USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 714 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 208 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 212 SER OG : rot 76:sc= 1.19 USER MOD Set 2.1: A 185 CYS SG : rot 180:sc= 0 USER MOD Set 2.2: A 188 THR OG1 : rot -25:sc= -0.197 USER MOD Set 2.3: A 189 HIS : no HD1:sc= -0.471 X(o=-0.67,f=-0.23) USER MOD Single : A 159 GLN : amide:sc=-0.00568 K(o=-0.0057,f=-1.2) USER MOD Single : A 162 ASN : amide:sc= -0.132 X(o=-0.13,f=-0.14) USER MOD Single : A 163 CYS SG : rot 62:sc= -2.67 USER MOD Single : A 165 GLN : amide:sc= -0.128 K(o=-0.13,f=-1.3!) USER MOD Single : A 167 MET CE :methyl -172:sc= -7.26! (180deg=-7.41!) USER MOD Single : A 173 HIS :FLIP no HD1:sc= -1.64 F(o=-3.4!,f=-1.6) USER MOD Single : A 174 SER OG : rot 180:sc= 0 USER MOD Single : A 179 TYR OH : rot 180:sc= -0.0528 USER MOD Single : A 180 THR OG1 : rot 98:sc= 1.13 USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 HIS :FLIP no HE2:sc= -0.14 F(o=-0.8,f=-0.14) USER MOD Single : A 187 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.303) USER MOD Single : A 192 GLN : amide:sc= -4.52! C(o=-4.5!,f=-11!) USER MOD Single : A 194 GLN : amide:sc= -2.37 K(o=-2.4,f=-7.4!) USER MOD Single : A 195 ASN : amide:sc=-0.00789 K(o=-0.0079,f=-3.4!) USER MOD Single : A 196 THR OG1 : rot -35:sc= 1.25 USER MOD Single : A 201 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 204 HIS :FLIP no HD1:sc= -3.26 F(o=-4.6!,f=-3.3) USER MOD Single : A 217 CYS SG : rot 180:sc= 0 USER MOD Single : A 218 SER OG : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= -2.51 K(o=-2.5,f=-8.3!) USER MOD Single : A 220 ASN : amide:sc= -0.287 X(o=-0.29,f=-0.074) USER MOD Single : A 222 THR OG1 : rot 180:sc= -0.297 USER MOD Single : A 230 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 232 ASN : amide:sc= 0.0374 X(o=0.037,f=-0.22) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 SER OG : rot 180:sc= 0 USER MOD Single : A 245 THR OG1 : rot 80:sc= 0.823 USER MOD Single : A 246 SER OG : rot 180:sc= 0 USER MOD Single : A 248 LYS NZ :NH3+ 154:sc= -0.317 (180deg=-1.31) USER MOD ----------------------------------------------------------------- ATOM 82 N GLN A 159 -8.446 -10.685 2.708 1.00 0.00 N ATOM 83 CA GLN A 159 -7.461 -11.343 1.857 1.00 0.00 C ATOM 84 C GLN A 159 -6.748 -10.330 0.968 1.00 0.00 C ATOM 85 O GLN A 159 -7.376 -9.436 0.399 1.00 0.00 O ATOM 86 CB GLN A 159 -8.133 -12.412 0.995 1.00 0.00 C ATOM 87 CG GLN A 159 -8.754 -13.542 1.802 1.00 0.00 C ATOM 88 CD GLN A 159 -8.874 -14.828 1.008 1.00 0.00 C ATOM 89 OE1 GLN A 159 -8.684 -14.840 -0.209 1.00 0.00 O ATOM 90 NE2 GLN A 159 -9.192 -15.920 1.693 1.00 0.00 N ATOM 0 HA GLN A 159 -6.721 -11.819 2.501 1.00 0.00 H new ATOM 0 HB2 GLN A 159 -8.907 -11.943 0.387 1.00 0.00 H new ATOM 0 HB3 GLN A 159 -7.397 -12.829 0.308 1.00 0.00 H new ATOM 0 HG2 GLN A 159 -8.150 -13.723 2.691 1.00 0.00 H new ATOM 0 HG3 GLN A 159 -9.743 -13.238 2.145 1.00 0.00 H new ATOM 0 HE21 GLN A 159 -9.341 -15.865 2.701 1.00 0.00 H new ATOM 0 HE22 GLN A 159 -9.288 -16.814 1.212 1.00 0.00 H new ATOM 99 N VAL A 160 -5.432 -10.475 0.851 1.00 0.00 N ATOM 100 CA VAL A 160 -4.633 -9.573 0.030 1.00 0.00 C ATOM 101 C VAL A 160 -5.367 -9.204 -1.254 1.00 0.00 C ATOM 102 O VAL A 160 -5.303 -8.064 -1.712 1.00 0.00 O ATOM 103 CB VAL A 160 -3.273 -10.199 -0.331 1.00 0.00 C ATOM 104 CG1 VAL A 160 -3.465 -11.583 -0.934 1.00 0.00 C ATOM 105 CG2 VAL A 160 -2.507 -9.295 -1.285 1.00 0.00 C ATOM 0 H VAL A 160 -4.896 -11.209 1.315 1.00 0.00 H new ATOM 0 HA VAL A 160 -4.465 -8.673 0.621 1.00 0.00 H new ATOM 0 HB VAL A 160 -2.688 -10.305 0.582 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -2.493 -12.010 -1.183 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -3.970 -12.227 -0.214 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -4.069 -11.505 -1.838 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -1.549 -9.753 -1.529 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -3.086 -9.156 -2.198 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -2.337 -8.328 -0.812 1.00 0.00 H new ATOM 115 N GLY A 161 -6.066 -10.177 -1.831 1.00 0.00 N ATOM 116 CA GLY A 161 -6.803 -9.934 -3.057 1.00 0.00 C ATOM 117 C GLY A 161 -7.824 -8.824 -2.910 1.00 0.00 C ATOM 118 O GLY A 161 -7.882 -7.912 -3.733 1.00 0.00 O ATOM 0 H GLY A 161 -6.135 -11.129 -1.471 1.00 0.00 H new ATOM 0 HA2 GLY A 161 -6.104 -9.677 -3.853 1.00 0.00 H new ATOM 0 HA3 GLY A 161 -7.309 -10.851 -3.361 1.00 0.00 H new ATOM 122 N ASN A 162 -8.633 -8.902 -1.858 1.00 0.00 N ATOM 123 CA ASN A 162 -9.659 -7.896 -1.607 1.00 0.00 C ATOM 124 C ASN A 162 -9.357 -7.118 -0.330 1.00 0.00 C ATOM 125 O ASN A 162 -10.267 -6.634 0.345 1.00 0.00 O ATOM 126 CB ASN A 162 -11.035 -8.557 -1.502 1.00 0.00 C ATOM 127 CG ASN A 162 -11.008 -9.818 -0.660 1.00 0.00 C ATOM 128 OD1 ASN A 162 -10.837 -10.921 -1.180 1.00 0.00 O ATOM 129 ND2 ASN A 162 -11.178 -9.661 0.647 1.00 0.00 N ATOM 0 H ASN A 162 -8.598 -9.651 -1.166 1.00 0.00 H new ATOM 0 HA ASN A 162 -9.661 -7.198 -2.444 1.00 0.00 H new ATOM 0 HB2 ASN A 162 -11.743 -7.850 -1.070 1.00 0.00 H new ATOM 0 HB3 ASN A 162 -11.396 -8.799 -2.502 1.00 0.00 H new ATOM 0 HD21 ASN A 162 -11.170 -10.474 1.264 1.00 0.00 H new ATOM 0 HD22 ASN A 162 -11.316 -8.728 1.035 1.00 0.00 H new ATOM 136 N CYS A 163 -8.074 -7.002 -0.004 1.00 0.00 N ATOM 137 CA CYS A 163 -7.652 -6.282 1.192 1.00 0.00 C ATOM 138 C CYS A 163 -7.723 -4.774 0.974 1.00 0.00 C ATOM 139 O CYS A 163 -8.103 -4.023 1.873 1.00 0.00 O ATOM 140 CB CYS A 163 -6.229 -6.687 1.580 1.00 0.00 C ATOM 141 SG CYS A 163 -4.945 -5.968 0.529 1.00 0.00 S ATOM 0 H CYS A 163 -7.309 -7.397 -0.551 1.00 0.00 H new ATOM 0 HA CYS A 163 -8.331 -6.545 2.003 1.00 0.00 H new ATOM 0 HB2 CYS A 163 -6.047 -6.390 2.613 1.00 0.00 H new ATOM 0 HB3 CYS A 163 -6.149 -7.773 1.542 1.00 0.00 H new ATOM 0 HG CYS A 163 -4.979 -4.672 0.627 1.00 0.00 H new ATOM 147 N LEU A 164 -7.354 -4.338 -0.225 1.00 0.00 N ATOM 148 CA LEU A 164 -7.374 -2.918 -0.562 1.00 0.00 C ATOM 149 C LEU A 164 -8.790 -2.357 -0.470 1.00 0.00 C ATOM 150 O LEU A 164 -9.049 -1.422 0.287 1.00 0.00 O ATOM 151 CB LEU A 164 -6.817 -2.700 -1.969 1.00 0.00 C ATOM 152 CG LEU A 164 -5.463 -3.347 -2.263 1.00 0.00 C ATOM 153 CD1 LEU A 164 -5.283 -3.552 -3.759 1.00 0.00 C ATOM 154 CD2 LEU A 164 -4.333 -2.499 -1.699 1.00 0.00 C ATOM 0 H LEU A 164 -7.037 -4.946 -0.980 1.00 0.00 H new ATOM 0 HA LEU A 164 -6.746 -2.390 0.156 1.00 0.00 H new ATOM 0 HB2 LEU A 164 -7.543 -3.080 -2.688 1.00 0.00 H new ATOM 0 HB3 LEU A 164 -6.730 -1.627 -2.141 1.00 0.00 H new ATOM 0 HG LEU A 164 -5.435 -4.323 -1.778 1.00 0.00 H new ATOM 0 HD11 LEU A 164 -4.314 -4.013 -3.949 1.00 0.00 H new ATOM 0 HD12 LEU A 164 -6.074 -4.201 -4.135 1.00 0.00 H new ATOM 0 HD13 LEU A 164 -5.332 -2.589 -4.267 1.00 0.00 H new ATOM 0 HD21 LEU A 164 -3.377 -2.975 -1.918 1.00 0.00 H new ATOM 0 HD22 LEU A 164 -4.358 -1.509 -2.155 1.00 0.00 H new ATOM 0 HD23 LEU A 164 -4.453 -2.404 -0.620 1.00 0.00 H new ATOM 166 N GLN A 165 -9.702 -2.936 -1.245 1.00 0.00 N ATOM 167 CA GLN A 165 -11.091 -2.494 -1.249 1.00 0.00 C ATOM 168 C GLN A 165 -11.614 -2.327 0.174 1.00 0.00 C ATOM 169 O GLN A 165 -12.178 -1.289 0.521 1.00 0.00 O ATOM 170 CB GLN A 165 -11.963 -3.493 -2.012 1.00 0.00 C ATOM 171 CG GLN A 165 -13.427 -3.461 -1.600 1.00 0.00 C ATOM 172 CD GLN A 165 -14.354 -3.920 -2.708 1.00 0.00 C ATOM 173 OE1 GLN A 165 -14.103 -3.671 -3.887 1.00 0.00 O ATOM 174 NE2 GLN A 165 -15.435 -4.595 -2.334 1.00 0.00 N ATOM 0 H GLN A 165 -9.504 -3.711 -1.877 1.00 0.00 H new ATOM 0 HA GLN A 165 -11.137 -1.526 -1.748 1.00 0.00 H new ATOM 0 HB2 GLN A 165 -11.890 -3.285 -3.080 1.00 0.00 H new ATOM 0 HB3 GLN A 165 -11.572 -4.498 -1.855 1.00 0.00 H new ATOM 0 HG2 GLN A 165 -13.569 -4.097 -0.726 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -13.695 -2.447 -1.304 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -15.604 -4.779 -1.345 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -16.096 -4.929 -3.036 1.00 0.00 H new ATOM 183 N VAL A 166 -11.423 -3.356 0.994 1.00 0.00 N ATOM 184 CA VAL A 166 -11.875 -3.323 2.380 1.00 0.00 C ATOM 185 C VAL A 166 -11.260 -2.146 3.130 1.00 0.00 C ATOM 186 O VAL A 166 -11.940 -1.166 3.431 1.00 0.00 O ATOM 187 CB VAL A 166 -11.521 -4.628 3.116 1.00 0.00 C ATOM 188 CG1 VAL A 166 -11.926 -4.542 4.580 1.00 0.00 C ATOM 189 CG2 VAL A 166 -12.187 -5.818 2.441 1.00 0.00 C ATOM 0 H VAL A 166 -10.958 -4.222 0.722 1.00 0.00 H new ATOM 0 HA VAL A 166 -12.959 -3.210 2.358 1.00 0.00 H new ATOM 0 HB VAL A 166 -10.441 -4.769 3.069 1.00 0.00 H new ATOM 0 HG11 VAL A 166 -11.668 -5.473 5.084 1.00 0.00 H new ATOM 0 HG12 VAL A 166 -11.400 -3.714 5.055 1.00 0.00 H new ATOM 0 HG13 VAL A 166 -13.001 -4.377 4.651 1.00 0.00 H new ATOM 0 HG21 VAL A 166 -11.926 -6.732 2.974 1.00 0.00 H new ATOM 0 HG22 VAL A 166 -13.269 -5.686 2.455 1.00 0.00 H new ATOM 0 HG23 VAL A 166 -11.844 -5.890 1.409 1.00 0.00 H new ATOM 199 N MET A 167 -9.970 -2.251 3.428 1.00 0.00 N ATOM 200 CA MET A 167 -9.262 -1.195 4.142 1.00 0.00 C ATOM 201 C MET A 167 -9.669 0.180 3.620 1.00 0.00 C ATOM 202 O MET A 167 -9.870 1.114 4.397 1.00 0.00 O ATOM 203 CB MET A 167 -7.750 -1.379 4.003 1.00 0.00 C ATOM 204 CG MET A 167 -7.155 -0.645 2.813 1.00 0.00 C ATOM 205 SD MET A 167 -5.378 -0.907 2.653 1.00 0.00 S ATOM 206 CE MET A 167 -4.745 0.528 3.517 1.00 0.00 C ATOM 0 H MET A 167 -9.393 -3.057 3.186 1.00 0.00 H new ATOM 0 HA MET A 167 -9.532 -1.260 5.196 1.00 0.00 H new ATOM 0 HB2 MET A 167 -7.265 -1.030 4.914 1.00 0.00 H new ATOM 0 HB3 MET A 167 -7.529 -2.442 3.911 1.00 0.00 H new ATOM 0 HG2 MET A 167 -7.651 -0.977 1.901 1.00 0.00 H new ATOM 0 HG3 MET A 167 -7.353 0.422 2.913 1.00 0.00 H new ATOM 0 HE1 MET A 167 -3.665 0.586 3.384 1.00 0.00 H new ATOM 0 HE2 MET A 167 -5.209 1.429 3.115 1.00 0.00 H new ATOM 0 HE3 MET A 167 -4.975 0.444 4.579 1.00 0.00 H new ATOM 216 N TRP A 168 -9.787 0.296 2.303 1.00 0.00 N ATOM 217 CA TRP A 168 -10.169 1.558 1.678 1.00 0.00 C ATOM 218 C TRP A 168 -11.429 2.124 2.322 1.00 0.00 C ATOM 219 O TRP A 168 -11.388 3.163 2.982 1.00 0.00 O ATOM 220 CB TRP A 168 -10.392 1.360 0.178 1.00 0.00 C ATOM 221 CG TRP A 168 -10.202 2.615 -0.621 1.00 0.00 C ATOM 222 CD1 TRP A 168 -9.040 3.062 -1.180 1.00 0.00 C ATOM 223 CD2 TRP A 168 -11.206 3.583 -0.947 1.00 0.00 C ATOM 224 NE1 TRP A 168 -9.260 4.251 -1.834 1.00 0.00 N ATOM 225 CE2 TRP A 168 -10.581 4.591 -1.707 1.00 0.00 C ATOM 226 CE3 TRP A 168 -12.571 3.695 -0.673 1.00 0.00 C ATOM 227 CZ2 TRP A 168 -11.276 5.695 -2.193 1.00 0.00 C ATOM 228 CZ3 TRP A 168 -13.259 4.792 -1.155 1.00 0.00 C ATOM 229 CH2 TRP A 168 -12.612 5.779 -1.909 1.00 0.00 C ATOM 0 H TRP A 168 -9.624 -0.468 1.647 1.00 0.00 H new ATOM 0 HA TRP A 168 -9.357 2.270 1.826 1.00 0.00 H new ATOM 0 HB2 TRP A 168 -9.704 0.598 -0.187 1.00 0.00 H new ATOM 0 HB3 TRP A 168 -11.402 0.983 0.015 1.00 0.00 H new ATOM 0 HD1 TRP A 168 -8.088 2.556 -1.118 1.00 0.00 H new ATOM 0 HE1 TRP A 168 -8.554 4.792 -2.333 1.00 0.00 H new ATOM 0 HE3 TRP A 168 -13.080 2.938 -0.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 168 -10.779 6.458 -2.773 1.00 0.00 H new ATOM 0 HZ3 TRP A 168 -14.314 4.890 -0.947 1.00 0.00 H new ATOM 0 HH2 TRP A 168 -13.179 6.623 -2.274 1.00 0.00 H new ATOM 240 N LEU A 169 -12.549 1.436 2.126 1.00 0.00 N ATOM 241 CA LEU A 169 -13.822 1.871 2.689 1.00 0.00 C ATOM 242 C LEU A 169 -13.696 2.133 4.186 1.00 0.00 C ATOM 243 O LEU A 169 -14.178 3.145 4.692 1.00 0.00 O ATOM 244 CB LEU A 169 -14.902 0.817 2.433 1.00 0.00 C ATOM 245 CG LEU A 169 -15.576 0.866 1.062 1.00 0.00 C ATOM 246 CD1 LEU A 169 -14.644 0.325 -0.011 1.00 0.00 C ATOM 247 CD2 LEU A 169 -16.881 0.083 1.081 1.00 0.00 C ATOM 0 H LEU A 169 -12.601 0.575 1.582 1.00 0.00 H new ATOM 0 HA LEU A 169 -14.108 2.802 2.200 1.00 0.00 H new ATOM 0 HB2 LEU A 169 -14.456 -0.169 2.561 1.00 0.00 H new ATOM 0 HB3 LEU A 169 -15.672 0.921 3.198 1.00 0.00 H new ATOM 0 HG LEU A 169 -15.802 1.906 0.827 1.00 0.00 H new ATOM 0 HD11 LEU A 169 -15.141 0.368 -0.980 1.00 0.00 H new ATOM 0 HD12 LEU A 169 -13.736 0.928 -0.042 1.00 0.00 H new ATOM 0 HD13 LEU A 169 -14.386 -0.709 0.219 1.00 0.00 H new ATOM 0 HD21 LEU A 169 -17.347 0.129 0.097 1.00 0.00 H new ATOM 0 HD22 LEU A 169 -16.678 -0.957 1.338 1.00 0.00 H new ATOM 0 HD23 LEU A 169 -17.554 0.515 1.822 1.00 0.00 H new ATOM 259 N ALA A 170 -13.041 1.214 4.889 1.00 0.00 N ATOM 260 CA ALA A 170 -12.847 1.348 6.327 1.00 0.00 C ATOM 261 C ALA A 170 -12.258 2.711 6.677 1.00 0.00 C ATOM 262 O ALA A 170 -12.831 3.461 7.468 1.00 0.00 O ATOM 263 CB ALA A 170 -11.948 0.234 6.844 1.00 0.00 C ATOM 0 H ALA A 170 -12.636 0.369 4.486 1.00 0.00 H new ATOM 0 HA ALA A 170 -13.821 1.268 6.809 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -11.811 0.346 7.920 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -12.409 -0.732 6.636 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -10.979 0.288 6.348 1.00 0.00 H new ATOM 269 N ASP A 171 -11.111 3.024 6.084 1.00 0.00 N ATOM 270 CA ASP A 171 -10.445 4.298 6.334 1.00 0.00 C ATOM 271 C ASP A 171 -11.393 5.466 6.081 1.00 0.00 C ATOM 272 O ASP A 171 -11.360 6.469 6.793 1.00 0.00 O ATOM 273 CB ASP A 171 -9.205 4.430 5.448 1.00 0.00 C ATOM 274 CG ASP A 171 -8.630 5.833 5.463 1.00 0.00 C ATOM 275 OD1 ASP A 171 -7.913 6.170 6.429 1.00 0.00 O ATOM 276 OD2 ASP A 171 -8.897 6.594 4.510 1.00 0.00 O ATOM 0 H ASP A 171 -10.623 2.414 5.428 1.00 0.00 H new ATOM 0 HA ASP A 171 -10.140 4.322 7.380 1.00 0.00 H new ATOM 0 HB2 ASP A 171 -8.445 3.725 5.785 1.00 0.00 H new ATOM 0 HB3 ASP A 171 -9.462 4.157 4.425 1.00 0.00 H new ATOM 281 N ARG A 172 -12.236 5.328 5.063 1.00 0.00 N ATOM 282 CA ARG A 172 -13.191 6.372 4.715 1.00 0.00 C ATOM 283 C ARG A 172 -14.288 6.479 5.770 1.00 0.00 C ATOM 284 O ARG A 172 -14.856 7.550 5.984 1.00 0.00 O ATOM 285 CB ARG A 172 -13.812 6.090 3.345 1.00 0.00 C ATOM 286 CG ARG A 172 -12.788 5.789 2.263 1.00 0.00 C ATOM 287 CD ARG A 172 -12.283 7.063 1.604 1.00 0.00 C ATOM 288 NE ARG A 172 -10.993 6.866 0.948 1.00 0.00 N ATOM 289 CZ ARG A 172 -10.342 7.827 0.302 1.00 0.00 C ATOM 290 NH1 ARG A 172 -10.859 9.046 0.225 1.00 0.00 N ATOM 291 NH2 ARG A 172 -9.173 7.570 -0.269 1.00 0.00 N ATOM 0 H ARG A 172 -12.277 4.503 4.465 1.00 0.00 H new ATOM 0 HA ARG A 172 -12.655 7.320 4.675 1.00 0.00 H new ATOM 0 HB2 ARG A 172 -14.495 5.245 3.432 1.00 0.00 H new ATOM 0 HB3 ARG A 172 -14.407 6.951 3.041 1.00 0.00 H new ATOM 0 HG2 ARG A 172 -11.949 5.245 2.696 1.00 0.00 H new ATOM 0 HG3 ARG A 172 -13.234 5.140 1.509 1.00 0.00 H new ATOM 0 HD2 ARG A 172 -13.013 7.406 0.871 1.00 0.00 H new ATOM 0 HD3 ARG A 172 -12.192 7.848 2.355 1.00 0.00 H new ATOM 0 HE ARG A 172 -10.569 5.939 0.988 1.00 0.00 H new ATOM 0 HH11 ARG A 172 -11.758 9.247 0.662 1.00 0.00 H new ATOM 0 HH12 ARG A 172 -10.357 9.782 -0.272 1.00 0.00 H new ATOM 0 HH21 ARG A 172 -8.773 6.634 -0.212 1.00 0.00 H new ATOM 0 HH22 ARG A 172 -8.674 8.309 -0.765 1.00 0.00 H new ATOM 305 N HIS A 173 -14.582 5.360 6.426 1.00 0.00 N ATOM 306 CA HIS A 173 -15.611 5.328 7.459 1.00 0.00 C ATOM 307 C HIS A 173 -14.986 5.349 8.850 1.00 0.00 C ATOM 308 O HIS A 173 -15.575 4.860 9.814 1.00 0.00 O ATOM 309 CB HIS A 173 -16.485 4.084 7.299 1.00 0.00 C ATOM 310 CG HIS A 173 -16.970 3.868 5.898 1.00 0.00 C ATOM 311 ND1 HIS A 173 -16.693 2.889 5.006 1.00 0.00 N flip ATOM 312 CD2 HIS A 173 -17.849 4.723 5.266 1.00 0.00 C flip ATOM 313 CE1 HIS A 173 -17.402 3.166 3.863 1.00 0.00 C flip ATOM 314 NE2 HIS A 173 -18.092 4.277 4.047 1.00 0.00 N flip ATOM 0 H HIS A 173 -14.122 4.465 6.260 1.00 0.00 H new ATOM 0 HA HIS A 173 -16.232 6.217 7.346 1.00 0.00 H new ATOM 0 HB2 HIS A 173 -15.919 3.209 7.618 1.00 0.00 H new ATOM 0 HB3 HIS A 173 -17.345 4.166 7.964 1.00 0.00 H new ATOM 0 HD2 HIS A 173 -18.272 5.617 5.700 1.00 0.00 H new ATOM 0 HE1 HIS A 173 -17.396 2.572 2.961 1.00 0.00 H new ATOM 0 HE2 HIS A 173 -18.708 4.716 3.363 1.00 0.00 H new ATOM 322 N SER A 174 -13.788 5.918 8.947 1.00 0.00 N ATOM 323 CA SER A 174 -13.081 5.998 10.219 1.00 0.00 C ATOM 324 C SER A 174 -13.099 4.652 10.937 1.00 0.00 C ATOM 325 O SER A 174 -13.351 4.582 12.140 1.00 0.00 O ATOM 326 CB SER A 174 -13.709 7.073 11.109 1.00 0.00 C ATOM 327 OG SER A 174 -13.162 8.350 10.829 1.00 0.00 O ATOM 0 H SER A 174 -13.287 6.330 8.160 1.00 0.00 H new ATOM 0 HA SER A 174 -12.045 6.266 10.014 1.00 0.00 H new ATOM 0 HB2 SER A 174 -14.788 7.094 10.953 1.00 0.00 H new ATOM 0 HB3 SER A 174 -13.543 6.825 12.157 1.00 0.00 H new ATOM 0 HG SER A 174 -13.581 9.020 11.409 1.00 0.00 H new ATOM 333 N ASP A 175 -12.831 3.587 10.190 1.00 0.00 N ATOM 334 CA ASP A 175 -12.815 2.242 10.754 1.00 0.00 C ATOM 335 C ASP A 175 -11.384 1.749 10.944 1.00 0.00 C ATOM 336 O ASP A 175 -10.764 1.203 10.032 1.00 0.00 O ATOM 337 CB ASP A 175 -13.584 1.278 9.850 1.00 0.00 C ATOM 338 CG ASP A 175 -15.056 1.199 10.206 1.00 0.00 C ATOM 339 OD1 ASP A 175 -15.591 2.194 10.740 1.00 0.00 O ATOM 340 OD2 ASP A 175 -15.672 0.144 9.951 1.00 0.00 O ATOM 0 H ASP A 175 -12.622 3.629 9.193 1.00 0.00 H new ATOM 0 HA ASP A 175 -13.300 2.278 11.730 1.00 0.00 H new ATOM 0 HB2 ASP A 175 -13.481 1.597 8.813 1.00 0.00 H new ATOM 0 HB3 ASP A 175 -13.142 0.285 9.924 1.00 0.00 H new ATOM 345 N PRO A 176 -10.846 1.947 12.157 1.00 0.00 N ATOM 346 CA PRO A 176 -9.481 1.530 12.495 1.00 0.00 C ATOM 347 C PRO A 176 -9.341 0.014 12.572 1.00 0.00 C ATOM 348 O PRO A 176 -8.361 -0.553 12.090 1.00 0.00 O ATOM 349 CB PRO A 176 -9.249 2.159 13.871 1.00 0.00 C ATOM 350 CG PRO A 176 -10.612 2.314 14.452 1.00 0.00 C ATOM 351 CD PRO A 176 -11.527 2.592 13.291 1.00 0.00 C ATOM 0 HA PRO A 176 -8.760 1.844 11.740 1.00 0.00 H new ATOM 0 HB2 PRO A 176 -8.622 1.523 14.496 1.00 0.00 H new ATOM 0 HB3 PRO A 176 -8.743 3.121 13.786 1.00 0.00 H new ATOM 0 HG2 PRO A 176 -10.916 1.411 14.981 1.00 0.00 H new ATOM 0 HG3 PRO A 176 -10.638 3.130 15.174 1.00 0.00 H new ATOM 0 HD2 PRO A 176 -12.520 2.174 13.453 1.00 0.00 H new ATOM 0 HD3 PRO A 176 -11.654 3.662 13.127 1.00 0.00 H new ATOM 359 N GLU A 177 -10.327 -0.638 13.180 1.00 0.00 N ATOM 360 CA GLU A 177 -10.312 -2.089 13.319 1.00 0.00 C ATOM 361 C GLU A 177 -10.081 -2.763 11.970 1.00 0.00 C ATOM 362 O GLU A 177 -9.088 -3.466 11.776 1.00 0.00 O ATOM 363 CB GLU A 177 -11.627 -2.579 13.928 1.00 0.00 C ATOM 364 CG GLU A 177 -11.862 -2.089 15.347 1.00 0.00 C ATOM 365 CD GLU A 177 -13.291 -2.299 15.808 1.00 0.00 C ATOM 366 OE1 GLU A 177 -14.202 -1.683 15.215 1.00 0.00 O ATOM 367 OE2 GLU A 177 -13.499 -3.078 16.761 1.00 0.00 O ATOM 0 H GLU A 177 -11.146 -0.184 13.584 1.00 0.00 H new ATOM 0 HA GLU A 177 -9.490 -2.356 13.984 1.00 0.00 H new ATOM 0 HB2 GLU A 177 -12.454 -2.251 13.298 1.00 0.00 H new ATOM 0 HB3 GLU A 177 -11.636 -3.669 13.923 1.00 0.00 H new ATOM 0 HG2 GLU A 177 -11.186 -2.611 16.024 1.00 0.00 H new ATOM 0 HG3 GLU A 177 -11.617 -1.028 15.406 1.00 0.00 H new ATOM 374 N LEU A 178 -11.004 -2.544 11.040 1.00 0.00 N ATOM 375 CA LEU A 178 -10.902 -3.130 9.708 1.00 0.00 C ATOM 376 C LEU A 178 -9.715 -2.548 8.947 1.00 0.00 C ATOM 377 O LEU A 178 -8.800 -3.273 8.557 1.00 0.00 O ATOM 378 CB LEU A 178 -12.193 -2.888 8.924 1.00 0.00 C ATOM 379 CG LEU A 178 -12.336 -3.661 7.612 1.00 0.00 C ATOM 380 CD1 LEU A 178 -12.219 -5.157 7.858 1.00 0.00 C ATOM 381 CD2 LEU A 178 -13.661 -3.332 6.940 1.00 0.00 C ATOM 0 H LEU A 178 -11.831 -1.965 11.184 1.00 0.00 H new ATOM 0 HA LEU A 178 -10.747 -4.203 9.820 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -13.037 -3.141 9.566 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -12.267 -1.823 8.705 1.00 0.00 H new ATOM 0 HG LEU A 178 -11.528 -3.359 6.945 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -12.323 -5.690 6.913 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -11.245 -5.379 8.294 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -13.005 -5.476 8.543 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -13.745 -3.891 6.008 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -14.483 -3.605 7.602 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -13.706 -2.264 6.727 1.00 0.00 H new ATOM 393 N TYR A 179 -9.736 -1.236 8.741 1.00 0.00 N ATOM 394 CA TYR A 179 -8.662 -0.557 8.026 1.00 0.00 C ATOM 395 C TYR A 179 -7.302 -1.122 8.423 1.00 0.00 C ATOM 396 O TYR A 179 -6.502 -1.507 7.569 1.00 0.00 O ATOM 397 CB TYR A 179 -8.704 0.946 8.307 1.00 0.00 C ATOM 398 CG TYR A 179 -7.741 1.747 7.461 1.00 0.00 C ATOM 399 CD1 TYR A 179 -7.569 1.463 6.112 1.00 0.00 C ATOM 400 CD2 TYR A 179 -7.003 2.788 8.011 1.00 0.00 C ATOM 401 CE1 TYR A 179 -6.689 2.192 5.335 1.00 0.00 C ATOM 402 CE2 TYR A 179 -6.122 3.523 7.241 1.00 0.00 C ATOM 403 CZ TYR A 179 -5.969 3.221 5.904 1.00 0.00 C ATOM 404 OH TYR A 179 -5.091 3.950 5.134 1.00 0.00 O ATOM 0 H TYR A 179 -10.485 -0.621 9.059 1.00 0.00 H new ATOM 0 HA TYR A 179 -8.808 -0.724 6.959 1.00 0.00 H new ATOM 0 HB2 TYR A 179 -9.716 1.311 8.135 1.00 0.00 H new ATOM 0 HB3 TYR A 179 -8.478 1.117 9.360 1.00 0.00 H new ATOM 0 HD1 TYR A 179 -8.133 0.659 5.663 1.00 0.00 H new ATOM 0 HD2 TYR A 179 -7.120 3.027 9.058 1.00 0.00 H new ATOM 0 HE1 TYR A 179 -6.566 1.957 4.288 1.00 0.00 H new ATOM 0 HE2 TYR A 179 -5.556 4.330 7.684 1.00 0.00 H new ATOM 0 HH TYR A 179 -4.665 4.638 5.687 1.00 0.00 H new ATOM 414 N THR A 180 -7.045 -1.170 9.727 1.00 0.00 N ATOM 415 CA THR A 180 -5.783 -1.686 10.239 1.00 0.00 C ATOM 416 C THR A 180 -5.558 -3.127 9.795 1.00 0.00 C ATOM 417 O THR A 180 -4.480 -3.477 9.314 1.00 0.00 O ATOM 418 CB THR A 180 -5.732 -1.622 11.778 1.00 0.00 C ATOM 419 OG1 THR A 180 -5.931 -0.274 12.218 1.00 0.00 O ATOM 420 CG2 THR A 180 -4.400 -2.139 12.297 1.00 0.00 C ATOM 0 H THR A 180 -7.696 -0.857 10.448 1.00 0.00 H new ATOM 0 HA THR A 180 -4.994 -1.054 9.830 1.00 0.00 H new ATOM 0 HB THR A 180 -6.527 -2.254 12.173 1.00 0.00 H new ATOM 0 HG1 THR A 180 -6.868 -0.150 12.478 1.00 0.00 H new ATOM 0 HG21 THR A 180 -4.388 -2.084 13.386 1.00 0.00 H new ATOM 0 HG22 THR A 180 -4.265 -3.174 11.984 1.00 0.00 H new ATOM 0 HG23 THR A 180 -3.591 -1.530 11.894 1.00 0.00 H new ATOM 428 N ALA A 181 -6.581 -3.959 9.959 1.00 0.00 N ATOM 429 CA ALA A 181 -6.495 -5.362 9.572 1.00 0.00 C ATOM 430 C ALA A 181 -6.091 -5.503 8.108 1.00 0.00 C ATOM 431 O ALA A 181 -4.991 -5.959 7.799 1.00 0.00 O ATOM 432 CB ALA A 181 -7.822 -6.061 9.825 1.00 0.00 C ATOM 0 H ALA A 181 -7.479 -3.686 10.357 1.00 0.00 H new ATOM 0 HA ALA A 181 -5.726 -5.836 10.182 1.00 0.00 H new ATOM 0 HB1 ALA A 181 -7.744 -7.108 9.532 1.00 0.00 H new ATOM 0 HB2 ALA A 181 -8.070 -5.999 10.885 1.00 0.00 H new ATOM 0 HB3 ALA A 181 -8.605 -5.578 9.240 1.00 0.00 H new ATOM 438 N ALA A 182 -6.989 -5.111 7.210 1.00 0.00 N ATOM 439 CA ALA A 182 -6.725 -5.193 5.779 1.00 0.00 C ATOM 440 C ALA A 182 -5.398 -4.530 5.427 1.00 0.00 C ATOM 441 O ALA A 182 -4.612 -5.066 4.645 1.00 0.00 O ATOM 442 CB ALA A 182 -7.862 -4.553 4.995 1.00 0.00 C ATOM 0 H ALA A 182 -7.906 -4.733 7.449 1.00 0.00 H new ATOM 0 HA ALA A 182 -6.658 -6.246 5.506 1.00 0.00 H new ATOM 0 HB1 ALA A 182 -7.652 -4.621 3.928 1.00 0.00 H new ATOM 0 HB2 ALA A 182 -8.794 -5.074 5.215 1.00 0.00 H new ATOM 0 HB3 ALA A 182 -7.956 -3.505 5.280 1.00 0.00 H new ATOM 448 N LYS A 183 -5.154 -3.360 6.007 1.00 0.00 N ATOM 449 CA LYS A 183 -3.922 -2.622 5.756 1.00 0.00 C ATOM 450 C LYS A 183 -2.701 -3.510 5.977 1.00 0.00 C ATOM 451 O LYS A 183 -1.798 -3.560 5.142 1.00 0.00 O ATOM 452 CB LYS A 183 -3.843 -1.394 6.665 1.00 0.00 C ATOM 453 CG LYS A 183 -2.600 -0.550 6.442 1.00 0.00 C ATOM 454 CD LYS A 183 -2.808 0.882 6.904 1.00 0.00 C ATOM 455 CE LYS A 183 -2.819 0.982 8.422 1.00 0.00 C ATOM 456 NZ LYS A 183 -2.435 2.342 8.891 1.00 0.00 N ATOM 0 H LYS A 183 -5.794 -2.902 6.655 1.00 0.00 H new ATOM 0 HA LYS A 183 -3.930 -2.296 4.716 1.00 0.00 H new ATOM 0 HB2 LYS A 183 -4.726 -0.775 6.503 1.00 0.00 H new ATOM 0 HB3 LYS A 183 -3.869 -1.720 7.705 1.00 0.00 H new ATOM 0 HG2 LYS A 183 -1.760 -0.989 6.981 1.00 0.00 H new ATOM 0 HG3 LYS A 183 -2.339 -0.558 5.384 1.00 0.00 H new ATOM 0 HD2 LYS A 183 -2.016 1.514 6.502 1.00 0.00 H new ATOM 0 HD3 LYS A 183 -3.750 1.261 6.507 1.00 0.00 H new ATOM 0 HE2 LYS A 183 -3.813 0.737 8.795 1.00 0.00 H new ATOM 0 HE3 LYS A 183 -2.132 0.246 8.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 -2.455 2.369 9.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 -1.476 2.567 8.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 -3.106 3.042 8.514 1.00 0.00 H new ATOM 470 N HIS A 184 -2.682 -4.211 7.107 1.00 0.00 N ATOM 471 CA HIS A 184 -1.573 -5.099 7.437 1.00 0.00 C ATOM 472 C HIS A 184 -1.405 -6.177 6.370 1.00 0.00 C ATOM 473 O HIS A 184 -0.301 -6.405 5.874 1.00 0.00 O ATOM 474 CB HIS A 184 -1.800 -5.748 8.802 1.00 0.00 C ATOM 475 CG HIS A 184 -1.515 -4.834 9.954 1.00 0.00 C ATOM 476 ND1 HIS A 184 -1.764 -3.514 10.121 1.00 0.00 N flip ATOM 477 CD2 HIS A 184 -0.897 -5.255 11.113 1.00 0.00 C flip ATOM 478 CE1 HIS A 184 -1.298 -3.166 11.365 1.00 0.00 C flip ATOM 479 NE2 HIS A 184 -0.781 -4.234 11.943 1.00 0.00 N flip ATOM 0 H HIS A 184 -3.422 -4.181 7.809 1.00 0.00 H new ATOM 0 HA HIS A 184 -0.661 -4.503 7.474 1.00 0.00 H new ATOM 0 HB2 HIS A 184 -2.833 -6.089 8.866 1.00 0.00 H new ATOM 0 HB3 HIS A 184 -1.167 -6.632 8.885 1.00 0.00 H new ATOM 0 HD1 HIS A 184 -2.214 -2.893 9.448 1.00 0.00 H new ATOM 0 HD2 HIS A 184 -0.561 -6.262 11.311 1.00 0.00 H new ATOM 0 HE1 HIS A 184 -1.347 -2.179 11.800 1.00 0.00 H new ATOM 487 N CYS A 185 -2.504 -6.836 6.023 1.00 0.00 N ATOM 488 CA CYS A 185 -2.478 -7.891 5.016 1.00 0.00 C ATOM 489 C CYS A 185 -1.904 -7.374 3.701 1.00 0.00 C ATOM 490 O CYS A 185 -1.337 -8.134 2.918 1.00 0.00 O ATOM 491 CB CYS A 185 -3.885 -8.445 4.790 1.00 0.00 C ATOM 492 SG CYS A 185 -3.921 -10.155 4.206 1.00 0.00 S ATOM 0 H CYS A 185 -3.425 -6.659 6.424 1.00 0.00 H new ATOM 0 HA CYS A 185 -1.835 -8.692 5.382 1.00 0.00 H new ATOM 0 HB2 CYS A 185 -4.444 -8.380 5.724 1.00 0.00 H new ATOM 0 HB3 CYS A 185 -4.400 -7.814 4.065 1.00 0.00 H new ATOM 0 HG CYS A 185 -5.155 -10.533 4.047 1.00 0.00 H new ATOM 498 N ALA A 186 -2.058 -6.075 3.465 1.00 0.00 N ATOM 499 CA ALA A 186 -1.555 -5.455 2.245 1.00 0.00 C ATOM 500 C ALA A 186 -0.033 -5.361 2.264 1.00 0.00 C ATOM 501 O ALA A 186 0.644 -5.916 1.398 1.00 0.00 O ATOM 502 CB ALA A 186 -2.169 -4.075 2.063 1.00 0.00 C ATOM 0 H ALA A 186 -2.527 -5.432 4.103 1.00 0.00 H new ATOM 0 HA ALA A 186 -1.843 -6.083 1.402 1.00 0.00 H new ATOM 0 HB1 ALA A 186 -1.785 -3.624 1.148 1.00 0.00 H new ATOM 0 HB2 ALA A 186 -3.253 -4.165 1.995 1.00 0.00 H new ATOM 0 HB3 ALA A 186 -1.910 -3.446 2.915 1.00 0.00 H new ATOM 508 N LYS A 187 0.499 -4.656 3.256 1.00 0.00 N ATOM 509 CA LYS A 187 1.941 -4.489 3.389 1.00 0.00 C ATOM 510 C LYS A 187 2.658 -5.829 3.260 1.00 0.00 C ATOM 511 O LYS A 187 3.731 -5.917 2.661 1.00 0.00 O ATOM 512 CB LYS A 187 2.279 -3.845 4.735 1.00 0.00 C ATOM 513 CG LYS A 187 1.802 -4.651 5.931 1.00 0.00 C ATOM 514 CD LYS A 187 2.534 -4.249 7.201 1.00 0.00 C ATOM 515 CE LYS A 187 2.133 -5.128 8.377 1.00 0.00 C ATOM 516 NZ LYS A 187 2.993 -6.340 8.482 1.00 0.00 N ATOM 0 H LYS A 187 -0.048 -4.191 3.981 1.00 0.00 H new ATOM 0 HA LYS A 187 2.281 -3.836 2.585 1.00 0.00 H new ATOM 0 HB2 LYS A 187 3.359 -3.712 4.804 1.00 0.00 H new ATOM 0 HB3 LYS A 187 1.833 -2.851 4.775 1.00 0.00 H new ATOM 0 HG2 LYS A 187 0.730 -4.505 6.066 1.00 0.00 H new ATOM 0 HG3 LYS A 187 1.957 -5.713 5.741 1.00 0.00 H new ATOM 0 HD2 LYS A 187 3.610 -4.322 7.041 1.00 0.00 H new ATOM 0 HD3 LYS A 187 2.316 -3.207 7.433 1.00 0.00 H new ATOM 0 HE2 LYS A 187 2.202 -4.553 9.300 1.00 0.00 H new ATOM 0 HE3 LYS A 187 1.092 -5.430 8.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 187 2.521 -7.050 9.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 187 3.153 -6.735 7.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 187 3.906 -6.082 8.909 1.00 0.00 H new ATOM 530 N THR A 188 2.059 -6.873 3.825 1.00 0.00 N ATOM 531 CA THR A 188 2.639 -8.208 3.773 1.00 0.00 C ATOM 532 C THR A 188 2.624 -8.760 2.352 1.00 0.00 C ATOM 533 O THR A 188 3.644 -9.231 1.847 1.00 0.00 O ATOM 534 CB THR A 188 1.888 -9.184 4.698 1.00 0.00 C ATOM 535 OG1 THR A 188 0.518 -9.286 4.293 1.00 0.00 O ATOM 536 CG2 THR A 188 1.961 -8.723 6.145 1.00 0.00 C ATOM 0 H THR A 188 1.171 -6.819 4.324 1.00 0.00 H new ATOM 0 HA THR A 188 3.670 -8.117 4.114 1.00 0.00 H new ATOM 0 HB THR A 188 2.363 -10.162 4.621 1.00 0.00 H new ATOM 0 HG1 THR A 188 0.255 -8.469 3.820 1.00 0.00 H new ATOM 0 HG21 THR A 188 1.424 -9.428 6.779 1.00 0.00 H new ATOM 0 HG22 THR A 188 3.004 -8.674 6.459 1.00 0.00 H new ATOM 0 HG23 THR A 188 1.508 -7.736 6.236 1.00 0.00 H new ATOM 544 N HIS A 189 1.462 -8.697 1.710 1.00 0.00 N ATOM 545 CA HIS A 189 1.315 -9.189 0.344 1.00 0.00 C ATOM 546 C HIS A 189 1.239 -8.030 -0.645 1.00 0.00 C ATOM 547 O HIS A 189 0.406 -8.029 -1.553 1.00 0.00 O ATOM 548 CB HIS A 189 0.064 -10.060 0.226 1.00 0.00 C ATOM 549 CG HIS A 189 0.046 -11.215 1.179 1.00 0.00 C ATOM 550 ND1 HIS A 189 1.095 -12.101 1.308 1.00 0.00 N ATOM 551 CD2 HIS A 189 -0.901 -11.626 2.054 1.00 0.00 C ATOM 552 CE1 HIS A 189 0.793 -13.008 2.220 1.00 0.00 C ATOM 553 NE2 HIS A 189 -0.413 -12.742 2.688 1.00 0.00 N ATOM 0 H HIS A 189 0.609 -8.310 2.113 1.00 0.00 H new ATOM 0 HA HIS A 189 2.191 -9.791 0.104 1.00 0.00 H new ATOM 0 HB2 HIS A 189 -0.817 -9.442 0.400 1.00 0.00 H new ATOM 0 HB3 HIS A 189 -0.010 -10.439 -0.793 1.00 0.00 H new ATOM 0 HD2 HIS A 189 -1.862 -11.162 2.222 1.00 0.00 H new ATOM 0 HE1 HIS A 189 1.425 -13.827 2.530 1.00 0.00 H new ATOM 0 HE2 HIS A 189 -0.903 -13.279 3.404 1.00 0.00 H new ATOM 561 N LEU A 190 2.111 -7.045 -0.464 1.00 0.00 N ATOM 562 CA LEU A 190 2.142 -5.879 -1.341 1.00 0.00 C ATOM 563 C LEU A 190 2.332 -6.297 -2.796 1.00 0.00 C ATOM 564 O LEU A 190 1.498 -6.001 -3.651 1.00 0.00 O ATOM 565 CB LEU A 190 3.265 -4.930 -0.920 1.00 0.00 C ATOM 566 CG LEU A 190 3.035 -3.447 -1.213 1.00 0.00 C ATOM 567 CD1 LEU A 190 4.117 -2.600 -0.561 1.00 0.00 C ATOM 568 CD2 LEU A 190 2.994 -3.200 -2.714 1.00 0.00 C ATOM 0 H LEU A 190 2.806 -7.030 0.282 1.00 0.00 H new ATOM 0 HA LEU A 190 1.186 -5.363 -1.253 1.00 0.00 H new ATOM 0 HB2 LEU A 190 3.430 -5.047 0.151 1.00 0.00 H new ATOM 0 HB3 LEU A 190 4.183 -5.241 -1.420 1.00 0.00 H new ATOM 0 HG LEU A 190 2.072 -3.158 -0.791 1.00 0.00 H new ATOM 0 HD11 LEU A 190 3.937 -1.548 -0.780 1.00 0.00 H new ATOM 0 HD12 LEU A 190 4.099 -2.754 0.518 1.00 0.00 H new ATOM 0 HD13 LEU A 190 5.092 -2.891 -0.953 1.00 0.00 H new ATOM 0 HD21 LEU A 190 2.830 -2.139 -2.904 1.00 0.00 H new ATOM 0 HD22 LEU A 190 3.941 -3.506 -3.159 1.00 0.00 H new ATOM 0 HD23 LEU A 190 2.182 -3.778 -3.156 1.00 0.00 H new ATOM 580 N ALA A 191 3.434 -6.988 -3.068 1.00 0.00 N ATOM 581 CA ALA A 191 3.731 -7.451 -4.418 1.00 0.00 C ATOM 582 C ALA A 191 2.460 -7.877 -5.145 1.00 0.00 C ATOM 583 O ALA A 191 2.256 -7.535 -6.309 1.00 0.00 O ATOM 584 CB ALA A 191 4.728 -8.599 -4.375 1.00 0.00 C ATOM 0 H ALA A 191 4.136 -7.239 -2.372 1.00 0.00 H new ATOM 0 HA ALA A 191 4.173 -6.622 -4.971 1.00 0.00 H new ATOM 0 HB1 ALA A 191 4.940 -8.935 -5.390 1.00 0.00 H new ATOM 0 HB2 ALA A 191 5.651 -8.262 -3.904 1.00 0.00 H new ATOM 0 HB3 ALA A 191 4.308 -9.424 -3.800 1.00 0.00 H new ATOM 590 N GLN A 192 1.610 -8.626 -4.450 1.00 0.00 N ATOM 591 CA GLN A 192 0.360 -9.101 -5.031 1.00 0.00 C ATOM 592 C GLN A 192 -0.540 -7.931 -5.417 1.00 0.00 C ATOM 593 O GLN A 192 -1.192 -7.954 -6.461 1.00 0.00 O ATOM 594 CB GLN A 192 -0.370 -10.017 -4.046 1.00 0.00 C ATOM 595 CG GLN A 192 0.080 -11.467 -4.118 1.00 0.00 C ATOM 596 CD GLN A 192 -0.769 -12.384 -3.259 1.00 0.00 C ATOM 597 OE1 GLN A 192 -0.865 -12.204 -2.045 1.00 0.00 O ATOM 598 NE2 GLN A 192 -1.391 -13.375 -3.887 1.00 0.00 N ATOM 0 H GLN A 192 1.764 -8.917 -3.485 1.00 0.00 H new ATOM 0 HA GLN A 192 0.599 -9.665 -5.932 1.00 0.00 H new ATOM 0 HB2 GLN A 192 -0.213 -9.646 -3.033 1.00 0.00 H new ATOM 0 HB3 GLN A 192 -1.441 -9.967 -4.242 1.00 0.00 H new ATOM 0 HG2 GLN A 192 0.040 -11.805 -5.153 1.00 0.00 H new ATOM 0 HG3 GLN A 192 1.120 -11.537 -3.800 1.00 0.00 H new ATOM 0 HE21 GLN A 192 -1.283 -13.487 -4.895 1.00 0.00 H new ATOM 0 HE22 GLN A 192 -1.976 -14.024 -3.361 1.00 0.00 H new ATOM 607 N LEU A 193 -0.570 -6.909 -4.568 1.00 0.00 N ATOM 608 CA LEU A 193 -1.389 -5.729 -4.820 1.00 0.00 C ATOM 609 C LEU A 193 -0.768 -4.856 -5.905 1.00 0.00 C ATOM 610 O LEU A 193 -1.444 -4.446 -6.848 1.00 0.00 O ATOM 611 CB LEU A 193 -1.561 -4.919 -3.534 1.00 0.00 C ATOM 612 CG LEU A 193 -1.783 -5.729 -2.255 1.00 0.00 C ATOM 613 CD1 LEU A 193 -1.573 -4.856 -1.028 1.00 0.00 C ATOM 614 CD2 LEU A 193 -3.176 -6.340 -2.246 1.00 0.00 C ATOM 0 H LEU A 193 -0.036 -6.874 -3.699 1.00 0.00 H new ATOM 0 HA LEU A 193 -2.367 -6.064 -5.165 1.00 0.00 H new ATOM 0 HB2 LEU A 193 -0.675 -4.298 -3.398 1.00 0.00 H new ATOM 0 HB3 LEU A 193 -2.407 -4.244 -3.664 1.00 0.00 H new ATOM 0 HG LEU A 193 -1.053 -6.538 -2.229 1.00 0.00 H new ATOM 0 HD11 LEU A 193 -1.735 -5.449 -0.128 1.00 0.00 H new ATOM 0 HD12 LEU A 193 -0.555 -4.467 -1.028 1.00 0.00 H new ATOM 0 HD13 LEU A 193 -2.279 -4.025 -1.047 1.00 0.00 H new ATOM 0 HD21 LEU A 193 -3.316 -6.912 -1.329 1.00 0.00 H new ATOM 0 HD22 LEU A 193 -3.922 -5.547 -2.296 1.00 0.00 H new ATOM 0 HD23 LEU A 193 -3.290 -6.999 -3.106 1.00 0.00 H new ATOM 626 N GLN A 194 0.524 -4.577 -5.765 1.00 0.00 N ATOM 627 CA GLN A 194 1.237 -3.754 -6.735 1.00 0.00 C ATOM 628 C GLN A 194 1.138 -4.352 -8.134 1.00 0.00 C ATOM 629 O GLN A 194 1.237 -3.640 -9.132 1.00 0.00 O ATOM 630 CB GLN A 194 2.705 -3.610 -6.332 1.00 0.00 C ATOM 631 CG GLN A 194 3.605 -4.688 -6.914 1.00 0.00 C ATOM 632 CD GLN A 194 5.075 -4.427 -6.651 1.00 0.00 C ATOM 633 OE1 GLN A 194 5.843 -4.153 -7.574 1.00 0.00 O ATOM 634 NE2 GLN A 194 5.474 -4.510 -5.388 1.00 0.00 N ATOM 0 H GLN A 194 1.098 -4.909 -4.990 1.00 0.00 H new ATOM 0 HA GLN A 194 0.773 -2.768 -6.748 1.00 0.00 H new ATOM 0 HB2 GLN A 194 3.067 -2.634 -6.654 1.00 0.00 H new ATOM 0 HB3 GLN A 194 2.779 -3.635 -5.245 1.00 0.00 H new ATOM 0 HG2 GLN A 194 3.330 -5.654 -6.490 1.00 0.00 H new ATOM 0 HG3 GLN A 194 3.438 -4.753 -7.989 1.00 0.00 H new ATOM 0 HE21 GLN A 194 4.803 -4.740 -4.655 1.00 0.00 H new ATOM 0 HE22 GLN A 194 6.452 -4.344 -5.150 1.00 0.00 H new ATOM 643 N ASN A 195 0.942 -5.665 -8.199 1.00 0.00 N ATOM 644 CA ASN A 195 0.830 -6.359 -9.476 1.00 0.00 C ATOM 645 C ASN A 195 -0.591 -6.267 -10.023 1.00 0.00 C ATOM 646 O ASN A 195 -0.856 -6.650 -11.163 1.00 0.00 O ATOM 647 CB ASN A 195 1.234 -7.826 -9.320 1.00 0.00 C ATOM 648 CG ASN A 195 2.739 -8.015 -9.317 1.00 0.00 C ATOM 649 OD1 ASN A 195 3.487 -7.122 -8.917 1.00 0.00 O ATOM 650 ND2 ASN A 195 3.190 -9.181 -9.764 1.00 0.00 N ATOM 0 H ASN A 195 0.857 -6.270 -7.382 1.00 0.00 H new ATOM 0 HA ASN A 195 1.504 -5.876 -10.183 1.00 0.00 H new ATOM 0 HB2 ASN A 195 0.820 -8.217 -8.391 1.00 0.00 H new ATOM 0 HB3 ASN A 195 0.799 -8.408 -10.133 1.00 0.00 H new ATOM 0 HD21 ASN A 195 4.193 -9.366 -9.786 1.00 0.00 H new ATOM 0 HD22 ASN A 195 2.534 -9.892 -10.086 1.00 0.00 H new ATOM 657 N THR A 196 -1.503 -5.755 -9.203 1.00 0.00 N ATOM 658 CA THR A 196 -2.897 -5.612 -9.603 1.00 0.00 C ATOM 659 C THR A 196 -3.207 -4.177 -10.013 1.00 0.00 C ATOM 660 O THR A 196 -2.367 -3.288 -9.877 1.00 0.00 O ATOM 661 CB THR A 196 -3.853 -6.028 -8.469 1.00 0.00 C ATOM 662 OG1 THR A 196 -3.908 -5.001 -7.473 1.00 0.00 O ATOM 663 CG2 THR A 196 -3.401 -7.334 -7.832 1.00 0.00 C ATOM 0 H THR A 196 -1.301 -5.432 -8.257 1.00 0.00 H new ATOM 0 HA THR A 196 -3.050 -6.272 -10.457 1.00 0.00 H new ATOM 0 HB THR A 196 -4.845 -6.174 -8.896 1.00 0.00 H new ATOM 0 HG1 THR A 196 -3.027 -4.581 -7.387 1.00 0.00 H new ATOM 0 HG21 THR A 196 -4.091 -7.608 -7.034 1.00 0.00 H new ATOM 0 HG22 THR A 196 -3.388 -8.121 -8.586 1.00 0.00 H new ATOM 0 HG23 THR A 196 -2.400 -7.210 -7.419 1.00 0.00 H new ATOM 671 N GLU A 197 -4.419 -3.958 -10.514 1.00 0.00 N ATOM 672 CA GLU A 197 -4.839 -2.630 -10.943 1.00 0.00 C ATOM 673 C GLU A 197 -5.278 -1.786 -9.750 1.00 0.00 C ATOM 674 O GLU A 197 -4.764 -0.689 -9.530 1.00 0.00 O ATOM 675 CB GLU A 197 -5.981 -2.734 -11.956 1.00 0.00 C ATOM 676 CG GLU A 197 -5.618 -3.521 -13.204 1.00 0.00 C ATOM 677 CD GLU A 197 -5.886 -5.006 -13.055 1.00 0.00 C ATOM 678 OE1 GLU A 197 -6.123 -5.454 -11.913 1.00 0.00 O ATOM 679 OE2 GLU A 197 -5.858 -5.720 -14.079 1.00 0.00 O ATOM 0 H GLU A 197 -5.126 -4.683 -10.632 1.00 0.00 H new ATOM 0 HA GLU A 197 -3.986 -2.143 -11.416 1.00 0.00 H new ATOM 0 HB2 GLU A 197 -6.839 -3.205 -11.476 1.00 0.00 H new ATOM 0 HB3 GLU A 197 -6.290 -1.730 -12.247 1.00 0.00 H new ATOM 0 HG2 GLU A 197 -6.187 -3.136 -14.050 1.00 0.00 H new ATOM 0 HG3 GLU A 197 -4.563 -3.367 -13.432 1.00 0.00 H new ATOM 686 N GLU A 198 -6.232 -2.306 -8.984 1.00 0.00 N ATOM 687 CA GLU A 198 -6.742 -1.599 -7.814 1.00 0.00 C ATOM 688 C GLU A 198 -5.632 -0.801 -7.135 1.00 0.00 C ATOM 689 O GLU A 198 -5.691 0.427 -7.063 1.00 0.00 O ATOM 690 CB GLU A 198 -7.355 -2.588 -6.821 1.00 0.00 C ATOM 691 CG GLU A 198 -8.356 -3.542 -7.450 1.00 0.00 C ATOM 692 CD GLU A 198 -9.392 -4.037 -6.461 1.00 0.00 C ATOM 693 OE1 GLU A 198 -9.966 -3.199 -5.734 1.00 0.00 O ATOM 694 OE2 GLU A 198 -9.630 -5.262 -6.412 1.00 0.00 O ATOM 0 H GLU A 198 -6.667 -3.213 -9.152 1.00 0.00 H new ATOM 0 HA GLU A 198 -7.513 -0.905 -8.147 1.00 0.00 H new ATOM 0 HB2 GLU A 198 -6.556 -3.167 -6.358 1.00 0.00 H new ATOM 0 HB3 GLU A 198 -7.848 -2.031 -6.024 1.00 0.00 H new ATOM 0 HG2 GLU A 198 -8.859 -3.041 -8.277 1.00 0.00 H new ATOM 0 HG3 GLU A 198 -7.824 -4.395 -7.870 1.00 0.00 H new ATOM 701 N PHE A 199 -4.623 -1.507 -6.638 1.00 0.00 N ATOM 702 CA PHE A 199 -3.500 -0.866 -5.963 1.00 0.00 C ATOM 703 C PHE A 199 -3.071 0.398 -6.703 1.00 0.00 C ATOM 704 O PHE A 199 -3.092 1.495 -6.145 1.00 0.00 O ATOM 705 CB PHE A 199 -2.321 -1.834 -5.857 1.00 0.00 C ATOM 706 CG PHE A 199 -1.060 -1.191 -5.353 1.00 0.00 C ATOM 707 CD1 PHE A 199 -0.805 -1.106 -3.994 1.00 0.00 C ATOM 708 CD2 PHE A 199 -0.130 -0.671 -6.239 1.00 0.00 C ATOM 709 CE1 PHE A 199 0.353 -0.514 -3.528 1.00 0.00 C ATOM 710 CE2 PHE A 199 1.030 -0.078 -5.779 1.00 0.00 C ATOM 711 CZ PHE A 199 1.273 0.000 -4.422 1.00 0.00 C ATOM 0 H PHE A 199 -4.559 -2.524 -6.690 1.00 0.00 H new ATOM 0 HA PHE A 199 -3.822 -0.587 -4.960 1.00 0.00 H new ATOM 0 HB2 PHE A 199 -2.593 -2.653 -5.191 1.00 0.00 H new ATOM 0 HB3 PHE A 199 -2.130 -2.270 -6.838 1.00 0.00 H new ATOM 0 HD1 PHE A 199 -1.520 -1.507 -3.291 1.00 0.00 H new ATOM 0 HD2 PHE A 199 -0.314 -0.730 -7.302 1.00 0.00 H new ATOM 0 HE1 PHE A 199 0.539 -0.453 -2.466 1.00 0.00 H new ATOM 0 HE2 PHE A 199 1.746 0.324 -6.480 1.00 0.00 H new ATOM 0 HZ PHE A 199 2.180 0.462 -4.060 1.00 0.00 H new ATOM 721 N LEU A 200 -2.680 0.234 -7.962 1.00 0.00 N ATOM 722 CA LEU A 200 -2.245 1.361 -8.780 1.00 0.00 C ATOM 723 C LEU A 200 -3.339 2.419 -8.876 1.00 0.00 C ATOM 724 O LEU A 200 -3.063 3.590 -9.140 1.00 0.00 O ATOM 725 CB LEU A 200 -1.859 0.881 -10.180 1.00 0.00 C ATOM 726 CG LEU A 200 -0.782 -0.203 -10.245 1.00 0.00 C ATOM 727 CD1 LEU A 200 -0.966 -1.064 -11.485 1.00 0.00 C ATOM 728 CD2 LEU A 200 0.605 0.423 -10.229 1.00 0.00 C ATOM 0 H LEU A 200 -2.655 -0.668 -8.438 1.00 0.00 H new ATOM 0 HA LEU A 200 -1.373 1.809 -8.303 1.00 0.00 H new ATOM 0 HB2 LEU A 200 -2.755 0.505 -10.673 1.00 0.00 H new ATOM 0 HB3 LEU A 200 -1.516 1.741 -10.755 1.00 0.00 H new ATOM 0 HG LEU A 200 -0.881 -0.841 -9.367 1.00 0.00 H new ATOM 0 HD11 LEU A 200 -0.191 -1.830 -11.515 1.00 0.00 H new ATOM 0 HD12 LEU A 200 -1.946 -1.541 -11.455 1.00 0.00 H new ATOM 0 HD13 LEU A 200 -0.893 -0.440 -12.376 1.00 0.00 H new ATOM 0 HD21 LEU A 200 1.359 -0.362 -10.276 1.00 0.00 H new ATOM 0 HD22 LEU A 200 0.716 1.084 -11.089 1.00 0.00 H new ATOM 0 HD23 LEU A 200 0.735 0.996 -9.311 1.00 0.00 H new ATOM 740 N HIS A 201 -4.581 2.000 -8.659 1.00 0.00 N ATOM 741 CA HIS A 201 -5.717 2.913 -8.718 1.00 0.00 C ATOM 742 C HIS A 201 -5.941 3.591 -7.370 1.00 0.00 C ATOM 743 O HIS A 201 -6.696 4.559 -7.267 1.00 0.00 O ATOM 744 CB HIS A 201 -6.981 2.162 -9.140 1.00 0.00 C ATOM 745 CG HIS A 201 -7.178 2.107 -10.623 1.00 0.00 C ATOM 746 ND1 HIS A 201 -8.085 2.901 -11.292 1.00 0.00 N ATOM 747 CD2 HIS A 201 -6.577 1.347 -11.569 1.00 0.00 C ATOM 748 CE1 HIS A 201 -8.035 2.631 -12.584 1.00 0.00 C ATOM 749 NE2 HIS A 201 -7.127 1.692 -12.779 1.00 0.00 N ATOM 0 H HIS A 201 -4.827 1.034 -8.441 1.00 0.00 H new ATOM 0 HA HIS A 201 -5.495 3.681 -9.459 1.00 0.00 H new ATOM 0 HB2 HIS A 201 -6.937 1.145 -8.750 1.00 0.00 H new ATOM 0 HB3 HIS A 201 -7.848 2.641 -8.684 1.00 0.00 H new ATOM 0 HD2 HIS A 201 -5.808 0.607 -11.403 1.00 0.00 H new ATOM 0 HE1 HIS A 201 -8.635 3.099 -13.351 1.00 0.00 H new ATOM 0 HE2 HIS A 201 -6.875 1.289 -13.681 1.00 0.00 H new ATOM 757 N LEU A 202 -5.281 3.077 -6.338 1.00 0.00 N ATOM 758 CA LEU A 202 -5.407 3.632 -4.995 1.00 0.00 C ATOM 759 C LEU A 202 -4.775 5.018 -4.917 1.00 0.00 C ATOM 760 O LEU A 202 -3.873 5.360 -5.682 1.00 0.00 O ATOM 761 CB LEU A 202 -4.752 2.701 -3.973 1.00 0.00 C ATOM 762 CG LEU A 202 -5.444 1.356 -3.749 1.00 0.00 C ATOM 763 CD1 LEU A 202 -4.843 0.639 -2.551 1.00 0.00 C ATOM 764 CD2 LEU A 202 -6.942 1.552 -3.560 1.00 0.00 C ATOM 0 H LEU A 202 -4.653 2.276 -6.406 1.00 0.00 H new ATOM 0 HA LEU A 202 -6.468 3.724 -4.765 1.00 0.00 H new ATOM 0 HB2 LEU A 202 -3.727 2.511 -4.290 1.00 0.00 H new ATOM 0 HB3 LEU A 202 -4.699 3.223 -3.018 1.00 0.00 H new ATOM 0 HG LEU A 202 -5.287 0.737 -4.632 1.00 0.00 H new ATOM 0 HD11 LEU A 202 -5.348 -0.316 -2.407 1.00 0.00 H new ATOM 0 HD12 LEU A 202 -3.781 0.465 -2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 202 -4.968 1.253 -1.659 1.00 0.00 H new ATOM 0 HD21 LEU A 202 -7.418 0.584 -3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 202 -7.119 2.190 -2.694 1.00 0.00 H new ATOM 0 HD23 LEU A 202 -7.362 2.022 -4.449 1.00 0.00 H new ATOM 776 N PRO A 203 -5.256 5.835 -3.968 1.00 0.00 N ATOM 777 CA PRO A 203 -4.750 7.196 -3.765 1.00 0.00 C ATOM 778 C PRO A 203 -3.334 7.210 -3.198 1.00 0.00 C ATOM 779 O PRO A 203 -2.679 6.171 -3.113 1.00 0.00 O ATOM 780 CB PRO A 203 -5.735 7.795 -2.759 1.00 0.00 C ATOM 781 CG PRO A 203 -6.288 6.621 -2.026 1.00 0.00 C ATOM 782 CD PRO A 203 -6.330 5.494 -3.021 1.00 0.00 C ATOM 0 HA PRO A 203 -4.686 7.751 -4.701 1.00 0.00 H new ATOM 0 HB2 PRO A 203 -5.236 8.487 -2.080 1.00 0.00 H new ATOM 0 HB3 PRO A 203 -6.523 8.355 -3.262 1.00 0.00 H new ATOM 0 HG2 PRO A 203 -5.662 6.364 -1.172 1.00 0.00 H new ATOM 0 HG3 PRO A 203 -7.284 6.837 -1.638 1.00 0.00 H new ATOM 0 HD2 PRO A 203 -6.154 4.530 -2.544 1.00 0.00 H new ATOM 0 HD3 PRO A 203 -7.299 5.432 -3.517 1.00 0.00 H new ATOM 790 N HIS A 204 -2.869 8.393 -2.810 1.00 0.00 N ATOM 791 CA HIS A 204 -1.531 8.541 -2.248 1.00 0.00 C ATOM 792 C HIS A 204 -1.568 8.459 -0.725 1.00 0.00 C ATOM 793 O HIS A 204 -0.549 8.204 -0.083 1.00 0.00 O ATOM 794 CB HIS A 204 -0.916 9.871 -2.685 1.00 0.00 C ATOM 795 CG HIS A 204 0.282 10.270 -1.880 1.00 0.00 C ATOM 796 ND1 HIS A 204 1.554 9.806 -1.896 1.00 0.00 N flip ATOM 797 CD2 HIS A 204 0.249 11.259 -0.920 1.00 0.00 C flip ATOM 798 CE1 HIS A 204 2.258 10.516 -0.955 1.00 0.00 C flip ATOM 799 NE2 HIS A 204 1.448 11.387 -0.381 1.00 0.00 N flip ATOM 0 H HIS A 204 -3.398 9.263 -2.874 1.00 0.00 H new ATOM 0 HA HIS A 204 -0.914 7.724 -2.622 1.00 0.00 H new ATOM 0 HB2 HIS A 204 -0.632 9.803 -3.735 1.00 0.00 H new ATOM 0 HB3 HIS A 204 -1.671 10.653 -2.609 1.00 0.00 H new ATOM 0 HD2 HIS A 204 -0.622 11.839 -0.651 1.00 0.00 H new ATOM 0 HE1 HIS A 204 3.304 10.384 -0.722 1.00 0.00 H new ATOM 0 HE2 HIS A 204 1.705 12.046 0.354 1.00 0.00 H new ATOM 807 N ARG A 205 -2.748 8.679 -0.155 1.00 0.00 N ATOM 808 CA ARG A 205 -2.917 8.632 1.293 1.00 0.00 C ATOM 809 C ARG A 205 -2.826 7.197 1.805 1.00 0.00 C ATOM 810 O ARG A 205 -1.953 6.867 2.608 1.00 0.00 O ATOM 811 CB ARG A 205 -4.262 9.242 1.690 1.00 0.00 C ATOM 812 CG ARG A 205 -4.200 10.739 1.948 1.00 0.00 C ATOM 813 CD ARG A 205 -4.179 11.528 0.649 1.00 0.00 C ATOM 814 NE ARG A 205 -4.002 12.959 0.880 1.00 0.00 N ATOM 815 CZ ARG A 205 -4.079 13.874 -0.081 1.00 0.00 C ATOM 816 NH1 ARG A 205 -4.327 13.508 -1.331 1.00 0.00 N ATOM 817 NH2 ARG A 205 -3.907 15.157 0.209 1.00 0.00 N ATOM 0 H ARG A 205 -3.601 8.891 -0.673 1.00 0.00 H new ATOM 0 HA ARG A 205 -2.114 9.213 1.747 1.00 0.00 H new ATOM 0 HB2 ARG A 205 -4.987 9.048 0.899 1.00 0.00 H new ATOM 0 HB3 ARG A 205 -4.627 8.742 2.587 1.00 0.00 H new ATOM 0 HG2 ARG A 205 -5.060 11.042 2.545 1.00 0.00 H new ATOM 0 HG3 ARG A 205 -3.309 10.972 2.531 1.00 0.00 H new ATOM 0 HD2 ARG A 205 -3.372 11.161 0.015 1.00 0.00 H new ATOM 0 HD3 ARG A 205 -5.111 11.361 0.108 1.00 0.00 H new ATOM 0 HE ARG A 205 -3.809 13.274 1.831 1.00 0.00 H new ATOM 0 HH11 ARG A 205 -4.459 12.522 -1.557 1.00 0.00 H new ATOM 0 HH12 ARG A 205 -4.386 14.212 -2.067 1.00 0.00 H new ATOM 0 HH21 ARG A 205 -3.716 15.442 1.170 1.00 0.00 H new ATOM 0 HH22 ARG A 205 -3.966 15.859 -0.529 1.00 0.00 H new ATOM 831 N LEU A 206 -3.734 6.349 1.335 1.00 0.00 N ATOM 832 CA LEU A 206 -3.758 4.949 1.746 1.00 0.00 C ATOM 833 C LEU A 206 -2.430 4.267 1.430 1.00 0.00 C ATOM 834 O LEU A 206 -1.932 3.460 2.216 1.00 0.00 O ATOM 835 CB LEU A 206 -4.902 4.211 1.048 1.00 0.00 C ATOM 836 CG LEU A 206 -6.243 4.204 1.782 1.00 0.00 C ATOM 837 CD1 LEU A 206 -7.085 5.401 1.369 1.00 0.00 C ATOM 838 CD2 LEU A 206 -6.990 2.906 1.515 1.00 0.00 C ATOM 0 H LEU A 206 -4.463 6.606 0.669 1.00 0.00 H new ATOM 0 HA LEU A 206 -3.916 4.915 2.824 1.00 0.00 H new ATOM 0 HB2 LEU A 206 -5.051 4.659 0.066 1.00 0.00 H new ATOM 0 HB3 LEU A 206 -4.595 3.178 0.884 1.00 0.00 H new ATOM 0 HG LEU A 206 -6.050 4.275 2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 206 -8.036 5.378 1.902 1.00 0.00 H new ATOM 0 HD12 LEU A 206 -6.554 6.321 1.613 1.00 0.00 H new ATOM 0 HD13 LEU A 206 -7.270 5.363 0.296 1.00 0.00 H new ATOM 0 HD21 LEU A 206 -7.942 2.918 2.045 1.00 0.00 H new ATOM 0 HD22 LEU A 206 -7.172 2.804 0.445 1.00 0.00 H new ATOM 0 HD23 LEU A 206 -6.392 2.064 1.863 1.00 0.00 H new ATOM 850 N LEU A 207 -1.861 4.598 0.277 1.00 0.00 N ATOM 851 CA LEU A 207 -0.589 4.019 -0.143 1.00 0.00 C ATOM 852 C LEU A 207 0.520 4.367 0.846 1.00 0.00 C ATOM 853 O LEU A 207 1.108 3.484 1.472 1.00 0.00 O ATOM 854 CB LEU A 207 -0.216 4.516 -1.540 1.00 0.00 C ATOM 855 CG LEU A 207 1.120 4.019 -2.095 1.00 0.00 C ATOM 856 CD1 LEU A 207 1.115 2.503 -2.218 1.00 0.00 C ATOM 857 CD2 LEU A 207 1.411 4.665 -3.442 1.00 0.00 C ATOM 0 H LEU A 207 -2.260 5.264 -0.384 1.00 0.00 H new ATOM 0 HA LEU A 207 -0.702 2.935 -0.168 1.00 0.00 H new ATOM 0 HB2 LEU A 207 -1.006 4.222 -2.231 1.00 0.00 H new ATOM 0 HB3 LEU A 207 -0.197 5.606 -1.523 1.00 0.00 H new ATOM 0 HG LEU A 207 1.910 4.304 -1.400 1.00 0.00 H new ATOM 0 HD11 LEU A 207 2.073 2.167 -2.614 1.00 0.00 H new ATOM 0 HD12 LEU A 207 0.953 2.059 -1.236 1.00 0.00 H new ATOM 0 HD13 LEU A 207 0.316 2.195 -2.892 1.00 0.00 H new ATOM 0 HD21 LEU A 207 2.365 4.300 -3.822 1.00 0.00 H new ATOM 0 HD22 LEU A 207 0.619 4.411 -4.146 1.00 0.00 H new ATOM 0 HD23 LEU A 207 1.458 5.748 -3.324 1.00 0.00 H new ATOM 869 N THR A 208 0.799 5.659 0.984 1.00 0.00 N ATOM 870 CA THR A 208 1.836 6.124 1.897 1.00 0.00 C ATOM 871 C THR A 208 1.637 5.547 3.294 1.00 0.00 C ATOM 872 O THR A 208 2.596 5.367 4.044 1.00 0.00 O ATOM 873 CB THR A 208 1.857 7.661 1.987 1.00 0.00 C ATOM 874 OG1 THR A 208 3.052 8.097 2.644 1.00 0.00 O ATOM 875 CG2 THR A 208 0.641 8.176 2.741 1.00 0.00 C ATOM 0 H THR A 208 0.321 6.403 0.475 1.00 0.00 H new ATOM 0 HA THR A 208 2.789 5.778 1.496 1.00 0.00 H new ATOM 0 HB THR A 208 1.833 8.062 0.974 1.00 0.00 H new ATOM 0 HG1 THR A 208 3.058 9.076 2.696 1.00 0.00 H new ATOM 0 HG21 THR A 208 0.678 9.264 2.792 1.00 0.00 H new ATOM 0 HG22 THR A 208 -0.266 7.868 2.222 1.00 0.00 H new ATOM 0 HG23 THR A 208 0.638 7.766 3.751 1.00 0.00 H new ATOM 883 N ASP A 209 0.386 5.258 3.637 1.00 0.00 N ATOM 884 CA ASP A 209 0.062 4.700 4.944 1.00 0.00 C ATOM 885 C ASP A 209 0.595 3.277 5.075 1.00 0.00 C ATOM 886 O ASP A 209 1.300 2.953 6.031 1.00 0.00 O ATOM 887 CB ASP A 209 -1.452 4.714 5.167 1.00 0.00 C ATOM 888 CG ASP A 209 -1.930 5.998 5.816 1.00 0.00 C ATOM 889 OD1 ASP A 209 -1.575 7.085 5.313 1.00 0.00 O ATOM 890 OD2 ASP A 209 -2.660 5.916 6.825 1.00 0.00 O ATOM 0 H ASP A 209 -0.420 5.401 3.028 1.00 0.00 H new ATOM 0 HA ASP A 209 0.539 5.318 5.704 1.00 0.00 H new ATOM 0 HB2 ASP A 209 -1.958 4.583 4.211 1.00 0.00 H new ATOM 0 HB3 ASP A 209 -1.732 3.867 5.794 1.00 0.00 H new ATOM 895 N ILE A 210 0.252 2.431 4.109 1.00 0.00 N ATOM 896 CA ILE A 210 0.697 1.043 4.116 1.00 0.00 C ATOM 897 C ILE A 210 2.216 0.952 4.217 1.00 0.00 C ATOM 898 O ILE A 210 2.750 0.183 5.017 1.00 0.00 O ATOM 899 CB ILE A 210 0.232 0.297 2.851 1.00 0.00 C ATOM 900 CG1 ILE A 210 -1.291 0.156 2.846 1.00 0.00 C ATOM 901 CG2 ILE A 210 0.896 -1.070 2.769 1.00 0.00 C ATOM 902 CD1 ILE A 210 -1.889 0.112 1.458 1.00 0.00 C ATOM 0 H ILE A 210 -0.333 2.683 3.312 1.00 0.00 H new ATOM 0 HA ILE A 210 0.249 0.573 4.991 1.00 0.00 H new ATOM 0 HB ILE A 210 0.527 0.876 1.976 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -1.565 -0.754 3.380 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -1.727 0.991 3.394 1.00 0.00 H new ATOM 0 HG21 ILE A 210 0.558 -1.585 1.870 1.00 0.00 H new ATOM 0 HG22 ILE A 210 1.978 -0.947 2.731 1.00 0.00 H new ATOM 0 HG23 ILE A 210 0.628 -1.658 3.647 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -2.972 0.011 1.531 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -1.645 1.033 0.928 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -1.481 -0.739 0.913 1.00 0.00 H new ATOM 914 N ILE A 211 2.906 1.744 3.403 1.00 0.00 N ATOM 915 CA ILE A 211 4.363 1.755 3.403 1.00 0.00 C ATOM 916 C ILE A 211 4.907 2.475 4.633 1.00 0.00 C ATOM 917 O ILE A 211 5.950 2.104 5.171 1.00 0.00 O ATOM 918 CB ILE A 211 4.921 2.432 2.137 1.00 0.00 C ATOM 919 CG1 ILE A 211 4.476 3.894 2.076 1.00 0.00 C ATOM 920 CG2 ILE A 211 4.469 1.682 0.893 1.00 0.00 C ATOM 921 CD1 ILE A 211 5.115 4.674 0.948 1.00 0.00 C ATOM 0 H ILE A 211 2.479 2.386 2.735 1.00 0.00 H new ATOM 0 HA ILE A 211 4.687 0.714 3.421 1.00 0.00 H new ATOM 0 HB ILE A 211 6.010 2.405 2.178 1.00 0.00 H new ATOM 0 HG12 ILE A 211 3.392 3.931 1.964 1.00 0.00 H new ATOM 0 HG13 ILE A 211 4.716 4.378 3.023 1.00 0.00 H new ATOM 0 HG21 ILE A 211 4.871 2.172 0.006 1.00 0.00 H new ATOM 0 HG22 ILE A 211 4.831 0.655 0.936 1.00 0.00 H new ATOM 0 HG23 ILE A 211 3.380 1.681 0.844 1.00 0.00 H new ATOM 0 HD11 ILE A 211 4.753 5.702 0.966 1.00 0.00 H new ATOM 0 HD12 ILE A 211 6.198 4.668 1.070 1.00 0.00 H new ATOM 0 HD13 ILE A 211 4.854 4.214 -0.005 1.00 0.00 H new ATOM 933 N SER A 212 4.192 3.505 5.073 1.00 0.00 N ATOM 934 CA SER A 212 4.604 4.279 6.238 1.00 0.00 C ATOM 935 C SER A 212 4.759 3.379 7.461 1.00 0.00 C ATOM 936 O SER A 212 5.642 3.590 8.293 1.00 0.00 O ATOM 937 CB SER A 212 3.586 5.383 6.530 1.00 0.00 C ATOM 938 OG SER A 212 3.909 6.572 5.830 1.00 0.00 O ATOM 0 H SER A 212 3.325 3.823 4.641 1.00 0.00 H new ATOM 0 HA SER A 212 5.570 4.734 6.018 1.00 0.00 H new ATOM 0 HB2 SER A 212 2.589 5.048 6.244 1.00 0.00 H new ATOM 0 HB3 SER A 212 3.559 5.584 7.601 1.00 0.00 H new ATOM 0 HG SER A 212 3.661 6.474 4.887 1.00 0.00 H new ATOM 944 N ASP A 213 3.895 2.375 7.561 1.00 0.00 N ATOM 945 CA ASP A 213 3.936 1.441 8.681 1.00 0.00 C ATOM 946 C ASP A 213 5.092 0.458 8.527 1.00 0.00 C ATOM 947 O ASP A 213 5.363 -0.342 9.421 1.00 0.00 O ATOM 948 CB ASP A 213 2.613 0.680 8.785 1.00 0.00 C ATOM 949 CG ASP A 213 2.329 0.204 10.196 1.00 0.00 C ATOM 950 OD1 ASP A 213 2.627 0.956 11.147 1.00 0.00 O ATOM 951 OD2 ASP A 213 1.811 -0.922 10.350 1.00 0.00 O ATOM 0 H ASP A 213 3.158 2.187 6.881 1.00 0.00 H new ATOM 0 HA ASP A 213 4.090 2.014 9.595 1.00 0.00 H new ATOM 0 HB2 ASP A 213 1.799 1.324 8.451 1.00 0.00 H new ATOM 0 HB3 ASP A 213 2.637 -0.178 8.113 1.00 0.00 H new ATOM 956 N GLY A 214 5.770 0.523 7.385 1.00 0.00 N ATOM 957 CA GLY A 214 6.888 -0.367 7.134 1.00 0.00 C ATOM 958 C GLY A 214 6.542 -1.470 6.154 1.00 0.00 C ATOM 959 O GLY A 214 5.404 -1.938 6.110 1.00 0.00 O ATOM 0 H GLY A 214 5.565 1.176 6.629 1.00 0.00 H new ATOM 0 HA2 GLY A 214 7.727 0.210 6.746 1.00 0.00 H new ATOM 0 HA3 GLY A 214 7.214 -0.810 8.075 1.00 0.00 H new ATOM 963 N VAL A 215 7.526 -1.887 5.363 1.00 0.00 N ATOM 964 CA VAL A 215 7.320 -2.942 4.378 1.00 0.00 C ATOM 965 C VAL A 215 8.453 -3.961 4.419 1.00 0.00 C ATOM 966 O VAL A 215 9.628 -3.616 4.545 1.00 0.00 O ATOM 967 CB VAL A 215 7.213 -2.366 2.953 1.00 0.00 C ATOM 968 CG1 VAL A 215 7.063 -3.486 1.934 1.00 0.00 C ATOM 969 CG2 VAL A 215 6.051 -1.389 2.859 1.00 0.00 C ATOM 0 H VAL A 215 8.474 -1.510 5.385 1.00 0.00 H new ATOM 0 HA VAL A 215 6.382 -3.435 4.634 1.00 0.00 H new ATOM 0 HB VAL A 215 8.132 -1.824 2.729 1.00 0.00 H new ATOM 0 HG11 VAL A 215 6.989 -3.060 0.933 1.00 0.00 H new ATOM 0 HG12 VAL A 215 7.931 -4.143 1.985 1.00 0.00 H new ATOM 0 HG13 VAL A 215 6.161 -4.058 2.152 1.00 0.00 H new ATOM 0 HG21 VAL A 215 5.990 -0.992 1.846 1.00 0.00 H new ATOM 0 HG22 VAL A 215 5.122 -1.904 3.103 1.00 0.00 H new ATOM 0 HG23 VAL A 215 6.207 -0.570 3.561 1.00 0.00 H new ATOM 979 N PRO A 216 8.094 -5.249 4.309 1.00 0.00 N ATOM 980 CA PRO A 216 9.066 -6.346 4.329 1.00 0.00 C ATOM 981 C PRO A 216 9.931 -6.378 3.074 1.00 0.00 C ATOM 982 O PRO A 216 9.423 -6.530 1.962 1.00 0.00 O ATOM 983 CB PRO A 216 8.188 -7.597 4.405 1.00 0.00 C ATOM 984 CG PRO A 216 6.889 -7.185 3.804 1.00 0.00 C ATOM 985 CD PRO A 216 6.712 -5.734 4.155 1.00 0.00 C ATOM 0 HA PRO A 216 9.770 -6.251 5.156 1.00 0.00 H new ATOM 0 HB2 PRO A 216 8.633 -8.427 3.856 1.00 0.00 H new ATOM 0 HB3 PRO A 216 8.060 -7.929 5.435 1.00 0.00 H new ATOM 0 HG2 PRO A 216 6.897 -7.327 2.723 1.00 0.00 H new ATOM 0 HG3 PRO A 216 6.069 -7.785 4.199 1.00 0.00 H new ATOM 0 HD2 PRO A 216 6.181 -5.193 3.372 1.00 0.00 H new ATOM 0 HD3 PRO A 216 6.138 -5.610 5.073 1.00 0.00 H new ATOM 993 N CYS A 217 11.239 -6.234 3.258 1.00 0.00 N ATOM 994 CA CYS A 217 12.175 -6.247 2.140 1.00 0.00 C ATOM 995 C CYS A 217 11.735 -7.245 1.074 1.00 0.00 C ATOM 996 O CYS A 217 11.795 -6.958 -0.122 1.00 0.00 O ATOM 997 CB CYS A 217 13.582 -6.591 2.629 1.00 0.00 C ATOM 998 SG CYS A 217 14.801 -6.768 1.305 1.00 0.00 S ATOM 0 H CYS A 217 11.675 -6.107 4.171 1.00 0.00 H new ATOM 0 HA CYS A 217 12.187 -5.251 1.697 1.00 0.00 H new ATOM 0 HB2 CYS A 217 13.917 -5.813 3.315 1.00 0.00 H new ATOM 0 HB3 CYS A 217 13.541 -7.520 3.197 1.00 0.00 H new ATOM 0 HG CYS A 217 15.960 -7.057 1.818 1.00 0.00 H new ATOM 1004 N SER A 218 11.294 -8.418 1.515 1.00 0.00 N ATOM 1005 CA SER A 218 10.849 -9.462 0.599 1.00 0.00 C ATOM 1006 C SER A 218 9.928 -8.887 -0.473 1.00 0.00 C ATOM 1007 O SER A 218 10.142 -9.094 -1.667 1.00 0.00 O ATOM 1008 CB SER A 218 10.128 -10.571 1.367 1.00 0.00 C ATOM 1009 OG SER A 218 9.988 -11.735 0.571 1.00 0.00 O ATOM 0 H SER A 218 11.235 -8.670 2.502 1.00 0.00 H new ATOM 0 HA SER A 218 11.728 -9.882 0.111 1.00 0.00 H new ATOM 0 HB2 SER A 218 10.684 -10.811 2.273 1.00 0.00 H new ATOM 0 HB3 SER A 218 9.145 -10.220 1.680 1.00 0.00 H new ATOM 0 HG SER A 218 9.526 -12.429 1.085 1.00 0.00 H new ATOM 1015 N GLN A 219 8.901 -8.164 -0.036 1.00 0.00 N ATOM 1016 CA GLN A 219 7.946 -7.560 -0.957 1.00 0.00 C ATOM 1017 C GLN A 219 8.519 -6.291 -1.580 1.00 0.00 C ATOM 1018 O GLN A 219 8.336 -5.193 -1.056 1.00 0.00 O ATOM 1019 CB GLN A 219 6.638 -7.240 -0.231 1.00 0.00 C ATOM 1020 CG GLN A 219 5.707 -8.434 -0.101 1.00 0.00 C ATOM 1021 CD GLN A 219 6.285 -9.534 0.768 1.00 0.00 C ATOM 1022 OE1 GLN A 219 6.542 -9.332 1.955 1.00 0.00 O ATOM 1023 NE2 GLN A 219 6.494 -10.705 0.179 1.00 0.00 N ATOM 0 H GLN A 219 8.710 -7.983 0.949 1.00 0.00 H new ATOM 0 HA GLN A 219 7.745 -8.276 -1.754 1.00 0.00 H new ATOM 0 HB2 GLN A 219 6.868 -6.859 0.764 1.00 0.00 H new ATOM 0 HB3 GLN A 219 6.121 -6.443 -0.766 1.00 0.00 H new ATOM 0 HG2 GLN A 219 4.757 -8.105 0.320 1.00 0.00 H new ATOM 0 HG3 GLN A 219 5.494 -8.834 -1.093 1.00 0.00 H new ATOM 0 HE21 GLN A 219 6.266 -10.827 -0.808 1.00 0.00 H new ATOM 0 HE22 GLN A 219 6.882 -11.482 0.713 1.00 0.00 H new ATOM 1032 N ASN A 220 9.213 -6.450 -2.703 1.00 0.00 N ATOM 1033 CA ASN A 220 9.814 -5.317 -3.397 1.00 0.00 C ATOM 1034 C ASN A 220 8.935 -4.076 -3.274 1.00 0.00 C ATOM 1035 O ASN A 220 7.970 -3.892 -4.016 1.00 0.00 O ATOM 1036 CB ASN A 220 10.034 -5.656 -4.873 1.00 0.00 C ATOM 1037 CG ASN A 220 11.006 -6.804 -5.064 1.00 0.00 C ATOM 1038 OD1 ASN A 220 12.219 -6.600 -5.133 1.00 0.00 O ATOM 1039 ND2 ASN A 220 10.477 -8.019 -5.151 1.00 0.00 N ATOM 0 H ASN A 220 9.373 -7.352 -3.151 1.00 0.00 H new ATOM 0 HA ASN A 220 10.777 -5.106 -2.932 1.00 0.00 H new ATOM 0 HB2 ASN A 220 9.078 -5.913 -5.330 1.00 0.00 H new ATOM 0 HB3 ASN A 220 10.410 -4.775 -5.393 1.00 0.00 H new ATOM 0 HD21 ASN A 220 11.081 -8.830 -5.280 1.00 0.00 H new ATOM 0 HD22 ASN A 220 9.466 -8.141 -5.088 1.00 0.00 H new ATOM 1046 N PRO A 221 9.276 -3.202 -2.316 1.00 0.00 N ATOM 1047 CA PRO A 221 8.533 -1.962 -2.073 1.00 0.00 C ATOM 1048 C PRO A 221 8.713 -0.949 -3.198 1.00 0.00 C ATOM 1049 O PRO A 221 7.739 -0.410 -3.726 1.00 0.00 O ATOM 1050 CB PRO A 221 9.141 -1.432 -0.773 1.00 0.00 C ATOM 1051 CG PRO A 221 10.514 -2.010 -0.734 1.00 0.00 C ATOM 1052 CD PRO A 221 10.415 -3.357 -1.395 1.00 0.00 C ATOM 0 HA PRO A 221 7.458 -2.135 -2.016 1.00 0.00 H new ATOM 0 HB2 PRO A 221 9.170 -0.342 -0.765 1.00 0.00 H new ATOM 0 HB3 PRO A 221 8.556 -1.742 0.093 1.00 0.00 H new ATOM 0 HG2 PRO A 221 11.222 -1.369 -1.259 1.00 0.00 H new ATOM 0 HG3 PRO A 221 10.869 -2.104 0.292 1.00 0.00 H new ATOM 0 HD2 PRO A 221 11.331 -3.611 -1.928 1.00 0.00 H new ATOM 0 HD3 PRO A 221 10.239 -4.150 -0.668 1.00 0.00 H new ATOM 1060 N THR A 222 9.966 -0.693 -3.563 1.00 0.00 N ATOM 1061 CA THR A 222 10.274 0.257 -4.624 1.00 0.00 C ATOM 1062 C THR A 222 9.450 -0.030 -5.875 1.00 0.00 C ATOM 1063 O THR A 222 8.831 0.870 -6.441 1.00 0.00 O ATOM 1064 CB THR A 222 11.770 0.225 -4.990 1.00 0.00 C ATOM 1065 OG1 THR A 222 12.079 -0.990 -5.683 1.00 0.00 O ATOM 1066 CG2 THR A 222 12.634 0.338 -3.744 1.00 0.00 C ATOM 0 H THR A 222 10.784 -1.131 -3.139 1.00 0.00 H new ATOM 0 HA THR A 222 10.022 1.247 -4.245 1.00 0.00 H new ATOM 0 HB THR A 222 11.981 1.076 -5.638 1.00 0.00 H new ATOM 0 HG1 THR A 222 13.031 -1.002 -5.914 1.00 0.00 H new ATOM 0 HG21 THR A 222 13.686 0.313 -4.027 1.00 0.00 H new ATOM 0 HG22 THR A 222 12.417 1.277 -3.235 1.00 0.00 H new ATOM 0 HG23 THR A 222 12.419 -0.495 -3.075 1.00 0.00 H new ATOM 1074 N GLU A 223 9.448 -1.290 -6.300 1.00 0.00 N ATOM 1075 CA GLU A 223 8.699 -1.694 -7.484 1.00 0.00 C ATOM 1076 C GLU A 223 7.285 -1.121 -7.456 1.00 0.00 C ATOM 1077 O GLU A 223 6.840 -0.491 -8.415 1.00 0.00 O ATOM 1078 CB GLU A 223 8.641 -3.220 -7.582 1.00 0.00 C ATOM 1079 CG GLU A 223 9.923 -3.845 -8.106 1.00 0.00 C ATOM 1080 CD GLU A 223 10.129 -3.599 -9.588 1.00 0.00 C ATOM 1081 OE1 GLU A 223 9.377 -4.181 -10.397 1.00 0.00 O ATOM 1082 OE2 GLU A 223 11.043 -2.823 -9.938 1.00 0.00 O ATOM 0 H GLU A 223 9.956 -2.047 -5.843 1.00 0.00 H new ATOM 0 HA GLU A 223 9.214 -1.300 -8.360 1.00 0.00 H new ATOM 0 HB2 GLU A 223 8.423 -3.631 -6.596 1.00 0.00 H new ATOM 0 HB3 GLU A 223 7.815 -3.503 -8.235 1.00 0.00 H new ATOM 0 HG2 GLU A 223 10.772 -3.442 -7.553 1.00 0.00 H new ATOM 0 HG3 GLU A 223 9.902 -4.919 -7.919 1.00 0.00 H new ATOM 1089 N ALA A 224 6.584 -1.346 -6.350 1.00 0.00 N ATOM 1090 CA ALA A 224 5.221 -0.851 -6.195 1.00 0.00 C ATOM 1091 C ALA A 224 5.171 0.668 -6.317 1.00 0.00 C ATOM 1092 O ALA A 224 4.222 1.224 -6.869 1.00 0.00 O ATOM 1093 CB ALA A 224 4.648 -1.294 -4.857 1.00 0.00 C ATOM 0 H ALA A 224 6.937 -1.868 -5.548 1.00 0.00 H new ATOM 0 HA ALA A 224 4.614 -1.273 -6.996 1.00 0.00 H new ATOM 0 HB1 ALA A 224 3.630 -0.918 -4.755 1.00 0.00 H new ATOM 0 HB2 ALA A 224 4.639 -2.383 -4.808 1.00 0.00 H new ATOM 0 HB3 ALA A 224 5.264 -0.899 -4.049 1.00 0.00 H new ATOM 1099 N ILE A 225 6.198 1.332 -5.799 1.00 0.00 N ATOM 1100 CA ILE A 225 6.271 2.787 -5.851 1.00 0.00 C ATOM 1101 C ILE A 225 6.460 3.277 -7.282 1.00 0.00 C ATOM 1102 O ILE A 225 5.771 4.193 -7.731 1.00 0.00 O ATOM 1103 CB ILE A 225 7.421 3.325 -4.979 1.00 0.00 C ATOM 1104 CG1 ILE A 225 7.145 3.043 -3.501 1.00 0.00 C ATOM 1105 CG2 ILE A 225 7.610 4.816 -5.213 1.00 0.00 C ATOM 1106 CD1 ILE A 225 8.320 3.347 -2.598 1.00 0.00 C ATOM 0 H ILE A 225 6.991 0.886 -5.338 1.00 0.00 H new ATOM 0 HA ILE A 225 5.325 3.164 -5.463 1.00 0.00 H new ATOM 0 HB ILE A 225 8.341 2.813 -5.261 1.00 0.00 H new ATOM 0 HG12 ILE A 225 6.288 3.635 -3.180 1.00 0.00 H new ATOM 0 HG13 ILE A 225 6.869 1.995 -3.385 1.00 0.00 H new ATOM 0 HG21 ILE A 225 8.426 5.182 -4.590 1.00 0.00 H new ATOM 0 HG22 ILE A 225 7.847 4.992 -6.262 1.00 0.00 H new ATOM 0 HG23 ILE A 225 6.692 5.344 -4.955 1.00 0.00 H new ATOM 0 HD11 ILE A 225 8.053 3.124 -1.565 1.00 0.00 H new ATOM 0 HD12 ILE A 225 9.173 2.735 -2.892 1.00 0.00 H new ATOM 0 HD13 ILE A 225 8.582 4.401 -2.685 1.00 0.00 H new ATOM 1118 N GLU A 226 7.398 2.660 -7.994 1.00 0.00 N ATOM 1119 CA GLU A 226 7.676 3.034 -9.376 1.00 0.00 C ATOM 1120 C GLU A 226 6.421 2.915 -10.235 1.00 0.00 C ATOM 1121 O GLU A 226 6.169 3.749 -11.104 1.00 0.00 O ATOM 1122 CB GLU A 226 8.787 2.153 -9.951 1.00 0.00 C ATOM 1123 CG GLU A 226 10.070 2.182 -9.137 1.00 0.00 C ATOM 1124 CD GLU A 226 11.270 1.689 -9.922 1.00 0.00 C ATOM 1125 OE1 GLU A 226 11.104 0.760 -10.740 1.00 0.00 O ATOM 1126 OE2 GLU A 226 12.376 2.233 -9.718 1.00 0.00 O ATOM 0 H GLU A 226 7.977 1.900 -7.637 1.00 0.00 H new ATOM 0 HA GLU A 226 8.004 4.073 -9.386 1.00 0.00 H new ATOM 0 HB2 GLU A 226 8.429 1.125 -10.013 1.00 0.00 H new ATOM 0 HB3 GLU A 226 9.005 2.476 -10.969 1.00 0.00 H new ATOM 0 HG2 GLU A 226 10.257 3.200 -8.796 1.00 0.00 H new ATOM 0 HG3 GLU A 226 9.945 1.566 -8.247 1.00 0.00 H new ATOM 1133 N ALA A 227 5.637 1.870 -9.986 1.00 0.00 N ATOM 1134 CA ALA A 227 4.408 1.642 -10.736 1.00 0.00 C ATOM 1135 C ALA A 227 3.331 2.648 -10.344 1.00 0.00 C ATOM 1136 O ALA A 227 2.950 3.505 -11.141 1.00 0.00 O ATOM 1137 CB ALA A 227 3.911 0.221 -10.514 1.00 0.00 C ATOM 0 H ALA A 227 5.831 1.169 -9.271 1.00 0.00 H new ATOM 0 HA ALA A 227 4.627 1.778 -11.795 1.00 0.00 H new ATOM 0 HB1 ALA A 227 2.993 0.064 -11.080 1.00 0.00 H new ATOM 0 HB2 ALA A 227 4.669 -0.486 -10.850 1.00 0.00 H new ATOM 0 HB3 ALA A 227 3.715 0.066 -9.453 1.00 0.00 H new ATOM 1143 N TRP A 228 2.845 2.537 -9.113 1.00 0.00 N ATOM 1144 CA TRP A 228 1.811 3.438 -8.616 1.00 0.00 C ATOM 1145 C TRP A 228 2.121 4.883 -8.992 1.00 0.00 C ATOM 1146 O TRP A 228 1.219 5.715 -9.089 1.00 0.00 O ATOM 1147 CB TRP A 228 1.680 3.310 -7.098 1.00 0.00 C ATOM 1148 CG TRP A 228 0.579 4.149 -6.523 1.00 0.00 C ATOM 1149 CD1 TRP A 228 -0.617 3.708 -6.035 1.00 0.00 C ATOM 1150 CD2 TRP A 228 0.573 5.573 -6.379 1.00 0.00 C ATOM 1151 NE1 TRP A 228 -1.367 4.773 -5.596 1.00 0.00 N ATOM 1152 CE2 TRP A 228 -0.659 5.928 -5.795 1.00 0.00 C ATOM 1153 CE3 TRP A 228 1.489 6.583 -6.685 1.00 0.00 C ATOM 1154 CZ2 TRP A 228 -0.996 7.249 -5.514 1.00 0.00 C ATOM 1155 CZ3 TRP A 228 1.153 7.894 -6.405 1.00 0.00 C ATOM 1156 CH2 TRP A 228 -0.080 8.218 -5.823 1.00 0.00 C ATOM 0 H TRP A 228 3.150 1.833 -8.441 1.00 0.00 H new ATOM 0 HA TRP A 228 0.866 3.156 -9.080 1.00 0.00 H new ATOM 0 HB2 TRP A 228 1.502 2.265 -6.843 1.00 0.00 H new ATOM 0 HB3 TRP A 228 2.624 3.595 -6.634 1.00 0.00 H new ATOM 0 HD1 TRP A 228 -0.928 2.674 -5.999 1.00 0.00 H new ATOM 0 HE1 TRP A 228 -2.300 4.713 -5.188 1.00 0.00 H new ATOM 0 HE3 TRP A 228 2.442 6.343 -7.132 1.00 0.00 H new ATOM 0 HZ2 TRP A 228 -1.947 7.501 -5.068 1.00 0.00 H new ATOM 0 HZ3 TRP A 228 1.853 8.683 -6.639 1.00 0.00 H new ATOM 0 HH2 TRP A 228 -0.312 9.252 -5.614 1.00 0.00 H new ATOM 1167 N ILE A 229 3.400 5.173 -9.203 1.00 0.00 N ATOM 1168 CA ILE A 229 3.827 6.518 -9.569 1.00 0.00 C ATOM 1169 C ILE A 229 3.821 6.703 -11.083 1.00 0.00 C ATOM 1170 O ILE A 229 3.165 7.602 -11.606 1.00 0.00 O ATOM 1171 CB ILE A 229 5.236 6.827 -9.031 1.00 0.00 C ATOM 1172 CG1 ILE A 229 5.168 7.203 -7.549 1.00 0.00 C ATOM 1173 CG2 ILE A 229 5.878 7.946 -9.838 1.00 0.00 C ATOM 1174 CD1 ILE A 229 4.743 8.635 -7.308 1.00 0.00 C ATOM 0 H ILE A 229 4.158 4.495 -9.127 1.00 0.00 H new ATOM 0 HA ILE A 229 3.115 7.209 -9.118 1.00 0.00 H new ATOM 0 HB ILE A 229 5.852 5.933 -9.132 1.00 0.00 H new ATOM 0 HG12 ILE A 229 4.469 6.535 -7.045 1.00 0.00 H new ATOM 0 HG13 ILE A 229 6.146 7.042 -7.096 1.00 0.00 H new ATOM 0 HG21 ILE A 229 6.874 8.153 -9.445 1.00 0.00 H new ATOM 0 HG22 ILE A 229 5.955 7.643 -10.882 1.00 0.00 H new ATOM 0 HG23 ILE A 229 5.265 8.845 -9.765 1.00 0.00 H new ATOM 0 HD11 ILE A 229 4.717 8.831 -6.236 1.00 0.00 H new ATOM 0 HD12 ILE A 229 5.454 9.311 -7.783 1.00 0.00 H new ATOM 0 HD13 ILE A 229 3.751 8.796 -7.731 1.00 0.00 H new ATOM 1186 N ASN A 230 4.556 5.844 -11.781 1.00 0.00 N ATOM 1187 CA ASN A 230 4.635 5.911 -13.236 1.00 0.00 C ATOM 1188 C ASN A 230 3.267 6.208 -13.842 1.00 0.00 C ATOM 1189 O ASN A 230 3.159 6.919 -14.841 1.00 0.00 O ATOM 1190 CB ASN A 230 5.181 4.598 -13.800 1.00 0.00 C ATOM 1191 CG ASN A 230 4.746 4.358 -15.232 1.00 0.00 C ATOM 1192 OD1 ASN A 230 5.286 4.954 -16.165 1.00 0.00 O ATOM 1193 ND2 ASN A 230 3.765 3.482 -15.414 1.00 0.00 N ATOM 0 H ASN A 230 5.106 5.093 -11.363 1.00 0.00 H new ATOM 0 HA ASN A 230 5.314 6.722 -13.501 1.00 0.00 H new ATOM 0 HB2 ASN A 230 6.270 4.610 -13.751 1.00 0.00 H new ATOM 0 HB3 ASN A 230 4.843 3.770 -13.177 1.00 0.00 H new ATOM 0 HD21 ASN A 230 3.430 3.280 -16.356 1.00 0.00 H new ATOM 0 HD22 ASN A 230 3.346 3.011 -14.612 1.00 0.00 H new ATOM 1200 N PHE A 231 2.223 5.657 -13.230 1.00 0.00 N ATOM 1201 CA PHE A 231 0.861 5.862 -13.709 1.00 0.00 C ATOM 1202 C PHE A 231 0.654 7.305 -14.160 1.00 0.00 C ATOM 1203 O PHE A 231 0.358 7.566 -15.325 1.00 0.00 O ATOM 1204 CB PHE A 231 -0.146 5.509 -12.613 1.00 0.00 C ATOM 1205 CG PHE A 231 -1.501 5.135 -13.141 1.00 0.00 C ATOM 1206 CD1 PHE A 231 -1.797 3.819 -13.459 1.00 0.00 C ATOM 1207 CD2 PHE A 231 -2.480 6.099 -13.321 1.00 0.00 C ATOM 1208 CE1 PHE A 231 -3.043 3.473 -13.946 1.00 0.00 C ATOM 1209 CE2 PHE A 231 -3.728 5.759 -13.807 1.00 0.00 C ATOM 1210 CZ PHE A 231 -4.010 4.444 -14.119 1.00 0.00 C ATOM 0 H PHE A 231 2.295 5.066 -12.402 1.00 0.00 H new ATOM 0 HA PHE A 231 0.701 5.206 -14.565 1.00 0.00 H new ATOM 0 HB2 PHE A 231 0.247 4.681 -12.023 1.00 0.00 H new ATOM 0 HB3 PHE A 231 -0.250 6.359 -11.939 1.00 0.00 H new ATOM 0 HD1 PHE A 231 -1.045 3.055 -13.325 1.00 0.00 H new ATOM 0 HD2 PHE A 231 -2.265 7.129 -13.078 1.00 0.00 H new ATOM 0 HE1 PHE A 231 -3.261 2.444 -14.191 1.00 0.00 H new ATOM 0 HE2 PHE A 231 -4.482 6.521 -13.943 1.00 0.00 H new ATOM 0 HZ PHE A 231 -4.985 4.175 -14.498 1.00 0.00 H new ATOM 1220 N ASN A 232 0.812 8.238 -13.227 1.00 0.00 N ATOM 1221 CA ASN A 232 0.641 9.655 -13.527 1.00 0.00 C ATOM 1222 C ASN A 232 1.897 10.443 -13.166 1.00 0.00 C ATOM 1223 O ASN A 232 1.817 11.557 -12.647 1.00 0.00 O ATOM 1224 CB ASN A 232 -0.563 10.217 -12.769 1.00 0.00 C ATOM 1225 CG ASN A 232 -1.204 11.388 -13.488 1.00 0.00 C ATOM 1226 OD1 ASN A 232 -2.243 11.242 -14.131 1.00 0.00 O ATOM 1227 ND2 ASN A 232 -0.586 12.558 -13.382 1.00 0.00 N ATOM 0 H ASN A 232 1.058 8.039 -12.257 1.00 0.00 H new ATOM 0 HA ASN A 232 0.466 9.755 -14.598 1.00 0.00 H new ATOM 0 HB2 ASN A 232 -1.303 9.429 -12.633 1.00 0.00 H new ATOM 0 HB3 ASN A 232 -0.248 10.533 -11.775 1.00 0.00 H new ATOM 0 HD21 ASN A 232 -0.971 13.382 -13.844 1.00 0.00 H new ATOM 0 HD22 ASN A 232 0.274 12.633 -12.838 1.00 0.00 H new ATOM 1234 N LYS A 233 3.057 9.857 -13.443 1.00 0.00 N ATOM 1235 CA LYS A 233 4.330 10.503 -13.150 1.00 0.00 C ATOM 1236 C LYS A 233 4.251 12.004 -13.407 1.00 0.00 C ATOM 1237 O LYS A 233 4.952 12.789 -12.770 1.00 0.00 O ATOM 1238 CB LYS A 233 5.445 9.887 -13.999 1.00 0.00 C ATOM 1239 CG LYS A 233 6.841 10.289 -13.555 1.00 0.00 C ATOM 1240 CD LYS A 233 7.392 9.330 -12.513 1.00 0.00 C ATOM 1241 CE LYS A 233 8.637 9.891 -11.842 1.00 0.00 C ATOM 1242 NZ LYS A 233 9.800 9.926 -12.772 1.00 0.00 N ATOM 0 H LYS A 233 3.141 8.935 -13.871 1.00 0.00 H new ATOM 0 HA LYS A 233 4.555 10.345 -12.095 1.00 0.00 H new ATOM 0 HB2 LYS A 233 5.360 8.801 -13.962 1.00 0.00 H new ATOM 0 HB3 LYS A 233 5.304 10.183 -15.039 1.00 0.00 H new ATOM 0 HG2 LYS A 233 7.506 10.311 -14.418 1.00 0.00 H new ATOM 0 HG3 LYS A 233 6.817 11.299 -13.145 1.00 0.00 H new ATOM 0 HD2 LYS A 233 6.629 9.132 -11.760 1.00 0.00 H new ATOM 0 HD3 LYS A 233 7.630 8.376 -12.984 1.00 0.00 H new ATOM 0 HE2 LYS A 233 8.432 10.898 -11.479 1.00 0.00 H new ATOM 0 HE3 LYS A 233 8.886 9.283 -10.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 233 10.628 10.314 -12.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 233 10.012 8.962 -13.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 233 9.572 10.526 -13.590 1.00 0.00 H new ATOM 1256 N GLU A 234 3.392 12.395 -14.343 1.00 0.00 N ATOM 1257 CA GLU A 234 3.222 13.803 -14.683 1.00 0.00 C ATOM 1258 C GLU A 234 3.392 14.685 -13.449 1.00 0.00 C ATOM 1259 O GLU A 234 4.361 15.435 -13.339 1.00 0.00 O ATOM 1260 CB GLU A 234 1.843 14.038 -15.304 1.00 0.00 C ATOM 1261 CG GLU A 234 1.515 13.080 -16.437 1.00 0.00 C ATOM 1262 CD GLU A 234 2.560 13.096 -17.535 1.00 0.00 C ATOM 1263 OE1 GLU A 234 3.701 12.659 -17.276 1.00 0.00 O ATOM 1264 OE2 GLU A 234 2.237 13.545 -18.655 1.00 0.00 O ATOM 0 H GLU A 234 2.803 11.757 -14.879 1.00 0.00 H new ATOM 0 HA GLU A 234 3.990 14.070 -15.409 1.00 0.00 H new ATOM 0 HB2 GLU A 234 1.083 13.943 -14.528 1.00 0.00 H new ATOM 0 HB3 GLU A 234 1.791 15.061 -15.678 1.00 0.00 H new ATOM 0 HG2 GLU A 234 1.427 12.069 -16.039 1.00 0.00 H new ATOM 0 HG3 GLU A 234 0.545 13.342 -16.860 1.00 0.00 H new ATOM 1271 N GLU A 235 2.443 14.587 -12.523 1.00 0.00 N ATOM 1272 CA GLU A 235 2.488 15.377 -11.298 1.00 0.00 C ATOM 1273 C GLU A 235 2.749 14.487 -10.086 1.00 0.00 C ATOM 1274 O GLU A 235 3.060 14.975 -9.000 1.00 0.00 O ATOM 1275 CB GLU A 235 1.176 16.141 -11.109 1.00 0.00 C ATOM 1276 CG GLU A 235 1.314 17.382 -10.243 1.00 0.00 C ATOM 1277 CD GLU A 235 0.094 18.281 -10.313 1.00 0.00 C ATOM 1278 OE1 GLU A 235 -0.895 17.994 -9.606 1.00 0.00 O ATOM 1279 OE2 GLU A 235 0.129 19.270 -11.075 1.00 0.00 O ATOM 0 H GLU A 235 1.635 13.969 -12.598 1.00 0.00 H new ATOM 0 HA GLU A 235 3.307 16.091 -11.387 1.00 0.00 H new ATOM 0 HB2 GLU A 235 0.790 16.431 -12.086 1.00 0.00 H new ATOM 0 HB3 GLU A 235 0.439 15.475 -10.660 1.00 0.00 H new ATOM 0 HG2 GLU A 235 1.481 17.082 -9.208 1.00 0.00 H new ATOM 0 HG3 GLU A 235 2.193 17.944 -10.557 1.00 0.00 H new ATOM 1286 N ARG A 236 2.621 13.179 -10.282 1.00 0.00 N ATOM 1287 CA ARG A 236 2.841 12.220 -9.206 1.00 0.00 C ATOM 1288 C ARG A 236 4.323 12.129 -8.854 1.00 0.00 C ATOM 1289 O ARG A 236 4.703 11.446 -7.903 1.00 0.00 O ATOM 1290 CB ARG A 236 2.315 10.841 -9.607 1.00 0.00 C ATOM 1291 CG ARG A 236 0.861 10.609 -9.228 1.00 0.00 C ATOM 1292 CD ARG A 236 0.436 9.175 -9.504 1.00 0.00 C ATOM 1293 NE ARG A 236 -0.991 9.076 -9.801 1.00 0.00 N ATOM 1294 CZ ARG A 236 -1.946 9.325 -8.913 1.00 0.00 C ATOM 1295 NH1 ARG A 236 -1.629 9.687 -7.677 1.00 0.00 N ATOM 1296 NH2 ARG A 236 -3.222 9.212 -9.259 1.00 0.00 N ATOM 0 H ARG A 236 2.366 12.759 -11.176 1.00 0.00 H new ATOM 0 HA ARG A 236 2.297 12.567 -8.327 1.00 0.00 H new ATOM 0 HB2 ARG A 236 2.425 10.719 -10.685 1.00 0.00 H new ATOM 0 HB3 ARG A 236 2.931 10.075 -9.135 1.00 0.00 H new ATOM 0 HG2 ARG A 236 0.719 10.835 -8.171 1.00 0.00 H new ATOM 0 HG3 ARG A 236 0.224 11.293 -9.789 1.00 0.00 H new ATOM 0 HD2 ARG A 236 1.009 8.782 -10.343 1.00 0.00 H new ATOM 0 HD3 ARG A 236 0.671 8.554 -8.639 1.00 0.00 H new ATOM 0 HE ARG A 236 -1.269 8.800 -10.743 1.00 0.00 H new ATOM 0 HH11 ARG A 236 -0.649 9.775 -7.407 1.00 0.00 H new ATOM 0 HH12 ARG A 236 -2.365 9.878 -6.997 1.00 0.00 H new ATOM 0 HH21 ARG A 236 -3.470 8.933 -10.208 1.00 0.00 H new ATOM 0 HH22 ARG A 236 -3.955 9.404 -8.576 1.00 0.00 H new ATOM 1310 N GLU A 237 5.153 12.821 -9.627 1.00 0.00 N ATOM 1311 CA GLU A 237 6.593 12.816 -9.397 1.00 0.00 C ATOM 1312 C GLU A 237 6.917 13.231 -7.965 1.00 0.00 C ATOM 1313 O GLU A 237 7.615 12.520 -7.244 1.00 0.00 O ATOM 1314 CB GLU A 237 7.293 13.755 -10.383 1.00 0.00 C ATOM 1315 CG GLU A 237 8.621 14.290 -9.875 1.00 0.00 C ATOM 1316 CD GLU A 237 9.601 14.578 -10.996 1.00 0.00 C ATOM 1317 OE1 GLU A 237 9.508 15.666 -11.601 1.00 0.00 O ATOM 1318 OE2 GLU A 237 10.461 13.713 -11.267 1.00 0.00 O ATOM 0 H GLU A 237 4.854 13.392 -10.417 1.00 0.00 H new ATOM 0 HA GLU A 237 6.956 11.800 -9.553 1.00 0.00 H new ATOM 0 HB2 GLU A 237 7.459 13.225 -11.321 1.00 0.00 H new ATOM 0 HB3 GLU A 237 6.633 14.594 -10.604 1.00 0.00 H new ATOM 0 HG2 GLU A 237 8.447 15.203 -9.306 1.00 0.00 H new ATOM 0 HG3 GLU A 237 9.062 13.566 -9.189 1.00 0.00 H new ATOM 1325 N ALA A 238 6.404 14.389 -7.561 1.00 0.00 N ATOM 1326 CA ALA A 238 6.637 14.899 -6.215 1.00 0.00 C ATOM 1327 C ALA A 238 6.378 13.822 -5.168 1.00 0.00 C ATOM 1328 O ALA A 238 7.172 13.637 -4.244 1.00 0.00 O ATOM 1329 CB ALA A 238 5.760 16.114 -5.953 1.00 0.00 C ATOM 0 H ALA A 238 5.825 14.991 -8.146 1.00 0.00 H new ATOM 0 HA ALA A 238 7.683 15.196 -6.141 1.00 0.00 H new ATOM 0 HB1 ALA A 238 5.944 16.485 -4.945 1.00 0.00 H new ATOM 0 HB2 ALA A 238 5.996 16.895 -6.676 1.00 0.00 H new ATOM 0 HB3 ALA A 238 4.711 15.834 -6.051 1.00 0.00 H new ATOM 1335 N PHE A 239 5.264 13.113 -5.316 1.00 0.00 N ATOM 1336 CA PHE A 239 4.900 12.055 -4.381 1.00 0.00 C ATOM 1337 C PHE A 239 5.895 10.900 -4.454 1.00 0.00 C ATOM 1338 O PHE A 239 6.086 10.169 -3.482 1.00 0.00 O ATOM 1339 CB PHE A 239 3.488 11.547 -4.678 1.00 0.00 C ATOM 1340 CG PHE A 239 2.434 12.612 -4.577 1.00 0.00 C ATOM 1341 CD1 PHE A 239 2.207 13.483 -5.630 1.00 0.00 C ATOM 1342 CD2 PHE A 239 1.670 12.743 -3.428 1.00 0.00 C ATOM 1343 CE1 PHE A 239 1.237 14.464 -5.541 1.00 0.00 C ATOM 1344 CE2 PHE A 239 0.699 13.721 -3.333 1.00 0.00 C ATOM 1345 CZ PHE A 239 0.483 14.584 -4.390 1.00 0.00 C ATOM 0 H PHE A 239 4.597 13.252 -6.075 1.00 0.00 H new ATOM 0 HA PHE A 239 4.925 12.470 -3.373 1.00 0.00 H new ATOM 0 HB2 PHE A 239 3.467 11.121 -5.681 1.00 0.00 H new ATOM 0 HB3 PHE A 239 3.247 10.742 -3.984 1.00 0.00 H new ATOM 0 HD1 PHE A 239 2.795 13.395 -6.532 1.00 0.00 H new ATOM 0 HD2 PHE A 239 1.836 12.073 -2.597 1.00 0.00 H new ATOM 0 HE1 PHE A 239 1.069 15.135 -6.370 1.00 0.00 H new ATOM 0 HE2 PHE A 239 0.109 13.811 -2.433 1.00 0.00 H new ATOM 0 HZ PHE A 239 -0.274 15.351 -4.316 1.00 0.00 H new ATOM 1355 N ALA A 240 6.524 10.741 -5.613 1.00 0.00 N ATOM 1356 CA ALA A 240 7.500 9.677 -5.814 1.00 0.00 C ATOM 1357 C ALA A 240 8.735 9.894 -4.947 1.00 0.00 C ATOM 1358 O ALA A 240 9.116 9.024 -4.164 1.00 0.00 O ATOM 1359 CB ALA A 240 7.891 9.589 -7.281 1.00 0.00 C ATOM 0 H ALA A 240 6.375 11.336 -6.428 1.00 0.00 H new ATOM 0 HA ALA A 240 7.040 8.735 -5.516 1.00 0.00 H new ATOM 0 HB1 ALA A 240 8.620 8.790 -7.416 1.00 0.00 H new ATOM 0 HB2 ALA A 240 7.006 9.378 -7.881 1.00 0.00 H new ATOM 0 HB3 ALA A 240 8.327 10.536 -7.599 1.00 0.00 H new ATOM 1365 N GLU A 241 9.357 11.060 -5.093 1.00 0.00 N ATOM 1366 CA GLU A 241 10.551 11.389 -4.323 1.00 0.00 C ATOM 1367 C GLU A 241 10.255 11.373 -2.826 1.00 0.00 C ATOM 1368 O GLU A 241 11.059 10.888 -2.029 1.00 0.00 O ATOM 1369 CB GLU A 241 11.086 12.763 -4.733 1.00 0.00 C ATOM 1370 CG GLU A 241 10.104 13.896 -4.491 1.00 0.00 C ATOM 1371 CD GLU A 241 10.663 15.248 -4.888 1.00 0.00 C ATOM 1372 OE1 GLU A 241 10.978 15.434 -6.082 1.00 0.00 O ATOM 1373 OE2 GLU A 241 10.786 16.121 -4.003 1.00 0.00 O ATOM 0 H GLU A 241 9.054 11.791 -5.736 1.00 0.00 H new ATOM 0 HA GLU A 241 11.308 10.634 -4.534 1.00 0.00 H new ATOM 0 HB2 GLU A 241 12.004 12.965 -4.181 1.00 0.00 H new ATOM 0 HB3 GLU A 241 11.348 12.741 -5.791 1.00 0.00 H new ATOM 0 HG2 GLU A 241 9.190 13.706 -5.053 1.00 0.00 H new ATOM 0 HG3 GLU A 241 9.831 13.916 -3.436 1.00 0.00 H new ATOM 1380 N SER A 242 9.097 11.906 -2.452 1.00 0.00 N ATOM 1381 CA SER A 242 8.696 11.957 -1.051 1.00 0.00 C ATOM 1382 C SER A 242 8.384 10.560 -0.524 1.00 0.00 C ATOM 1383 O SER A 242 8.826 10.180 0.562 1.00 0.00 O ATOM 1384 CB SER A 242 7.475 12.863 -0.881 1.00 0.00 C ATOM 1385 OG SER A 242 7.276 13.201 0.481 1.00 0.00 O ATOM 0 H SER A 242 8.420 12.309 -3.099 1.00 0.00 H new ATOM 0 HA SER A 242 9.526 12.366 -0.476 1.00 0.00 H new ATOM 0 HB2 SER A 242 7.608 13.771 -1.469 1.00 0.00 H new ATOM 0 HB3 SER A 242 6.588 12.360 -1.267 1.00 0.00 H new ATOM 0 HG SER A 242 6.491 13.782 0.563 1.00 0.00 H new ATOM 1391 N LEU A 243 7.621 9.798 -1.299 1.00 0.00 N ATOM 1392 CA LEU A 243 7.249 8.442 -0.912 1.00 0.00 C ATOM 1393 C LEU A 243 8.487 7.571 -0.723 1.00 0.00 C ATOM 1394 O LEU A 243 8.604 6.848 0.266 1.00 0.00 O ATOM 1395 CB LEU A 243 6.332 7.822 -1.968 1.00 0.00 C ATOM 1396 CG LEU A 243 4.853 8.203 -1.880 1.00 0.00 C ATOM 1397 CD1 LEU A 243 4.069 7.562 -3.014 1.00 0.00 C ATOM 1398 CD2 LEU A 243 4.277 7.793 -0.532 1.00 0.00 C ATOM 0 H LEU A 243 7.247 10.096 -2.200 1.00 0.00 H new ATOM 0 HA LEU A 243 6.716 8.495 0.037 1.00 0.00 H new ATOM 0 HB2 LEU A 243 6.702 8.106 -2.953 1.00 0.00 H new ATOM 0 HB3 LEU A 243 6.412 6.737 -1.898 1.00 0.00 H new ATOM 0 HG LEU A 243 4.769 9.286 -1.975 1.00 0.00 H new ATOM 0 HD11 LEU A 243 3.019 7.844 -2.935 1.00 0.00 H new ATOM 0 HD12 LEU A 243 4.466 7.904 -3.970 1.00 0.00 H new ATOM 0 HD13 LEU A 243 4.159 6.478 -2.951 1.00 0.00 H new ATOM 0 HD21 LEU A 243 3.224 8.071 -0.486 1.00 0.00 H new ATOM 0 HD22 LEU A 243 4.373 6.714 -0.408 1.00 0.00 H new ATOM 0 HD23 LEU A 243 4.821 8.299 0.265 1.00 0.00 H new ATOM 1410 N ARG A 244 9.409 7.647 -1.677 1.00 0.00 N ATOM 1411 CA ARG A 244 10.639 6.867 -1.615 1.00 0.00 C ATOM 1412 C ARG A 244 11.435 7.205 -0.358 1.00 0.00 C ATOM 1413 O ARG A 244 11.920 6.315 0.341 1.00 0.00 O ATOM 1414 CB ARG A 244 11.494 7.123 -2.858 1.00 0.00 C ATOM 1415 CG ARG A 244 11.029 6.357 -4.085 1.00 0.00 C ATOM 1416 CD ARG A 244 12.004 6.513 -5.242 1.00 0.00 C ATOM 1417 NE ARG A 244 13.216 5.721 -5.047 1.00 0.00 N ATOM 1418 CZ ARG A 244 14.128 5.528 -5.993 1.00 0.00 C ATOM 1419 NH1 ARG A 244 13.966 6.066 -7.194 1.00 0.00 N ATOM 1420 NH2 ARG A 244 15.204 4.795 -5.739 1.00 0.00 N ATOM 0 H ARG A 244 9.327 8.241 -2.502 1.00 0.00 H new ATOM 0 HA ARG A 244 10.369 5.812 -1.580 1.00 0.00 H new ATOM 0 HB2 ARG A 244 11.485 8.190 -3.081 1.00 0.00 H new ATOM 0 HB3 ARG A 244 12.527 6.851 -2.640 1.00 0.00 H new ATOM 0 HG2 ARG A 244 10.923 5.301 -3.837 1.00 0.00 H new ATOM 0 HG3 ARG A 244 10.044 6.714 -4.387 1.00 0.00 H new ATOM 0 HD2 ARG A 244 11.518 6.209 -6.169 1.00 0.00 H new ATOM 0 HD3 ARG A 244 12.271 7.564 -5.352 1.00 0.00 H new ATOM 0 HE ARG A 244 13.370 5.293 -4.134 1.00 0.00 H new ATOM 0 HH11 ARG A 244 13.139 6.630 -7.393 1.00 0.00 H new ATOM 0 HH12 ARG A 244 14.668 5.916 -7.919 1.00 0.00 H new ATOM 0 HH21 ARG A 244 15.332 4.379 -4.816 1.00 0.00 H new ATOM 0 HH22 ARG A 244 15.904 4.647 -6.466 1.00 0.00 H new ATOM 1434 N THR A 245 11.565 8.498 -0.076 1.00 0.00 N ATOM 1435 CA THR A 245 12.303 8.954 1.094 1.00 0.00 C ATOM 1436 C THR A 245 11.668 8.437 2.380 1.00 0.00 C ATOM 1437 O THR A 245 12.367 8.082 3.329 1.00 0.00 O ATOM 1438 CB THR A 245 12.372 10.492 1.151 1.00 0.00 C ATOM 1439 OG1 THR A 245 13.072 10.994 0.007 1.00 0.00 O ATOM 1440 CG2 THR A 245 13.067 10.956 2.422 1.00 0.00 C ATOM 0 H THR A 245 11.168 9.247 -0.643 1.00 0.00 H new ATOM 0 HA THR A 245 13.314 8.556 1.005 1.00 0.00 H new ATOM 0 HB THR A 245 11.353 10.880 1.151 1.00 0.00 H new ATOM 0 HG1 THR A 245 12.471 11.002 -0.767 1.00 0.00 H new ATOM 0 HG21 THR A 245 13.104 12.045 2.440 1.00 0.00 H new ATOM 0 HG22 THR A 245 12.515 10.597 3.290 1.00 0.00 H new ATOM 0 HG23 THR A 245 14.082 10.558 2.448 1.00 0.00 H new ATOM 1448 N SER A 246 10.340 8.397 2.405 1.00 0.00 N ATOM 1449 CA SER A 246 9.611 7.926 3.576 1.00 0.00 C ATOM 1450 C SER A 246 9.612 6.402 3.640 1.00 0.00 C ATOM 1451 O SER A 246 9.440 5.813 4.708 1.00 0.00 O ATOM 1452 CB SER A 246 8.172 8.446 3.551 1.00 0.00 C ATOM 1453 OG SER A 246 7.495 8.133 4.756 1.00 0.00 O ATOM 0 H SER A 246 9.747 8.685 1.627 1.00 0.00 H new ATOM 0 HA SER A 246 10.113 8.310 4.464 1.00 0.00 H new ATOM 0 HB2 SER A 246 8.175 9.526 3.402 1.00 0.00 H new ATOM 0 HB3 SER A 246 7.639 8.009 2.707 1.00 0.00 H new ATOM 0 HG SER A 246 6.578 8.477 4.715 1.00 0.00 H new ATOM 1459 N LEU A 247 9.806 5.768 2.489 1.00 0.00 N ATOM 1460 CA LEU A 247 9.829 4.312 2.412 1.00 0.00 C ATOM 1461 C LEU A 247 10.550 3.714 3.616 1.00 0.00 C ATOM 1462 O LEU A 247 11.634 4.162 3.989 1.00 0.00 O ATOM 1463 CB LEU A 247 10.512 3.861 1.119 1.00 0.00 C ATOM 1464 CG LEU A 247 10.414 2.370 0.793 1.00 0.00 C ATOM 1465 CD1 LEU A 247 10.732 2.122 -0.674 1.00 0.00 C ATOM 1466 CD2 LEU A 247 11.346 1.566 1.686 1.00 0.00 C ATOM 0 H LEU A 247 9.950 6.240 1.596 1.00 0.00 H new ATOM 0 HA LEU A 247 8.799 3.956 2.415 1.00 0.00 H new ATOM 0 HB2 LEU A 247 10.082 4.423 0.290 1.00 0.00 H new ATOM 0 HB3 LEU A 247 11.566 4.132 1.175 1.00 0.00 H new ATOM 0 HG LEU A 247 9.391 2.043 0.982 1.00 0.00 H new ATOM 0 HD11 LEU A 247 10.657 1.056 -0.887 1.00 0.00 H new ATOM 0 HD12 LEU A 247 10.023 2.667 -1.297 1.00 0.00 H new ATOM 0 HD13 LEU A 247 11.744 2.465 -0.890 1.00 0.00 H new ATOM 0 HD21 LEU A 247 11.263 0.507 1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 247 12.373 1.895 1.530 1.00 0.00 H new ATOM 0 HD23 LEU A 247 11.071 1.718 2.730 1.00 0.00 H new ATOM 1478 N LYS A 248 9.941 2.699 4.219 1.00 0.00 N ATOM 1479 CA LYS A 248 10.525 2.036 5.379 1.00 0.00 C ATOM 1480 C LYS A 248 10.705 0.544 5.120 1.00 0.00 C ATOM 1481 O LYS A 248 9.846 -0.098 4.518 1.00 0.00 O ATOM 1482 CB LYS A 248 9.643 2.248 6.611 1.00 0.00 C ATOM 1483 CG LYS A 248 9.890 3.570 7.317 1.00 0.00 C ATOM 1484 CD LYS A 248 10.988 3.448 8.360 1.00 0.00 C ATOM 1485 CE LYS A 248 10.433 2.996 9.703 1.00 0.00 C ATOM 1486 NZ LYS A 248 10.345 1.513 9.795 1.00 0.00 N ATOM 0 H LYS A 248 9.043 2.317 3.923 1.00 0.00 H new ATOM 0 HA LYS A 248 11.506 2.476 5.562 1.00 0.00 H new ATOM 0 HB2 LYS A 248 8.596 2.196 6.311 1.00 0.00 H new ATOM 0 HB3 LYS A 248 9.814 1.433 7.314 1.00 0.00 H new ATOM 0 HG2 LYS A 248 10.165 4.329 6.585 1.00 0.00 H new ATOM 0 HG3 LYS A 248 8.969 3.906 7.794 1.00 0.00 H new ATOM 0 HD2 LYS A 248 11.739 2.737 8.017 1.00 0.00 H new ATOM 0 HD3 LYS A 248 11.489 4.409 8.477 1.00 0.00 H new ATOM 0 HE2 LYS A 248 11.069 3.373 10.504 1.00 0.00 H new ATOM 0 HE3 LYS A 248 9.444 3.429 9.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 248 10.398 1.223 10.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 248 9.443 1.193 9.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 248 11.133 1.085 9.268 1.00 0.00 H new ATOM 1500 N GLU A 249 11.827 -0.001 5.580 1.00 0.00 N ATOM 1501 CA GLU A 249 12.118 -1.419 5.398 1.00 0.00 C ATOM 1502 C GLU A 249 12.177 -2.139 6.741 1.00 0.00 C ATOM 1503 O GLU A 249 12.707 -1.610 7.719 1.00 0.00 O ATOM 1504 CB GLU A 249 13.442 -1.599 4.652 1.00 0.00 C ATOM 1505 CG GLU A 249 13.349 -1.296 3.165 1.00 0.00 C ATOM 1506 CD GLU A 249 14.702 -1.020 2.540 1.00 0.00 C ATOM 1507 OE1 GLU A 249 15.266 0.064 2.798 1.00 0.00 O ATOM 1508 OE2 GLU A 249 15.198 -1.890 1.793 1.00 0.00 O ATOM 0 H GLU A 249 12.549 0.517 6.081 1.00 0.00 H new ATOM 0 HA GLU A 249 11.313 -1.856 4.806 1.00 0.00 H new ATOM 0 HB2 GLU A 249 14.193 -0.949 5.100 1.00 0.00 H new ATOM 0 HB3 GLU A 249 13.788 -2.624 4.784 1.00 0.00 H new ATOM 0 HG2 GLU A 249 12.883 -2.139 2.655 1.00 0.00 H new ATOM 0 HG3 GLU A 249 12.700 -0.433 3.014 1.00 0.00 H new ATOM 1515 N ILE A 250 11.629 -3.349 6.782 1.00 0.00 N ATOM 1516 CA ILE A 250 11.619 -4.142 8.005 1.00 0.00 C ATOM 1517 C ILE A 250 12.225 -5.522 7.770 1.00 0.00 C ATOM 1518 O ILE A 250 12.718 -6.161 8.698 1.00 0.00 O ATOM 1519 CB ILE A 250 10.191 -4.308 8.557 1.00 0.00 C ATOM 1520 CG1 ILE A 250 9.263 -4.861 7.474 1.00 0.00 C ATOM 1521 CG2 ILE A 250 9.669 -2.979 9.082 1.00 0.00 C ATOM 1522 CD1 ILE A 250 7.838 -5.059 7.943 1.00 0.00 C ATOM 0 H ILE A 250 11.186 -3.801 5.982 1.00 0.00 H new ATOM 0 HA ILE A 250 12.221 -3.603 8.736 1.00 0.00 H new ATOM 0 HB ILE A 250 10.217 -5.018 9.383 1.00 0.00 H new ATOM 0 HG12 ILE A 250 9.266 -4.181 6.622 1.00 0.00 H new ATOM 0 HG13 ILE A 250 9.657 -5.814 7.121 1.00 0.00 H new ATOM 0 HG21 ILE A 250 8.659 -3.112 9.469 1.00 0.00 H new ATOM 0 HG22 ILE A 250 10.319 -2.623 9.881 1.00 0.00 H new ATOM 0 HG23 ILE A 250 9.654 -2.249 8.273 1.00 0.00 H new ATOM 0 HD11 ILE A 250 7.237 -5.453 7.124 1.00 0.00 H new ATOM 0 HD12 ILE A 250 7.823 -5.763 8.775 1.00 0.00 H new ATOM 0 HD13 ILE A 250 7.426 -4.104 8.268 1.00 0.00 H new