USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 969 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 59 ASN : amide:sc= 0.947 K(o=-0.099,f=-4.3!) USER MOD Set 1.2: B 66 GLN : amide:sc= -1.05 K(o=-0.099,f=-1.3) USER MOD Set 2.1: B 47 THR OG1 : rot -75:sc= 1.18 USER MOD Set 2.2: B 48 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 39 ASN : amide:sc= -0.63 K(o=0.65,f=-0.25) USER MOD Set 3.2: B 43 ASN : amide:sc= 1.27 K(o=0.65,f=-0.67) USER MOD Set 4.1: A 66 GLN : amide:sc= 1.1 K(o=2,f=-0.52) USER MOD Set 4.2: B 59 ASN : amide:sc= 0.903 K(o=2,f=-2.2) USER MOD Set 5.1: A 26 HIS : +bothHN:sc= -0.223 K(o=-1.5,f=-12!) USER MOD Set 5.2: B 11 GLN :FLIP amide:sc= -1.95 F(o=-5.7!,f=-1.5) USER MOD Set 5.3: B 14 GLN : amide:sc= 0.627! C(o=-1.5!,f=-7.7!) USER MOD Single : A 11 GLN : amide:sc= -0.101 K(o=-0.1,f=-0.97) USER MOD Single : A 14 GLN : amide:sc= -0.429 K(o=-0.43,f=-1.1) USER MOD Single : A 21 ASN : amide:sc= -0.0434 X(o=-0.043,f=0) USER MOD Single : A 25 LYS NZ :NH3+ -161:sc= 1.22 (180deg=1.02) USER MOD Single : A 27 LYS NZ :NH3+ -138:sc= 1.23 (180deg=0.887) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= -0.195 USER MOD Single : A 35 MET CE :methyl -164:sc= 0 (180deg=-0.00619) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 40 MET CE :methyl -159:sc= -0.143 (180deg=-1.08) USER MOD Single : A 42 THR OG1 : rot -95:sc= 1.25 USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 46 ASN : amide:sc= -1.15! K(o=-1.1!,f=-2.3) USER MOD Single : A 47 THR OG1 : rot -86:sc= 1.24 USER MOD Single : A 48 SER OG : rot -70:sc= 1.19 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 55 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 60 SER OG : rot 73:sc= 1.29 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 77:sc= 1.23 USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 21 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : B 25 LYS NZ :NH3+ 161:sc= 1.16 (180deg=0.57) USER MOD Single : B 26 HIS : no HD1:sc= 0.361 K(o=0.36,f=-6.3!) USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 THR OG1 : rot 180:sc= 0.0027 USER MOD Single : B 33 SER OG : rot 75:sc= 0.721 USER MOD Single : B 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 40 MET CE :methyl -155:sc= -0.262 (180deg=-1.33) USER MOD Single : B 42 THR OG1 : rot -78:sc= 1.19 USER MOD Single : B 46 ASN : amide:sc= -1.81! C(o=-1.8!,f=-6!) USER MOD Single : B 53 GLN : amide:sc=-0.00951 K(o=-0.0095,f=-1.6!) USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 60 SER OG : rot 23:sc= 1.04 USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD Single : B 68 SER OG : rot 82:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 137 N ASP A 9 -12.863 7.335 13.577 1.00 0.00 N ATOM 138 CA ASP A 9 -13.382 7.400 12.209 1.00 0.00 C ATOM 139 C ASP A 9 -12.888 8.639 11.479 1.00 0.00 C ATOM 140 O ASP A 9 -12.211 8.540 10.455 1.00 0.00 O ATOM 141 CB ASP A 9 -14.914 7.420 12.218 1.00 0.00 C ATOM 142 CG ASP A 9 -15.518 6.319 13.057 1.00 0.00 C ATOM 143 OD1 ASP A 9 -15.694 6.529 14.278 1.00 0.00 O ATOM 144 OD2 ASP A 9 -15.836 5.249 12.505 1.00 0.00 O ATOM 0 HA ASP A 9 -13.019 6.514 11.689 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -15.256 8.384 12.594 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -15.278 7.330 11.195 1.00 0.00 H new ATOM 149 N GLU A 10 -13.223 9.804 12.032 1.00 0.00 N ATOM 150 CA GLU A 10 -12.933 11.090 11.404 1.00 0.00 C ATOM 151 C GLU A 10 -11.452 11.211 11.064 1.00 0.00 C ATOM 152 O GLU A 10 -11.087 11.751 10.029 1.00 0.00 O ATOM 153 CB GLU A 10 -13.339 12.230 12.344 1.00 0.00 C ATOM 154 CG GLU A 10 -13.360 13.600 11.686 1.00 0.00 C ATOM 155 CD GLU A 10 -14.531 13.774 10.738 1.00 0.00 C ATOM 156 OE1 GLU A 10 -14.456 13.297 9.591 1.00 0.00 O ATOM 157 OE2 GLU A 10 -15.539 14.397 11.142 1.00 0.00 O ATOM 0 H GLU A 10 -13.703 9.882 12.928 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.506 11.155 10.479 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -14.329 12.018 12.748 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -12.649 12.254 13.187 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -13.405 14.369 12.457 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.429 13.751 11.139 1.00 0.00 H new ATOM 164 N GLN A 11 -10.613 10.682 11.941 1.00 0.00 N ATOM 165 CA GLN A 11 -9.166 10.744 11.773 1.00 0.00 C ATOM 166 C GLN A 11 -8.720 10.000 10.512 1.00 0.00 C ATOM 167 O GLN A 11 -8.173 10.598 9.575 1.00 0.00 O ATOM 168 CB GLN A 11 -8.491 10.143 13.008 1.00 0.00 C ATOM 169 CG GLN A 11 -6.973 10.115 12.939 1.00 0.00 C ATOM 170 CD GLN A 11 -6.363 9.402 14.129 1.00 0.00 C ATOM 171 OE1 GLN A 11 -6.971 8.499 14.706 1.00 0.00 O ATOM 172 NE2 GLN A 11 -5.160 9.801 14.507 1.00 0.00 N ATOM 0 H GLN A 11 -10.913 10.199 12.788 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.872 11.788 11.662 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -8.793 10.713 13.886 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -8.856 9.125 13.148 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -6.661 9.619 12.020 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -6.593 11.136 12.894 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -4.690 10.553 14.002 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -4.702 9.357 15.303 1.00 0.00 H new ATOM 181 N VAL A 12 -8.980 8.699 10.487 1.00 0.00 N ATOM 182 CA VAL A 12 -8.515 7.840 9.406 1.00 0.00 C ATOM 183 C VAL A 12 -9.206 8.179 8.091 1.00 0.00 C ATOM 184 O VAL A 12 -8.566 8.220 7.035 1.00 0.00 O ATOM 185 CB VAL A 12 -8.744 6.350 9.741 1.00 0.00 C ATOM 186 CG1 VAL A 12 -8.205 5.452 8.635 1.00 0.00 C ATOM 187 CG2 VAL A 12 -8.099 6.003 11.073 1.00 0.00 C ATOM 0 H VAL A 12 -9.514 8.213 11.208 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.445 8.017 9.295 1.00 0.00 H new ATOM 0 HB VAL A 12 -9.818 6.180 9.818 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -8.379 4.408 8.896 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.715 5.682 7.699 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -7.135 5.623 8.517 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -8.269 4.950 11.296 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -7.027 6.194 11.019 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.538 6.616 11.860 1.00 0.00 H new ATOM 197 N GLU A 13 -10.506 8.446 8.153 1.00 0.00 N ATOM 198 CA GLU A 13 -11.278 8.714 6.948 1.00 0.00 C ATOM 199 C GLU A 13 -10.970 10.100 6.386 1.00 0.00 C ATOM 200 O GLU A 13 -11.153 10.338 5.196 1.00 0.00 O ATOM 201 CB GLU A 13 -12.780 8.555 7.204 1.00 0.00 C ATOM 202 CG GLU A 13 -13.174 7.135 7.575 1.00 0.00 C ATOM 203 CD GLU A 13 -14.672 6.913 7.567 1.00 0.00 C ATOM 204 OE1 GLU A 13 -15.350 7.321 8.536 1.00 0.00 O ATOM 205 OE2 GLU A 13 -15.185 6.321 6.592 1.00 0.00 O ATOM 0 H GLU A 13 -11.043 8.482 9.019 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.982 7.976 6.202 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -13.079 9.230 8.006 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.329 8.857 6.312 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -12.706 6.440 6.877 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -12.784 6.903 8.566 1.00 0.00 H new ATOM 212 N GLN A 14 -10.489 11.007 7.233 1.00 0.00 N ATOM 213 CA GLN A 14 -10.085 12.331 6.765 1.00 0.00 C ATOM 214 C GLN A 14 -8.841 12.207 5.900 1.00 0.00 C ATOM 215 O GLN A 14 -8.751 12.805 4.827 1.00 0.00 O ATOM 216 CB GLN A 14 -9.805 13.270 7.937 1.00 0.00 C ATOM 217 CG GLN A 14 -9.781 14.737 7.546 1.00 0.00 C ATOM 218 CD GLN A 14 -9.449 15.649 8.708 1.00 0.00 C ATOM 219 OE1 GLN A 14 -8.687 15.285 9.607 1.00 0.00 O ATOM 220 NE2 GLN A 14 -10.022 16.840 8.704 1.00 0.00 N ATOM 0 H GLN A 14 -10.370 10.853 8.234 1.00 0.00 H new ATOM 0 HA GLN A 14 -10.903 12.752 6.180 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -10.566 13.119 8.703 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -8.846 13.005 8.383 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -9.048 14.885 6.753 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -10.753 15.015 7.138 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -10.646 17.103 7.942 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -9.840 17.496 9.463 1.00 0.00 H new ATOM 229 N LEU A 15 -7.882 11.421 6.380 1.00 0.00 N ATOM 230 CA LEU A 15 -6.679 11.135 5.611 1.00 0.00 C ATOM 231 C LEU A 15 -7.040 10.419 4.314 1.00 0.00 C ATOM 232 O LEU A 15 -6.549 10.771 3.242 1.00 0.00 O ATOM 233 CB LEU A 15 -5.710 10.284 6.434 1.00 0.00 C ATOM 234 CG LEU A 15 -5.017 11.020 7.580 1.00 0.00 C ATOM 235 CD1 LEU A 15 -4.265 10.044 8.470 1.00 0.00 C ATOM 236 CD2 LEU A 15 -4.065 12.068 7.026 1.00 0.00 C ATOM 0 H LEU A 15 -7.916 10.973 7.296 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.191 12.078 5.366 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.255 9.434 6.845 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -4.948 9.881 5.767 1.00 0.00 H new ATOM 0 HG LEU A 15 -5.778 11.515 8.183 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.779 10.589 9.279 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.964 9.320 8.889 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.511 9.521 7.881 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.576 12.587 7.850 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.312 11.583 6.405 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.624 12.786 6.425 1.00 0.00 H new ATOM 248 N LEU A 16 -7.919 9.427 4.426 1.00 0.00 N ATOM 249 CA LEU A 16 -8.393 8.673 3.273 1.00 0.00 C ATOM 250 C LEU A 16 -9.021 9.607 2.241 1.00 0.00 C ATOM 251 O LEU A 16 -8.729 9.518 1.048 1.00 0.00 O ATOM 252 CB LEU A 16 -9.422 7.628 3.720 1.00 0.00 C ATOM 253 CG LEU A 16 -9.966 6.719 2.615 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.874 5.797 2.096 1.00 0.00 C ATOM 255 CD2 LEU A 16 -11.153 5.913 3.126 1.00 0.00 C ATOM 0 H LEU A 16 -8.320 9.126 5.314 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.542 8.170 2.815 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.968 7.003 4.489 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.261 8.146 4.185 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.305 7.344 1.789 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.280 5.158 1.311 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.056 6.393 1.692 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.503 5.177 2.912 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -11.528 5.272 2.328 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.839 5.297 3.969 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.943 6.592 3.447 1.00 0.00 H new ATOM 267 N ALA A 17 -9.867 10.513 2.719 1.00 0.00 N ATOM 268 CA ALA A 17 -10.574 11.447 1.853 1.00 0.00 C ATOM 269 C ALA A 17 -9.607 12.302 1.037 1.00 0.00 C ATOM 270 O ALA A 17 -9.762 12.433 -0.176 1.00 0.00 O ATOM 271 CB ALA A 17 -11.501 12.336 2.671 1.00 0.00 C ATOM 0 H ALA A 17 -10.080 10.620 3.711 1.00 0.00 H new ATOM 0 HA ALA A 17 -11.170 10.859 1.155 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.021 13.027 2.008 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.230 11.717 3.194 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.916 12.900 3.397 1.00 0.00 H new ATOM 277 N GLU A 18 -8.604 12.876 1.696 1.00 0.00 N ATOM 278 CA GLU A 18 -7.657 13.749 1.011 1.00 0.00 C ATOM 279 C GLU A 18 -6.748 12.965 0.068 1.00 0.00 C ATOM 280 O GLU A 18 -6.349 13.478 -0.977 1.00 0.00 O ATOM 281 CB GLU A 18 -6.820 14.554 2.005 1.00 0.00 C ATOM 282 CG GLU A 18 -7.618 15.610 2.751 1.00 0.00 C ATOM 283 CD GLU A 18 -6.753 16.759 3.221 1.00 0.00 C ATOM 284 OE1 GLU A 18 -6.497 17.680 2.417 1.00 0.00 O ATOM 285 OE2 GLU A 18 -6.320 16.752 4.390 1.00 0.00 O ATOM 0 H GLU A 18 -8.427 12.754 2.693 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.245 14.446 0.413 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.371 13.872 2.727 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.002 15.037 1.472 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.405 15.993 2.102 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -8.108 15.152 3.610 1.00 0.00 H new ATOM 292 N LEU A 19 -6.429 11.726 0.426 1.00 0.00 N ATOM 293 CA LEU A 19 -5.620 10.876 -0.444 1.00 0.00 C ATOM 294 C LEU A 19 -6.393 10.525 -1.713 1.00 0.00 C ATOM 295 O LEU A 19 -5.859 10.604 -2.821 1.00 0.00 O ATOM 296 CB LEU A 19 -5.181 9.607 0.289 1.00 0.00 C ATOM 297 CG LEU A 19 -4.181 9.830 1.425 1.00 0.00 C ATOM 298 CD1 LEU A 19 -3.831 8.513 2.098 1.00 0.00 C ATOM 299 CD2 LEU A 19 -2.925 10.506 0.898 1.00 0.00 C ATOM 0 H LEU A 19 -6.714 11.290 1.303 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.724 11.429 -0.726 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.065 9.115 0.695 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.739 8.922 -0.435 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.643 10.482 2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.119 8.694 2.903 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.735 8.062 2.508 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.388 7.837 1.367 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.223 10.658 1.717 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.464 9.875 0.138 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.187 11.470 0.461 1.00 0.00 H new ATOM 311 N LEU A 20 -7.658 10.157 -1.547 1.00 0.00 N ATOM 312 CA LEU A 20 -8.535 9.918 -2.687 1.00 0.00 C ATOM 313 C LEU A 20 -8.704 11.201 -3.492 1.00 0.00 C ATOM 314 O LEU A 20 -8.734 11.181 -4.722 1.00 0.00 O ATOM 315 CB LEU A 20 -9.898 9.404 -2.218 1.00 0.00 C ATOM 316 CG LEU A 20 -9.879 8.017 -1.572 1.00 0.00 C ATOM 317 CD1 LEU A 20 -11.238 7.687 -0.981 1.00 0.00 C ATOM 318 CD2 LEU A 20 -9.471 6.958 -2.586 1.00 0.00 C ATOM 0 H LEU A 20 -8.098 10.018 -0.637 1.00 0.00 H new ATOM 0 HA LEU A 20 -8.081 9.158 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.311 10.116 -1.503 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.574 9.381 -3.072 1.00 0.00 H new ATOM 0 HG LEU A 20 -9.143 8.025 -0.768 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -11.206 6.697 -0.526 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -11.494 8.427 -0.223 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -11.990 7.700 -1.769 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -9.464 5.979 -2.107 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -10.182 6.952 -3.412 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -8.475 7.183 -2.966 1.00 0.00 H new ATOM 330 N ASN A 21 -8.796 12.318 -2.776 1.00 0.00 N ATOM 331 CA ASN A 21 -8.867 13.640 -3.392 1.00 0.00 C ATOM 332 C ASN A 21 -7.649 13.899 -4.272 1.00 0.00 C ATOM 333 O ASN A 21 -7.765 14.495 -5.337 1.00 0.00 O ATOM 334 CB ASN A 21 -8.987 14.722 -2.309 1.00 0.00 C ATOM 335 CG ASN A 21 -8.693 16.119 -2.824 1.00 0.00 C ATOM 336 OD1 ASN A 21 -9.573 16.802 -3.342 1.00 0.00 O ATOM 337 ND2 ASN A 21 -7.456 16.565 -2.652 1.00 0.00 N ATOM 0 H ASN A 21 -8.823 12.333 -1.756 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.753 13.676 -4.026 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -9.994 14.700 -1.893 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -8.300 14.490 -1.495 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -7.207 17.507 -2.954 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -6.754 15.966 -2.217 1.00 0.00 H new ATOM 344 N VAL A 22 -6.485 13.445 -3.826 1.00 0.00 N ATOM 345 CA VAL A 22 -5.260 13.586 -4.603 1.00 0.00 C ATOM 346 C VAL A 22 -5.395 12.897 -5.959 1.00 0.00 C ATOM 347 O VAL A 22 -5.158 13.507 -7.006 1.00 0.00 O ATOM 348 CB VAL A 22 -4.041 13.000 -3.854 1.00 0.00 C ATOM 349 CG1 VAL A 22 -2.836 12.897 -4.774 1.00 0.00 C ATOM 350 CG2 VAL A 22 -3.703 13.846 -2.637 1.00 0.00 C ATOM 0 H VAL A 22 -6.363 12.975 -2.929 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.098 14.654 -4.752 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.303 11.996 -3.519 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.992 12.482 -4.223 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.075 12.247 -5.615 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.575 13.888 -5.144 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -2.843 13.417 -2.123 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.467 14.862 -2.954 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -4.557 13.866 -1.960 1.00 0.00 H new ATOM 360 N LEU A 23 -5.792 11.633 -5.933 1.00 0.00 N ATOM 361 CA LEU A 23 -5.925 10.854 -7.159 1.00 0.00 C ATOM 362 C LEU A 23 -7.052 11.386 -8.038 1.00 0.00 C ATOM 363 O LEU A 23 -6.972 11.326 -9.261 1.00 0.00 O ATOM 364 CB LEU A 23 -6.147 9.369 -6.851 1.00 0.00 C ATOM 365 CG LEU A 23 -4.884 8.578 -6.495 1.00 0.00 C ATOM 366 CD1 LEU A 23 -4.318 9.001 -5.150 1.00 0.00 C ATOM 367 CD2 LEU A 23 -5.174 7.089 -6.504 1.00 0.00 C ATOM 0 H LEU A 23 -6.027 11.125 -5.080 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.989 10.955 -7.708 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.852 9.288 -6.023 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.617 8.902 -7.717 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.131 8.797 -7.252 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.423 8.418 -4.932 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.063 10.060 -5.180 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.062 8.829 -4.372 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.267 6.540 -6.249 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -5.951 6.865 -5.773 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.512 6.790 -7.496 1.00 0.00 H new ATOM 379 N GLU A 24 -8.095 11.910 -7.412 1.00 0.00 N ATOM 380 CA GLU A 24 -9.211 12.495 -8.144 1.00 0.00 C ATOM 381 C GLU A 24 -8.797 13.820 -8.785 1.00 0.00 C ATOM 382 O GLU A 24 -8.921 14.004 -9.996 1.00 0.00 O ATOM 383 CB GLU A 24 -10.398 12.708 -7.197 1.00 0.00 C ATOM 384 CG GLU A 24 -11.627 13.303 -7.868 1.00 0.00 C ATOM 385 CD GLU A 24 -12.184 12.421 -8.966 1.00 0.00 C ATOM 386 OE1 GLU A 24 -13.001 11.530 -8.664 1.00 0.00 O ATOM 387 OE2 GLU A 24 -11.823 12.631 -10.145 1.00 0.00 O ATOM 0 H GLU A 24 -8.193 11.943 -6.397 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.509 11.810 -8.938 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.668 11.752 -6.749 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.087 13.364 -6.384 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.399 13.471 -7.117 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.371 14.277 -8.286 1.00 0.00 H new ATOM 394 N LYS A 25 -8.281 14.724 -7.965 1.00 0.00 N ATOM 395 CA LYS A 25 -7.892 16.061 -8.407 1.00 0.00 C ATOM 396 C LYS A 25 -6.849 16.005 -9.522 1.00 0.00 C ATOM 397 O LYS A 25 -6.964 16.701 -10.532 1.00 0.00 O ATOM 398 CB LYS A 25 -7.327 16.849 -7.220 1.00 0.00 C ATOM 399 CG LYS A 25 -6.898 18.269 -7.556 1.00 0.00 C ATOM 400 CD LYS A 25 -6.096 18.887 -6.419 1.00 0.00 C ATOM 401 CE LYS A 25 -4.810 18.116 -6.169 1.00 0.00 C ATOM 402 NZ LYS A 25 -3.983 18.730 -5.096 1.00 0.00 N ATOM 0 H LYS A 25 -8.119 14.554 -6.972 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.780 16.556 -8.800 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.080 16.887 -6.433 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.470 16.310 -6.816 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -6.299 18.265 -8.466 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.778 18.879 -7.757 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.860 19.924 -6.659 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.698 18.899 -5.511 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.052 17.089 -5.895 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.230 18.072 -7.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -3.004 18.387 -5.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -3.996 19.765 -5.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -4.370 18.468 -4.167 1.00 0.00 H new ATOM 416 N HIS A 26 -5.835 15.173 -9.337 1.00 0.00 N ATOM 417 CA HIS A 26 -4.715 15.122 -10.271 1.00 0.00 C ATOM 418 C HIS A 26 -4.949 14.062 -11.347 1.00 0.00 C ATOM 419 O HIS A 26 -4.226 14.014 -12.340 1.00 0.00 O ATOM 420 CB HIS A 26 -3.416 14.825 -9.513 1.00 0.00 C ATOM 421 CG HIS A 26 -2.170 15.178 -10.268 1.00 0.00 C ATOM 422 ND1 HIS A 26 -1.687 14.437 -11.326 1.00 0.00 N ATOM 423 CD2 HIS A 26 -1.298 16.200 -10.101 1.00 0.00 C ATOM 424 CE1 HIS A 26 -0.573 14.986 -11.772 1.00 0.00 C ATOM 425 NE2 HIS A 26 -0.316 16.056 -11.046 1.00 0.00 N ATOM 0 H HIS A 26 -5.762 14.525 -8.552 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.632 16.092 -10.761 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.424 15.374 -8.571 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -3.388 13.764 -9.264 1.00 0.00 H new ATOM 0 HD1 HIS A 26 -2.123 13.596 -11.705 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -1.364 16.983 -9.360 1.00 0.00 H new ATOM 0 HE1 HIS A 26 0.027 14.621 -12.593 1.00 0.00 H new ATOM 0 HE2 HIS A 26 0.484 16.676 -11.168 1.00 0.00 H new ATOM 434 N LYS A 27 -5.959 13.221 -11.134 1.00 0.00 N ATOM 435 CA LYS A 27 -6.284 12.122 -12.047 1.00 0.00 C ATOM 436 C LYS A 27 -5.130 11.136 -12.174 1.00 0.00 C ATOM 437 O LYS A 27 -4.274 11.255 -13.051 1.00 0.00 O ATOM 438 CB LYS A 27 -6.706 12.634 -13.429 1.00 0.00 C ATOM 439 CG LYS A 27 -8.127 13.167 -13.472 1.00 0.00 C ATOM 440 CD LYS A 27 -9.109 12.126 -12.959 1.00 0.00 C ATOM 441 CE LYS A 27 -10.548 12.536 -13.208 1.00 0.00 C ATOM 442 NZ LYS A 27 -11.508 11.609 -12.553 1.00 0.00 N ATOM 0 H LYS A 27 -6.576 13.280 -10.324 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.133 11.596 -11.611 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.021 13.423 -13.739 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -6.608 11.825 -14.152 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.200 14.071 -12.868 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -8.385 13.445 -14.494 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -8.914 11.171 -13.447 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.954 11.976 -11.891 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.707 13.548 -12.835 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.739 12.558 -14.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.300 11.416 -13.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.026 10.717 -12.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.871 12.044 -11.681 1.00 0.00 H new ATOM 456 N ALA A 28 -5.105 10.170 -11.274 1.00 0.00 N ATOM 457 CA ALA A 28 -4.090 9.132 -11.302 1.00 0.00 C ATOM 458 C ALA A 28 -4.711 7.794 -11.682 1.00 0.00 C ATOM 459 O ALA A 28 -5.497 7.232 -10.920 1.00 0.00 O ATOM 460 CB ALA A 28 -3.392 9.034 -9.952 1.00 0.00 C ATOM 0 H ALA A 28 -5.778 10.082 -10.512 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.346 9.393 -12.055 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.634 8.251 -9.990 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.918 9.987 -9.718 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -4.124 8.793 -9.181 1.00 0.00 H new ATOM 466 N PRO A 29 -4.381 7.282 -12.880 1.00 0.00 N ATOM 467 CA PRO A 29 -4.872 5.982 -13.351 1.00 0.00 C ATOM 468 C PRO A 29 -4.408 4.844 -12.448 1.00 0.00 C ATOM 469 O PRO A 29 -3.375 4.957 -11.790 1.00 0.00 O ATOM 470 CB PRO A 29 -4.261 5.841 -14.750 1.00 0.00 C ATOM 471 CG PRO A 29 -3.123 6.804 -14.783 1.00 0.00 C ATOM 472 CD PRO A 29 -3.507 7.931 -13.870 1.00 0.00 C ATOM 0 HA PRO A 29 -5.961 5.932 -13.352 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -3.919 4.822 -14.928 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -4.993 6.071 -15.524 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -2.200 6.329 -14.449 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.947 7.165 -15.796 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.634 8.383 -13.400 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -4.027 8.724 -14.407 1.00 0.00 H new ATOM 480 N THR A 30 -5.163 3.753 -12.435 1.00 0.00 N ATOM 481 CA THR A 30 -4.895 2.626 -11.542 1.00 0.00 C ATOM 482 C THR A 30 -3.456 2.115 -11.677 1.00 0.00 C ATOM 483 O THR A 30 -2.801 1.810 -10.677 1.00 0.00 O ATOM 484 CB THR A 30 -5.881 1.474 -11.817 1.00 0.00 C ATOM 485 OG1 THR A 30 -7.223 1.981 -11.808 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.749 0.373 -10.774 1.00 0.00 C ATOM 0 H THR A 30 -5.975 3.622 -13.038 1.00 0.00 H new ATOM 0 HA THR A 30 -5.029 2.987 -10.522 1.00 0.00 H new ATOM 0 HB THR A 30 -5.646 1.050 -12.793 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.850 1.249 -11.985 1.00 0.00 H new ATOM 0 HG21 THR A 30 -6.458 -0.425 -10.996 1.00 0.00 H new ATOM 0 HG22 THR A 30 -4.735 -0.027 -10.793 1.00 0.00 H new ATOM 0 HG23 THR A 30 -5.960 0.781 -9.785 1.00 0.00 H new ATOM 494 N ASP A 31 -2.965 2.049 -12.909 1.00 0.00 N ATOM 495 CA ASP A 31 -1.607 1.577 -13.175 1.00 0.00 C ATOM 496 C ASP A 31 -0.583 2.486 -12.494 1.00 0.00 C ATOM 497 O ASP A 31 0.268 2.030 -11.723 1.00 0.00 O ATOM 498 CB ASP A 31 -1.360 1.550 -14.687 1.00 0.00 C ATOM 499 CG ASP A 31 -0.124 0.759 -15.079 1.00 0.00 C ATOM 500 OD1 ASP A 31 0.979 1.076 -14.592 1.00 0.00 O ATOM 501 OD2 ASP A 31 -0.254 -0.178 -15.897 1.00 0.00 O ATOM 0 H ASP A 31 -3.487 2.317 -13.743 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.497 0.570 -12.773 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -2.230 1.120 -15.183 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -1.259 2.573 -15.050 1.00 0.00 H new ATOM 506 N LEU A 32 -0.698 3.782 -12.764 1.00 0.00 N ATOM 507 CA LEU A 32 0.216 4.773 -12.211 1.00 0.00 C ATOM 508 C LEU A 32 0.040 4.891 -10.699 1.00 0.00 C ATOM 509 O LEU A 32 0.999 5.133 -9.975 1.00 0.00 O ATOM 510 CB LEU A 32 -0.015 6.133 -12.878 1.00 0.00 C ATOM 511 CG LEU A 32 0.879 7.272 -12.378 1.00 0.00 C ATOM 512 CD1 LEU A 32 2.346 6.954 -12.619 1.00 0.00 C ATOM 513 CD2 LEU A 32 0.499 8.579 -13.056 1.00 0.00 C ATOM 0 H LEU A 32 -1.422 4.172 -13.368 1.00 0.00 H new ATOM 0 HA LEU A 32 1.237 4.448 -12.412 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.134 6.022 -13.952 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.056 6.419 -12.729 1.00 0.00 H new ATOM 0 HG LEU A 32 0.727 7.380 -11.304 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.961 7.777 -12.256 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.612 6.040 -12.088 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.518 6.816 -13.687 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.143 9.379 -12.691 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.622 8.479 -14.134 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.540 8.818 -12.830 1.00 0.00 H new ATOM 525 N SER A 33 -1.191 4.714 -10.239 1.00 0.00 N ATOM 526 CA SER A 33 -1.503 4.777 -8.819 1.00 0.00 C ATOM 527 C SER A 33 -0.646 3.788 -8.031 1.00 0.00 C ATOM 528 O SER A 33 0.018 4.162 -7.063 1.00 0.00 O ATOM 529 CB SER A 33 -2.991 4.488 -8.596 1.00 0.00 C ATOM 530 OG SER A 33 -3.328 4.530 -7.221 1.00 0.00 O ATOM 0 H SER A 33 -1.996 4.524 -10.836 1.00 0.00 H new ATOM 0 HA SER A 33 -1.279 5.782 -8.460 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.590 5.218 -9.141 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.237 3.507 -9.002 1.00 0.00 H new ATOM 0 HG SER A 33 -4.284 4.343 -7.113 1.00 0.00 H new ATOM 536 N LEU A 34 -0.639 2.534 -8.473 1.00 0.00 N ATOM 537 CA LEU A 34 0.139 1.493 -7.811 1.00 0.00 C ATOM 538 C LEU A 34 1.627 1.818 -7.874 1.00 0.00 C ATOM 539 O LEU A 34 2.365 1.584 -6.916 1.00 0.00 O ATOM 540 CB LEU A 34 -0.130 0.133 -8.462 1.00 0.00 C ATOM 541 CG LEU A 34 -1.586 -0.335 -8.412 1.00 0.00 C ATOM 542 CD1 LEU A 34 -1.745 -1.660 -9.142 1.00 0.00 C ATOM 543 CD2 LEU A 34 -2.060 -0.457 -6.970 1.00 0.00 C ATOM 0 H LEU A 34 -1.164 2.214 -9.287 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.165 1.449 -6.765 1.00 0.00 H new ATOM 0 HB2 LEU A 34 0.185 0.178 -9.504 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.493 -0.616 -7.973 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.204 0.410 -8.913 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.787 -1.978 -9.096 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.448 -1.539 -10.184 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.115 -2.414 -8.670 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.097 -0.791 -6.955 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.438 -1.181 -6.443 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.984 0.513 -6.479 1.00 0.00 H new ATOM 555 N MET A 35 2.055 2.367 -9.008 1.00 0.00 N ATOM 556 CA MET A 35 3.444 2.768 -9.191 1.00 0.00 C ATOM 557 C MET A 35 3.830 3.848 -8.177 1.00 0.00 C ATOM 558 O MET A 35 4.833 3.720 -7.472 1.00 0.00 O ATOM 559 CB MET A 35 3.659 3.264 -10.629 1.00 0.00 C ATOM 560 CG MET A 35 5.102 3.621 -10.972 1.00 0.00 C ATOM 561 SD MET A 35 5.588 5.266 -10.404 1.00 0.00 S ATOM 562 CE MET A 35 7.273 5.354 -11.010 1.00 0.00 C ATOM 0 H MET A 35 1.457 2.544 -9.815 1.00 0.00 H new ATOM 0 HA MET A 35 4.087 1.905 -9.021 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.316 2.494 -11.320 1.00 0.00 H new ATOM 0 HB3 MET A 35 3.033 4.141 -10.794 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.767 2.880 -10.528 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.236 3.563 -12.052 1.00 0.00 H new ATOM 0 HE1 MET A 35 7.798 6.167 -10.508 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.783 4.412 -10.806 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.264 5.536 -12.085 1.00 0.00 H new ATOM 572 N VAL A 36 3.011 4.892 -8.093 1.00 0.00 N ATOM 573 CA VAL A 36 3.276 6.008 -7.190 1.00 0.00 C ATOM 574 C VAL A 36 3.206 5.570 -5.732 1.00 0.00 C ATOM 575 O VAL A 36 4.101 5.878 -4.947 1.00 0.00 O ATOM 576 CB VAL A 36 2.295 7.179 -7.421 1.00 0.00 C ATOM 577 CG1 VAL A 36 2.539 8.297 -6.417 1.00 0.00 C ATOM 578 CG2 VAL A 36 2.427 7.708 -8.842 1.00 0.00 C ATOM 0 H VAL A 36 2.156 4.989 -8.641 1.00 0.00 H new ATOM 0 HA VAL A 36 4.286 6.352 -7.411 1.00 0.00 H new ATOM 0 HB VAL A 36 1.281 6.806 -7.278 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.836 9.110 -6.600 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.397 7.915 -5.406 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.558 8.667 -6.525 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.730 8.533 -8.990 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.445 8.060 -9.006 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.201 6.910 -9.550 1.00 0.00 H new ATOM 588 N LEU A 37 2.152 4.842 -5.377 1.00 0.00 N ATOM 589 CA LEU A 37 1.983 4.352 -4.009 1.00 0.00 C ATOM 590 C LEU A 37 3.164 3.484 -3.593 1.00 0.00 C ATOM 591 O LEU A 37 3.700 3.641 -2.500 1.00 0.00 O ATOM 592 CB LEU A 37 0.682 3.556 -3.879 1.00 0.00 C ATOM 593 CG LEU A 37 -0.606 4.369 -4.046 1.00 0.00 C ATOM 594 CD1 LEU A 37 -1.819 3.455 -3.972 1.00 0.00 C ATOM 595 CD2 LEU A 37 -0.694 5.457 -2.985 1.00 0.00 C ATOM 0 H LEU A 37 1.402 4.577 -6.015 1.00 0.00 H new ATOM 0 HA LEU A 37 1.936 5.217 -3.348 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.688 2.759 -4.623 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.665 3.078 -2.900 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.589 4.847 -5.026 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.727 4.045 -4.092 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.763 2.710 -4.766 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.838 2.953 -3.005 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.615 6.023 -3.120 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.690 5.001 -1.995 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.161 6.127 -3.079 1.00 0.00 H new ATOM 607 N GLY A 38 3.581 2.588 -4.479 1.00 0.00 N ATOM 608 CA GLY A 38 4.715 1.732 -4.193 1.00 0.00 C ATOM 609 C GLY A 38 5.979 2.524 -3.926 1.00 0.00 C ATOM 610 O GLY A 38 6.701 2.257 -2.963 1.00 0.00 O ATOM 0 H GLY A 38 3.152 2.439 -5.393 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.489 1.110 -3.327 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.881 1.059 -5.034 1.00 0.00 H new ATOM 614 N ASN A 39 6.233 3.515 -4.772 1.00 0.00 N ATOM 615 CA ASN A 39 7.405 4.376 -4.635 1.00 0.00 C ATOM 616 C ASN A 39 7.295 5.245 -3.380 1.00 0.00 C ATOM 617 O ASN A 39 8.288 5.530 -2.707 1.00 0.00 O ATOM 618 CB ASN A 39 7.545 5.259 -5.880 1.00 0.00 C ATOM 619 CG ASN A 39 8.770 6.150 -5.839 1.00 0.00 C ATOM 620 OD1 ASN A 39 8.718 7.282 -5.358 1.00 0.00 O ATOM 621 ND2 ASN A 39 9.882 5.651 -6.351 1.00 0.00 N ATOM 0 H ASN A 39 5.638 3.745 -5.568 1.00 0.00 H new ATOM 0 HA ASN A 39 8.291 3.749 -4.538 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.593 4.625 -6.765 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.654 5.879 -5.981 1.00 0.00 H new ATOM 0 HD21 ASN A 39 10.736 6.209 -6.356 1.00 0.00 H new ATOM 0 HD22 ASN A 39 9.886 4.708 -6.741 1.00 0.00 H new ATOM 628 N MET A 40 6.073 5.644 -3.070 1.00 0.00 N ATOM 629 CA MET A 40 5.790 6.481 -1.913 1.00 0.00 C ATOM 630 C MET A 40 5.997 5.704 -0.610 1.00 0.00 C ATOM 631 O MET A 40 6.693 6.169 0.295 1.00 0.00 O ATOM 632 CB MET A 40 4.353 7.010 -2.021 1.00 0.00 C ATOM 633 CG MET A 40 3.915 7.929 -0.891 1.00 0.00 C ATOM 634 SD MET A 40 3.381 7.036 0.580 1.00 0.00 S ATOM 635 CE MET A 40 2.636 8.367 1.507 1.00 0.00 C ATOM 0 H MET A 40 5.246 5.397 -3.614 1.00 0.00 H new ATOM 0 HA MET A 40 6.482 7.323 -1.897 1.00 0.00 H new ATOM 0 HB2 MET A 40 4.250 7.546 -2.964 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.672 6.160 -2.061 1.00 0.00 H new ATOM 0 HG2 MET A 40 4.741 8.590 -0.628 1.00 0.00 H new ATOM 0 HG3 MET A 40 3.099 8.562 -1.241 1.00 0.00 H new ATOM 0 HE1 MET A 40 2.592 8.096 2.562 1.00 0.00 H new ATOM 0 HE2 MET A 40 3.233 9.271 1.390 1.00 0.00 H new ATOM 0 HE3 MET A 40 1.627 8.548 1.137 1.00 0.00 H new ATOM 645 N VAL A 41 5.410 4.515 -0.531 1.00 0.00 N ATOM 646 CA VAL A 41 5.506 3.691 0.669 1.00 0.00 C ATOM 647 C VAL A 41 6.954 3.283 0.937 1.00 0.00 C ATOM 648 O VAL A 41 7.434 3.388 2.067 1.00 0.00 O ATOM 649 CB VAL A 41 4.620 2.427 0.566 1.00 0.00 C ATOM 650 CG1 VAL A 41 4.782 1.542 1.794 1.00 0.00 C ATOM 651 CG2 VAL A 41 3.158 2.805 0.382 1.00 0.00 C ATOM 0 H VAL A 41 4.862 4.100 -1.284 1.00 0.00 H new ATOM 0 HA VAL A 41 5.146 4.296 1.501 1.00 0.00 H new ATOM 0 HB VAL A 41 4.948 1.864 -0.308 1.00 0.00 H new ATOM 0 HG11 VAL A 41 4.148 0.661 1.694 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.823 1.231 1.884 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.492 2.099 2.685 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.554 1.900 0.312 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.826 3.398 1.234 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.045 3.388 -0.532 1.00 0.00 H new ATOM 661 N THR A 42 7.656 2.844 -0.104 1.00 0.00 N ATOM 662 CA THR A 42 9.049 2.434 0.042 1.00 0.00 C ATOM 663 C THR A 42 9.909 3.591 0.544 1.00 0.00 C ATOM 664 O THR A 42 10.818 3.392 1.356 1.00 0.00 O ATOM 665 CB THR A 42 9.626 1.896 -1.282 1.00 0.00 C ATOM 666 OG1 THR A 42 9.257 2.756 -2.366 1.00 0.00 O ATOM 667 CG2 THR A 42 9.139 0.481 -1.554 1.00 0.00 C ATOM 0 H THR A 42 7.286 2.763 -1.051 1.00 0.00 H new ATOM 0 HA THR A 42 9.069 1.629 0.777 1.00 0.00 H new ATOM 0 HB THR A 42 10.712 1.874 -1.194 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.446 2.412 -2.795 1.00 0.00 H new ATOM 0 HG21 THR A 42 9.561 0.125 -2.494 1.00 0.00 H new ATOM 0 HG22 THR A 42 9.456 -0.175 -0.743 1.00 0.00 H new ATOM 0 HG23 THR A 42 8.051 0.477 -1.620 1.00 0.00 H new ATOM 675 N ASN A 43 9.608 4.796 0.069 1.00 0.00 N ATOM 676 CA ASN A 43 10.295 5.995 0.531 1.00 0.00 C ATOM 677 C ASN A 43 10.125 6.157 2.036 1.00 0.00 C ATOM 678 O ASN A 43 11.105 6.253 2.775 1.00 0.00 O ATOM 679 CB ASN A 43 9.756 7.235 -0.189 1.00 0.00 C ATOM 680 CG ASN A 43 10.369 8.522 0.331 1.00 0.00 C ATOM 681 OD1 ASN A 43 9.849 9.141 1.260 1.00 0.00 O ATOM 682 ND2 ASN A 43 11.476 8.936 -0.265 1.00 0.00 N ATOM 0 H ASN A 43 8.892 4.967 -0.637 1.00 0.00 H new ATOM 0 HA ASN A 43 11.356 5.890 0.303 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.956 7.147 -1.257 1.00 0.00 H new ATOM 0 HB3 ASN A 43 8.673 7.278 -0.070 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.929 9.797 0.042 1.00 0.00 H new ATOM 0 HD22 ASN A 43 11.876 8.394 -1.031 1.00 0.00 H new ATOM 689 N LEU A 44 8.873 6.155 2.479 1.00 0.00 N ATOM 690 CA LEU A 44 8.545 6.335 3.888 1.00 0.00 C ATOM 691 C LEU A 44 9.245 5.290 4.754 1.00 0.00 C ATOM 692 O LEU A 44 9.864 5.624 5.765 1.00 0.00 O ATOM 693 CB LEU A 44 7.029 6.252 4.090 1.00 0.00 C ATOM 694 CG LEU A 44 6.547 6.472 5.529 1.00 0.00 C ATOM 695 CD1 LEU A 44 6.863 7.885 5.993 1.00 0.00 C ATOM 696 CD2 LEU A 44 5.058 6.195 5.639 1.00 0.00 C ATOM 0 H LEU A 44 8.061 6.029 1.875 1.00 0.00 H new ATOM 0 HA LEU A 44 8.895 7.321 4.194 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.552 6.992 3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.687 5.272 3.756 1.00 0.00 H new ATOM 0 HG LEU A 44 7.077 5.774 6.177 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.512 8.019 7.016 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.940 8.048 5.954 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.364 8.602 5.342 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.733 6.356 6.667 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.513 6.867 4.976 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.858 5.162 5.353 1.00 0.00 H new ATOM 708 N ILE A 45 9.163 4.032 4.339 1.00 0.00 N ATOM 709 CA ILE A 45 9.740 2.932 5.104 1.00 0.00 C ATOM 710 C ILE A 45 11.253 3.088 5.263 1.00 0.00 C ATOM 711 O ILE A 45 11.788 2.928 6.357 1.00 0.00 O ATOM 712 CB ILE A 45 9.439 1.564 4.453 1.00 0.00 C ATOM 713 CG1 ILE A 45 7.929 1.335 4.363 1.00 0.00 C ATOM 714 CG2 ILE A 45 10.100 0.444 5.243 1.00 0.00 C ATOM 715 CD1 ILE A 45 7.549 0.028 3.697 1.00 0.00 C ATOM 0 H ILE A 45 8.702 3.747 3.475 1.00 0.00 H new ATOM 0 HA ILE A 45 9.273 2.967 6.089 1.00 0.00 H new ATOM 0 HB ILE A 45 9.849 1.564 3.443 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.507 1.357 5.368 1.00 0.00 H new ATOM 0 HG13 ILE A 45 7.478 2.159 3.810 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.879 -0.514 4.772 1.00 0.00 H new ATOM 0 HG22 ILE A 45 11.179 0.599 5.261 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.717 0.443 6.263 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.463 -0.064 3.670 1.00 0.00 H new ATOM 0 HD12 ILE A 45 7.940 0.011 2.680 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.970 -0.804 4.262 1.00 0.00 H new ATOM 727 N ASN A 46 11.940 3.426 4.180 1.00 0.00 N ATOM 728 CA ASN A 46 13.400 3.489 4.203 1.00 0.00 C ATOM 729 C ASN A 46 13.911 4.753 4.884 1.00 0.00 C ATOM 730 O ASN A 46 15.085 4.830 5.251 1.00 0.00 O ATOM 731 CB ASN A 46 13.978 3.395 2.788 1.00 0.00 C ATOM 732 CG ASN A 46 13.957 1.980 2.237 1.00 0.00 C ATOM 733 OD1 ASN A 46 14.893 1.209 2.441 1.00 0.00 O ATOM 734 ND2 ASN A 46 12.896 1.631 1.526 1.00 0.00 N ATOM 0 H ASN A 46 11.517 3.659 3.281 1.00 0.00 H new ATOM 0 HA ASN A 46 13.738 2.632 4.786 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.410 4.047 2.124 1.00 0.00 H new ATOM 0 HB3 ASN A 46 15.004 3.762 2.794 1.00 0.00 H new ATOM 0 HD21 ASN A 46 12.836 0.695 1.126 1.00 0.00 H new ATOM 0 HD22 ASN A 46 12.139 2.298 1.378 1.00 0.00 H new ATOM 741 N THR A 47 13.043 5.741 5.053 1.00 0.00 N ATOM 742 CA THR A 47 13.454 7.005 5.648 1.00 0.00 C ATOM 743 C THR A 47 13.105 7.085 7.137 1.00 0.00 C ATOM 744 O THR A 47 13.948 7.458 7.958 1.00 0.00 O ATOM 745 CB THR A 47 12.822 8.198 4.906 1.00 0.00 C ATOM 746 OG1 THR A 47 11.415 7.985 4.739 1.00 0.00 O ATOM 747 CG2 THR A 47 13.472 8.398 3.545 1.00 0.00 C ATOM 0 H THR A 47 12.059 5.693 4.789 1.00 0.00 H new ATOM 0 HA THR A 47 14.539 7.054 5.551 1.00 0.00 H new ATOM 0 HB THR A 47 12.986 9.094 5.505 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.258 7.460 3.926 1.00 0.00 H new ATOM 0 HG21 THR A 47 13.008 9.246 3.041 1.00 0.00 H new ATOM 0 HG22 THR A 47 14.537 8.591 3.675 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.337 7.500 2.942 1.00 0.00 H new ATOM 755 N SER A 48 11.875 6.727 7.488 1.00 0.00 N ATOM 756 CA SER A 48 11.405 6.895 8.858 1.00 0.00 C ATOM 757 C SER A 48 11.555 5.612 9.673 1.00 0.00 C ATOM 758 O SER A 48 11.883 5.657 10.862 1.00 0.00 O ATOM 759 CB SER A 48 9.945 7.362 8.865 1.00 0.00 C ATOM 760 OG SER A 48 9.102 6.447 8.182 1.00 0.00 O ATOM 0 H SER A 48 11.191 6.322 6.849 1.00 0.00 H new ATOM 0 HA SER A 48 12.028 7.656 9.328 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.603 7.475 9.894 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.874 8.343 8.396 1.00 0.00 H new ATOM 0 HG SER A 48 9.292 6.482 7.221 1.00 0.00 H new ATOM 766 N ILE A 49 11.332 4.472 9.035 1.00 0.00 N ATOM 767 CA ILE A 49 11.346 3.193 9.730 1.00 0.00 C ATOM 768 C ILE A 49 12.774 2.684 9.912 1.00 0.00 C ATOM 769 O ILE A 49 13.617 2.834 9.024 1.00 0.00 O ATOM 770 CB ILE A 49 10.497 2.140 8.977 1.00 0.00 C ATOM 771 CG1 ILE A 49 9.038 2.604 8.900 1.00 0.00 C ATOM 772 CG2 ILE A 49 10.591 0.778 9.650 1.00 0.00 C ATOM 773 CD1 ILE A 49 8.123 1.645 8.170 1.00 0.00 C ATOM 0 H ILE A 49 11.139 4.407 8.036 1.00 0.00 H new ATOM 0 HA ILE A 49 10.906 3.350 10.715 1.00 0.00 H new ATOM 0 HB ILE A 49 10.890 2.039 7.966 1.00 0.00 H new ATOM 0 HG12 ILE A 49 8.661 2.750 9.912 1.00 0.00 H new ATOM 0 HG13 ILE A 49 9.002 3.573 8.403 1.00 0.00 H new ATOM 0 HG21 ILE A 49 9.985 0.058 9.100 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.630 0.447 9.658 1.00 0.00 H new ATOM 0 HG23 ILE A 49 10.226 0.852 10.674 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.109 2.046 8.159 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.473 1.516 7.146 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.126 0.681 8.678 1.00 0.00 H new ATOM 785 N ALA A 50 13.039 2.127 11.090 1.00 0.00 N ATOM 786 CA ALA A 50 14.332 1.538 11.409 1.00 0.00 C ATOM 787 C ALA A 50 14.749 0.508 10.356 1.00 0.00 C ATOM 788 O ALA A 50 13.981 -0.399 10.021 1.00 0.00 O ATOM 789 CB ALA A 50 14.280 0.901 12.788 1.00 0.00 C ATOM 0 H ALA A 50 12.361 2.072 11.850 1.00 0.00 H new ATOM 0 HA ALA A 50 15.081 2.330 11.409 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.250 0.462 13.023 1.00 0.00 H new ATOM 0 HB2 ALA A 50 14.037 1.661 13.531 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.516 0.123 12.801 1.00 0.00 H new ATOM 795 N PRO A 51 15.979 0.640 9.832 1.00 0.00 N ATOM 796 CA PRO A 51 16.481 -0.188 8.725 1.00 0.00 C ATOM 797 C PRO A 51 16.485 -1.687 9.026 1.00 0.00 C ATOM 798 O PRO A 51 16.374 -2.504 8.111 1.00 0.00 O ATOM 799 CB PRO A 51 17.916 0.311 8.514 1.00 0.00 C ATOM 800 CG PRO A 51 18.267 1.038 9.766 1.00 0.00 C ATOM 801 CD PRO A 51 16.983 1.621 10.275 1.00 0.00 C ATOM 0 HA PRO A 51 15.838 -0.089 7.850 1.00 0.00 H new ATOM 0 HB2 PRO A 51 18.599 -0.520 8.337 1.00 0.00 H new ATOM 0 HB3 PRO A 51 17.981 0.968 7.646 1.00 0.00 H new ATOM 0 HG2 PRO A 51 18.707 0.363 10.500 1.00 0.00 H new ATOM 0 HG3 PRO A 51 19.001 1.820 9.571 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.991 1.730 11.360 1.00 0.00 H new ATOM 0 HD3 PRO A 51 16.794 2.610 9.857 1.00 0.00 H new ATOM 809 N ALA A 52 16.607 -2.049 10.296 1.00 0.00 N ATOM 810 CA ALA A 52 16.664 -3.456 10.681 1.00 0.00 C ATOM 811 C ALA A 52 15.351 -4.172 10.395 1.00 0.00 C ATOM 812 O ALA A 52 15.340 -5.273 9.847 1.00 0.00 O ATOM 813 CB ALA A 52 17.012 -3.590 12.153 1.00 0.00 C ATOM 0 H ALA A 52 16.668 -1.393 11.075 1.00 0.00 H new ATOM 0 HA ALA A 52 17.443 -3.926 10.081 1.00 0.00 H new ATOM 0 HB1 ALA A 52 17.050 -4.645 12.423 1.00 0.00 H new ATOM 0 HB2 ALA A 52 17.983 -3.132 12.340 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.253 -3.089 12.753 1.00 0.00 H new ATOM 819 N GLN A 53 14.244 -3.541 10.747 1.00 0.00 N ATOM 820 CA GLN A 53 12.940 -4.191 10.665 1.00 0.00 C ATOM 821 C GLN A 53 12.079 -3.601 9.555 1.00 0.00 C ATOM 822 O GLN A 53 10.879 -3.863 9.490 1.00 0.00 O ATOM 823 CB GLN A 53 12.213 -4.071 12.003 1.00 0.00 C ATOM 824 CG GLN A 53 12.254 -2.667 12.582 1.00 0.00 C ATOM 825 CD GLN A 53 11.381 -2.510 13.807 1.00 0.00 C ATOM 826 OE1 GLN A 53 11.139 -3.465 14.544 1.00 0.00 O ATOM 827 NE2 GLN A 53 10.915 -1.297 14.034 1.00 0.00 N ATOM 0 H GLN A 53 14.218 -2.581 11.092 1.00 0.00 H new ATOM 0 HA GLN A 53 13.110 -5.242 10.430 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.174 -4.373 11.873 1.00 0.00 H new ATOM 0 HB3 GLN A 53 12.660 -4.764 12.716 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.283 -2.416 12.841 1.00 0.00 H new ATOM 0 HG3 GLN A 53 11.934 -1.956 11.820 1.00 0.00 H new ATOM 0 HE21 GLN A 53 11.142 -0.535 13.395 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.327 -1.121 14.849 1.00 0.00 H new ATOM 836 N ARG A 54 12.692 -2.823 8.674 1.00 0.00 N ATOM 837 CA ARG A 54 11.954 -2.163 7.600 1.00 0.00 C ATOM 838 C ARG A 54 11.272 -3.176 6.677 1.00 0.00 C ATOM 839 O ARG A 54 10.126 -2.979 6.274 1.00 0.00 O ATOM 840 CB ARG A 54 12.869 -1.229 6.793 1.00 0.00 C ATOM 841 CG ARG A 54 14.089 -1.913 6.198 1.00 0.00 C ATOM 842 CD ARG A 54 14.908 -0.955 5.346 1.00 0.00 C ATOM 843 NE ARG A 54 16.204 -1.525 4.975 1.00 0.00 N ATOM 844 CZ ARG A 54 16.574 -1.801 3.725 1.00 0.00 C ATOM 845 NH1 ARG A 54 15.742 -1.574 2.719 1.00 0.00 N ATOM 846 NH2 ARG A 54 17.782 -2.291 3.490 1.00 0.00 N ATOM 0 H ARG A 54 13.694 -2.632 8.679 1.00 0.00 H new ATOM 0 HA ARG A 54 11.175 -1.561 8.067 1.00 0.00 H new ATOM 0 HB2 ARG A 54 12.290 -0.779 5.987 1.00 0.00 H new ATOM 0 HB3 ARG A 54 13.201 -0.417 7.439 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.711 -2.311 7.000 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.772 -2.761 5.591 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.350 -0.704 4.444 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.064 -0.025 5.893 1.00 0.00 H new ATOM 0 HE ARG A 54 16.868 -1.724 5.723 1.00 0.00 H new ATOM 0 HH11 ARG A 54 14.816 -1.187 2.901 1.00 0.00 H new ATOM 0 HH12 ARG A 54 16.028 -1.786 1.763 1.00 0.00 H new ATOM 0 HH21 ARG A 54 18.425 -2.456 4.264 1.00 0.00 H new ATOM 0 HH22 ARG A 54 18.069 -2.504 2.535 1.00 0.00 H new ATOM 860 N GLN A 55 11.958 -4.269 6.362 1.00 0.00 N ATOM 861 CA GLN A 55 11.403 -5.270 5.460 1.00 0.00 C ATOM 862 C GLN A 55 10.373 -6.121 6.192 1.00 0.00 C ATOM 863 O GLN A 55 9.359 -6.518 5.620 1.00 0.00 O ATOM 864 CB GLN A 55 12.503 -6.163 4.885 1.00 0.00 C ATOM 865 CG GLN A 55 12.008 -7.094 3.789 1.00 0.00 C ATOM 866 CD GLN A 55 13.066 -8.075 3.324 1.00 0.00 C ATOM 867 OE1 GLN A 55 13.924 -8.492 4.098 1.00 0.00 O ATOM 868 NE2 GLN A 55 13.009 -8.450 2.058 1.00 0.00 N ATOM 0 H GLN A 55 12.891 -4.483 6.714 1.00 0.00 H new ATOM 0 HA GLN A 55 10.919 -4.750 4.634 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.300 -5.535 4.487 1.00 0.00 H new ATOM 0 HB3 GLN A 55 12.937 -6.757 5.689 1.00 0.00 H new ATOM 0 HG2 GLN A 55 11.142 -7.647 4.153 1.00 0.00 H new ATOM 0 HG3 GLN A 55 11.672 -6.500 2.939 1.00 0.00 H new ATOM 0 HE21 GLN A 55 12.280 -8.079 1.449 1.00 0.00 H new ATOM 0 HE22 GLN A 55 13.694 -9.110 1.690 1.00 0.00 H new ATOM 877 N ALA A 56 10.636 -6.389 7.464 1.00 0.00 N ATOM 878 CA ALA A 56 9.712 -7.154 8.289 1.00 0.00 C ATOM 879 C ALA A 56 8.394 -6.406 8.457 1.00 0.00 C ATOM 880 O ALA A 56 7.320 -7.008 8.420 1.00 0.00 O ATOM 881 CB ALA A 56 10.331 -7.453 9.646 1.00 0.00 C ATOM 0 H ALA A 56 11.482 -6.088 7.947 1.00 0.00 H new ATOM 0 HA ALA A 56 9.508 -8.099 7.786 1.00 0.00 H new ATOM 0 HB1 ALA A 56 9.626 -8.025 10.249 1.00 0.00 H new ATOM 0 HB2 ALA A 56 11.245 -8.031 9.510 1.00 0.00 H new ATOM 0 HB3 ALA A 56 10.566 -6.517 10.153 1.00 0.00 H new ATOM 887 N ILE A 57 8.478 -5.093 8.632 1.00 0.00 N ATOM 888 CA ILE A 57 7.287 -4.259 8.733 1.00 0.00 C ATOM 889 C ILE A 57 6.567 -4.195 7.386 1.00 0.00 C ATOM 890 O ILE A 57 5.338 -4.225 7.330 1.00 0.00 O ATOM 891 CB ILE A 57 7.625 -2.835 9.233 1.00 0.00 C ATOM 892 CG1 ILE A 57 8.135 -2.900 10.677 1.00 0.00 C ATOM 893 CG2 ILE A 57 6.409 -1.916 9.137 1.00 0.00 C ATOM 894 CD1 ILE A 57 8.504 -1.553 11.261 1.00 0.00 C ATOM 0 H ILE A 57 9.358 -4.583 8.707 1.00 0.00 H new ATOM 0 HA ILE A 57 6.625 -4.717 9.468 1.00 0.00 H new ATOM 0 HB ILE A 57 8.407 -2.421 8.596 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.368 -3.358 11.302 1.00 0.00 H new ATOM 0 HG13 ILE A 57 9.008 -3.552 10.714 1.00 0.00 H new ATOM 0 HG21 ILE A 57 6.675 -0.922 9.495 1.00 0.00 H new ATOM 0 HG22 ILE A 57 6.082 -1.852 8.099 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.601 -2.317 9.748 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.855 -1.684 12.284 1.00 0.00 H new ATOM 0 HD12 ILE A 57 9.294 -1.100 10.661 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.629 -0.903 11.258 1.00 0.00 H new ATOM 906 N ALA A 58 7.338 -4.136 6.305 1.00 0.00 N ATOM 907 CA ALA A 58 6.770 -4.172 4.961 1.00 0.00 C ATOM 908 C ALA A 58 6.045 -5.495 4.726 1.00 0.00 C ATOM 909 O ALA A 58 4.979 -5.536 4.117 1.00 0.00 O ATOM 910 CB ALA A 58 7.856 -3.966 3.916 1.00 0.00 C ATOM 0 H ALA A 58 8.355 -4.063 6.332 1.00 0.00 H new ATOM 0 HA ALA A 58 6.048 -3.360 4.869 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.413 -3.996 2.920 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.332 -2.998 4.072 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.602 -4.756 4.006 1.00 0.00 H new ATOM 916 N ASN A 59 6.632 -6.575 5.227 1.00 0.00 N ATOM 917 CA ASN A 59 6.014 -7.894 5.155 1.00 0.00 C ATOM 918 C ASN A 59 4.745 -7.930 6.001 1.00 0.00 C ATOM 919 O ASN A 59 3.736 -8.514 5.607 1.00 0.00 O ATOM 920 CB ASN A 59 6.996 -8.970 5.631 1.00 0.00 C ATOM 921 CG ASN A 59 6.416 -10.371 5.558 1.00 0.00 C ATOM 922 OD1 ASN A 59 5.811 -10.860 6.513 1.00 0.00 O ATOM 923 ND2 ASN A 59 6.599 -11.026 4.424 1.00 0.00 N ATOM 0 H ASN A 59 7.541 -6.563 5.690 1.00 0.00 H new ATOM 0 HA ASN A 59 5.750 -8.097 4.117 1.00 0.00 H new ATOM 0 HB2 ASN A 59 7.900 -8.924 5.024 1.00 0.00 H new ATOM 0 HB3 ASN A 59 7.291 -8.757 6.659 1.00 0.00 H new ATOM 0 HD21 ASN A 59 6.233 -11.972 4.317 1.00 0.00 H new ATOM 0 HD22 ASN A 59 7.106 -10.585 3.656 1.00 0.00 H new ATOM 930 N SER A 60 4.801 -7.287 7.160 1.00 0.00 N ATOM 931 CA SER A 60 3.649 -7.193 8.045 1.00 0.00 C ATOM 932 C SER A 60 2.528 -6.396 7.377 1.00 0.00 C ATOM 933 O SER A 60 1.345 -6.697 7.550 1.00 0.00 O ATOM 934 CB SER A 60 4.060 -6.543 9.368 1.00 0.00 C ATOM 935 OG SER A 60 5.138 -7.251 9.966 1.00 0.00 O ATOM 0 H SER A 60 5.638 -6.820 7.510 1.00 0.00 H new ATOM 0 HA SER A 60 3.277 -8.197 8.250 1.00 0.00 H new ATOM 0 HB2 SER A 60 4.352 -5.507 9.194 1.00 0.00 H new ATOM 0 HB3 SER A 60 3.209 -6.525 10.049 1.00 0.00 H new ATOM 0 HG SER A 60 5.962 -7.076 9.466 1.00 0.00 H new ATOM 941 N PHE A 61 2.919 -5.394 6.598 1.00 0.00 N ATOM 942 CA PHE A 61 1.975 -4.603 5.820 1.00 0.00 C ATOM 943 C PHE A 61 1.203 -5.507 4.862 1.00 0.00 C ATOM 944 O PHE A 61 -0.011 -5.385 4.720 1.00 0.00 O ATOM 945 CB PHE A 61 2.727 -3.512 5.049 1.00 0.00 C ATOM 946 CG PHE A 61 1.852 -2.619 4.213 1.00 0.00 C ATOM 947 CD1 PHE A 61 1.207 -1.533 4.782 1.00 0.00 C ATOM 948 CD2 PHE A 61 1.683 -2.860 2.857 1.00 0.00 C ATOM 949 CE1 PHE A 61 0.414 -0.701 4.016 1.00 0.00 C ATOM 950 CE2 PHE A 61 0.888 -2.033 2.086 1.00 0.00 C ATOM 951 CZ PHE A 61 0.252 -0.952 2.666 1.00 0.00 C ATOM 0 H PHE A 61 3.892 -5.109 6.489 1.00 0.00 H new ATOM 0 HA PHE A 61 1.262 -4.126 6.492 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.277 -2.896 5.761 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.464 -3.986 4.401 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.326 -1.335 5.837 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.178 -3.703 2.399 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.079 0.145 4.471 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.764 -2.231 1.032 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.370 -0.305 2.066 1.00 0.00 H new ATOM 961 N ALA A 62 1.920 -6.431 4.232 1.00 0.00 N ATOM 962 CA ALA A 62 1.313 -7.390 3.316 1.00 0.00 C ATOM 963 C ALA A 62 0.336 -8.308 4.045 1.00 0.00 C ATOM 964 O ALA A 62 -0.706 -8.677 3.503 1.00 0.00 O ATOM 965 CB ALA A 62 2.390 -8.209 2.622 1.00 0.00 C ATOM 0 H ALA A 62 2.929 -6.536 4.340 1.00 0.00 H new ATOM 0 HA ALA A 62 0.753 -6.832 2.565 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.924 -8.921 1.941 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.046 -7.545 2.059 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.974 -8.749 3.368 1.00 0.00 H new ATOM 971 N ARG A 63 0.676 -8.660 5.281 1.00 0.00 N ATOM 972 CA ARG A 63 -0.179 -9.514 6.101 1.00 0.00 C ATOM 973 C ARG A 63 -1.524 -8.838 6.345 1.00 0.00 C ATOM 974 O ARG A 63 -2.581 -9.431 6.119 1.00 0.00 O ATOM 975 CB ARG A 63 0.495 -9.825 7.442 1.00 0.00 C ATOM 976 CG ARG A 63 1.870 -10.458 7.301 1.00 0.00 C ATOM 977 CD ARG A 63 2.509 -10.715 8.658 1.00 0.00 C ATOM 978 NE ARG A 63 3.889 -11.181 8.530 1.00 0.00 N ATOM 979 CZ ARG A 63 4.605 -11.697 9.529 1.00 0.00 C ATOM 980 NH1 ARG A 63 4.080 -11.820 10.742 1.00 0.00 N ATOM 981 NH2 ARG A 63 5.857 -12.077 9.313 1.00 0.00 N ATOM 0 H ARG A 63 1.539 -8.367 5.738 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.341 -10.449 5.565 1.00 0.00 H new ATOM 0 HB2 ARG A 63 0.586 -8.903 8.016 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.147 -10.494 8.015 1.00 0.00 H new ATOM 0 HG2 ARG A 63 1.785 -11.397 6.754 1.00 0.00 H new ATOM 0 HG3 ARG A 63 2.514 -9.804 6.713 1.00 0.00 H new ATOM 0 HD2 ARG A 63 2.488 -9.799 9.249 1.00 0.00 H new ATOM 0 HD3 ARG A 63 1.924 -11.457 9.200 1.00 0.00 H new ATOM 0 HE ARG A 63 4.334 -11.106 7.615 1.00 0.00 H new ATOM 0 HH11 ARG A 63 3.121 -11.519 10.916 1.00 0.00 H new ATOM 0 HH12 ARG A 63 4.635 -12.216 11.500 1.00 0.00 H new ATOM 0 HH21 ARG A 63 6.268 -11.974 8.385 1.00 0.00 H new ATOM 0 HH22 ARG A 63 6.409 -12.472 10.075 1.00 0.00 H new ATOM 995 N ALA A 64 -1.474 -7.587 6.792 1.00 0.00 N ATOM 996 CA ALA A 64 -2.682 -6.810 7.033 1.00 0.00 C ATOM 997 C ALA A 64 -3.413 -6.531 5.725 1.00 0.00 C ATOM 998 O ALA A 64 -4.644 -6.478 5.686 1.00 0.00 O ATOM 999 CB ALA A 64 -2.339 -5.509 7.741 1.00 0.00 C ATOM 0 H ALA A 64 -0.607 -7.090 6.995 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.344 -7.391 7.675 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.251 -4.938 7.915 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.861 -5.729 8.696 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.659 -4.926 7.121 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.643 -6.365 4.657 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.195 -6.121 3.330 1.00 0.00 C ATOM 1007 C LEU A 65 -4.112 -7.267 2.907 1.00 0.00 C ATOM 1008 O LEU A 65 -5.275 -7.050 2.567 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.055 -5.962 2.317 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.472 -5.567 0.897 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.074 -4.172 0.885 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.279 -5.641 -0.043 1.00 0.00 C ATOM 0 H LEU A 65 -1.624 -6.395 4.685 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.783 -5.204 3.361 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.362 -5.210 2.694 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.507 -6.903 2.265 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.231 -6.269 0.551 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.364 -3.910 -0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.952 -4.149 1.530 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.338 -3.455 1.249 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.590 -5.358 -1.049 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.501 -4.960 0.302 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.889 -6.659 -0.057 1.00 0.00 H new ATOM 1024 N GLN A 66 -3.582 -8.486 2.952 1.00 0.00 N ATOM 1025 CA GLN A 66 -4.337 -9.674 2.564 1.00 0.00 C ATOM 1026 C GLN A 66 -5.544 -9.884 3.477 1.00 0.00 C ATOM 1027 O GLN A 66 -6.641 -10.196 3.007 1.00 0.00 O ATOM 1028 CB GLN A 66 -3.435 -10.913 2.596 1.00 0.00 C ATOM 1029 CG GLN A 66 -2.309 -10.879 1.575 1.00 0.00 C ATOM 1030 CD GLN A 66 -1.471 -12.146 1.578 1.00 0.00 C ATOM 1031 OE1 GLN A 66 -1.299 -12.796 2.610 1.00 0.00 O ATOM 1032 NE2 GLN A 66 -0.956 -12.513 0.418 1.00 0.00 N ATOM 0 H GLN A 66 -2.627 -8.678 3.255 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.700 -9.522 1.547 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -3.006 -11.013 3.593 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -4.045 -11.799 2.421 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -2.731 -10.731 0.581 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -1.666 -10.023 1.779 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -1.121 -11.948 -0.415 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -0.393 -13.362 0.355 1.00 0.00 H new ATOM 1041 N SER A 67 -5.334 -9.691 4.775 1.00 0.00 N ATOM 1042 CA SER A 67 -6.382 -9.892 5.770 1.00 0.00 C ATOM 1043 C SER A 67 -7.553 -8.935 5.541 1.00 0.00 C ATOM 1044 O SER A 67 -8.717 -9.306 5.706 1.00 0.00 O ATOM 1045 CB SER A 67 -5.806 -9.698 7.179 1.00 0.00 C ATOM 1046 OG SER A 67 -6.760 -10.014 8.179 1.00 0.00 O ATOM 0 H SER A 67 -4.440 -9.393 5.165 1.00 0.00 H new ATOM 0 HA SER A 67 -6.757 -10.910 5.671 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.925 -10.328 7.303 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.479 -8.665 7.300 1.00 0.00 H new ATOM 0 HG SER A 67 -6.362 -9.882 9.065 1.00 0.00 H new ATOM 1052 N SER A 68 -7.240 -7.706 5.145 1.00 0.00 N ATOM 1053 CA SER A 68 -8.266 -6.702 4.909 1.00 0.00 C ATOM 1054 C SER A 68 -9.056 -7.015 3.642 1.00 0.00 C ATOM 1055 O SER A 68 -10.253 -6.739 3.564 1.00 0.00 O ATOM 1056 CB SER A 68 -7.633 -5.315 4.817 1.00 0.00 C ATOM 1057 OG SER A 68 -6.937 -4.999 6.013 1.00 0.00 O ATOM 0 H SER A 68 -6.286 -7.384 4.982 1.00 0.00 H new ATOM 0 HA SER A 68 -8.960 -6.717 5.749 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.947 -5.279 3.971 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.406 -4.569 4.633 1.00 0.00 H new ATOM 0 HG SER A 68 -6.080 -5.473 6.028 1.00 0.00 H new ATOM 1063 N ILE A 69 -8.386 -7.601 2.656 1.00 0.00 N ATOM 1064 CA ILE A 69 -9.042 -7.987 1.414 1.00 0.00 C ATOM 1065 C ILE A 69 -9.946 -9.195 1.636 1.00 0.00 C ATOM 1066 O ILE A 69 -11.107 -9.195 1.229 1.00 0.00 O ATOM 1067 CB ILE A 69 -8.016 -8.295 0.302 1.00 0.00 C ATOM 1068 CG1 ILE A 69 -7.221 -7.032 -0.035 1.00 0.00 C ATOM 1069 CG2 ILE A 69 -8.710 -8.840 -0.942 1.00 0.00 C ATOM 1070 CD1 ILE A 69 -6.170 -7.238 -1.101 1.00 0.00 C ATOM 0 H ILE A 69 -7.390 -7.819 2.693 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.649 -7.142 1.091 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.329 -9.060 0.664 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -7.912 -6.256 -0.365 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.739 -6.665 0.871 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -7.967 -9.049 -1.711 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.240 -9.759 -0.690 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -9.420 -8.102 -1.315 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.649 -6.298 -1.285 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.455 -7.990 -0.767 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -6.647 -7.575 -2.022 1.00 0.00 H new ATOM 1442 N SER B 8 7.098 9.831 -16.549 1.00 0.00 N ATOM 1443 CA SER B 8 8.094 10.876 -16.391 1.00 0.00 C ATOM 1444 C SER B 8 8.261 11.229 -14.912 1.00 0.00 C ATOM 1445 O SER B 8 7.296 11.176 -14.142 1.00 0.00 O ATOM 1446 CB SER B 8 7.654 12.108 -17.189 1.00 0.00 C ATOM 1447 OG SER B 8 8.627 13.134 -17.161 1.00 0.00 O ATOM 0 HA SER B 8 9.055 10.525 -16.766 1.00 0.00 H new ATOM 0 HB2 SER B 8 7.461 11.820 -18.222 1.00 0.00 H new ATOM 0 HB3 SER B 8 6.716 12.487 -16.783 1.00 0.00 H new ATOM 0 HG SER B 8 8.309 13.901 -17.682 1.00 0.00 H new ATOM 1453 N ASP B 9 9.482 11.601 -14.529 1.00 0.00 N ATOM 1454 CA ASP B 9 9.793 11.940 -13.139 1.00 0.00 C ATOM 1455 C ASP B 9 8.903 13.068 -12.648 1.00 0.00 C ATOM 1456 O ASP B 9 8.348 12.996 -11.557 1.00 0.00 O ATOM 1457 CB ASP B 9 11.257 12.372 -12.987 1.00 0.00 C ATOM 1458 CG ASP B 9 12.250 11.261 -13.258 1.00 0.00 C ATOM 1459 OD1 ASP B 9 12.514 10.454 -12.344 1.00 0.00 O ATOM 1460 OD2 ASP B 9 12.795 11.210 -14.382 1.00 0.00 O ATOM 0 H ASP B 9 10.276 11.676 -15.165 1.00 0.00 H new ATOM 0 HA ASP B 9 9.617 11.044 -12.544 1.00 0.00 H new ATOM 0 HB2 ASP B 9 11.455 13.199 -13.669 1.00 0.00 H new ATOM 0 HB3 ASP B 9 11.413 12.748 -11.976 1.00 0.00 H new ATOM 1465 N GLU B 10 8.767 14.098 -13.477 1.00 0.00 N ATOM 1466 CA GLU B 10 8.004 15.297 -13.135 1.00 0.00 C ATOM 1467 C GLU B 10 6.596 14.938 -12.646 1.00 0.00 C ATOM 1468 O GLU B 10 6.127 15.458 -11.633 1.00 0.00 O ATOM 1469 CB GLU B 10 7.934 16.205 -14.369 1.00 0.00 C ATOM 1470 CG GLU B 10 7.813 17.693 -14.070 1.00 0.00 C ATOM 1471 CD GLU B 10 6.431 18.100 -13.611 1.00 0.00 C ATOM 1472 OE1 GLU B 10 5.513 18.155 -14.456 1.00 0.00 O ATOM 1473 OE2 GLU B 10 6.252 18.380 -12.411 1.00 0.00 O ATOM 0 H GLU B 10 9.183 14.126 -14.408 1.00 0.00 H new ATOM 0 HA GLU B 10 8.504 15.820 -12.320 1.00 0.00 H new ATOM 0 HB2 GLU B 10 8.828 16.043 -14.971 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.081 15.902 -14.976 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.538 17.962 -13.301 1.00 0.00 H new ATOM 0 HG3 GLU B 10 8.072 18.259 -14.965 1.00 0.00 H new ATOM 1480 N GLN B 11 5.941 14.024 -13.350 1.00 0.00 N ATOM 1481 CA GLN B 11 4.569 13.654 -13.025 1.00 0.00 C ATOM 1482 C GLN B 11 4.506 12.864 -11.716 1.00 0.00 C ATOM 1483 O GLN B 11 3.663 13.133 -10.855 1.00 0.00 O ATOM 1484 CB GLN B 11 3.954 12.838 -14.169 1.00 0.00 C ATOM 1485 CG GLN B 11 2.464 12.562 -14.006 1.00 0.00 C ATOM 1486 CD GLN B 11 1.584 13.787 -14.240 1.00 0.00 C ATOM 1487 OE1 GLN B 11 2.109 14.977 -13.975 1.00 0.00 O flip ATOM 1488 NE2 GLN B 11 0.434 13.663 -14.658 1.00 0.00 N flip ATOM 0 H GLN B 11 6.336 13.526 -14.148 1.00 0.00 H new ATOM 0 HA GLN B 11 3.993 14.570 -12.894 1.00 0.00 H new ATOM 0 HB2 GLN B 11 4.113 13.370 -15.107 1.00 0.00 H new ATOM 0 HB3 GLN B 11 4.482 11.888 -14.248 1.00 0.00 H new ATOM 0 HG2 GLN B 11 2.171 11.777 -14.702 1.00 0.00 H new ATOM 0 HG3 GLN B 11 2.282 12.181 -13.001 1.00 0.00 H new ATOM 0 HE21 GLN B 11 0.059 12.734 -14.852 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -0.145 14.489 -14.810 1.00 0.00 H new ATOM 1497 N VAL B 12 5.412 11.905 -11.564 1.00 0.00 N ATOM 1498 CA VAL B 12 5.440 11.066 -10.372 1.00 0.00 C ATOM 1499 C VAL B 12 5.855 11.881 -9.150 1.00 0.00 C ATOM 1500 O VAL B 12 5.314 11.705 -8.057 1.00 0.00 O ATOM 1501 CB VAL B 12 6.402 9.871 -10.547 1.00 0.00 C ATOM 1502 CG1 VAL B 12 6.375 8.968 -9.320 1.00 0.00 C ATOM 1503 CG2 VAL B 12 6.055 9.079 -11.800 1.00 0.00 C ATOM 0 H VAL B 12 6.136 11.689 -12.250 1.00 0.00 H new ATOM 0 HA VAL B 12 4.432 10.680 -10.222 1.00 0.00 H new ATOM 0 HB VAL B 12 7.412 10.265 -10.658 1.00 0.00 H new ATOM 0 HG11 VAL B 12 7.061 8.134 -9.467 1.00 0.00 H new ATOM 0 HG12 VAL B 12 6.680 9.538 -8.442 1.00 0.00 H new ATOM 0 HG13 VAL B 12 5.365 8.586 -9.172 1.00 0.00 H new ATOM 0 HG21 VAL B 12 6.745 8.242 -11.904 1.00 0.00 H new ATOM 0 HG22 VAL B 12 5.036 8.701 -11.721 1.00 0.00 H new ATOM 0 HG23 VAL B 12 6.135 9.726 -12.673 1.00 0.00 H new ATOM 1513 N GLU B 13 6.805 12.789 -9.354 1.00 0.00 N ATOM 1514 CA GLU B 13 7.312 13.640 -8.287 1.00 0.00 C ATOM 1515 C GLU B 13 6.179 14.472 -7.688 1.00 0.00 C ATOM 1516 O GLU B 13 6.088 14.625 -6.467 1.00 0.00 O ATOM 1517 CB GLU B 13 8.432 14.532 -8.838 1.00 0.00 C ATOM 1518 CG GLU B 13 9.289 15.211 -7.780 1.00 0.00 C ATOM 1519 CD GLU B 13 8.786 16.589 -7.402 1.00 0.00 C ATOM 1520 OE1 GLU B 13 8.844 17.499 -8.257 1.00 0.00 O ATOM 1521 OE2 GLU B 13 8.343 16.771 -6.252 1.00 0.00 O ATOM 0 H GLU B 13 7.242 12.954 -10.261 1.00 0.00 H new ATOM 0 HA GLU B 13 7.722 13.022 -7.488 1.00 0.00 H new ATOM 0 HB2 GLU B 13 9.078 13.928 -9.475 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.987 15.299 -9.472 1.00 0.00 H new ATOM 0 HG2 GLU B 13 9.319 14.585 -6.888 1.00 0.00 H new ATOM 0 HG3 GLU B 13 10.312 15.292 -8.147 1.00 0.00 H new ATOM 1528 N GLN B 14 5.301 14.980 -8.553 1.00 0.00 N ATOM 1529 CA GLN B 14 4.120 15.709 -8.102 1.00 0.00 C ATOM 1530 C GLN B 14 3.260 14.838 -7.196 1.00 0.00 C ATOM 1531 O GLN B 14 2.949 15.222 -6.072 1.00 0.00 O ATOM 1532 CB GLN B 14 3.269 16.174 -9.283 1.00 0.00 C ATOM 1533 CG GLN B 14 3.911 17.252 -10.134 1.00 0.00 C ATOM 1534 CD GLN B 14 2.982 17.738 -11.224 1.00 0.00 C ATOM 1535 OE1 GLN B 14 1.761 17.741 -11.065 1.00 0.00 O ATOM 1536 NE2 GLN B 14 3.548 18.146 -12.340 1.00 0.00 N ATOM 0 H GLN B 14 5.386 14.900 -9.566 1.00 0.00 H new ATOM 0 HA GLN B 14 4.474 16.579 -7.550 1.00 0.00 H new ATOM 0 HB2 GLN B 14 3.046 15.314 -9.915 1.00 0.00 H new ATOM 0 HB3 GLN B 14 2.317 16.546 -8.904 1.00 0.00 H new ATOM 0 HG2 GLN B 14 4.198 18.091 -9.501 1.00 0.00 H new ATOM 0 HG3 GLN B 14 4.825 16.864 -10.583 1.00 0.00 H new ATOM 0 HE21 GLN B 14 4.564 18.128 -12.433 1.00 0.00 H new ATOM 0 HE22 GLN B 14 2.971 18.480 -13.112 1.00 0.00 H new ATOM 1545 N LEU B 15 2.887 13.661 -7.692 1.00 0.00 N ATOM 1546 CA LEU B 15 2.011 12.756 -6.948 1.00 0.00 C ATOM 1547 C LEU B 15 2.645 12.328 -5.627 1.00 0.00 C ATOM 1548 O LEU B 15 1.946 12.100 -4.638 1.00 0.00 O ATOM 1549 CB LEU B 15 1.658 11.535 -7.799 1.00 0.00 C ATOM 1550 CG LEU B 15 0.705 11.818 -8.963 1.00 0.00 C ATOM 1551 CD1 LEU B 15 0.471 10.560 -9.781 1.00 0.00 C ATOM 1552 CD2 LEU B 15 -0.618 12.367 -8.446 1.00 0.00 C ATOM 0 H LEU B 15 3.177 13.311 -8.605 1.00 0.00 H new ATOM 0 HA LEU B 15 1.093 13.295 -6.714 1.00 0.00 H new ATOM 0 HB2 LEU B 15 2.579 11.109 -8.197 1.00 0.00 H new ATOM 0 HB3 LEU B 15 1.209 10.779 -7.155 1.00 0.00 H new ATOM 0 HG LEU B 15 1.165 12.567 -9.607 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -0.209 10.782 -10.603 1.00 0.00 H new ATOM 0 HD12 LEU B 15 1.420 10.204 -10.181 1.00 0.00 H new ATOM 0 HD13 LEU B 15 0.033 9.789 -9.146 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -1.284 12.563 -9.286 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -1.079 11.638 -7.780 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -0.439 13.294 -7.901 1.00 0.00 H new ATOM 1564 N LEU B 16 3.968 12.231 -5.613 1.00 0.00 N ATOM 1565 CA LEU B 16 4.695 11.930 -4.391 1.00 0.00 C ATOM 1566 C LEU B 16 4.505 13.055 -3.374 1.00 0.00 C ATOM 1567 O LEU B 16 4.185 12.811 -2.210 1.00 0.00 O ATOM 1568 CB LEU B 16 6.184 11.737 -4.692 1.00 0.00 C ATOM 1569 CG LEU B 16 7.046 11.327 -3.494 1.00 0.00 C ATOM 1570 CD1 LEU B 16 6.647 9.949 -2.987 1.00 0.00 C ATOM 1571 CD2 LEU B 16 8.517 11.351 -3.868 1.00 0.00 C ATOM 0 H LEU B 16 4.558 12.357 -6.435 1.00 0.00 H new ATOM 0 HA LEU B 16 4.301 11.005 -3.970 1.00 0.00 H new ATOM 0 HB2 LEU B 16 6.286 10.979 -5.468 1.00 0.00 H new ATOM 0 HB3 LEU B 16 6.579 12.667 -5.101 1.00 0.00 H new ATOM 0 HG LEU B 16 6.880 12.045 -2.691 1.00 0.00 H new ATOM 0 HD11 LEU B 16 7.273 9.679 -2.136 1.00 0.00 H new ATOM 0 HD12 LEU B 16 5.602 9.963 -2.679 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.780 9.216 -3.783 1.00 0.00 H new ATOM 0 HD21 LEU B 16 9.116 11.057 -3.006 1.00 0.00 H new ATOM 0 HD22 LEU B 16 8.695 10.655 -4.688 1.00 0.00 H new ATOM 0 HD23 LEU B 16 8.797 12.358 -4.179 1.00 0.00 H new ATOM 1583 N ALA B 17 4.680 14.292 -3.834 1.00 0.00 N ATOM 1584 CA ALA B 17 4.522 15.463 -2.981 1.00 0.00 C ATOM 1585 C ALA B 17 3.082 15.592 -2.497 1.00 0.00 C ATOM 1586 O ALA B 17 2.837 15.965 -1.352 1.00 0.00 O ATOM 1587 CB ALA B 17 4.946 16.720 -3.727 1.00 0.00 C ATOM 0 H ALA B 17 4.933 14.508 -4.798 1.00 0.00 H new ATOM 0 HA ALA B 17 5.164 15.340 -2.109 1.00 0.00 H new ATOM 0 HB1 ALA B 17 4.823 17.587 -3.078 1.00 0.00 H new ATOM 0 HB2 ALA B 17 5.992 16.633 -4.022 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.327 16.841 -4.616 1.00 0.00 H new ATOM 1593 N GLU B 18 2.140 15.273 -3.380 1.00 0.00 N ATOM 1594 CA GLU B 18 0.719 15.286 -3.044 1.00 0.00 C ATOM 1595 C GLU B 18 0.437 14.408 -1.828 1.00 0.00 C ATOM 1596 O GLU B 18 -0.142 14.864 -0.840 1.00 0.00 O ATOM 1597 CB GLU B 18 -0.108 14.792 -4.231 1.00 0.00 C ATOM 1598 CG GLU B 18 -0.045 15.688 -5.457 1.00 0.00 C ATOM 1599 CD GLU B 18 -0.700 17.031 -5.229 1.00 0.00 C ATOM 1600 OE1 GLU B 18 -1.938 17.117 -5.346 1.00 0.00 O ATOM 1601 OE2 GLU B 18 0.017 18.008 -4.933 1.00 0.00 O ATOM 0 H GLU B 18 2.338 15.000 -4.343 1.00 0.00 H new ATOM 0 HA GLU B 18 0.439 16.312 -2.807 1.00 0.00 H new ATOM 0 HB2 GLU B 18 0.235 13.795 -4.507 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -1.148 14.697 -3.919 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.997 15.839 -5.739 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -0.532 15.188 -6.294 1.00 0.00 H new ATOM 1608 N LEU B 19 0.862 13.152 -1.902 1.00 0.00 N ATOM 1609 CA LEU B 19 0.621 12.195 -0.830 1.00 0.00 C ATOM 1610 C LEU B 19 1.338 12.610 0.452 1.00 0.00 C ATOM 1611 O LEU B 19 0.762 12.562 1.541 1.00 0.00 O ATOM 1612 CB LEU B 19 1.080 10.799 -1.254 1.00 0.00 C ATOM 1613 CG LEU B 19 0.403 10.251 -2.513 1.00 0.00 C ATOM 1614 CD1 LEU B 19 0.957 8.882 -2.868 1.00 0.00 C ATOM 1615 CD2 LEU B 19 -1.105 10.184 -2.322 1.00 0.00 C ATOM 0 H LEU B 19 1.377 12.772 -2.696 1.00 0.00 H new ATOM 0 HA LEU B 19 -0.451 12.177 -0.632 1.00 0.00 H new ATOM 0 HB2 LEU B 19 2.157 10.822 -1.419 1.00 0.00 H new ATOM 0 HB3 LEU B 19 0.898 10.107 -0.431 1.00 0.00 H new ATOM 0 HG LEU B 19 0.616 10.930 -3.339 1.00 0.00 H new ATOM 0 HD11 LEU B 19 0.462 8.511 -3.766 1.00 0.00 H new ATOM 0 HD12 LEU B 19 2.029 8.959 -3.050 1.00 0.00 H new ATOM 0 HD13 LEU B 19 0.778 8.192 -2.043 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -1.569 9.792 -3.227 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -1.337 9.529 -1.482 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -1.491 11.183 -2.120 1.00 0.00 H new ATOM 1627 N LEU B 20 2.593 13.023 0.317 1.00 0.00 N ATOM 1628 CA LEU B 20 3.384 13.445 1.469 1.00 0.00 C ATOM 1629 C LEU B 20 2.770 14.665 2.144 1.00 0.00 C ATOM 1630 O LEU B 20 2.762 14.756 3.369 1.00 0.00 O ATOM 1631 CB LEU B 20 4.834 13.735 1.063 1.00 0.00 C ATOM 1632 CG LEU B 20 5.809 12.559 1.210 1.00 0.00 C ATOM 1633 CD1 LEU B 20 5.902 12.116 2.663 1.00 0.00 C ATOM 1634 CD2 LEU B 20 5.395 11.391 0.328 1.00 0.00 C ATOM 0 H LEU B 20 3.084 13.075 -0.575 1.00 0.00 H new ATOM 0 HA LEU B 20 3.383 12.623 2.185 1.00 0.00 H new ATOM 0 HB2 LEU B 20 4.843 14.064 0.024 1.00 0.00 H new ATOM 0 HB3 LEU B 20 5.202 14.567 1.664 1.00 0.00 H new ATOM 0 HG LEU B 20 6.792 12.899 0.886 1.00 0.00 H new ATOM 0 HD11 LEU B 20 6.598 11.281 2.745 1.00 0.00 H new ATOM 0 HD12 LEU B 20 6.257 12.946 3.274 1.00 0.00 H new ATOM 0 HD13 LEU B 20 4.918 11.803 3.012 1.00 0.00 H new ATOM 0 HD21 LEU B 20 6.104 10.572 0.452 1.00 0.00 H new ATOM 0 HD22 LEU B 20 4.398 11.055 0.614 1.00 0.00 H new ATOM 0 HD23 LEU B 20 5.386 11.708 -0.715 1.00 0.00 H new ATOM 1646 N ASN B 21 2.244 15.587 1.343 1.00 0.00 N ATOM 1647 CA ASN B 21 1.600 16.791 1.863 1.00 0.00 C ATOM 1648 C ASN B 21 0.431 16.428 2.775 1.00 0.00 C ATOM 1649 O ASN B 21 0.293 16.974 3.868 1.00 0.00 O ATOM 1650 CB ASN B 21 1.112 17.674 0.708 1.00 0.00 C ATOM 1651 CG ASN B 21 0.377 18.920 1.179 1.00 0.00 C ATOM 1652 OD1 ASN B 21 0.663 19.467 2.242 1.00 0.00 O ATOM 1653 ND2 ASN B 21 -0.579 19.373 0.384 1.00 0.00 N ATOM 0 H ASN B 21 2.251 15.523 0.325 1.00 0.00 H new ATOM 0 HA ASN B 21 2.334 17.346 2.447 1.00 0.00 H new ATOM 0 HB2 ASN B 21 1.966 17.971 0.100 1.00 0.00 H new ATOM 0 HB3 ASN B 21 0.452 17.091 0.066 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -1.109 20.205 0.646 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -0.786 18.891 -0.490 1.00 0.00 H new ATOM 1660 N VAL B 22 -0.392 15.484 2.331 1.00 0.00 N ATOM 1661 CA VAL B 22 -1.548 15.046 3.112 1.00 0.00 C ATOM 1662 C VAL B 22 -1.116 14.517 4.480 1.00 0.00 C ATOM 1663 O VAL B 22 -1.691 14.881 5.509 1.00 0.00 O ATOM 1664 CB VAL B 22 -2.349 13.953 2.371 1.00 0.00 C ATOM 1665 CG1 VAL B 22 -3.539 13.492 3.204 1.00 0.00 C ATOM 1666 CG2 VAL B 22 -2.812 14.459 1.013 1.00 0.00 C ATOM 0 H VAL B 22 -0.282 15.007 1.436 1.00 0.00 H new ATOM 0 HA VAL B 22 -2.189 15.917 3.250 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.692 13.097 2.216 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.087 12.722 2.661 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.184 13.085 4.151 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -4.198 14.339 3.397 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.375 13.676 0.505 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -3.449 15.333 1.148 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.945 14.731 0.411 1.00 0.00 H new ATOM 1676 N LEU B 23 -0.090 13.678 4.488 1.00 0.00 N ATOM 1677 CA LEU B 23 0.419 13.104 5.729 1.00 0.00 C ATOM 1678 C LEU B 23 1.093 14.169 6.593 1.00 0.00 C ATOM 1679 O LEU B 23 0.910 14.196 7.808 1.00 0.00 O ATOM 1680 CB LEU B 23 1.399 11.958 5.441 1.00 0.00 C ATOM 1681 CG LEU B 23 0.762 10.587 5.173 1.00 0.00 C ATOM 1682 CD1 LEU B 23 -0.122 10.616 3.934 1.00 0.00 C ATOM 1683 CD2 LEU B 23 1.840 9.524 5.034 1.00 0.00 C ATOM 0 H LEU B 23 0.408 13.378 3.650 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.432 12.703 6.280 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.005 12.231 4.577 1.00 0.00 H new ATOM 0 HB3 LEU B 23 2.077 11.863 6.289 1.00 0.00 H new ATOM 0 HG LEU B 23 0.129 10.339 6.025 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -0.557 9.629 3.774 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -0.920 11.346 4.073 1.00 0.00 H new ATOM 0 HD13 LEU B 23 0.477 10.894 3.066 1.00 0.00 H new ATOM 0 HD21 LEU B 23 1.375 8.557 4.844 1.00 0.00 H new ATOM 0 HD22 LEU B 23 2.498 9.779 4.203 1.00 0.00 H new ATOM 0 HD23 LEU B 23 2.421 9.473 5.955 1.00 0.00 H new ATOM 1695 N GLU B 24 1.853 15.049 5.955 1.00 0.00 N ATOM 1696 CA GLU B 24 2.566 16.116 6.656 1.00 0.00 C ATOM 1697 C GLU B 24 1.584 17.086 7.308 1.00 0.00 C ATOM 1698 O GLU B 24 1.715 17.426 8.484 1.00 0.00 O ATOM 1699 CB GLU B 24 3.464 16.871 5.672 1.00 0.00 C ATOM 1700 CG GLU B 24 4.361 17.912 6.323 1.00 0.00 C ATOM 1701 CD GLU B 24 5.438 17.287 7.183 1.00 0.00 C ATOM 1702 OE1 GLU B 24 6.458 16.836 6.622 1.00 0.00 O ATOM 1703 OE2 GLU B 24 5.269 17.239 8.418 1.00 0.00 O ATOM 0 H GLU B 24 1.994 15.047 4.945 1.00 0.00 H new ATOM 0 HA GLU B 24 3.179 15.667 7.438 1.00 0.00 H new ATOM 0 HB2 GLU B 24 4.087 16.152 5.140 1.00 0.00 H new ATOM 0 HB3 GLU B 24 2.837 17.362 4.928 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.826 18.522 5.549 1.00 0.00 H new ATOM 0 HG3 GLU B 24 3.754 18.580 6.934 1.00 0.00 H new ATOM 1710 N LYS B 25 0.586 17.503 6.539 1.00 0.00 N ATOM 1711 CA LYS B 25 -0.391 18.489 6.990 1.00 0.00 C ATOM 1712 C LYS B 25 -1.197 17.976 8.189 1.00 0.00 C ATOM 1713 O LYS B 25 -1.778 18.759 8.939 1.00 0.00 O ATOM 1714 CB LYS B 25 -1.327 18.845 5.831 1.00 0.00 C ATOM 1715 CG LYS B 25 -2.263 20.012 6.117 1.00 0.00 C ATOM 1716 CD LYS B 25 -3.129 20.349 4.910 1.00 0.00 C ATOM 1717 CE LYS B 25 -4.016 19.182 4.513 1.00 0.00 C ATOM 1718 NZ LYS B 25 -4.911 19.523 3.376 1.00 0.00 N ATOM 0 H LYS B 25 0.430 17.169 5.588 1.00 0.00 H new ATOM 0 HA LYS B 25 0.145 19.381 7.315 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -0.726 19.083 4.954 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -1.924 17.969 5.579 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.901 19.767 6.966 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -1.678 20.887 6.401 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -3.749 21.216 5.137 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -2.491 20.624 4.070 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -3.393 18.330 4.241 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -4.618 18.877 5.369 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -5.255 18.648 2.931 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -5.720 20.076 3.725 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -4.385 20.084 2.676 1.00 0.00 H new ATOM 1732 N HIS B 26 -1.234 16.661 8.364 1.00 0.00 N ATOM 1733 CA HIS B 26 -1.961 16.065 9.483 1.00 0.00 C ATOM 1734 C HIS B 26 -0.998 15.556 10.545 1.00 0.00 C ATOM 1735 O HIS B 26 -1.414 15.222 11.656 1.00 0.00 O ATOM 1736 CB HIS B 26 -2.843 14.906 9.008 1.00 0.00 C ATOM 1737 CG HIS B 26 -4.023 15.326 8.187 1.00 0.00 C ATOM 1738 ND1 HIS B 26 -5.324 15.051 8.550 1.00 0.00 N ATOM 1739 CD2 HIS B 26 -4.099 15.970 6.999 1.00 0.00 C ATOM 1740 CE1 HIS B 26 -6.141 15.505 7.624 1.00 0.00 C ATOM 1741 NE2 HIS B 26 -5.426 16.065 6.674 1.00 0.00 N ATOM 0 H HIS B 26 -0.773 15.989 7.751 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.592 16.843 9.913 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.234 14.218 8.422 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.199 14.355 9.879 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.268 16.340 6.416 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.218 15.430 7.642 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.799 16.500 5.830 1.00 0.00 H new ATOM 1750 N LYS B 27 0.285 15.511 10.193 1.00 0.00 N ATOM 1751 CA LYS B 27 1.320 14.926 11.041 1.00 0.00 C ATOM 1752 C LYS B 27 0.922 13.532 11.505 1.00 0.00 C ATOM 1753 O LYS B 27 0.798 13.263 12.701 1.00 0.00 O ATOM 1754 CB LYS B 27 1.637 15.830 12.231 1.00 0.00 C ATOM 1755 CG LYS B 27 2.405 17.076 11.838 1.00 0.00 C ATOM 1756 CD LYS B 27 2.851 17.866 13.052 1.00 0.00 C ATOM 1757 CE LYS B 27 3.828 18.959 12.657 1.00 0.00 C ATOM 1758 NZ LYS B 27 4.352 19.699 13.833 1.00 0.00 N ATOM 0 H LYS B 27 0.637 15.880 9.310 1.00 0.00 H new ATOM 0 HA LYS B 27 2.227 14.835 10.443 1.00 0.00 H new ATOM 0 HB2 LYS B 27 0.706 16.122 12.717 1.00 0.00 H new ATOM 0 HB3 LYS B 27 2.217 15.268 12.963 1.00 0.00 H new ATOM 0 HG2 LYS B 27 3.276 16.795 11.247 1.00 0.00 H new ATOM 0 HG3 LYS B 27 1.779 17.705 11.205 1.00 0.00 H new ATOM 0 HD2 LYS B 27 1.984 18.308 13.542 1.00 0.00 H new ATOM 0 HD3 LYS B 27 3.319 17.197 13.774 1.00 0.00 H new ATOM 0 HE2 LYS B 27 4.660 18.518 12.108 1.00 0.00 H new ATOM 0 HE3 LYS B 27 3.334 19.658 11.981 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 5.014 20.434 13.513 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 3.562 20.143 14.344 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 4.847 19.039 14.466 1.00 0.00 H new ATOM 1772 N ALA B 28 0.710 12.654 10.539 1.00 0.00 N ATOM 1773 CA ALA B 28 0.306 11.289 10.824 1.00 0.00 C ATOM 1774 C ALA B 28 1.517 10.436 11.180 1.00 0.00 C ATOM 1775 O ALA B 28 2.465 10.339 10.402 1.00 0.00 O ATOM 1776 CB ALA B 28 -0.429 10.696 9.631 1.00 0.00 C ATOM 0 H ALA B 28 0.812 12.864 9.546 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.370 11.300 11.679 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.726 9.672 9.859 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -1.316 11.292 9.417 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.228 10.698 8.761 1.00 0.00 H new ATOM 1782 N PRO B 29 1.512 9.826 12.374 1.00 0.00 N ATOM 1783 CA PRO B 29 2.589 8.937 12.809 1.00 0.00 C ATOM 1784 C PRO B 29 2.734 7.728 11.887 1.00 0.00 C ATOM 1785 O PRO B 29 1.826 7.417 11.111 1.00 0.00 O ATOM 1786 CB PRO B 29 2.167 8.498 14.216 1.00 0.00 C ATOM 1787 CG PRO B 29 0.710 8.798 14.304 1.00 0.00 C ATOM 1788 CD PRO B 29 0.466 9.969 13.397 1.00 0.00 C ATOM 0 HA PRO B 29 3.559 9.434 12.791 1.00 0.00 H new ATOM 0 HB2 PRO B 29 2.360 7.436 14.371 1.00 0.00 H new ATOM 0 HB3 PRO B 29 2.726 9.038 14.980 1.00 0.00 H new ATOM 0 HG2 PRO B 29 0.116 7.937 13.996 1.00 0.00 H new ATOM 0 HG3 PRO B 29 0.423 9.033 15.329 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -0.532 9.938 12.959 1.00 0.00 H new ATOM 0 HD3 PRO B 29 0.551 10.916 13.930 1.00 0.00 H new ATOM 1796 N THR B 30 3.870 7.048 11.988 1.00 0.00 N ATOM 1797 CA THR B 30 4.203 5.939 11.098 1.00 0.00 C ATOM 1798 C THR B 30 3.097 4.880 11.053 1.00 0.00 C ATOM 1799 O THR B 30 2.655 4.486 9.973 1.00 0.00 O ATOM 1800 CB THR B 30 5.530 5.281 11.524 1.00 0.00 C ATOM 1801 OG1 THR B 30 6.529 6.292 11.723 1.00 0.00 O ATOM 1802 CG2 THR B 30 6.008 4.286 10.473 1.00 0.00 C ATOM 0 H THR B 30 4.586 7.248 12.687 1.00 0.00 H new ATOM 0 HA THR B 30 4.307 6.358 10.097 1.00 0.00 H new ATOM 0 HB THR B 30 5.362 4.742 12.456 1.00 0.00 H new ATOM 0 HG1 THR B 30 7.371 5.871 11.995 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.946 3.836 10.798 1.00 0.00 H new ATOM 0 HG22 THR B 30 5.258 3.506 10.342 1.00 0.00 H new ATOM 0 HG23 THR B 30 6.163 4.803 9.526 1.00 0.00 H new ATOM 1810 N ASP B 31 2.641 4.437 12.222 1.00 0.00 N ATOM 1811 CA ASP B 31 1.609 3.402 12.302 1.00 0.00 C ATOM 1812 C ASP B 31 0.317 3.852 11.634 1.00 0.00 C ATOM 1813 O ASP B 31 -0.254 3.123 10.821 1.00 0.00 O ATOM 1814 CB ASP B 31 1.328 3.018 13.755 1.00 0.00 C ATOM 1815 CG ASP B 31 2.468 2.246 14.379 1.00 0.00 C ATOM 1816 OD1 ASP B 31 2.607 1.041 14.081 1.00 0.00 O ATOM 1817 OD2 ASP B 31 3.224 2.836 15.175 1.00 0.00 O ATOM 0 H ASP B 31 2.968 4.777 13.126 1.00 0.00 H new ATOM 0 HA ASP B 31 1.989 2.529 11.771 1.00 0.00 H new ATOM 0 HB2 ASP B 31 1.143 3.921 14.337 1.00 0.00 H new ATOM 0 HB3 ASP B 31 0.419 2.418 13.800 1.00 0.00 H new ATOM 1822 N LEU B 32 -0.139 5.049 11.984 1.00 0.00 N ATOM 1823 CA LEU B 32 -1.343 5.618 11.390 1.00 0.00 C ATOM 1824 C LEU B 32 -1.198 5.729 9.878 1.00 0.00 C ATOM 1825 O LEU B 32 -2.097 5.342 9.134 1.00 0.00 O ATOM 1826 CB LEU B 32 -1.637 6.996 11.988 1.00 0.00 C ATOM 1827 CG LEU B 32 -2.858 7.715 11.408 1.00 0.00 C ATOM 1828 CD1 LEU B 32 -4.122 6.909 11.657 1.00 0.00 C ATOM 1829 CD2 LEU B 32 -2.984 9.107 12.005 1.00 0.00 C ATOM 0 H LEU B 32 0.309 5.646 12.679 1.00 0.00 H new ATOM 0 HA LEU B 32 -2.176 4.952 11.613 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -1.779 6.884 13.063 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -0.762 7.630 11.846 1.00 0.00 H new ATOM 0 HG LEU B 32 -2.723 7.812 10.331 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -4.979 7.437 11.237 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -4.030 5.932 11.183 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -4.266 6.780 12.730 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -3.856 9.606 11.583 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -3.097 9.030 13.086 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -2.089 9.684 11.774 1.00 0.00 H new ATOM 1841 N SER B 33 -0.062 6.250 9.434 1.00 0.00 N ATOM 1842 CA SER B 33 0.212 6.396 8.012 1.00 0.00 C ATOM 1843 C SER B 33 0.112 5.051 7.297 1.00 0.00 C ATOM 1844 O SER B 33 -0.585 4.930 6.293 1.00 0.00 O ATOM 1845 CB SER B 33 1.599 7.006 7.802 1.00 0.00 C ATOM 1846 OG SER B 33 1.677 8.297 8.379 1.00 0.00 O ATOM 0 H SER B 33 0.688 6.580 10.042 1.00 0.00 H new ATOM 0 HA SER B 33 -0.537 7.064 7.586 1.00 0.00 H new ATOM 0 HB2 SER B 33 2.356 6.359 8.245 1.00 0.00 H new ATOM 0 HB3 SER B 33 1.816 7.066 6.736 1.00 0.00 H new ATOM 0 HG SER B 33 1.736 8.217 9.354 1.00 0.00 H new ATOM 1852 N LEU B 34 0.787 4.038 7.836 1.00 0.00 N ATOM 1853 CA LEU B 34 0.771 2.701 7.242 1.00 0.00 C ATOM 1854 C LEU B 34 -0.649 2.147 7.179 1.00 0.00 C ATOM 1855 O LEU B 34 -1.032 1.509 6.199 1.00 0.00 O ATOM 1856 CB LEU B 34 1.671 1.750 8.036 1.00 0.00 C ATOM 1857 CG LEU B 34 3.160 2.102 8.026 1.00 0.00 C ATOM 1858 CD1 LEU B 34 3.939 1.138 8.905 1.00 0.00 C ATOM 1859 CD2 LEU B 34 3.707 2.083 6.605 1.00 0.00 C ATOM 0 H LEU B 34 1.351 4.116 8.682 1.00 0.00 H new ATOM 0 HA LEU B 34 1.154 2.782 6.225 1.00 0.00 H new ATOM 0 HB2 LEU B 34 1.326 1.728 9.070 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.549 0.743 7.637 1.00 0.00 H new ATOM 0 HG LEU B 34 3.276 3.109 8.426 1.00 0.00 H new ATOM 0 HD11 LEU B 34 4.996 1.402 8.887 1.00 0.00 H new ATOM 0 HD12 LEU B 34 3.568 1.197 9.928 1.00 0.00 H new ATOM 0 HD13 LEU B 34 3.813 0.122 8.532 1.00 0.00 H new ATOM 0 HD21 LEU B 34 4.767 2.336 6.620 1.00 0.00 H new ATOM 0 HD22 LEU B 34 3.577 1.088 6.178 1.00 0.00 H new ATOM 0 HD23 LEU B 34 3.169 2.811 5.998 1.00 0.00 H new ATOM 1871 N MET B 35 -1.429 2.408 8.222 1.00 0.00 N ATOM 1872 CA MET B 35 -2.817 1.967 8.270 1.00 0.00 C ATOM 1873 C MET B 35 -3.627 2.627 7.159 1.00 0.00 C ATOM 1874 O MET B 35 -4.353 1.957 6.429 1.00 0.00 O ATOM 1875 CB MET B 35 -3.437 2.289 9.630 1.00 0.00 C ATOM 1876 CG MET B 35 -4.902 1.895 9.739 1.00 0.00 C ATOM 1877 SD MET B 35 -5.640 2.389 11.307 1.00 0.00 S ATOM 1878 CE MET B 35 -7.327 1.825 11.086 1.00 0.00 C ATOM 0 H MET B 35 -1.122 2.924 9.047 1.00 0.00 H new ATOM 0 HA MET B 35 -2.835 0.887 8.124 1.00 0.00 H new ATOM 0 HB2 MET B 35 -2.872 1.776 10.408 1.00 0.00 H new ATOM 0 HB3 MET B 35 -3.342 3.358 9.820 1.00 0.00 H new ATOM 0 HG2 MET B 35 -5.459 2.351 8.920 1.00 0.00 H new ATOM 0 HG3 MET B 35 -4.993 0.815 9.623 1.00 0.00 H new ATOM 0 HE1 MET B 35 -7.909 2.061 11.977 1.00 0.00 H new ATOM 0 HE2 MET B 35 -7.767 2.324 10.222 1.00 0.00 H new ATOM 0 HE3 MET B 35 -7.332 0.747 10.924 1.00 0.00 H new ATOM 1888 N VAL B 36 -3.488 3.940 7.027 1.00 0.00 N ATOM 1889 CA VAL B 36 -4.223 4.685 6.011 1.00 0.00 C ATOM 1890 C VAL B 36 -3.743 4.317 4.607 1.00 0.00 C ATOM 1891 O VAL B 36 -4.543 4.213 3.680 1.00 0.00 O ATOM 1892 CB VAL B 36 -4.102 6.209 6.225 1.00 0.00 C ATOM 1893 CG1 VAL B 36 -4.902 6.969 5.177 1.00 0.00 C ATOM 1894 CG2 VAL B 36 -4.567 6.588 7.621 1.00 0.00 C ATOM 0 H VAL B 36 -2.875 4.511 7.609 1.00 0.00 H new ATOM 0 HA VAL B 36 -5.273 4.409 6.108 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.053 6.484 6.120 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -4.801 8.041 5.349 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -4.526 6.724 4.184 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -5.953 6.688 5.247 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -4.475 7.666 7.755 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -5.609 6.294 7.750 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -3.951 6.077 8.361 1.00 0.00 H new ATOM 1904 N LEU B 37 -2.439 4.106 4.461 1.00 0.00 N ATOM 1905 CA LEU B 37 -1.873 3.675 3.187 1.00 0.00 C ATOM 1906 C LEU B 37 -2.433 2.314 2.795 1.00 0.00 C ATOM 1907 O LEU B 37 -2.859 2.115 1.657 1.00 0.00 O ATOM 1908 CB LEU B 37 -0.344 3.618 3.260 1.00 0.00 C ATOM 1909 CG LEU B 37 0.347 4.969 3.455 1.00 0.00 C ATOM 1910 CD1 LEU B 37 1.853 4.788 3.573 1.00 0.00 C ATOM 1911 CD2 LEU B 37 0.006 5.911 2.308 1.00 0.00 C ATOM 0 H LEU B 37 -1.755 4.226 5.208 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.151 4.404 2.426 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.059 2.960 4.081 1.00 0.00 H new ATOM 0 HB3 LEU B 37 0.031 3.164 2.343 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.016 5.412 4.382 1.00 0.00 H new ATOM 0 HD11 LEU B 37 2.327 5.760 3.711 1.00 0.00 H new ATOM 0 HD12 LEU B 37 2.077 4.150 4.428 1.00 0.00 H new ATOM 0 HD13 LEU B 37 2.236 4.324 2.664 1.00 0.00 H new ATOM 0 HD21 LEU B 37 0.505 6.868 2.462 1.00 0.00 H new ATOM 0 HD22 LEU B 37 0.340 5.474 1.367 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -1.072 6.066 2.273 1.00 0.00 H new ATOM 1923 N GLY B 38 -2.448 1.386 3.746 1.00 0.00 N ATOM 1924 CA GLY B 38 -3.029 0.080 3.502 1.00 0.00 C ATOM 1925 C GLY B 38 -4.509 0.174 3.207 1.00 0.00 C ATOM 1926 O GLY B 38 -5.033 -0.549 2.356 1.00 0.00 O ATOM 0 H GLY B 38 -2.067 1.516 4.683 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.520 -0.394 2.663 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.871 -0.557 4.372 1.00 0.00 H new ATOM 1930 N ASN B 39 -5.181 1.079 3.909 1.00 0.00 N ATOM 1931 CA ASN B 39 -6.598 1.338 3.696 1.00 0.00 C ATOM 1932 C ASN B 39 -6.830 1.844 2.273 1.00 0.00 C ATOM 1933 O ASN B 39 -7.786 1.451 1.609 1.00 0.00 O ATOM 1934 CB ASN B 39 -7.101 2.366 4.715 1.00 0.00 C ATOM 1935 CG ASN B 39 -8.611 2.514 4.711 1.00 0.00 C ATOM 1936 OD1 ASN B 39 -9.343 1.564 4.443 1.00 0.00 O ATOM 1937 ND2 ASN B 39 -9.085 3.713 5.016 1.00 0.00 N ATOM 0 H ASN B 39 -4.759 1.652 4.640 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.153 0.410 3.831 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -6.773 2.072 5.712 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -6.646 3.333 4.502 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -10.092 3.874 5.034 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -8.443 4.475 5.232 1.00 0.00 H new ATOM 1944 N MET B 40 -5.934 2.708 1.813 1.00 0.00 N ATOM 1945 CA MET B 40 -5.979 3.218 0.445 1.00 0.00 C ATOM 1946 C MET B 40 -5.771 2.101 -0.570 1.00 0.00 C ATOM 1947 O MET B 40 -6.568 1.939 -1.493 1.00 0.00 O ATOM 1948 CB MET B 40 -4.915 4.298 0.243 1.00 0.00 C ATOM 1949 CG MET B 40 -5.374 5.689 0.641 1.00 0.00 C ATOM 1950 SD MET B 40 -6.602 6.363 -0.495 1.00 0.00 S ATOM 1951 CE MET B 40 -5.677 6.362 -2.031 1.00 0.00 C ATOM 0 H MET B 40 -5.162 3.073 2.370 1.00 0.00 H new ATOM 0 HA MET B 40 -6.968 3.649 0.287 1.00 0.00 H new ATOM 0 HB2 MET B 40 -4.030 4.037 0.824 1.00 0.00 H new ATOM 0 HB3 MET B 40 -4.616 4.310 -0.805 1.00 0.00 H new ATOM 0 HG2 MET B 40 -5.794 5.656 1.646 1.00 0.00 H new ATOM 0 HG3 MET B 40 -4.513 6.356 0.677 1.00 0.00 H new ATOM 0 HE1 MET B 40 -6.085 7.118 -2.702 1.00 0.00 H new ATOM 0 HE2 MET B 40 -4.630 6.586 -1.826 1.00 0.00 H new ATOM 0 HE3 MET B 40 -5.752 5.381 -2.501 1.00 0.00 H new ATOM 1961 N VAL B 41 -4.702 1.330 -0.386 1.00 0.00 N ATOM 1962 CA VAL B 41 -4.364 0.253 -1.313 1.00 0.00 C ATOM 1963 C VAL B 41 -5.502 -0.761 -1.412 1.00 0.00 C ATOM 1964 O VAL B 41 -5.913 -1.133 -2.511 1.00 0.00 O ATOM 1965 CB VAL B 41 -3.059 -0.466 -0.898 1.00 0.00 C ATOM 1966 CG1 VAL B 41 -2.735 -1.610 -1.851 1.00 0.00 C ATOM 1967 CG2 VAL B 41 -1.899 0.517 -0.843 1.00 0.00 C ATOM 0 H VAL B 41 -4.055 1.431 0.396 1.00 0.00 H new ATOM 0 HA VAL B 41 -4.209 0.710 -2.291 1.00 0.00 H new ATOM 0 HB VAL B 41 -3.211 -0.884 0.097 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -1.813 -2.097 -1.535 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -3.550 -2.334 -1.841 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -2.611 -1.218 -2.861 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -0.990 -0.009 -0.549 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -1.756 0.967 -1.826 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -2.118 1.298 -0.115 1.00 0.00 H new ATOM 1977 N THR B 42 -6.025 -1.184 -0.264 1.00 0.00 N ATOM 1978 CA THR B 42 -7.112 -2.155 -0.241 1.00 0.00 C ATOM 1979 C THR B 42 -8.350 -1.613 -0.951 1.00 0.00 C ATOM 1980 O THR B 42 -8.911 -2.279 -1.817 1.00 0.00 O ATOM 1981 CB THR B 42 -7.482 -2.568 1.198 1.00 0.00 C ATOM 1982 OG1 THR B 42 -7.580 -1.411 2.036 1.00 0.00 O ATOM 1983 CG2 THR B 42 -6.455 -3.529 1.774 1.00 0.00 C ATOM 0 H THR B 42 -5.715 -0.871 0.656 1.00 0.00 H new ATOM 0 HA THR B 42 -6.754 -3.038 -0.771 1.00 0.00 H new ATOM 0 HB THR B 42 -8.447 -3.073 1.163 1.00 0.00 H new ATOM 0 HG1 THR B 42 -6.681 -1.111 2.286 1.00 0.00 H new ATOM 0 HG21 THR B 42 -6.742 -3.803 2.789 1.00 0.00 H new ATOM 0 HG22 THR B 42 -6.409 -4.426 1.156 1.00 0.00 H new ATOM 0 HG23 THR B 42 -5.477 -3.049 1.791 1.00 0.00 H new ATOM 1991 N ASN B 43 -8.757 -0.397 -0.596 1.00 0.00 N ATOM 1992 CA ASN B 43 -9.920 0.233 -1.219 1.00 0.00 C ATOM 1993 C ASN B 43 -9.738 0.349 -2.725 1.00 0.00 C ATOM 1994 O ASN B 43 -10.596 -0.084 -3.487 1.00 0.00 O ATOM 1995 CB ASN B 43 -10.182 1.620 -0.626 1.00 0.00 C ATOM 1996 CG ASN B 43 -11.093 1.579 0.586 1.00 0.00 C ATOM 1997 OD1 ASN B 43 -12.315 1.664 0.460 1.00 0.00 O ATOM 1998 ND2 ASN B 43 -10.510 1.456 1.766 1.00 0.00 N ATOM 0 H ASN B 43 -8.301 0.171 0.118 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.780 -0.404 -1.015 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.232 2.075 -0.346 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.628 2.258 -1.389 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -11.076 1.429 2.614 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -9.494 1.388 1.828 1.00 0.00 H new ATOM 2005 N LEU B 44 -8.604 0.906 -3.139 1.00 0.00 N ATOM 2006 CA LEU B 44 -8.321 1.140 -4.551 1.00 0.00 C ATOM 2007 C LEU B 44 -8.427 -0.160 -5.351 1.00 0.00 C ATOM 2008 O LEU B 44 -9.065 -0.201 -6.404 1.00 0.00 O ATOM 2009 CB LEU B 44 -6.921 1.766 -4.700 1.00 0.00 C ATOM 2010 CG LEU B 44 -6.579 2.383 -6.070 1.00 0.00 C ATOM 2011 CD1 LEU B 44 -6.209 1.312 -7.088 1.00 0.00 C ATOM 2012 CD2 LEU B 44 -7.738 3.232 -6.579 1.00 0.00 C ATOM 0 H LEU B 44 -7.860 1.206 -2.510 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.062 1.833 -4.951 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -6.813 2.541 -3.942 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.180 0.998 -4.479 1.00 0.00 H new ATOM 0 HG LEU B 44 -5.709 3.026 -5.937 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -5.974 1.783 -8.042 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -5.340 0.757 -6.733 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.048 0.628 -7.218 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -7.478 3.659 -7.547 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -8.627 2.609 -6.684 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -7.939 4.035 -5.870 1.00 0.00 H new ATOM 2024 N ILE B 45 -7.820 -1.221 -4.840 1.00 0.00 N ATOM 2025 CA ILE B 45 -7.823 -2.501 -5.533 1.00 0.00 C ATOM 2026 C ILE B 45 -9.205 -3.154 -5.490 1.00 0.00 C ATOM 2027 O ILE B 45 -9.691 -3.651 -6.500 1.00 0.00 O ATOM 2028 CB ILE B 45 -6.771 -3.469 -4.944 1.00 0.00 C ATOM 2029 CG1 ILE B 45 -5.364 -2.876 -5.083 1.00 0.00 C ATOM 2030 CG2 ILE B 45 -6.845 -4.822 -5.635 1.00 0.00 C ATOM 2031 CD1 ILE B 45 -4.275 -3.744 -4.489 1.00 0.00 C ATOM 0 H ILE B 45 -7.321 -1.221 -3.951 1.00 0.00 H new ATOM 0 HA ILE B 45 -7.563 -2.297 -6.572 1.00 0.00 H new ATOM 0 HB ILE B 45 -6.987 -3.610 -3.885 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.151 -2.714 -6.140 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.342 -1.899 -4.600 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -6.097 -5.490 -5.208 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -7.838 -5.249 -5.493 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -6.653 -4.697 -6.701 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -3.308 -3.259 -4.625 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -4.463 -3.886 -3.425 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -4.269 -4.713 -4.989 1.00 0.00 H new ATOM 2043 N ASN B 46 -9.844 -3.127 -4.329 1.00 0.00 N ATOM 2044 CA ASN B 46 -11.131 -3.799 -4.152 1.00 0.00 C ATOM 2045 C ASN B 46 -12.245 -3.129 -4.952 1.00 0.00 C ATOM 2046 O ASN B 46 -13.208 -3.787 -5.346 1.00 0.00 O ATOM 2047 CB ASN B 46 -11.526 -3.857 -2.672 1.00 0.00 C ATOM 2048 CG ASN B 46 -10.679 -4.837 -1.875 1.00 0.00 C ATOM 2049 OD1 ASN B 46 -10.184 -5.828 -2.406 1.00 0.00 O ATOM 2050 ND2 ASN B 46 -10.515 -4.569 -0.586 1.00 0.00 N ATOM 0 H ASN B 46 -9.497 -2.650 -3.497 1.00 0.00 H new ATOM 0 HA ASN B 46 -11.004 -4.814 -4.530 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.431 -2.863 -2.236 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -12.575 -4.141 -2.591 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -9.962 -5.196 -0.001 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -10.941 -3.736 -0.180 1.00 0.00 H new ATOM 2057 N THR B 47 -12.129 -1.828 -5.184 1.00 0.00 N ATOM 2058 CA THR B 47 -13.156 -1.108 -5.924 1.00 0.00 C ATOM 2059 C THR B 47 -12.880 -1.127 -7.425 1.00 0.00 C ATOM 2060 O THR B 47 -13.757 -1.465 -8.219 1.00 0.00 O ATOM 2061 CB THR B 47 -13.286 0.355 -5.447 1.00 0.00 C ATOM 2062 OG1 THR B 47 -12.027 1.034 -5.561 1.00 0.00 O ATOM 2063 CG2 THR B 47 -13.771 0.411 -4.004 1.00 0.00 C ATOM 0 H THR B 47 -11.344 -1.255 -4.875 1.00 0.00 H new ATOM 0 HA THR B 47 -14.096 -1.624 -5.729 1.00 0.00 H new ATOM 0 HB THR B 47 -14.018 0.853 -6.083 1.00 0.00 H new ATOM 0 HG1 THR B 47 -11.430 0.739 -4.842 1.00 0.00 H new ATOM 0 HG21 THR B 47 -13.855 1.451 -3.689 1.00 0.00 H new ATOM 0 HG22 THR B 47 -14.746 -0.071 -3.929 1.00 0.00 H new ATOM 0 HG23 THR B 47 -13.059 -0.107 -3.361 1.00 0.00 H new ATOM 2071 N SER B 48 -11.657 -0.783 -7.810 1.00 0.00 N ATOM 2072 CA SER B 48 -11.320 -0.637 -9.218 1.00 0.00 C ATOM 2073 C SER B 48 -11.031 -1.987 -9.876 1.00 0.00 C ATOM 2074 O SER B 48 -11.430 -2.225 -11.017 1.00 0.00 O ATOM 2075 CB SER B 48 -10.115 0.293 -9.372 1.00 0.00 C ATOM 2076 OG SER B 48 -10.356 1.544 -8.744 1.00 0.00 O ATOM 0 H SER B 48 -10.885 -0.601 -7.168 1.00 0.00 H new ATOM 0 HA SER B 48 -12.182 -0.203 -9.724 1.00 0.00 H new ATOM 0 HB2 SER B 48 -9.232 -0.174 -8.935 1.00 0.00 H new ATOM 0 HB3 SER B 48 -9.903 0.448 -10.430 1.00 0.00 H new ATOM 0 HG SER B 48 -9.572 2.122 -8.854 1.00 0.00 H new ATOM 2082 N ILE B 49 -10.359 -2.871 -9.151 1.00 0.00 N ATOM 2083 CA ILE B 49 -9.933 -4.146 -9.711 1.00 0.00 C ATOM 2084 C ILE B 49 -10.980 -5.227 -9.457 1.00 0.00 C ATOM 2085 O ILE B 49 -11.592 -5.279 -8.388 1.00 0.00 O ATOM 2086 CB ILE B 49 -8.571 -4.589 -9.121 1.00 0.00 C ATOM 2087 CG1 ILE B 49 -7.506 -3.514 -9.366 1.00 0.00 C ATOM 2088 CG2 ILE B 49 -8.125 -5.924 -9.706 1.00 0.00 C ATOM 2089 CD1 ILE B 49 -7.258 -3.212 -10.829 1.00 0.00 C ATOM 0 H ILE B 49 -10.098 -2.729 -8.175 1.00 0.00 H new ATOM 0 HA ILE B 49 -9.818 -4.009 -10.786 1.00 0.00 H new ATOM 0 HB ILE B 49 -8.697 -4.719 -8.046 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -7.809 -2.596 -8.863 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -6.570 -3.834 -8.908 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -7.166 -6.209 -9.273 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -8.868 -6.688 -9.477 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -8.022 -5.831 -10.787 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -6.492 -2.442 -10.917 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -6.923 -4.117 -11.336 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -8.181 -2.860 -11.289 1.00 0.00 H new ATOM 2101 N ALA B 50 -11.188 -6.080 -10.457 1.00 0.00 N ATOM 2102 CA ALA B 50 -12.142 -7.176 -10.355 1.00 0.00 C ATOM 2103 C ALA B 50 -11.793 -8.108 -9.196 1.00 0.00 C ATOM 2104 O ALA B 50 -10.639 -8.524 -9.048 1.00 0.00 O ATOM 2105 CB ALA B 50 -12.188 -7.954 -11.663 1.00 0.00 C ATOM 0 H ALA B 50 -10.703 -6.030 -11.353 1.00 0.00 H new ATOM 0 HA ALA B 50 -13.126 -6.751 -10.158 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -12.904 -8.771 -11.575 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -12.493 -7.289 -12.471 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -11.200 -8.360 -11.880 1.00 0.00 H new ATOM 2111 N PRO B 51 -12.798 -8.444 -8.364 1.00 0.00 N ATOM 2112 CA PRO B 51 -12.631 -9.313 -7.187 1.00 0.00 C ATOM 2113 C PRO B 51 -11.860 -10.598 -7.481 1.00 0.00 C ATOM 2114 O PRO B 51 -11.117 -11.090 -6.630 1.00 0.00 O ATOM 2115 CB PRO B 51 -14.070 -9.643 -6.791 1.00 0.00 C ATOM 2116 CG PRO B 51 -14.863 -8.471 -7.246 1.00 0.00 C ATOM 2117 CD PRO B 51 -14.194 -7.976 -8.500 1.00 0.00 C ATOM 0 HA PRO B 51 -12.048 -8.818 -6.410 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -14.411 -10.562 -7.268 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -14.161 -9.790 -5.715 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -15.898 -8.753 -7.441 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -14.883 -7.694 -6.482 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -14.667 -8.384 -9.393 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -14.246 -6.890 -8.579 1.00 0.00 H new ATOM 2125 N ALA B 52 -12.027 -11.121 -8.690 1.00 0.00 N ATOM 2126 CA ALA B 52 -11.386 -12.368 -9.100 1.00 0.00 C ATOM 2127 C ALA B 52 -9.862 -12.307 -8.963 1.00 0.00 C ATOM 2128 O ALA B 52 -9.216 -13.323 -8.708 1.00 0.00 O ATOM 2129 CB ALA B 52 -11.765 -12.700 -10.533 1.00 0.00 C ATOM 0 H ALA B 52 -12.608 -10.696 -9.412 1.00 0.00 H new ATOM 0 HA ALA B 52 -11.743 -13.153 -8.433 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -11.283 -13.631 -10.830 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -12.847 -12.812 -10.607 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -11.438 -11.895 -11.192 1.00 0.00 H new ATOM 2135 N GLN B 53 -9.282 -11.122 -9.126 1.00 0.00 N ATOM 2136 CA GLN B 53 -7.830 -10.992 -9.083 1.00 0.00 C ATOM 2137 C GLN B 53 -7.387 -9.870 -8.146 1.00 0.00 C ATOM 2138 O GLN B 53 -6.219 -9.486 -8.149 1.00 0.00 O ATOM 2139 CB GLN B 53 -7.271 -10.751 -10.489 1.00 0.00 C ATOM 2140 CG GLN B 53 -7.776 -9.478 -11.147 1.00 0.00 C ATOM 2141 CD GLN B 53 -7.130 -9.228 -12.493 1.00 0.00 C ATOM 2142 OE1 GLN B 53 -6.084 -8.586 -12.584 1.00 0.00 O ATOM 2143 NE2 GLN B 53 -7.747 -9.735 -13.546 1.00 0.00 N ATOM 0 H GLN B 53 -9.786 -10.250 -9.287 1.00 0.00 H new ATOM 0 HA GLN B 53 -7.432 -11.929 -8.693 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -6.183 -10.712 -10.434 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.528 -11.601 -11.121 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -8.857 -9.541 -11.272 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -7.580 -8.630 -10.490 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -8.613 -10.261 -13.426 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -7.358 -9.600 -14.479 1.00 0.00 H new ATOM 2152 N ARG B 54 -8.307 -9.369 -7.325 1.00 0.00 N ATOM 2153 CA ARG B 54 -7.996 -8.271 -6.407 1.00 0.00 C ATOM 2154 C ARG B 54 -6.868 -8.658 -5.449 1.00 0.00 C ATOM 2155 O ARG B 54 -5.966 -7.867 -5.180 1.00 0.00 O ATOM 2156 CB ARG B 54 -9.240 -7.845 -5.614 1.00 0.00 C ATOM 2157 CG ARG B 54 -9.822 -8.946 -4.742 1.00 0.00 C ATOM 2158 CD ARG B 54 -11.034 -8.464 -3.967 1.00 0.00 C ATOM 2159 NE ARG B 54 -11.657 -9.545 -3.207 1.00 0.00 N ATOM 2160 CZ ARG B 54 -12.967 -9.655 -3.016 1.00 0.00 C ATOM 2161 NH1 ARG B 54 -13.791 -8.744 -3.526 1.00 0.00 N ATOM 2162 NH2 ARG B 54 -13.450 -10.674 -2.316 1.00 0.00 N ATOM 0 H ARG B 54 -9.270 -9.702 -7.275 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.664 -7.425 -7.009 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.983 -6.994 -4.984 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -10.005 -7.505 -6.312 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -10.102 -9.795 -5.366 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -9.061 -9.300 -4.046 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.737 -7.666 -3.287 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -11.762 -8.039 -4.658 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.051 -10.257 -2.799 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -13.417 -7.962 -4.063 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -14.797 -8.828 -3.380 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -12.816 -11.371 -1.926 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.456 -10.760 -2.168 1.00 0.00 H new ATOM 2176 N GLN B 55 -6.908 -9.889 -4.957 1.00 0.00 N ATOM 2177 CA GLN B 55 -5.896 -10.362 -4.026 1.00 0.00 C ATOM 2178 C GLN B 55 -4.595 -10.653 -4.767 1.00 0.00 C ATOM 2179 O GLN B 55 -3.509 -10.456 -4.231 1.00 0.00 O ATOM 2180 CB GLN B 55 -6.394 -11.605 -3.285 1.00 0.00 C ATOM 2181 CG GLN B 55 -5.426 -12.124 -2.233 1.00 0.00 C ATOM 2182 CD GLN B 55 -6.030 -13.226 -1.387 1.00 0.00 C ATOM 2183 OE1 GLN B 55 -5.963 -14.401 -1.738 1.00 0.00 O ATOM 2184 NE2 GLN B 55 -6.620 -12.855 -0.260 1.00 0.00 N ATOM 0 H GLN B 55 -7.628 -10.575 -5.187 1.00 0.00 H new ATOM 0 HA GLN B 55 -5.703 -9.583 -3.288 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -7.346 -11.374 -2.806 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -6.586 -12.396 -4.010 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -4.527 -12.497 -2.723 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -5.119 -11.301 -1.588 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -6.655 -11.868 -0.003 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -7.039 -13.556 0.351 1.00 0.00 H new ATOM 2193 N ALA B 56 -4.717 -11.084 -6.017 1.00 0.00 N ATOM 2194 CA ALA B 56 -3.551 -11.372 -6.842 1.00 0.00 C ATOM 2195 C ALA B 56 -2.739 -10.105 -7.079 1.00 0.00 C ATOM 2196 O ALA B 56 -1.510 -10.115 -6.981 1.00 0.00 O ATOM 2197 CB ALA B 56 -3.979 -11.988 -8.165 1.00 0.00 C ATOM 0 H ALA B 56 -5.612 -11.242 -6.481 1.00 0.00 H new ATOM 0 HA ALA B 56 -2.921 -12.089 -6.315 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -3.097 -12.198 -8.771 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -4.519 -12.916 -7.977 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.628 -11.292 -8.697 1.00 0.00 H new ATOM 2203 N ILE B 57 -3.442 -9.014 -7.372 1.00 0.00 N ATOM 2204 CA ILE B 57 -2.807 -7.716 -7.569 1.00 0.00 C ATOM 2205 C ILE B 57 -2.102 -7.271 -6.290 1.00 0.00 C ATOM 2206 O ILE B 57 -0.984 -6.754 -6.329 1.00 0.00 O ATOM 2207 CB ILE B 57 -3.835 -6.639 -7.994 1.00 0.00 C ATOM 2208 CG1 ILE B 57 -4.524 -7.043 -9.304 1.00 0.00 C ATOM 2209 CG2 ILE B 57 -3.170 -5.275 -8.138 1.00 0.00 C ATOM 2210 CD1 ILE B 57 -3.573 -7.225 -10.468 1.00 0.00 C ATOM 0 H ILE B 57 -4.456 -9.005 -7.478 1.00 0.00 H new ATOM 0 HA ILE B 57 -2.076 -7.827 -8.370 1.00 0.00 H new ATOM 0 HB ILE B 57 -4.591 -6.565 -7.212 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -5.069 -7.973 -9.144 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -5.260 -6.283 -9.565 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -3.914 -4.537 -8.437 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -2.731 -4.982 -7.184 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -2.388 -5.330 -8.896 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -4.136 -7.510 -11.357 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.046 -6.290 -10.657 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -2.852 -8.006 -10.230 1.00 0.00 H new ATOM 2222 N ALA B 58 -2.759 -7.495 -5.156 1.00 0.00 N ATOM 2223 CA ALA B 58 -2.186 -7.157 -3.858 1.00 0.00 C ATOM 2224 C ALA B 58 -0.914 -7.957 -3.598 1.00 0.00 C ATOM 2225 O ALA B 58 0.066 -7.430 -3.070 1.00 0.00 O ATOM 2226 CB ALA B 58 -3.197 -7.405 -2.753 1.00 0.00 C ATOM 0 H ALA B 58 -3.690 -7.910 -5.110 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.927 -6.098 -3.868 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.754 -7.148 -1.791 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -4.080 -6.789 -2.923 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.484 -8.457 -2.751 1.00 0.00 H new ATOM 2232 N ASN B 59 -0.935 -9.229 -3.978 1.00 0.00 N ATOM 2233 CA ASN B 59 0.230 -10.092 -3.823 1.00 0.00 C ATOM 2234 C ASN B 59 1.404 -9.541 -4.617 1.00 0.00 C ATOM 2235 O ASN B 59 2.505 -9.393 -4.086 1.00 0.00 O ATOM 2236 CB ASN B 59 -0.077 -11.525 -4.275 1.00 0.00 C ATOM 2237 CG ASN B 59 -1.115 -12.208 -3.404 1.00 0.00 C ATOM 2238 OD1 ASN B 59 -1.258 -11.893 -2.225 1.00 0.00 O ATOM 2239 ND2 ASN B 59 -1.844 -13.156 -3.978 1.00 0.00 N ATOM 0 H ASN B 59 -1.746 -9.686 -4.396 1.00 0.00 H new ATOM 0 HA ASN B 59 0.490 -10.115 -2.765 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -0.430 -11.508 -5.306 1.00 0.00 H new ATOM 0 HB3 ASN B 59 0.843 -12.110 -4.262 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -2.553 -13.652 -3.438 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -1.696 -13.389 -4.960 1.00 0.00 H new ATOM 2246 N SER B 60 1.163 -9.217 -5.883 1.00 0.00 N ATOM 2247 CA SER B 60 2.203 -8.658 -6.734 1.00 0.00 C ATOM 2248 C SER B 60 2.656 -7.292 -6.225 1.00 0.00 C ATOM 2249 O SER B 60 3.820 -6.920 -6.378 1.00 0.00 O ATOM 2250 CB SER B 60 1.717 -8.571 -8.184 1.00 0.00 C ATOM 2251 OG SER B 60 0.382 -8.101 -8.259 1.00 0.00 O ATOM 0 H SER B 60 0.258 -9.332 -6.340 1.00 0.00 H new ATOM 0 HA SER B 60 3.065 -9.324 -6.701 1.00 0.00 H new ATOM 0 HB2 SER B 60 2.370 -7.905 -8.748 1.00 0.00 H new ATOM 0 HB3 SER B 60 1.784 -9.554 -8.651 1.00 0.00 H new ATOM 0 HG SER B 60 0.167 -7.597 -7.447 1.00 0.00 H new ATOM 2257 N PHE B 61 1.743 -6.560 -5.595 1.00 0.00 N ATOM 2258 CA PHE B 61 2.068 -5.259 -5.027 1.00 0.00 C ATOM 2259 C PHE B 61 3.047 -5.422 -3.869 1.00 0.00 C ATOM 2260 O PHE B 61 4.061 -4.729 -3.800 1.00 0.00 O ATOM 2261 CB PHE B 61 0.796 -4.547 -4.553 1.00 0.00 C ATOM 2262 CG PHE B 61 1.037 -3.165 -4.008 1.00 0.00 C ATOM 2263 CD1 PHE B 61 1.248 -2.096 -4.862 1.00 0.00 C ATOM 2264 CD2 PHE B 61 1.052 -2.938 -2.641 1.00 0.00 C ATOM 2265 CE1 PHE B 61 1.469 -0.825 -4.366 1.00 0.00 C ATOM 2266 CE2 PHE B 61 1.272 -1.671 -2.137 1.00 0.00 C ATOM 2267 CZ PHE B 61 1.481 -0.613 -3.000 1.00 0.00 C ATOM 0 H PHE B 61 0.773 -6.847 -5.466 1.00 0.00 H new ATOM 0 HA PHE B 61 2.536 -4.649 -5.800 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.096 -4.481 -5.386 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.318 -5.152 -3.783 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.240 -2.257 -5.930 1.00 0.00 H new ATOM 0 HD2 PHE B 61 0.890 -3.762 -1.962 1.00 0.00 H new ATOM 0 HE1 PHE B 61 1.632 0.000 -5.044 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.281 -1.508 -1.069 1.00 0.00 H new ATOM 0 HZ PHE B 61 1.654 0.379 -2.608 1.00 0.00 H new ATOM 2277 N ALA B 62 2.745 -6.354 -2.971 1.00 0.00 N ATOM 2278 CA ALA B 62 3.612 -6.633 -1.833 1.00 0.00 C ATOM 2279 C ALA B 62 4.962 -7.173 -2.300 1.00 0.00 C ATOM 2280 O ALA B 62 6.007 -6.850 -1.733 1.00 0.00 O ATOM 2281 CB ALA B 62 2.943 -7.620 -0.890 1.00 0.00 C ATOM 0 H ALA B 62 1.904 -6.930 -3.010 1.00 0.00 H new ATOM 0 HA ALA B 62 3.786 -5.700 -1.297 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.602 -7.819 -0.045 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.005 -7.199 -0.528 1.00 0.00 H new ATOM 0 HB3 ALA B 62 2.742 -8.551 -1.420 1.00 0.00 H new ATOM 2287 N ARG B 63 4.928 -7.993 -3.343 1.00 0.00 N ATOM 2288 CA ARG B 63 6.141 -8.542 -3.936 1.00 0.00 C ATOM 2289 C ARG B 63 7.007 -7.431 -4.529 1.00 0.00 C ATOM 2290 O ARG B 63 8.213 -7.380 -4.286 1.00 0.00 O ATOM 2291 CB ARG B 63 5.779 -9.585 -4.998 1.00 0.00 C ATOM 2292 CG ARG B 63 5.294 -10.895 -4.398 1.00 0.00 C ATOM 2293 CD ARG B 63 4.415 -11.679 -5.359 1.00 0.00 C ATOM 2294 NE ARG B 63 5.067 -11.948 -6.638 1.00 0.00 N ATOM 2295 CZ ARG B 63 5.571 -13.134 -6.977 1.00 0.00 C ATOM 2296 NH1 ARG B 63 5.622 -14.117 -6.089 1.00 0.00 N ATOM 2297 NH2 ARG B 63 6.047 -13.324 -8.198 1.00 0.00 N ATOM 0 H ARG B 63 4.067 -8.294 -3.799 1.00 0.00 H new ATOM 0 HA ARG B 63 6.722 -9.032 -3.155 1.00 0.00 H new ATOM 0 HB2 ARG B 63 5.004 -9.180 -5.649 1.00 0.00 H new ATOM 0 HB3 ARG B 63 6.651 -9.778 -5.623 1.00 0.00 H new ATOM 0 HG2 ARG B 63 6.153 -11.503 -4.117 1.00 0.00 H new ATOM 0 HG3 ARG B 63 4.736 -10.689 -3.484 1.00 0.00 H new ATOM 0 HD2 ARG B 63 4.132 -12.624 -4.896 1.00 0.00 H new ATOM 0 HD3 ARG B 63 3.494 -11.123 -5.536 1.00 0.00 H new ATOM 0 HE ARG B 63 5.141 -11.184 -7.310 1.00 0.00 H new ATOM 0 HH11 ARG B 63 5.275 -13.967 -5.142 1.00 0.00 H new ATOM 0 HH12 ARG B 63 6.009 -15.023 -6.353 1.00 0.00 H new ATOM 0 HH21 ARG B 63 6.027 -12.563 -8.877 1.00 0.00 H new ATOM 0 HH22 ARG B 63 6.433 -14.231 -8.459 1.00 0.00 H new ATOM 2311 N ALA B 64 6.381 -6.532 -5.285 1.00 0.00 N ATOM 2312 CA ALA B 64 7.084 -5.388 -5.854 1.00 0.00 C ATOM 2313 C ALA B 64 7.587 -4.465 -4.752 1.00 0.00 C ATOM 2314 O ALA B 64 8.670 -3.890 -4.855 1.00 0.00 O ATOM 2315 CB ALA B 64 6.177 -4.631 -6.811 1.00 0.00 C ATOM 0 H ALA B 64 5.389 -6.575 -5.517 1.00 0.00 H new ATOM 0 HA ALA B 64 7.945 -5.756 -6.412 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.716 -3.780 -7.227 1.00 0.00 H new ATOM 0 HB2 ALA B 64 5.866 -5.294 -7.619 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.297 -4.276 -6.274 1.00 0.00 H new ATOM 2321 N LEU B 65 6.793 -4.335 -3.695 1.00 0.00 N ATOM 2322 CA LEU B 65 7.165 -3.539 -2.532 1.00 0.00 C ATOM 2323 C LEU B 65 8.486 -4.036 -1.947 1.00 0.00 C ATOM 2324 O LEU B 65 9.420 -3.258 -1.748 1.00 0.00 O ATOM 2325 CB LEU B 65 6.059 -3.611 -1.474 1.00 0.00 C ATOM 2326 CG LEU B 65 6.287 -2.764 -0.219 1.00 0.00 C ATOM 2327 CD1 LEU B 65 6.248 -1.284 -0.560 1.00 0.00 C ATOM 2328 CD2 LEU B 65 5.250 -3.094 0.843 1.00 0.00 C ATOM 0 H LEU B 65 5.877 -4.777 -3.620 1.00 0.00 H new ATOM 0 HA LEU B 65 7.292 -2.502 -2.843 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.121 -3.301 -1.934 1.00 0.00 H new ATOM 0 HB3 LEU B 65 5.938 -4.651 -1.171 1.00 0.00 H new ATOM 0 HG LEU B 65 7.274 -2.999 0.179 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.412 -0.698 0.344 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.029 -1.057 -1.286 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.275 -1.034 -0.983 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.428 -2.482 1.728 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.253 -2.888 0.454 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.325 -4.148 1.110 1.00 0.00 H new ATOM 2340 N GLN B 66 8.563 -5.341 -1.701 1.00 0.00 N ATOM 2341 CA GLN B 66 9.770 -5.945 -1.145 1.00 0.00 C ATOM 2342 C GLN B 66 10.926 -5.889 -2.140 1.00 0.00 C ATOM 2343 O GLN B 66 12.083 -5.753 -1.746 1.00 0.00 O ATOM 2344 CB GLN B 66 9.503 -7.388 -0.721 1.00 0.00 C ATOM 2345 CG GLN B 66 8.590 -7.503 0.492 1.00 0.00 C ATOM 2346 CD GLN B 66 8.346 -8.941 0.910 1.00 0.00 C ATOM 2347 OE1 GLN B 66 8.148 -9.235 2.092 1.00 0.00 O ATOM 2348 NE2 GLN B 66 8.361 -9.849 -0.053 1.00 0.00 N ATOM 0 H GLN B 66 7.805 -6.000 -1.878 1.00 0.00 H new ATOM 0 HA GLN B 66 10.055 -5.369 -0.265 1.00 0.00 H new ATOM 0 HB2 GLN B 66 9.055 -7.927 -1.556 1.00 0.00 H new ATOM 0 HB3 GLN B 66 10.452 -7.875 -0.499 1.00 0.00 H new ATOM 0 HG2 GLN B 66 9.031 -6.957 1.326 1.00 0.00 H new ATOM 0 HG3 GLN B 66 7.635 -7.027 0.269 1.00 0.00 H new ATOM 0 HE21 GLN B 66 8.528 -9.566 -1.018 1.00 0.00 H new ATOM 0 HE22 GLN B 66 8.205 -10.832 0.170 1.00 0.00 H new ATOM 2357 N SER B 67 10.607 -5.980 -3.424 1.00 0.00 N ATOM 2358 CA SER B 67 11.615 -5.906 -4.477 1.00 0.00 C ATOM 2359 C SER B 67 12.196 -4.491 -4.579 1.00 0.00 C ATOM 2360 O SER B 67 13.332 -4.302 -5.013 1.00 0.00 O ATOM 2361 CB SER B 67 10.999 -6.329 -5.818 1.00 0.00 C ATOM 2362 OG SER B 67 11.950 -6.294 -6.870 1.00 0.00 O ATOM 0 H SER B 67 9.654 -6.106 -3.764 1.00 0.00 H new ATOM 0 HA SER B 67 12.429 -6.587 -4.227 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.592 -7.336 -5.729 1.00 0.00 H new ATOM 0 HB3 SER B 67 10.166 -5.669 -6.059 1.00 0.00 H new ATOM 0 HG SER B 67 11.522 -6.571 -7.707 1.00 0.00 H new ATOM 2368 N SER B 68 11.410 -3.504 -4.175 1.00 0.00 N ATOM 2369 CA SER B 68 11.840 -2.117 -4.237 1.00 0.00 C ATOM 2370 C SER B 68 12.577 -1.711 -2.961 1.00 0.00 C ATOM 2371 O SER B 68 13.572 -0.986 -3.011 1.00 0.00 O ATOM 2372 CB SER B 68 10.632 -1.207 -4.469 1.00 0.00 C ATOM 2373 OG SER B 68 9.923 -1.593 -5.634 1.00 0.00 O ATOM 0 H SER B 68 10.471 -3.639 -3.801 1.00 0.00 H new ATOM 0 HA SER B 68 12.533 -2.009 -5.071 1.00 0.00 H new ATOM 0 HB2 SER B 68 9.969 -1.249 -3.605 1.00 0.00 H new ATOM 0 HB3 SER B 68 10.964 -0.173 -4.566 1.00 0.00 H new ATOM 0 HG SER B 68 9.322 -2.337 -5.420 1.00 0.00 H new ATOM 2379 N ILE B 69 12.094 -2.183 -1.815 1.00 0.00 N ATOM 2380 CA ILE B 69 12.732 -1.869 -0.542 1.00 0.00 C ATOM 2381 C ILE B 69 14.061 -2.614 -0.414 1.00 0.00 C ATOM 2382 O ILE B 69 15.025 -2.104 0.157 1.00 0.00 O ATOM 2383 CB ILE B 69 11.815 -2.195 0.667 1.00 0.00 C ATOM 2384 CG1 ILE B 69 12.471 -1.751 1.974 1.00 0.00 C ATOM 2385 CG2 ILE B 69 11.479 -3.678 0.722 1.00 0.00 C ATOM 2386 CD1 ILE B 69 11.629 -2.025 3.200 1.00 0.00 C ATOM 0 H ILE B 69 11.270 -2.779 -1.742 1.00 0.00 H new ATOM 0 HA ILE B 69 12.919 -0.795 -0.530 1.00 0.00 H new ATOM 0 HB ILE B 69 10.884 -1.643 0.536 1.00 0.00 H new ATOM 0 HG12 ILE B 69 13.429 -2.260 2.081 1.00 0.00 H new ATOM 0 HG13 ILE B 69 12.682 -0.683 1.920 1.00 0.00 H new ATOM 0 HG21 ILE B 69 10.836 -3.874 1.580 1.00 0.00 H new ATOM 0 HG22 ILE B 69 10.962 -3.968 -0.193 1.00 0.00 H new ATOM 0 HG23 ILE B 69 12.398 -4.256 0.819 1.00 0.00 H new ATOM 0 HD11 ILE B 69 12.159 -1.683 4.089 1.00 0.00 H new ATOM 0 HD12 ILE B 69 10.681 -1.494 3.116 1.00 0.00 H new ATOM 0 HD13 ILE B 69 11.440 -3.095 3.279 1.00 0.00 H new