1 TRP B 245 -24.851 -2.135 -2.355 1.00 0.00 N ATOM 1802 CE2 TRP B 245 -24.654 -2.540 -1.067 1.00 0.00 C ATOM 1803 CE3 TRP B 245 -25.727 -2.278 1.075 1.00 0.00 C ATOM 1804 CZ2 TRP B 245 -23.643 -3.314 -0.519 1.00 0.00 C ATOM 1805 CZ3 TRP B 245 -24.724 -3.050 1.619 1.00 0.00 C ATOM 1806 CH2 TRP B 245 -23.694 -3.562 0.821 1.00 0.00 C ATOM 0 H TRP B 245 -26.175 1.354 -0.982 1.00 0.00 H new ATOM 0 HA TRP B 245 -28.145 0.330 -2.742 1.00 0.00 H new ATOM 0 HB2 TRP B 245 -27.728 -0.201 0.211 1.00 0.00 H new ATOM 0 HB3 TRP B 245 -28.641 -1.194 -0.908 1.00 0.00 H new ATOM 0 HD1 TRP B 245 -26.408 -0.984 -3.329 1.00 0.00 H new ATOM 0 HE1 TRP B 245 -24.238 -2.348 -3.142 1.00 0.00 H new ATOM 0 HE3 TRP B 245 -26.518 -1.885 1.697 1.00 0.00 H new ATOM 0 HZ2 TRP B 245 -22.844 -3.706 -1.131 1.00 0.00 H new ATOM 0 HZ3 TRP B 245 -24.732 -3.264 2.678 1.00 0.00 H new ATOM 0 HH2 TRP B 245 -22.923 -4.166 1.276 1.00 0.00 H new ATOM 1817 N PHE B 246 -29.111 2.316 -0.347 1.00 0.00 N ATOM 1818 CA PHE B 246 -30.179 3.174 0.116 1.00 0.00 C ATOM 1819 C PHE B 246 -30.553 4.198 -0.968 1.00 0.00 C ATOM 1820 O PHE B 246 -31.702 4.584 -1.106 1.00 0.00 O ATOM 1821 CB PHE B 246 -29.739 3.853 1.431 1.00 0.00 C ATOM 1822 CG PHE B 246 -30.372 5.182 1.708 1.00 0.00 C ATOM 1823 CD1 PHE B 246 -31.636 5.279 2.253 1.00 0.00 C ATOM 1824 CD2 PHE B 246 -29.681 6.338 1.409 1.00 0.00 C ATOM 1825 CE1 PHE B 246 -32.203 6.514 2.494 1.00 0.00 C ATOM 1826 CE2 PHE B 246 -30.233 7.572 1.644 1.00 0.00 C ATOM 1827 CZ PHE B 246 -31.502 7.663 2.189 1.00 0.00 C ATOM 0 H PHE B 246 -28.229 2.452 0.147 1.00 0.00 H new ATOM 0 HA PHE B 246 -31.075 2.586 0.315 1.00 0.00 H new ATOM 0 HB2 PHE B 246 -29.964 3.182 2.260 1.00 0.00 H new ATOM 0 HB3 PHE B 246 -28.657 3.982 1.410 1.00 0.00 H new ATOM 0 HD1 PHE B 246 -32.186 4.381 2.493 1.00 0.00 H new ATOM 0 HD2 PHE B 246 -28.691 6.271 0.984 1.00 0.00 H new ATOM 0 HE1 PHE B 246 -33.193 6.581 2.920 1.00 0.00 H new ATOM 0 HE2 PHE B 246 -29.680 8.468 1.405 1.00 0.00 H new ATOM 0 HZ PHE B 246 -31.943 8.631 2.375 1.00 0.00 H new ATOM 1837 N ALA B 247 -29.595 4.613 -1.732 1.00 0.00 N ATOM 1838 CA ALA B 247 -29.838 5.556 -2.780 1.00 0.00 C ATOM 1839 C ALA B 247 -30.536 4.894 -3.959 1.00 0.00 C ATOM 1840 O ALA B 247 -31.475 5.447 -4.513 1.00 0.00 O ATOM 1841 CB ALA B 247 -28.544 6.230 -3.203 1.00 0.00 C ATOM 0 H ALA B 247 -28.624 4.310 -1.649 1.00 0.00 H new ATOM 0 HA ALA B 247 -30.506 6.328 -2.399 1.00 0.00 H new ATOM 0 HB1 ALA B 247 -28.749 6.944 -4.001 1.00 0.00 H new ATOM 0 HB2 ALA B 247 -28.111 6.753 -2.351 1.00 0.00 H new ATOM 0 HB3 ALA B 247 -27.842 5.477 -3.561 1.00 0.00 H new ATOM 1847 N LYS B 248 -30.147 3.673 -4.274 1.00 0.00 N ATOM 1848 CA LYS B 248 -30.668 2.976 -5.444 1.00 0.00 C ATOM 1849 C LYS B 248 -31.998 2.332 -5.163 1.00 0.00 C ATOM 1850 O LYS B 248 -32.727 1.953 -6.081 1.00 0.00 O ATOM 1851 CB LYS B 248 -29.656 1.948 -5.972 1.00 0.00 C ATOM 1852 CG LYS B 248 -29.282 0.807 -5.022 1.00 0.00 C ATOM 1853 CD LYS B 248 -30.277 -0.345 -5.042 1.00 0.00 C ATOM 1854 CE LYS B 248 -29.776 -1.522 -4.230 1.00 0.00 C ATOM 1855 NZ LYS B 248 -30.758 -2.621 -4.195 1.00 0.00 N ATOM 0 H LYS B 248 -29.467 3.137 -3.734 1.00 0.00 H new ATOM 0 HA LYS B 248 -30.827 3.723 -6.222 1.00 0.00 H new ATOM 0 HB2 LYS B 248 -30.058 1.512 -6.887 1.00 0.00 H new ATOM 0 HB3 LYS B 248 -28.743 2.477 -6.245 1.00 0.00 H new ATOM 0 HG2 LYS B 248 -28.295 0.430 -5.289 1.00 0.00 H new ATOM 0 HG3 LYS B 248 -29.210 1.198 -4.007 1.00 0.00 H new ATOM 0 HD2 LYS B 248 -31.234 -0.008 -4.645 1.00 0.00 H new ATOM 0 HD3 LYS B 248 -30.452 -0.659 -6.071 1.00 0.00 H new ATOM 0 HE2 LYS B 248 -28.840 -1.884 -4.655 1.00 0.00 H new ATOM 0 HE3 LYS B 248 -29.559 -1.196 -3.213 1.00 0.00 H new ATOM 0 HZ1 LYS B 248 -30.379 -3.408 -3.630 1.00 0.00 H new ATOM 0 HZ2 LYS B 248 -31.643 -2.282 -3.767 1.00 0.00 H new ATOM 0 HZ3 LYS B 248 -30.946 -2.950 -5.164 1.00 0.00 H new ATOM 1869 N GLN B 249 -32.331 2.231 -3.893 1.00 0.00 N ATOM 1870 CA GLN B 249 -33.579 1.612 -3.475 1.00 0.00 C ATOM 1871 C GLN B 249 -34.757 2.556 -3.741 1.00 0.00 C ATOM 1872 O GLN B 249 -35.913 2.267 -3.400 1.00 0.00 O ATOM 1873 CB GLN B 249 -33.533 1.215 -2.001 1.00 0.00 C ATOM 1874 CG GLN B 249 -33.664 2.358 -1.033 1.00 0.00 C ATOM 1875 CD GLN B 249 -33.703 1.902 0.404 1.00 0.00 C ATOM 1876 OE1 GLN B 249 -34.361 2.521 1.237 1.00 0.00 O ATOM 1877 NE2 GLN B 249 -32.983 0.856 0.717 1.00 0.00 N ATOM 0 H GLN B 249 -31.753 2.571 -3.125 1.00 0.00 H new ATOM 0 HA GLN B 249 -33.718 0.704 -4.061 1.00 0.00 H new ATOM 0 HB2 GLN B 249 -34.333 0.500 -1.807 1.00 0.00 H new ATOM 0 HB3 GLN B 249 -32.592 0.700 -1.808 1.00 0.00 H new ATOM 0 HG2 GLN B 249 -32.827 3.043 -1.170 1.00 0.00 H new ATOM 0 HG3 GLN B 249 -34.573 2.917 -1.257 1.00 0.00 H new ATOM 0 HE21 GLN B 249 -32.451 0.369 -0.004 1.00 0.00 H new ATOM 0 HE22 GLN B 249 -32.954 0.527 1.682 1.00 0.00 H new ATOM 1886 N ASN B 250 -34.442 3.699 -4.328 1.00 0.00 N ATOM 1887 CA ASN B 250 -35.447 4.678 -4.727 1.00 0.00 C ATOM 1888 C ASN B 250 -36.286 4.102 -5.850 1.00 0.00 C ATOM 1889 O ASN B 250 -37.430 4.490 -6.050 1.00 0.00 O ATOM 1890 CB ASN B 250 -34.822 6.007 -5.192 1.00 0.00 C ATOM 1891 CG ASN B 250 -34.236 5.961 -6.589 1.00 0.00 C ATOM 1892 OD1 ASN B 250 -34.895 6.293 -7.570 1.00 0.00 O ATOM 1893 ND2 ASN B 250 -33.032 5.549 -6.689 1.00 0.00 N ATOM 0 H ASN B 250 -33.484 3.977 -4.542 1.00 0.00 H new ATOM 0 HA ASN B 250 -36.062 4.892 -3.853 1.00 0.00 H new ATOM 0 HB2 ASN B 250 -35.583 6.787 -5.154 1.00 0.00 H new ATOM 0 HB3 ASN B 250 -34.038 6.293 -4.490 1.00 0.00 H new ATOM 0 HD21 ASN B 250 -32.588 5.488 -7.605 1.00 0.00 H new ATOM 0 HD22 ASN B 250 -32.513 5.281 -5.852 1.00 0.00 H new ATOM 1900 N GLU B 251 -35.686 3.180 -6.580 1.00 0.00 N ATOM 1901 CA GLU B 251 -36.329 2.500 -7.670 1.00 0.00 C ATOM 1902 C GLU B 251 -37.475 1.680 -7.162 1.00 0.00 C ATOM 1903 O GLU B 251 -37.308 0.726 -6.387 1.00 0.00 O ATOM 1904 CB GLU B 251 -35.332 1.659 -8.442 1.00 0.00 C ATOM 1905 CG GLU B 251 -34.273 2.503 -9.110 1.00 0.00 C ATOM 1906 CD GLU B 251 -34.745 3.210 -10.364 1.00 0.00 C ATOM 1907 OE1 GLU B 251 -35.783 3.890 -10.337 1.00 0.00 O ATOM 1908 OE2 GLU B 251 -34.059 3.125 -11.392 1.00 0.00 O ATOM 0 H GLU B 251 -34.723 2.884 -6.423 1.00 0.00 H new ATOM 0 HA GLU B 251 -36.730 3.240 -8.363 1.00 0.00 H new ATOM 0 HB2 GLU B 251 -34.856 0.950 -7.765 1.00 0.00 H new ATOM 0 HB3 GLU B 251 -35.859 1.075 -9.197 1.00 0.00 H new ATOM 0 HG2 GLU B 251 -33.915 3.248 -8.399 1.00 0.00 H new ATOM 0 HG3 GLU B 251 -33.423 1.868 -9.362 1.00 0.00 H new ATOM 1915 N ILE B 252 -38.619 2.065 -7.596 1.00 0.00 N ATOM 1916 CA ILE B 252 -39.863 1.492 -7.158 1.00 0.00 C ATOM 1917 C ILE B 252 -40.375 0.487 -8.158 1.00 0.00 C ATOM 1918 O ILE B 252 -41.077 -0.448 -7.804 1.00 0.00 O ATOM 1919 CB ILE B 252 -40.927 2.592 -6.917 1.00 0.00 C ATOM 1920 CG1 ILE B 252 -41.010 3.541 -8.138 1.00 0.00 C ATOM 1921 CG2 ILE B 252 -40.624 3.353 -5.630 1.00 0.00 C ATOM 1922 CD1 ILE B 252 -42.046 4.633 -8.027 1.00 0.00 C ATOM 0 H ILE B 252 -38.732 2.808 -8.286 1.00 0.00 H new ATOM 0 HA ILE B 252 -39.676 0.979 -6.215 1.00 0.00 H new ATOM 0 HB ILE B 252 -41.903 2.121 -6.799 1.00 0.00 H new ATOM 0 HG12 ILE B 252 -40.033 4.001 -8.289 1.00 0.00 H new ATOM 0 HG13 ILE B 252 -41.223 2.947 -9.027 1.00 0.00 H new ATOM 0 HG21 ILE B 252 -41.381 4.122 -5.475 1.00 0.00 H new ATOM 0 HG22 ILE B 252 -40.632 2.661 -4.788 1.00 0.00 H new ATOM 0 HG23 ILE B 252 -39.642 3.820 -5.706 1.00 0.00 H new ATOM 0 HD11 ILE B 252 -42.028 5.245 -8.929 1.00 0.00 H new ATOM 0 HD12 ILE B 252 -43.034 4.187 -7.911 1.00 0.00 H new ATOM 0 HD13 ILE B 252 -41.825 5.257 -7.161 1.00 0.00 H new ATOM 1934 N ASN B 253 -40.016 0.675 -9.399 1.00 0.00 N ATOM 1935 CA ASN B 253 -40.448 -0.225 -10.444 1.00 0.00 C ATOM 1936 C ASN B 253 -39.268 -0.845 -11.140 1.00 0.00 C ATOM 1937 O ASN B 253 -39.364 -1.943 -11.692 1.00 0.00 O ATOM 1938 CB ASN B 253 -41.338 0.494 -11.467 1.00 0.00 C ATOM 1939 CG ASN B 253 -40.619 1.545 -12.321 1.00 0.00 C ATOM 1940 OD1 ASN B 253 -40.038 1.235 -13.367 1.00 0.00 O ATOM 1941 ND2 ASN B 253 -40.696 2.785 -11.915 1.00 0.00 N ATOM 0 H ASN B 253 -39.425 1.443 -9.716 1.00 0.00 H new ATOM 0 HA ASN B 253 -41.033 -1.014 -9.972 1.00 0.00 H new ATOM 0 HB2 ASN B 253 -41.780 -0.250 -12.129 1.00 0.00 H new ATOM 0 HB3 ASN B 253 -42.159 0.977 -10.937 1.00 0.00 H new ATOM 0 HD21 ASN B 253 -40.269 3.530 -12.466 1.00 0.00 H new ATOM 0 HD22 ASN B 253 -41.183 3.008 -11.047 1.00 0.00 H new ATOM 1948 N GLU B 254 -38.163 -0.152 -11.117 1.00 0.00 N ATOM 1949 CA GLU B 254 -36.987 -0.603 -11.789 1.00 0.00 C ATOM 1950 C GLU B 254 -36.147 -1.576 -10.982 1.00 0.00 C ATOM 1951 O GLU B 254 -36.402 -1.822 -9.796 1.00 0.00 O ATOM 1952 CB GLU B 254 -36.169 0.549 -12.334 1.00 0.00 C ATOM 1953 CG GLU B 254 -36.264 0.666 -13.840 1.00 0.00 C ATOM 1954 CD GLU B 254 -35.959 -0.644 -14.509 1.00 0.00 C ATOM 1955 OE1 GLU B 254 -34.844 -1.145 -14.348 1.00 0.00 O ATOM 1956 OE2 GLU B 254 -36.852 -1.225 -15.140 1.00 0.00 O ATOM 0 H GLU B 254 -38.058 0.739 -10.632 1.00 0.00 H new ATOM 0 HA GLU B 254 -37.345 -1.181 -12.641 1.00 0.00 H new ATOM 0 HB2 GLU B 254 -36.509 1.479 -11.878 1.00 0.00 H new ATOM 0 HB3 GLU B 254 -35.125 0.417 -12.048 1.00 0.00 H new ATOM 0 HG2 GLU B 254 -37.265 0.995 -14.119 1.00 0.00 H new ATOM 0 HG3 GLU B 254 -35.568 1.428 -14.192 1.00 0.00 H new