USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=26 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 42 THR OG1 : rot 89:sc= 1.2 USER MOD Set 1.2: B 68 SER OG : rot 180:sc= 0.0289 USER MOD Set 2.1: A 55 GLN : amide:sc= -0.705 K(o=-0.48,f=-4.9!) USER MOD Set 2.2: B 66 GLN : amide:sc= 0.226 K(o=-0.48,f=-1.8) USER MOD Set 3.1: B 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 39 ASN : amide:sc= 1.15 K(o=1.2,f=-0.1) USER MOD Set 4.1: A 43 ASN : amide:sc= 0 K(o=0.96,f=0.46) USER MOD Set 4.2: A 47 THR OG1 : rot -67:sc= 1.27 USER MOD Set 4.3: A 48 SER OG : rot -150:sc= -0.306 USER MOD Set 5.1: A 26 HIS : +bothHN:sc= 2.16 K(o=3.1,f=-14!) USER MOD Set 5.2: B 11 GLN : amide:sc= 0.966 K(o=3.1,f=0.3!) USER MOD Set 5.3: B 14 GLN : amide:sc= -0.0265 K(o=3.1,f=2.3) USER MOD Set 6.1: A 21 ASN : amide:sc= 0.593 K(o=0.23,f=-2.3) USER MOD Set 6.2: A 25 LYS NZ :NH3+ -173:sc= -0.359! (180deg=-1.18!) USER MOD Set 7.1: A 11 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.044) USER MOD Set 7.2: B 26 HIS : no HD1:sc= 0 X(o=-0.13,f=-0.13) USER MOD Single : A 14 GLN : amide:sc= -1.05 K(o=-1.1,f=-1.9!) USER MOD Single : A 27 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0295) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.0487 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc=-0.00618 K(o=-0.0062,f=-0.96) USER MOD Single : A 40 MET CE :methyl -138:sc= -0.237 (180deg=-2.56) USER MOD Single : A 46 ASN :FLIP amide:sc= -2.56 F(o=-4!,f=-2.6) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 ASN : amide:sc= 1.16 K(o=1.2,f=-0.01) USER MOD Single : A 60 SER OG : rot 86:sc= 1.2 USER MOD Single : A 66 GLN : amide:sc= -2.14 K(o=-2.1,f=-4.4!) USER MOD Single : A 67 SER OG : rot -81:sc= 1 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : B 8 SER OG : rot 40:sc= 0.118 USER MOD Single : B 21 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : B 25 LYS NZ :NH3+ 168:sc= 1.26 (180deg=1.06) USER MOD Single : B 27 LYS NZ :NH3+ 170:sc= 1.16 (180deg=1.06) USER MOD Single : B 30 THR OG1 : rot 180:sc= 0.00949 USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 40 MET CE :methyl -132:sc= -0.29 (180deg=-1.37) USER MOD Single : B 42 THR OG1 : rot 86:sc= 1.26 USER MOD Single : B 43 ASN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : B 46 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : B 47 THR OG1 : rot -88:sc= 1.19 USER MOD Single : B 48 SER OG : rot -27:sc= 0.976 USER MOD Single : B 53 GLN : amide:sc= -0.0103 K(o=-0.01,f=-0.88) USER MOD Single : B 55 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 59 ASN : amide:sc= 1.15 K(o=1.2,f=-0.0051) USER MOD Single : B 60 SER OG : rot -78:sc= 1.01 USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 137 N ASP A 9 -13.485 6.573 13.327 1.00 0.00 N ATOM 138 CA ASP A 9 -13.955 6.487 11.941 1.00 0.00 C ATOM 139 C ASP A 9 -13.657 7.777 11.189 1.00 0.00 C ATOM 140 O ASP A 9 -13.114 7.755 10.083 1.00 0.00 O ATOM 141 CB ASP A 9 -15.466 6.231 11.901 1.00 0.00 C ATOM 142 CG ASP A 9 -15.880 4.966 12.624 1.00 0.00 C ATOM 143 OD1 ASP A 9 -15.931 4.982 13.870 1.00 0.00 O ATOM 144 OD2 ASP A 9 -16.170 3.953 11.947 1.00 0.00 O ATOM 0 HA ASP A 9 -13.429 5.659 11.465 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -15.983 7.081 12.346 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -15.789 6.169 10.862 1.00 0.00 H new ATOM 149 N GLU A 10 -14.009 8.895 11.818 1.00 0.00 N ATOM 150 CA GLU A 10 -13.837 10.214 11.224 1.00 0.00 C ATOM 151 C GLU A 10 -12.413 10.432 10.736 1.00 0.00 C ATOM 152 O GLU A 10 -12.194 10.683 9.556 1.00 0.00 O ATOM 153 CB GLU A 10 -14.191 11.298 12.236 1.00 0.00 C ATOM 154 CG GLU A 10 -15.650 11.303 12.648 1.00 0.00 C ATOM 155 CD GLU A 10 -15.909 12.245 13.801 1.00 0.00 C ATOM 156 OE1 GLU A 10 -16.096 13.454 13.562 1.00 0.00 O ATOM 157 OE2 GLU A 10 -15.907 11.779 14.960 1.00 0.00 O ATOM 0 H GLU A 10 -14.420 8.911 12.751 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.507 10.272 10.366 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.573 11.167 13.125 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -13.940 12.271 11.814 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -16.266 11.593 11.797 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -15.951 10.294 12.930 1.00 0.00 H new ATOM 164 N GLN A 11 -11.449 10.313 11.643 1.00 0.00 N ATOM 165 CA GLN A 11 -10.059 10.631 11.331 1.00 0.00 C ATOM 166 C GLN A 11 -9.544 9.771 10.180 1.00 0.00 C ATOM 167 O GLN A 11 -8.831 10.261 9.298 1.00 0.00 O ATOM 168 CB GLN A 11 -9.179 10.450 12.570 1.00 0.00 C ATOM 169 CG GLN A 11 -7.748 10.930 12.382 1.00 0.00 C ATOM 170 CD GLN A 11 -7.670 12.378 11.934 1.00 0.00 C ATOM 171 OE1 GLN A 11 -7.652 12.674 10.737 1.00 0.00 O ATOM 172 NE2 GLN A 11 -7.626 13.294 12.888 1.00 0.00 N ATOM 0 H GLN A 11 -11.604 9.999 12.601 1.00 0.00 H new ATOM 0 HA GLN A 11 -10.013 11.674 11.019 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -9.627 10.990 13.404 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -9.165 9.395 12.844 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -7.204 10.814 13.320 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -7.251 10.299 11.645 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -7.643 13.011 13.868 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -7.575 14.283 12.644 1.00 0.00 H new ATOM 181 N VAL A 12 -9.928 8.501 10.175 1.00 0.00 N ATOM 182 CA VAL A 12 -9.519 7.590 9.117 1.00 0.00 C ATOM 183 C VAL A 12 -10.077 8.043 7.768 1.00 0.00 C ATOM 184 O VAL A 12 -9.344 8.119 6.782 1.00 0.00 O ATOM 185 CB VAL A 12 -9.969 6.140 9.407 1.00 0.00 C ATOM 186 CG1 VAL A 12 -9.555 5.205 8.280 1.00 0.00 C ATOM 187 CG2 VAL A 12 -9.397 5.661 10.733 1.00 0.00 C ATOM 0 H VAL A 12 -10.521 8.080 10.891 1.00 0.00 H new ATOM 0 HA VAL A 12 -8.430 7.608 9.079 1.00 0.00 H new ATOM 0 HB VAL A 12 -11.057 6.130 9.473 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -9.884 4.191 8.509 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -10.014 5.533 7.348 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -8.470 5.220 8.175 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -9.724 4.638 10.922 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -8.308 5.693 10.692 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.749 6.308 11.536 1.00 0.00 H new ATOM 197 N GLU A 13 -11.368 8.370 7.734 1.00 0.00 N ATOM 198 CA GLU A 13 -12.013 8.814 6.500 1.00 0.00 C ATOM 199 C GLU A 13 -11.468 10.170 6.050 1.00 0.00 C ATOM 200 O GLU A 13 -11.256 10.396 4.859 1.00 0.00 O ATOM 201 CB GLU A 13 -13.531 8.903 6.677 1.00 0.00 C ATOM 202 CG GLU A 13 -14.199 7.565 6.950 1.00 0.00 C ATOM 203 CD GLU A 13 -15.709 7.674 7.020 1.00 0.00 C ATOM 204 OE1 GLU A 13 -16.240 7.983 8.107 1.00 0.00 O ATOM 205 OE2 GLU A 13 -16.377 7.451 5.986 1.00 0.00 O ATOM 0 H GLU A 13 -11.986 8.336 8.545 1.00 0.00 H new ATOM 0 HA GLU A 13 -11.789 8.074 5.732 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -13.752 9.583 7.500 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.967 9.339 5.778 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -13.925 6.859 6.166 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.823 7.160 7.890 1.00 0.00 H new ATOM 212 N GLN A 14 -11.235 11.061 7.008 1.00 0.00 N ATOM 213 CA GLN A 14 -10.758 12.408 6.705 1.00 0.00 C ATOM 214 C GLN A 14 -9.389 12.376 6.030 1.00 0.00 C ATOM 215 O GLN A 14 -9.178 13.033 5.009 1.00 0.00 O ATOM 216 CB GLN A 14 -10.698 13.260 7.977 1.00 0.00 C ATOM 217 CG GLN A 14 -12.056 13.508 8.614 1.00 0.00 C ATOM 218 CD GLN A 14 -11.973 14.350 9.874 1.00 0.00 C ATOM 219 OE1 GLN A 14 -12.763 14.176 10.805 1.00 0.00 O ATOM 220 NE2 GLN A 14 -11.032 15.280 9.908 1.00 0.00 N ATOM 0 H GLN A 14 -11.369 10.876 8.002 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.468 12.859 6.011 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -10.051 12.767 8.703 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -10.238 14.219 7.739 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -12.704 14.006 7.893 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -12.520 12.551 8.853 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -10.397 15.393 9.117 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -10.941 15.884 10.725 1.00 0.00 H new ATOM 229 N LEU A 15 -8.464 11.601 6.589 1.00 0.00 N ATOM 230 CA LEU A 15 -7.120 11.497 6.029 1.00 0.00 C ATOM 231 C LEU A 15 -7.170 10.722 4.710 1.00 0.00 C ATOM 232 O LEU A 15 -6.414 11.000 3.775 1.00 0.00 O ATOM 233 CB LEU A 15 -6.180 10.818 7.034 1.00 0.00 C ATOM 234 CG LEU A 15 -4.704 11.241 6.965 1.00 0.00 C ATOM 235 CD1 LEU A 15 -3.956 10.756 8.194 1.00 0.00 C ATOM 236 CD2 LEU A 15 -4.033 10.706 5.708 1.00 0.00 C ATOM 0 H LEU A 15 -8.619 11.038 7.425 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.732 12.496 5.828 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.549 11.019 8.040 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.236 9.740 6.883 1.00 0.00 H new ATOM 0 HG LEU A 15 -4.673 12.330 6.932 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.912 11.064 8.130 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.407 11.187 9.088 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.011 9.669 8.248 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.990 11.023 5.689 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.082 9.617 5.705 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.546 11.095 4.828 1.00 0.00 H new ATOM 248 N LEU A 16 -8.085 9.766 4.636 1.00 0.00 N ATOM 249 CA LEU A 16 -8.313 9.014 3.410 1.00 0.00 C ATOM 250 C LEU A 16 -8.750 9.957 2.287 1.00 0.00 C ATOM 251 O LEU A 16 -8.314 9.825 1.142 1.00 0.00 O ATOM 252 CB LEU A 16 -9.362 7.923 3.668 1.00 0.00 C ATOM 253 CG LEU A 16 -9.783 7.090 2.456 1.00 0.00 C ATOM 254 CD1 LEU A 16 -9.885 5.619 2.834 1.00 0.00 C ATOM 255 CD2 LEU A 16 -11.119 7.579 1.918 1.00 0.00 C ATOM 0 H LEU A 16 -8.684 9.492 5.415 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.387 8.533 3.095 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.973 7.247 4.430 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.252 8.395 4.085 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.026 7.203 1.680 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -10.185 5.039 1.961 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.916 5.266 3.188 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -10.626 5.497 3.624 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -11.406 6.977 1.056 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.879 7.487 2.694 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.030 8.623 1.618 1.00 0.00 H new ATOM 267 N ALA A 17 -9.587 10.930 2.635 1.00 0.00 N ATOM 268 CA ALA A 17 -10.059 11.921 1.677 1.00 0.00 C ATOM 269 C ALA A 17 -8.922 12.832 1.219 1.00 0.00 C ATOM 270 O ALA A 17 -8.916 13.298 0.080 1.00 0.00 O ATOM 271 CB ALA A 17 -11.187 12.741 2.275 1.00 0.00 C ATOM 0 H ALA A 17 -9.953 11.052 3.579 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.437 11.390 0.803 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -11.528 13.477 1.546 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.014 12.083 2.540 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.830 13.254 3.168 1.00 0.00 H new ATOM 277 N GLU A 18 -7.965 13.080 2.111 1.00 0.00 N ATOM 278 CA GLU A 18 -6.778 13.865 1.768 1.00 0.00 C ATOM 279 C GLU A 18 -6.054 13.219 0.589 1.00 0.00 C ATOM 280 O GLU A 18 -5.732 13.875 -0.406 1.00 0.00 O ATOM 281 CB GLU A 18 -5.821 13.944 2.965 1.00 0.00 C ATOM 282 CG GLU A 18 -6.433 14.532 4.227 1.00 0.00 C ATOM 283 CD GLU A 18 -6.613 16.033 4.159 1.00 0.00 C ATOM 284 OE1 GLU A 18 -7.517 16.497 3.438 1.00 0.00 O ATOM 285 OE2 GLU A 18 -5.861 16.758 4.850 1.00 0.00 O ATOM 0 H GLU A 18 -7.987 12.750 3.076 1.00 0.00 H new ATOM 0 HA GLU A 18 -7.096 14.872 1.499 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.455 12.942 3.187 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -4.956 14.544 2.683 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -7.401 14.064 4.405 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.799 14.287 5.079 1.00 0.00 H new ATOM 292 N LEU A 19 -5.828 11.916 0.706 1.00 0.00 N ATOM 293 CA LEU A 19 -5.134 11.156 -0.324 1.00 0.00 C ATOM 294 C LEU A 19 -5.979 11.068 -1.595 1.00 0.00 C ATOM 295 O LEU A 19 -5.450 11.100 -2.707 1.00 0.00 O ATOM 296 CB LEU A 19 -4.798 9.755 0.193 1.00 0.00 C ATOM 297 CG LEU A 19 -3.970 9.720 1.483 1.00 0.00 C ATOM 298 CD1 LEU A 19 -3.693 8.287 1.904 1.00 0.00 C ATOM 299 CD2 LEU A 19 -2.666 10.482 1.306 1.00 0.00 C ATOM 0 H LEU A 19 -6.118 11.361 1.511 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.206 11.673 -0.569 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.729 9.214 0.362 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.254 9.218 -0.584 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.548 10.205 2.270 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.104 8.285 2.821 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.637 7.770 2.077 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.139 7.777 1.116 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.094 10.445 2.233 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.085 10.028 0.503 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.883 11.520 1.055 1.00 0.00 H new ATOM 311 N LEU A 20 -7.292 10.970 -1.425 1.00 0.00 N ATOM 312 CA LEU A 20 -8.206 10.931 -2.561 1.00 0.00 C ATOM 313 C LEU A 20 -8.226 12.269 -3.291 1.00 0.00 C ATOM 314 O LEU A 20 -8.355 12.309 -4.514 1.00 0.00 O ATOM 315 CB LEU A 20 -9.618 10.551 -2.120 1.00 0.00 C ATOM 316 CG LEU A 20 -9.802 9.087 -1.722 1.00 0.00 C ATOM 317 CD1 LEU A 20 -11.234 8.832 -1.286 1.00 0.00 C ATOM 318 CD2 LEU A 20 -9.432 8.170 -2.879 1.00 0.00 C ATOM 0 H LEU A 20 -7.747 10.916 -0.514 1.00 0.00 H new ATOM 0 HA LEU A 20 -7.843 10.166 -3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -9.899 11.179 -1.275 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.309 10.780 -2.931 1.00 0.00 H new ATOM 0 HG LEU A 20 -9.139 8.873 -0.883 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -11.348 7.785 -1.006 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -11.472 9.464 -0.431 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -11.911 9.064 -2.108 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -9.569 7.131 -2.578 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -10.072 8.387 -3.734 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -8.390 8.334 -3.154 1.00 0.00 H new ATOM 330 N ASN A 21 -8.093 13.359 -2.540 1.00 0.00 N ATOM 331 CA ASN A 21 -8.015 14.689 -3.135 1.00 0.00 C ATOM 332 C ASN A 21 -6.827 14.764 -4.084 1.00 0.00 C ATOM 333 O ASN A 21 -6.923 15.317 -5.176 1.00 0.00 O ATOM 334 CB ASN A 21 -7.883 15.771 -2.057 1.00 0.00 C ATOM 335 CG ASN A 21 -7.796 17.169 -2.644 1.00 0.00 C ATOM 336 OD1 ASN A 21 -6.715 17.639 -3.007 1.00 0.00 O ATOM 337 ND2 ASN A 21 -8.928 17.852 -2.727 1.00 0.00 N ATOM 0 H ASN A 21 -8.037 13.347 -1.522 1.00 0.00 H new ATOM 0 HA ASN A 21 -8.937 14.866 -3.688 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -8.739 15.715 -1.384 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -6.994 15.576 -1.458 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -8.925 18.801 -3.101 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -9.803 17.429 -2.417 1.00 0.00 H new ATOM 344 N VAL A 22 -5.706 14.201 -3.655 1.00 0.00 N ATOM 345 CA VAL A 22 -4.518 14.123 -4.497 1.00 0.00 C ATOM 346 C VAL A 22 -4.792 13.269 -5.732 1.00 0.00 C ATOM 347 O VAL A 22 -4.536 13.691 -6.865 1.00 0.00 O ATOM 348 CB VAL A 22 -3.322 13.528 -3.726 1.00 0.00 C ATOM 349 CG1 VAL A 22 -2.087 13.448 -4.612 1.00 0.00 C ATOM 350 CG2 VAL A 22 -3.036 14.342 -2.472 1.00 0.00 C ATOM 0 H VAL A 22 -5.593 13.791 -2.728 1.00 0.00 H new ATOM 0 HA VAL A 22 -4.269 15.139 -4.803 1.00 0.00 H new ATOM 0 HB VAL A 22 -3.584 12.514 -3.424 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.258 13.025 -4.044 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.298 12.814 -5.473 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -1.819 14.448 -4.954 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -2.189 13.907 -1.941 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -2.801 15.369 -2.751 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -3.913 14.333 -1.825 1.00 0.00 H new ATOM 360 N LEU A 23 -5.344 12.082 -5.498 1.00 0.00 N ATOM 361 CA LEU A 23 -5.601 11.116 -6.559 1.00 0.00 C ATOM 362 C LEU A 23 -6.565 11.686 -7.603 1.00 0.00 C ATOM 363 O LEU A 23 -6.229 11.768 -8.782 1.00 0.00 O ATOM 364 CB LEU A 23 -6.168 9.820 -5.949 1.00 0.00 C ATOM 365 CG LEU A 23 -6.004 8.537 -6.784 1.00 0.00 C ATOM 366 CD1 LEU A 23 -6.872 8.563 -8.035 1.00 0.00 C ATOM 367 CD2 LEU A 23 -4.542 8.327 -7.151 1.00 0.00 C ATOM 0 H LEU A 23 -5.625 11.764 -4.570 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.661 10.894 -7.065 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.690 9.661 -4.982 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.231 9.969 -5.759 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.338 7.699 -6.172 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -6.728 7.640 -8.597 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -7.920 8.654 -7.749 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.590 9.414 -8.656 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.442 7.416 -7.741 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -4.187 9.177 -7.733 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.948 8.237 -6.242 1.00 0.00 H new ATOM 379 N GLU A 24 -7.746 12.095 -7.160 1.00 0.00 N ATOM 380 CA GLU A 24 -8.798 12.558 -8.065 1.00 0.00 C ATOM 381 C GLU A 24 -8.418 13.843 -8.795 1.00 0.00 C ATOM 382 O GLU A 24 -8.812 14.043 -9.943 1.00 0.00 O ATOM 383 CB GLU A 24 -10.103 12.769 -7.298 1.00 0.00 C ATOM 384 CG GLU A 24 -10.900 11.493 -7.093 1.00 0.00 C ATOM 385 CD GLU A 24 -11.418 10.931 -8.401 1.00 0.00 C ATOM 386 OE1 GLU A 24 -12.299 11.569 -9.016 1.00 0.00 O ATOM 387 OE2 GLU A 24 -10.951 9.853 -8.822 1.00 0.00 O ATOM 0 H GLU A 24 -8.004 12.117 -6.173 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.932 11.781 -8.817 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -9.877 13.206 -6.326 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.719 13.490 -7.836 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.273 10.749 -6.602 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.739 11.693 -6.427 1.00 0.00 H new ATOM 394 N LYS A 25 -7.651 14.704 -8.141 1.00 0.00 N ATOM 395 CA LYS A 25 -7.303 16.004 -8.711 1.00 0.00 C ATOM 396 C LYS A 25 -6.397 15.852 -9.936 1.00 0.00 C ATOM 397 O LYS A 25 -6.411 16.689 -10.837 1.00 0.00 O ATOM 398 CB LYS A 25 -6.640 16.885 -7.649 1.00 0.00 C ATOM 399 CG LYS A 25 -6.372 18.311 -8.099 1.00 0.00 C ATOM 400 CD LYS A 25 -5.998 19.226 -6.936 1.00 0.00 C ATOM 401 CE LYS A 25 -4.697 18.813 -6.256 1.00 0.00 C ATOM 402 NZ LYS A 25 -4.884 17.711 -5.268 1.00 0.00 N ATOM 0 H LYS A 25 -7.257 14.529 -7.217 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.222 16.487 -9.043 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.276 16.909 -6.764 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -5.697 16.427 -7.351 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.566 18.312 -8.833 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.258 18.705 -8.598 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.904 20.249 -7.300 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.804 19.222 -6.202 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -3.981 18.497 -7.014 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.266 19.678 -5.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -3.995 17.552 -4.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -5.633 17.972 -4.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.155 16.840 -5.767 1.00 0.00 H new ATOM 416 N HIS A 26 -5.609 14.784 -9.968 1.00 0.00 N ATOM 417 CA HIS A 26 -4.752 14.508 -11.120 1.00 0.00 C ATOM 418 C HIS A 26 -5.340 13.386 -11.965 1.00 0.00 C ATOM 419 O HIS A 26 -5.013 13.248 -13.144 1.00 0.00 O ATOM 420 CB HIS A 26 -3.338 14.133 -10.670 1.00 0.00 C ATOM 421 CG HIS A 26 -2.557 15.280 -10.103 1.00 0.00 C ATOM 422 ND1 HIS A 26 -1.403 15.765 -10.678 1.00 0.00 N ATOM 423 CD2 HIS A 26 -2.765 16.031 -8.998 1.00 0.00 C ATOM 424 CE1 HIS A 26 -0.940 16.763 -9.954 1.00 0.00 C ATOM 425 NE2 HIS A 26 -1.745 16.945 -8.928 1.00 0.00 N ATOM 0 H HIS A 26 -5.544 14.098 -9.216 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.697 15.415 -11.722 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.403 13.345 -9.920 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -2.794 13.721 -11.520 1.00 0.00 H new ATOM 0 HD1 HIS A 26 -0.974 15.407 -11.531 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.583 15.930 -8.300 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -0.049 17.336 -10.166 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -1.629 17.650 -8.200 1.00 0.00 H new ATOM 434 N LYS A 27 -6.218 12.605 -11.341 1.00 0.00 N ATOM 435 CA LYS A 27 -6.835 11.435 -11.956 1.00 0.00 C ATOM 436 C LYS A 27 -5.773 10.446 -12.431 1.00 0.00 C ATOM 437 O LYS A 27 -5.406 10.411 -13.605 1.00 0.00 O ATOM 438 CB LYS A 27 -7.776 11.828 -13.103 1.00 0.00 C ATOM 439 CG LYS A 27 -8.546 10.651 -13.696 1.00 0.00 C ATOM 440 CD LYS A 27 -9.287 9.863 -12.622 1.00 0.00 C ATOM 441 CE LYS A 27 -10.328 10.713 -11.908 1.00 0.00 C ATOM 442 NZ LYS A 27 -11.461 11.080 -12.796 1.00 0.00 N ATOM 0 H LYS A 27 -6.524 12.770 -10.382 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.440 10.944 -11.194 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -8.487 12.570 -12.740 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -7.194 12.304 -13.892 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.258 11.018 -14.435 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -7.855 9.991 -14.220 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.773 9.000 -13.076 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.571 9.480 -11.895 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.708 10.168 -11.044 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -9.856 11.620 -11.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.184 11.586 -12.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.117 11.694 -13.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.876 10.218 -13.203 1.00 0.00 H new ATOM 456 N ALA A 28 -5.266 9.663 -11.495 1.00 0.00 N ATOM 457 CA ALA A 28 -4.253 8.671 -11.803 1.00 0.00 C ATOM 458 C ALA A 28 -4.896 7.320 -12.076 1.00 0.00 C ATOM 459 O ALA A 28 -5.626 6.795 -11.236 1.00 0.00 O ATOM 460 CB ALA A 28 -3.257 8.559 -10.661 1.00 0.00 C ATOM 0 H ALA A 28 -5.541 9.696 -10.513 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.721 8.989 -12.700 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.504 7.811 -10.907 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.773 9.523 -10.504 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -3.779 8.263 -9.751 1.00 0.00 H new ATOM 466 N PRO A 29 -4.646 6.752 -13.264 1.00 0.00 N ATOM 467 CA PRO A 29 -5.132 5.418 -13.621 1.00 0.00 C ATOM 468 C PRO A 29 -4.450 4.332 -12.787 1.00 0.00 C ATOM 469 O PRO A 29 -3.513 4.619 -12.044 1.00 0.00 O ATOM 470 CB PRO A 29 -4.767 5.290 -15.102 1.00 0.00 C ATOM 471 CG PRO A 29 -3.629 6.231 -15.299 1.00 0.00 C ATOM 472 CD PRO A 29 -3.874 7.373 -14.354 1.00 0.00 C ATOM 0 HA PRO A 29 -6.199 5.294 -13.434 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -4.482 4.268 -15.352 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -5.611 5.551 -15.741 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -2.677 5.744 -15.086 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -3.584 6.580 -16.331 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.940 7.802 -13.991 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -4.431 8.179 -14.833 1.00 0.00 H new ATOM 480 N THR A 30 -4.903 3.091 -12.931 1.00 0.00 N ATOM 481 CA THR A 30 -4.435 1.995 -12.086 1.00 0.00 C ATOM 482 C THR A 30 -2.915 1.819 -12.136 1.00 0.00 C ATOM 483 O THR A 30 -2.279 1.635 -11.097 1.00 0.00 O ATOM 484 CB THR A 30 -5.133 0.673 -12.466 1.00 0.00 C ATOM 485 OG1 THR A 30 -5.378 0.635 -13.879 1.00 0.00 O ATOM 486 CG2 THR A 30 -6.447 0.519 -11.714 1.00 0.00 C ATOM 0 H THR A 30 -5.596 2.817 -13.627 1.00 0.00 H new ATOM 0 HA THR A 30 -4.698 2.260 -11.062 1.00 0.00 H new ATOM 0 HB THR A 30 -4.476 -0.151 -12.190 1.00 0.00 H new ATOM 0 HG1 THR A 30 -5.820 -0.208 -14.112 1.00 0.00 H new ATOM 0 HG21 THR A 30 -6.921 -0.420 -11.998 1.00 0.00 H new ATOM 0 HG22 THR A 30 -6.254 0.518 -10.641 1.00 0.00 H new ATOM 0 HG23 THR A 30 -7.108 1.349 -11.963 1.00 0.00 H new ATOM 494 N ASP A 31 -2.333 1.904 -13.330 1.00 0.00 N ATOM 495 CA ASP A 31 -0.884 1.755 -13.487 1.00 0.00 C ATOM 496 C ASP A 31 -0.141 2.846 -12.725 1.00 0.00 C ATOM 497 O ASP A 31 0.825 2.576 -12.009 1.00 0.00 O ATOM 498 CB ASP A 31 -0.467 1.811 -14.962 1.00 0.00 C ATOM 499 CG ASP A 31 -0.868 0.579 -15.749 1.00 0.00 C ATOM 500 OD1 ASP A 31 -0.121 -0.421 -15.727 1.00 0.00 O ATOM 501 OD2 ASP A 31 -1.925 0.612 -16.414 1.00 0.00 O ATOM 0 H ASP A 31 -2.837 2.074 -14.200 1.00 0.00 H new ATOM 0 HA ASP A 31 -0.621 0.778 -13.081 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -0.915 2.690 -15.425 1.00 0.00 H new ATOM 0 HB3 ASP A 31 0.614 1.935 -15.022 1.00 0.00 H new ATOM 506 N LEU A 32 -0.609 4.077 -12.881 1.00 0.00 N ATOM 507 CA LEU A 32 0.045 5.230 -12.277 1.00 0.00 C ATOM 508 C LEU A 32 -0.207 5.273 -10.773 1.00 0.00 C ATOM 509 O LEU A 32 0.700 5.564 -9.996 1.00 0.00 O ATOM 510 CB LEU A 32 -0.448 6.521 -12.938 1.00 0.00 C ATOM 511 CG LEU A 32 0.238 7.804 -12.461 1.00 0.00 C ATOM 512 CD1 LEU A 32 1.732 7.750 -12.739 1.00 0.00 C ATOM 513 CD2 LEU A 32 -0.385 9.017 -13.131 1.00 0.00 C ATOM 0 H LEU A 32 -1.443 4.303 -13.423 1.00 0.00 H new ATOM 0 HA LEU A 32 1.119 5.139 -12.437 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.309 6.434 -14.016 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.519 6.614 -12.761 1.00 0.00 H new ATOM 0 HG LEU A 32 0.095 7.890 -11.384 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.200 8.671 -12.392 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.169 6.901 -12.214 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.899 7.639 -13.810 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.113 9.921 -12.782 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.271 8.934 -14.212 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.445 9.067 -12.881 1.00 0.00 H new ATOM 525 N SER A 33 -1.433 4.963 -10.371 1.00 0.00 N ATOM 526 CA SER A 33 -1.813 4.989 -8.965 1.00 0.00 C ATOM 527 C SER A 33 -0.958 4.011 -8.160 1.00 0.00 C ATOM 528 O SER A 33 -0.329 4.395 -7.172 1.00 0.00 O ATOM 529 CB SER A 33 -3.299 4.651 -8.818 1.00 0.00 C ATOM 530 OG SER A 33 -3.741 4.835 -7.485 1.00 0.00 O ATOM 0 H SER A 33 -2.185 4.689 -11.003 1.00 0.00 H new ATOM 0 HA SER A 33 -1.641 5.992 -8.574 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.885 5.281 -9.487 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.470 3.618 -9.121 1.00 0.00 H new ATOM 0 HG SER A 33 -4.694 4.613 -7.423 1.00 0.00 H new ATOM 536 N LEU A 34 -0.912 2.757 -8.608 1.00 0.00 N ATOM 537 CA LEU A 34 -0.117 1.733 -7.934 1.00 0.00 C ATOM 538 C LEU A 34 1.359 2.115 -7.930 1.00 0.00 C ATOM 539 O LEU A 34 2.079 1.836 -6.972 1.00 0.00 O ATOM 540 CB LEU A 34 -0.301 0.374 -8.616 1.00 0.00 C ATOM 541 CG LEU A 34 -1.717 -0.204 -8.556 1.00 0.00 C ATOM 542 CD1 LEU A 34 -1.789 -1.515 -9.325 1.00 0.00 C ATOM 543 CD2 LEU A 34 -2.148 -0.412 -7.112 1.00 0.00 C ATOM 0 H LEU A 34 -1.414 2.427 -9.432 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.464 1.660 -6.903 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.010 0.469 -9.662 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.384 -0.339 -8.158 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.399 0.508 -9.020 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.803 -1.913 -9.272 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.521 -1.341 -10.367 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.095 -2.232 -8.887 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.157 -0.823 -7.089 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.463 -1.105 -6.624 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.134 0.543 -6.587 1.00 0.00 H new ATOM 555 N MET A 35 1.797 2.764 -9.003 1.00 0.00 N ATOM 556 CA MET A 35 3.179 3.213 -9.122 1.00 0.00 C ATOM 557 C MET A 35 3.509 4.260 -8.058 1.00 0.00 C ATOM 558 O MET A 35 4.471 4.108 -7.305 1.00 0.00 O ATOM 559 CB MET A 35 3.429 3.786 -10.519 1.00 0.00 C ATOM 560 CG MET A 35 4.845 4.288 -10.740 1.00 0.00 C ATOM 561 SD MET A 35 5.085 4.958 -12.396 1.00 0.00 S ATOM 562 CE MET A 35 6.791 5.497 -12.304 1.00 0.00 C ATOM 0 H MET A 35 1.212 2.992 -9.807 1.00 0.00 H new ATOM 0 HA MET A 35 3.830 2.353 -8.967 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.208 3.018 -11.260 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.733 4.607 -10.693 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.074 5.058 -10.003 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.547 3.471 -10.576 1.00 0.00 H new ATOM 0 HE1 MET A 35 7.086 5.935 -13.257 1.00 0.00 H new ATOM 0 HE2 MET A 35 6.895 6.241 -11.515 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.431 4.643 -12.084 1.00 0.00 H new ATOM 572 N VAL A 36 2.702 5.312 -7.993 1.00 0.00 N ATOM 573 CA VAL A 36 2.944 6.402 -7.053 1.00 0.00 C ATOM 574 C VAL A 36 2.807 5.922 -5.609 1.00 0.00 C ATOM 575 O VAL A 36 3.665 6.203 -4.768 1.00 0.00 O ATOM 576 CB VAL A 36 1.984 7.588 -7.296 1.00 0.00 C ATOM 577 CG1 VAL A 36 2.246 8.710 -6.304 1.00 0.00 C ATOM 578 CG2 VAL A 36 2.117 8.103 -8.721 1.00 0.00 C ATOM 0 H VAL A 36 1.876 5.434 -8.578 1.00 0.00 H new ATOM 0 HA VAL A 36 3.965 6.744 -7.221 1.00 0.00 H new ATOM 0 HB VAL A 36 0.965 7.231 -7.149 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.558 9.533 -6.496 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.097 8.341 -5.289 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.272 9.062 -6.415 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.433 8.938 -8.872 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.140 8.437 -8.893 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.874 7.304 -9.421 1.00 0.00 H new ATOM 588 N LEU A 37 1.740 5.181 -5.331 1.00 0.00 N ATOM 589 CA LEU A 37 1.499 4.669 -3.987 1.00 0.00 C ATOM 590 C LEU A 37 2.597 3.694 -3.578 1.00 0.00 C ATOM 591 O LEU A 37 3.089 3.743 -2.451 1.00 0.00 O ATOM 592 CB LEU A 37 0.131 3.986 -3.902 1.00 0.00 C ATOM 593 CG LEU A 37 -1.072 4.901 -4.146 1.00 0.00 C ATOM 594 CD1 LEU A 37 -2.366 4.113 -4.047 1.00 0.00 C ATOM 595 CD2 LEU A 37 -1.075 6.057 -3.157 1.00 0.00 C ATOM 0 H LEU A 37 1.030 4.922 -6.016 1.00 0.00 H new ATOM 0 HA LEU A 37 1.508 5.514 -3.299 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.103 3.174 -4.629 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.029 3.534 -2.915 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.993 5.312 -5.153 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.211 4.778 -4.223 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.367 3.320 -4.794 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.450 3.675 -3.052 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.938 6.696 -3.347 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.129 5.666 -2.141 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.160 6.638 -3.274 1.00 0.00 H new ATOM 607 N GLY A 38 2.987 2.825 -4.505 1.00 0.00 N ATOM 608 CA GLY A 38 4.039 1.861 -4.237 1.00 0.00 C ATOM 609 C GLY A 38 5.342 2.528 -3.849 1.00 0.00 C ATOM 610 O GLY A 38 5.997 2.112 -2.891 1.00 0.00 O ATOM 0 H GLY A 38 2.590 2.771 -5.443 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.722 1.193 -3.436 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.198 1.244 -5.122 1.00 0.00 H new ATOM 614 N ASN A 39 5.712 3.571 -4.585 1.00 0.00 N ATOM 615 CA ASN A 39 6.923 4.329 -4.288 1.00 0.00 C ATOM 616 C ASN A 39 6.835 4.956 -2.904 1.00 0.00 C ATOM 617 O ASN A 39 7.790 4.907 -2.130 1.00 0.00 O ATOM 618 CB ASN A 39 7.157 5.429 -5.331 1.00 0.00 C ATOM 619 CG ASN A 39 7.522 4.881 -6.698 1.00 0.00 C ATOM 620 OD1 ASN A 39 8.105 3.804 -6.818 1.00 0.00 O ATOM 621 ND2 ASN A 39 7.192 5.628 -7.743 1.00 0.00 N ATOM 0 H ASN A 39 5.190 3.911 -5.393 1.00 0.00 H new ATOM 0 HA ASN A 39 7.762 3.633 -4.317 1.00 0.00 H new ATOM 0 HB2 ASN A 39 6.257 6.037 -5.418 1.00 0.00 H new ATOM 0 HB3 ASN A 39 7.954 6.087 -4.985 1.00 0.00 H new ATOM 0 HD21 ASN A 39 7.421 5.315 -8.686 1.00 0.00 H new ATOM 0 HD22 ASN A 39 6.709 6.515 -7.603 1.00 0.00 H new ATOM 628 N MET A 40 5.678 5.529 -2.598 1.00 0.00 N ATOM 629 CA MET A 40 5.457 6.188 -1.315 1.00 0.00 C ATOM 630 C MET A 40 5.582 5.210 -0.151 1.00 0.00 C ATOM 631 O MET A 40 6.292 5.483 0.819 1.00 0.00 O ATOM 632 CB MET A 40 4.086 6.864 -1.294 1.00 0.00 C ATOM 633 CG MET A 40 4.062 8.212 -1.998 1.00 0.00 C ATOM 634 SD MET A 40 4.952 9.484 -1.082 1.00 0.00 S ATOM 635 CE MET A 40 3.986 9.541 0.426 1.00 0.00 C ATOM 0 H MET A 40 4.873 5.551 -3.224 1.00 0.00 H new ATOM 0 HA MET A 40 6.231 6.947 -1.196 1.00 0.00 H new ATOM 0 HB2 MET A 40 3.357 6.204 -1.765 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.772 6.998 -0.259 1.00 0.00 H new ATOM 0 HG2 MET A 40 4.502 8.108 -2.990 1.00 0.00 H new ATOM 0 HG3 MET A 40 3.028 8.526 -2.139 1.00 0.00 H new ATOM 0 HE1 MET A 40 3.846 10.579 0.730 1.00 0.00 H new ATOM 0 HE2 MET A 40 3.014 9.079 0.253 1.00 0.00 H new ATOM 0 HE3 MET A 40 4.509 9.000 1.214 1.00 0.00 H new ATOM 645 N VAL A 41 4.905 4.072 -0.250 1.00 0.00 N ATOM 646 CA VAL A 41 4.945 3.073 0.814 1.00 0.00 C ATOM 647 C VAL A 41 6.356 2.504 0.966 1.00 0.00 C ATOM 648 O VAL A 41 6.864 2.378 2.081 1.00 0.00 O ATOM 649 CB VAL A 41 3.942 1.921 0.569 1.00 0.00 C ATOM 650 CG1 VAL A 41 3.946 0.941 1.736 1.00 0.00 C ATOM 651 CG2 VAL A 41 2.540 2.469 0.347 1.00 0.00 C ATOM 0 H VAL A 41 4.325 3.818 -1.050 1.00 0.00 H new ATOM 0 HA VAL A 41 4.656 3.579 1.735 1.00 0.00 H new ATOM 0 HB VAL A 41 4.254 1.388 -0.329 1.00 0.00 H new ATOM 0 HG11 VAL A 41 3.233 0.140 1.541 1.00 0.00 H new ATOM 0 HG12 VAL A 41 4.944 0.518 1.853 1.00 0.00 H new ATOM 0 HG13 VAL A 41 3.664 1.463 2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.849 1.643 0.176 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.225 3.030 1.227 1.00 0.00 H new ATOM 0 HG23 VAL A 41 2.540 3.127 -0.522 1.00 0.00 H new ATOM 661 N THR A 42 6.993 2.189 -0.159 1.00 0.00 N ATOM 662 CA THR A 42 8.359 1.679 -0.145 1.00 0.00 C ATOM 663 C THR A 42 9.306 2.686 0.509 1.00 0.00 C ATOM 664 O THR A 42 10.138 2.322 1.344 1.00 0.00 O ATOM 665 CB THR A 42 8.855 1.363 -1.572 1.00 0.00 C ATOM 666 OG1 THR A 42 7.991 0.403 -2.189 1.00 0.00 O ATOM 667 CG2 THR A 42 10.278 0.825 -1.554 1.00 0.00 C ATOM 0 H THR A 42 6.585 2.278 -1.090 1.00 0.00 H new ATOM 0 HA THR A 42 8.355 0.757 0.436 1.00 0.00 H new ATOM 0 HB THR A 42 8.843 2.291 -2.144 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.265 0.868 -2.654 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.599 0.612 -2.574 1.00 0.00 H new ATOM 0 HG22 THR A 42 10.942 1.568 -1.112 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.313 -0.090 -0.963 1.00 0.00 H new ATOM 675 N ASN A 43 9.160 3.953 0.136 1.00 0.00 N ATOM 676 CA ASN A 43 9.988 5.019 0.691 1.00 0.00 C ATOM 677 C ASN A 43 9.812 5.107 2.201 1.00 0.00 C ATOM 678 O ASN A 43 10.790 5.160 2.948 1.00 0.00 O ATOM 679 CB ASN A 43 9.628 6.363 0.051 1.00 0.00 C ATOM 680 CG ASN A 43 10.455 7.508 0.603 1.00 0.00 C ATOM 681 OD1 ASN A 43 11.622 7.338 0.954 1.00 0.00 O ATOM 682 ND2 ASN A 43 9.850 8.681 0.695 1.00 0.00 N ATOM 0 H ASN A 43 8.474 4.268 -0.550 1.00 0.00 H new ATOM 0 HA ASN A 43 11.030 4.786 0.471 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.775 6.299 -1.027 1.00 0.00 H new ATOM 0 HB3 ASN A 43 8.571 6.569 0.217 1.00 0.00 H new ATOM 0 HD21 ASN A 43 10.353 9.486 1.068 1.00 0.00 H new ATOM 0 HD22 ASN A 43 8.881 8.780 0.393 1.00 0.00 H new ATOM 689 N LEU A 44 8.557 5.106 2.640 1.00 0.00 N ATOM 690 CA LEU A 44 8.226 5.223 4.058 1.00 0.00 C ATOM 691 C LEU A 44 8.908 4.127 4.876 1.00 0.00 C ATOM 692 O LEU A 44 9.519 4.400 5.910 1.00 0.00 O ATOM 693 CB LEU A 44 6.707 5.147 4.243 1.00 0.00 C ATOM 694 CG LEU A 44 6.202 5.418 5.663 1.00 0.00 C ATOM 695 CD1 LEU A 44 6.442 6.869 6.046 1.00 0.00 C ATOM 696 CD2 LEU A 44 4.726 5.074 5.776 1.00 0.00 C ATOM 0 H LEU A 44 7.745 5.025 2.028 1.00 0.00 H new ATOM 0 HA LEU A 44 8.588 6.187 4.416 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.240 5.863 3.567 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.371 4.156 3.939 1.00 0.00 H new ATOM 0 HG LEU A 44 6.758 4.784 6.354 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.077 7.043 7.058 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.510 7.085 6.003 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.912 7.521 5.352 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.383 5.272 6.791 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.156 5.683 5.075 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.579 4.019 5.543 1.00 0.00 H new ATOM 708 N ILE A 45 8.827 2.897 4.389 1.00 0.00 N ATOM 709 CA ILE A 45 9.360 1.746 5.110 1.00 0.00 C ATOM 710 C ILE A 45 10.894 1.751 5.142 1.00 0.00 C ATOM 711 O ILE A 45 11.505 1.198 6.054 1.00 0.00 O ATOM 712 CB ILE A 45 8.851 0.421 4.491 1.00 0.00 C ATOM 713 CG1 ILE A 45 7.318 0.393 4.490 1.00 0.00 C ATOM 714 CG2 ILE A 45 9.399 -0.779 5.253 1.00 0.00 C ATOM 715 CD1 ILE A 45 6.728 -0.845 3.845 1.00 0.00 C ATOM 0 H ILE A 45 8.396 2.668 3.494 1.00 0.00 H new ATOM 0 HA ILE A 45 9.001 1.821 6.136 1.00 0.00 H new ATOM 0 HB ILE A 45 9.207 0.364 3.462 1.00 0.00 H new ATOM 0 HG12 ILE A 45 6.962 0.460 5.518 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.948 1.275 3.967 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.028 -1.698 4.800 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.488 -0.769 5.213 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.074 -0.730 6.292 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.640 -0.792 3.883 1.00 0.00 H new ATOM 0 HD12 ILE A 45 7.053 -0.904 2.806 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.067 -1.731 4.382 1.00 0.00 H new ATOM 727 N ASN A 46 11.518 2.390 4.164 1.00 0.00 N ATOM 728 CA ASN A 46 12.977 2.379 4.079 1.00 0.00 C ATOM 729 C ASN A 46 13.610 3.577 4.780 1.00 0.00 C ATOM 730 O ASN A 46 14.717 3.472 5.304 1.00 0.00 O ATOM 731 CB ASN A 46 13.443 2.330 2.620 1.00 0.00 C ATOM 732 CG ASN A 46 13.373 0.936 2.026 1.00 0.00 C ATOM 733 OD1 ASN A 46 12.250 0.611 1.410 1.00 0.00 O flip ATOM 734 ND2 ASN A 46 14.324 0.157 2.114 1.00 0.00 N flip ATOM 0 H ASN A 46 11.049 2.916 3.427 1.00 0.00 H new ATOM 0 HA ASN A 46 13.308 1.477 4.594 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.828 3.005 2.024 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.468 2.695 2.559 1.00 0.00 H new ATOM 0 HD21 ASN A 46 15.175 0.444 2.597 1.00 0.00 H new ATOM 0 HD22 ASN A 46 14.260 -0.774 1.703 1.00 0.00 H new ATOM 741 N THR A 47 12.926 4.713 4.795 1.00 0.00 N ATOM 742 CA THR A 47 13.518 5.927 5.347 1.00 0.00 C ATOM 743 C THR A 47 12.931 6.304 6.707 1.00 0.00 C ATOM 744 O THR A 47 13.654 6.754 7.594 1.00 0.00 O ATOM 745 CB THR A 47 13.373 7.116 4.377 1.00 0.00 C ATOM 746 OG1 THR A 47 11.998 7.299 4.012 1.00 0.00 O ATOM 747 CG2 THR A 47 14.208 6.892 3.125 1.00 0.00 C ATOM 0 H THR A 47 11.977 4.821 4.438 1.00 0.00 H new ATOM 0 HA THR A 47 14.576 5.704 5.488 1.00 0.00 H new ATOM 0 HB THR A 47 13.731 8.012 4.884 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.697 6.535 3.478 1.00 0.00 H new ATOM 0 HG21 THR A 47 14.092 7.742 2.453 1.00 0.00 H new ATOM 0 HG22 THR A 47 15.257 6.788 3.401 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.874 5.984 2.622 1.00 0.00 H new ATOM 755 N SER A 48 11.627 6.127 6.873 1.00 0.00 N ATOM 756 CA SER A 48 10.966 6.517 8.111 1.00 0.00 C ATOM 757 C SER A 48 10.949 5.362 9.105 1.00 0.00 C ATOM 758 O SER A 48 11.070 5.567 10.313 1.00 0.00 O ATOM 759 CB SER A 48 9.544 6.986 7.817 1.00 0.00 C ATOM 760 OG SER A 48 9.550 7.996 6.822 1.00 0.00 O ATOM 0 H SER A 48 11.010 5.719 6.171 1.00 0.00 H new ATOM 0 HA SER A 48 11.526 7.339 8.558 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.938 6.143 7.484 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.085 7.368 8.729 1.00 0.00 H new ATOM 0 HG SER A 48 8.792 8.600 6.965 1.00 0.00 H new ATOM 766 N ILE A 49 10.797 4.153 8.591 1.00 0.00 N ATOM 767 CA ILE A 49 10.838 2.964 9.424 1.00 0.00 C ATOM 768 C ILE A 49 12.283 2.614 9.752 1.00 0.00 C ATOM 769 O ILE A 49 13.170 2.785 8.915 1.00 0.00 O ATOM 770 CB ILE A 49 10.146 1.764 8.733 1.00 0.00 C ATOM 771 CG1 ILE A 49 8.663 2.069 8.493 1.00 0.00 C ATOM 772 CG2 ILE A 49 10.302 0.489 9.551 1.00 0.00 C ATOM 773 CD1 ILE A 49 7.880 2.348 9.761 1.00 0.00 C ATOM 0 H ILE A 49 10.644 3.969 7.599 1.00 0.00 H new ATOM 0 HA ILE A 49 10.296 3.177 10.345 1.00 0.00 H new ATOM 0 HB ILE A 49 10.632 1.605 7.771 1.00 0.00 H new ATOM 0 HG12 ILE A 49 8.582 2.931 7.831 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.208 1.225 7.975 1.00 0.00 H new ATOM 0 HG21 ILE A 49 9.805 -0.335 9.039 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.361 0.258 9.667 1.00 0.00 H new ATOM 0 HG23 ILE A 49 9.852 0.630 10.534 1.00 0.00 H new ATOM 0 HD11 ILE A 49 6.840 2.555 9.508 1.00 0.00 H new ATOM 0 HD12 ILE A 49 7.928 1.479 10.417 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.308 3.211 10.270 1.00 0.00 H new ATOM 785 N ALA A 50 12.515 2.155 10.980 1.00 0.00 N ATOM 786 CA ALA A 50 13.847 1.767 11.425 1.00 0.00 C ATOM 787 C ALA A 50 14.476 0.764 10.462 1.00 0.00 C ATOM 788 O ALA A 50 13.989 -0.359 10.316 1.00 0.00 O ATOM 789 CB ALA A 50 13.779 1.187 12.831 1.00 0.00 C ATOM 0 H ALA A 50 11.789 2.043 11.688 1.00 0.00 H new ATOM 0 HA ALA A 50 14.477 2.656 11.440 1.00 0.00 H new ATOM 0 HB1 ALA A 50 14.779 0.900 13.155 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.377 1.935 13.514 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.132 0.310 12.832 1.00 0.00 H new ATOM 795 N PRO A 51 15.580 1.160 9.801 1.00 0.00 N ATOM 796 CA PRO A 51 16.233 0.349 8.765 1.00 0.00 C ATOM 797 C PRO A 51 16.655 -1.027 9.268 1.00 0.00 C ATOM 798 O PRO A 51 16.745 -1.975 8.493 1.00 0.00 O ATOM 799 CB PRO A 51 17.467 1.174 8.372 1.00 0.00 C ATOM 800 CG PRO A 51 17.649 2.160 9.475 1.00 0.00 C ATOM 801 CD PRO A 51 16.274 2.440 10.005 1.00 0.00 C ATOM 0 HA PRO A 51 15.556 0.150 7.935 1.00 0.00 H new ATOM 0 HB2 PRO A 51 18.346 0.539 8.263 1.00 0.00 H new ATOM 0 HB3 PRO A 51 17.316 1.676 7.416 1.00 0.00 H new ATOM 0 HG2 PRO A 51 18.295 1.758 10.256 1.00 0.00 H new ATOM 0 HG3 PRO A 51 18.120 3.072 9.110 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.296 2.725 11.057 1.00 0.00 H new ATOM 0 HD3 PRO A 51 15.790 3.253 9.464 1.00 0.00 H new ATOM 809 N ALA A 52 16.888 -1.130 10.571 1.00 0.00 N ATOM 810 CA ALA A 52 17.316 -2.380 11.194 1.00 0.00 C ATOM 811 C ALA A 52 16.252 -3.467 11.075 1.00 0.00 C ATOM 812 O ALA A 52 16.541 -4.652 11.230 1.00 0.00 O ATOM 813 CB ALA A 52 17.639 -2.143 12.660 1.00 0.00 C ATOM 0 H ALA A 52 16.787 -0.354 11.225 1.00 0.00 H new ATOM 0 HA ALA A 52 18.207 -2.723 10.667 1.00 0.00 H new ATOM 0 HB1 ALA A 52 17.957 -3.079 13.118 1.00 0.00 H new ATOM 0 HB2 ALA A 52 18.440 -1.408 12.742 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.752 -1.771 13.173 1.00 0.00 H new ATOM 819 N GLN A 53 15.023 -3.057 10.804 1.00 0.00 N ATOM 820 CA GLN A 53 13.895 -3.974 10.774 1.00 0.00 C ATOM 821 C GLN A 53 12.885 -3.550 9.713 1.00 0.00 C ATOM 822 O GLN A 53 11.687 -3.806 9.841 1.00 0.00 O ATOM 823 CB GLN A 53 13.247 -4.013 12.157 1.00 0.00 C ATOM 824 CG GLN A 53 12.959 -2.632 12.722 1.00 0.00 C ATOM 825 CD GLN A 53 12.664 -2.662 14.203 1.00 0.00 C ATOM 826 OE1 GLN A 53 13.570 -2.562 15.028 1.00 0.00 O ATOM 827 NE2 GLN A 53 11.400 -2.797 14.551 1.00 0.00 N ATOM 0 H GLN A 53 14.780 -2.087 10.600 1.00 0.00 H new ATOM 0 HA GLN A 53 14.246 -4.973 10.514 1.00 0.00 H new ATOM 0 HB2 GLN A 53 12.316 -4.576 12.099 1.00 0.00 H new ATOM 0 HB3 GLN A 53 13.902 -4.550 12.843 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.815 -1.982 12.539 1.00 0.00 H new ATOM 0 HG3 GLN A 53 12.110 -2.197 12.195 1.00 0.00 H new ATOM 0 HE21 GLN A 53 10.679 -2.877 13.834 1.00 0.00 H new ATOM 0 HE22 GLN A 53 11.143 -2.822 15.538 1.00 0.00 H new ATOM 836 N ARG A 54 13.385 -2.931 8.651 1.00 0.00 N ATOM 837 CA ARG A 54 12.530 -2.431 7.583 1.00 0.00 C ATOM 838 C ARG A 54 11.797 -3.580 6.886 1.00 0.00 C ATOM 839 O ARG A 54 10.616 -3.469 6.556 1.00 0.00 O ATOM 840 CB ARG A 54 13.350 -1.608 6.576 1.00 0.00 C ATOM 841 CG ARG A 54 14.482 -2.374 5.902 1.00 0.00 C ATOM 842 CD ARG A 54 15.380 -1.441 5.100 1.00 0.00 C ATOM 843 NE ARG A 54 16.433 -2.159 4.373 1.00 0.00 N ATOM 844 CZ ARG A 54 17.676 -2.328 4.829 1.00 0.00 C ATOM 845 NH1 ARG A 54 18.002 -1.929 6.050 1.00 0.00 N ATOM 846 NH2 ARG A 54 18.591 -2.914 4.066 1.00 0.00 N ATOM 0 H ARG A 54 14.381 -2.763 8.507 1.00 0.00 H new ATOM 0 HA ARG A 54 11.778 -1.777 8.025 1.00 0.00 H new ATOM 0 HB2 ARG A 54 12.679 -1.227 5.807 1.00 0.00 H new ATOM 0 HB3 ARG A 54 13.770 -0.743 7.090 1.00 0.00 H new ATOM 0 HG2 ARG A 54 15.074 -2.892 6.657 1.00 0.00 H new ATOM 0 HG3 ARG A 54 14.066 -3.137 5.244 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.773 -0.879 4.391 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.838 -0.716 5.773 1.00 0.00 H new ATOM 0 HE ARG A 54 16.200 -2.554 3.462 1.00 0.00 H new ATOM 0 HH11 ARG A 54 17.301 -1.490 6.647 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.954 -2.061 6.393 1.00 0.00 H new ATOM 0 HH21 ARG A 54 18.344 -3.236 3.130 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.540 -3.042 4.416 1.00 0.00 H new ATOM 860 N GLN A 55 12.489 -4.699 6.701 1.00 0.00 N ATOM 861 CA GLN A 55 11.892 -5.864 6.061 1.00 0.00 C ATOM 862 C GLN A 55 10.899 -6.557 6.986 1.00 0.00 C ATOM 863 O GLN A 55 9.933 -7.167 6.527 1.00 0.00 O ATOM 864 CB GLN A 55 12.971 -6.847 5.604 1.00 0.00 C ATOM 865 CG GLN A 55 13.480 -6.576 4.198 1.00 0.00 C ATOM 866 CD GLN A 55 12.426 -6.841 3.138 1.00 0.00 C ATOM 867 OE1 GLN A 55 11.227 -6.693 3.381 1.00 0.00 O ATOM 868 NE2 GLN A 55 12.861 -7.242 1.959 1.00 0.00 N ATOM 0 H GLN A 55 13.461 -4.823 6.984 1.00 0.00 H new ATOM 0 HA GLN A 55 11.348 -5.514 5.184 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.809 -6.804 6.300 1.00 0.00 H new ATOM 0 HB3 GLN A 55 12.571 -7.860 5.648 1.00 0.00 H new ATOM 0 HG2 GLN A 55 13.809 -5.539 4.128 1.00 0.00 H new ATOM 0 HG3 GLN A 55 14.352 -7.201 4.004 1.00 0.00 H new ATOM 0 HE21 GLN A 55 13.862 -7.353 1.795 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.197 -7.441 1.211 1.00 0.00 H new ATOM 877 N ALA A 56 11.130 -6.452 8.288 1.00 0.00 N ATOM 878 CA ALA A 56 10.220 -7.032 9.269 1.00 0.00 C ATOM 879 C ALA A 56 8.863 -6.344 9.197 1.00 0.00 C ATOM 880 O ALA A 56 7.814 -6.990 9.270 1.00 0.00 O ATOM 881 CB ALA A 56 10.800 -6.921 10.671 1.00 0.00 C ATOM 0 H ALA A 56 11.936 -5.973 8.689 1.00 0.00 H new ATOM 0 HA ALA A 56 10.089 -8.089 9.038 1.00 0.00 H new ATOM 0 HB1 ALA A 56 10.106 -7.359 11.388 1.00 0.00 H new ATOM 0 HB2 ALA A 56 11.751 -7.453 10.715 1.00 0.00 H new ATOM 0 HB3 ALA A 56 10.960 -5.871 10.916 1.00 0.00 H new ATOM 887 N ILE A 57 8.894 -5.030 9.034 1.00 0.00 N ATOM 888 CA ILE A 57 7.676 -4.246 8.901 1.00 0.00 C ATOM 889 C ILE A 57 7.015 -4.514 7.553 1.00 0.00 C ATOM 890 O ILE A 57 5.797 -4.677 7.469 1.00 0.00 O ATOM 891 CB ILE A 57 7.961 -2.734 9.056 1.00 0.00 C ATOM 892 CG1 ILE A 57 8.577 -2.449 10.430 1.00 0.00 C ATOM 893 CG2 ILE A 57 6.691 -1.915 8.858 1.00 0.00 C ATOM 894 CD1 ILE A 57 7.709 -2.878 11.596 1.00 0.00 C ATOM 0 H ILE A 57 9.753 -4.482 8.991 1.00 0.00 H new ATOM 0 HA ILE A 57 6.998 -4.549 9.699 1.00 0.00 H new ATOM 0 HB ILE A 57 8.673 -2.440 8.285 1.00 0.00 H new ATOM 0 HG12 ILE A 57 9.538 -2.959 10.499 1.00 0.00 H new ATOM 0 HG13 ILE A 57 8.777 -1.381 10.513 1.00 0.00 H new ATOM 0 HG21 ILE A 57 6.920 -0.855 8.972 1.00 0.00 H new ATOM 0 HG22 ILE A 57 6.294 -2.095 7.859 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.949 -2.208 9.601 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.215 -2.642 12.532 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.757 -2.349 11.555 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.530 -3.952 11.541 1.00 0.00 H new ATOM 906 N ALA A 58 7.830 -4.581 6.504 1.00 0.00 N ATOM 907 CA ALA A 58 7.337 -4.859 5.160 1.00 0.00 C ATOM 908 C ALA A 58 6.610 -6.201 5.106 1.00 0.00 C ATOM 909 O ALA A 58 5.528 -6.309 4.526 1.00 0.00 O ATOM 910 CB ALA A 58 8.484 -4.839 4.163 1.00 0.00 C ATOM 0 H ALA A 58 8.839 -4.446 6.560 1.00 0.00 H new ATOM 0 HA ALA A 58 6.624 -4.079 4.894 1.00 0.00 H new ATOM 0 HB1 ALA A 58 8.101 -5.048 3.164 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.957 -3.857 4.172 1.00 0.00 H new ATOM 0 HB3 ALA A 58 9.217 -5.598 4.437 1.00 0.00 H new ATOM 916 N ASN A 59 7.206 -7.219 5.722 1.00 0.00 N ATOM 917 CA ASN A 59 6.591 -8.542 5.778 1.00 0.00 C ATOM 918 C ASN A 59 5.272 -8.494 6.532 1.00 0.00 C ATOM 919 O ASN A 59 4.277 -9.055 6.083 1.00 0.00 O ATOM 920 CB ASN A 59 7.527 -9.563 6.438 1.00 0.00 C ATOM 921 CG ASN A 59 8.480 -10.209 5.452 1.00 0.00 C ATOM 922 OD1 ASN A 59 8.167 -11.238 4.853 1.00 0.00 O ATOM 923 ND2 ASN A 59 9.653 -9.619 5.281 1.00 0.00 N ATOM 0 H ASN A 59 8.111 -7.153 6.188 1.00 0.00 H new ATOM 0 HA ASN A 59 6.402 -8.857 4.752 1.00 0.00 H new ATOM 0 HB2 ASN A 59 8.102 -9.069 7.221 1.00 0.00 H new ATOM 0 HB3 ASN A 59 6.930 -10.337 6.920 1.00 0.00 H new ATOM 0 HD21 ASN A 59 10.334 -10.016 4.634 1.00 0.00 H new ATOM 0 HD22 ASN A 59 9.875 -8.767 5.796 1.00 0.00 H new ATOM 930 N SER A 60 5.269 -7.803 7.666 1.00 0.00 N ATOM 931 CA SER A 60 4.073 -7.687 8.490 1.00 0.00 C ATOM 932 C SER A 60 2.953 -6.968 7.738 1.00 0.00 C ATOM 933 O SER A 60 1.788 -7.362 7.817 1.00 0.00 O ATOM 934 CB SER A 60 4.405 -6.947 9.788 1.00 0.00 C ATOM 935 OG SER A 60 5.432 -7.618 10.505 1.00 0.00 O ATOM 0 H SER A 60 6.084 -7.314 8.036 1.00 0.00 H new ATOM 0 HA SER A 60 3.723 -8.691 8.730 1.00 0.00 H new ATOM 0 HB2 SER A 60 4.720 -5.929 9.560 1.00 0.00 H new ATOM 0 HB3 SER A 60 3.512 -6.873 10.408 1.00 0.00 H new ATOM 0 HG SER A 60 6.307 -7.322 10.177 1.00 0.00 H new ATOM 941 N PHE A 61 3.314 -5.925 6.996 1.00 0.00 N ATOM 942 CA PHE A 61 2.343 -5.167 6.217 1.00 0.00 C ATOM 943 C PHE A 61 1.732 -6.043 5.128 1.00 0.00 C ATOM 944 O PHE A 61 0.511 -6.116 4.992 1.00 0.00 O ATOM 945 CB PHE A 61 3.003 -3.930 5.596 1.00 0.00 C ATOM 946 CG PHE A 61 2.046 -3.037 4.857 1.00 0.00 C ATOM 947 CD1 PHE A 61 1.238 -2.148 5.548 1.00 0.00 C ATOM 948 CD2 PHE A 61 1.951 -3.086 3.474 1.00 0.00 C ATOM 949 CE1 PHE A 61 0.354 -1.325 4.874 1.00 0.00 C ATOM 950 CE2 PHE A 61 1.070 -2.268 2.796 1.00 0.00 C ATOM 951 CZ PHE A 61 0.270 -1.386 3.497 1.00 0.00 C ATOM 0 H PHE A 61 4.273 -5.586 6.919 1.00 0.00 H new ATOM 0 HA PHE A 61 1.547 -4.838 6.885 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.487 -3.354 6.384 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.786 -4.253 4.910 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.299 -2.097 6.625 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.574 -3.773 2.921 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.270 -0.636 5.424 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.006 -2.317 1.719 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.420 -0.745 2.969 1.00 0.00 H new ATOM 961 N ALA A 62 2.587 -6.718 4.366 1.00 0.00 N ATOM 962 CA ALA A 62 2.130 -7.599 3.297 1.00 0.00 C ATOM 963 C ALA A 62 1.298 -8.748 3.859 1.00 0.00 C ATOM 964 O ALA A 62 0.299 -9.159 3.265 1.00 0.00 O ATOM 965 CB ALA A 62 3.317 -8.137 2.517 1.00 0.00 C ATOM 0 H ALA A 62 3.601 -6.672 4.469 1.00 0.00 H new ATOM 0 HA ALA A 62 1.499 -7.021 2.622 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.963 -8.793 1.722 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.873 -7.307 2.081 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.969 -8.698 3.187 1.00 0.00 H new ATOM 971 N ARG A 63 1.721 -9.249 5.012 1.00 0.00 N ATOM 972 CA ARG A 63 1.035 -10.324 5.707 1.00 0.00 C ATOM 973 C ARG A 63 -0.413 -9.944 6.004 1.00 0.00 C ATOM 974 O ARG A 63 -1.336 -10.724 5.762 1.00 0.00 O ATOM 975 CB ARG A 63 1.788 -10.595 7.001 1.00 0.00 C ATOM 976 CG ARG A 63 1.494 -11.922 7.661 1.00 0.00 C ATOM 977 CD ARG A 63 2.455 -12.124 8.810 1.00 0.00 C ATOM 978 NE ARG A 63 2.355 -13.449 9.415 1.00 0.00 N ATOM 979 CZ ARG A 63 3.407 -14.133 9.858 1.00 0.00 C ATOM 980 NH1 ARG A 63 4.633 -13.650 9.688 1.00 0.00 N ATOM 981 NH2 ARG A 63 3.235 -15.304 10.454 1.00 0.00 N ATOM 0 H ARG A 63 2.557 -8.916 5.493 1.00 0.00 H new ATOM 0 HA ARG A 63 1.015 -11.217 5.083 1.00 0.00 H new ATOM 0 HB2 ARG A 63 2.857 -10.540 6.797 1.00 0.00 H new ATOM 0 HB3 ARG A 63 1.557 -9.798 7.708 1.00 0.00 H new ATOM 0 HG2 ARG A 63 0.466 -11.943 8.022 1.00 0.00 H new ATOM 0 HG3 ARG A 63 1.595 -12.732 6.939 1.00 0.00 H new ATOM 0 HD2 ARG A 63 3.474 -11.969 8.455 1.00 0.00 H new ATOM 0 HD3 ARG A 63 2.265 -11.368 9.572 1.00 0.00 H new ATOM 0 HE ARG A 63 1.431 -13.872 9.503 1.00 0.00 H new ATOM 0 HH11 ARG A 63 4.768 -12.755 9.218 1.00 0.00 H new ATOM 0 HH12 ARG A 63 5.439 -14.174 10.028 1.00 0.00 H new ATOM 0 HH21 ARG A 63 2.295 -15.682 10.574 1.00 0.00 H new ATOM 0 HH22 ARG A 63 4.042 -15.827 10.793 1.00 0.00 H new ATOM 995 N ALA A 64 -0.602 -8.735 6.518 1.00 0.00 N ATOM 996 CA ALA A 64 -1.931 -8.240 6.846 1.00 0.00 C ATOM 997 C ALA A 64 -2.707 -7.866 5.585 1.00 0.00 C ATOM 998 O ALA A 64 -3.913 -8.087 5.499 1.00 0.00 O ATOM 999 CB ALA A 64 -1.832 -7.047 7.783 1.00 0.00 C ATOM 0 H ALA A 64 0.152 -8.078 6.717 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.475 -9.039 7.350 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.833 -6.687 8.020 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.327 -7.347 8.701 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.265 -6.251 7.300 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.001 -7.310 4.607 1.00 0.00 N ATOM 1006 CA LEU A 65 -2.619 -6.904 3.348 1.00 0.00 C ATOM 1007 C LEU A 65 -3.240 -8.101 2.633 1.00 0.00 C ATOM 1008 O LEU A 65 -4.421 -8.082 2.277 1.00 0.00 O ATOM 1009 CB LEU A 65 -1.576 -6.235 2.443 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.104 -5.717 1.101 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.132 -4.615 1.318 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -0.955 -5.217 0.238 1.00 0.00 C ATOM 0 H LEU A 65 -0.999 -7.129 4.661 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.412 -6.190 3.571 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.131 -5.401 2.985 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -0.777 -6.950 2.248 1.00 0.00 H new ATOM 0 HG LEU A 65 -2.593 -6.540 0.581 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.495 -4.261 0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -3.968 -5.006 1.898 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.671 -3.788 1.858 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.345 -4.852 -0.712 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.439 -4.407 0.753 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.256 -6.033 0.054 1.00 0.00 H new ATOM 1024 N GLN A 66 -2.453 -9.154 2.459 1.00 0.00 N ATOM 1025 CA GLN A 66 -2.898 -10.334 1.722 1.00 0.00 C ATOM 1026 C GLN A 66 -3.961 -11.117 2.490 1.00 0.00 C ATOM 1027 O GLN A 66 -4.640 -11.968 1.921 1.00 0.00 O ATOM 1028 CB GLN A 66 -1.712 -11.243 1.397 1.00 0.00 C ATOM 1029 CG GLN A 66 -0.683 -10.597 0.482 1.00 0.00 C ATOM 1030 CD GLN A 66 0.479 -11.515 0.153 1.00 0.00 C ATOM 1031 OE1 GLN A 66 1.073 -11.422 -0.919 1.00 0.00 O ATOM 1032 NE2 GLN A 66 0.818 -12.409 1.072 1.00 0.00 N ATOM 0 H GLN A 66 -1.500 -9.217 2.818 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.347 -9.984 0.793 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -1.225 -11.538 2.327 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -2.082 -12.155 0.928 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -1.170 -10.291 -0.444 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -0.301 -9.693 0.956 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.302 -12.458 1.951 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.594 -13.048 0.900 1.00 0.00 H new ATOM 1041 N SER A 67 -4.107 -10.840 3.779 1.00 0.00 N ATOM 1042 CA SER A 67 -5.127 -11.503 4.578 1.00 0.00 C ATOM 1043 C SER A 67 -6.363 -10.615 4.721 1.00 0.00 C ATOM 1044 O SER A 67 -7.380 -11.028 5.284 1.00 0.00 O ATOM 1045 CB SER A 67 -4.567 -11.892 5.949 1.00 0.00 C ATOM 1046 OG SER A 67 -3.912 -10.801 6.571 1.00 0.00 O ATOM 0 H SER A 67 -3.537 -10.166 4.290 1.00 0.00 H new ATOM 0 HA SER A 67 -5.428 -12.416 4.065 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.377 -12.243 6.588 1.00 0.00 H new ATOM 0 HB3 SER A 67 -3.868 -12.721 5.836 1.00 0.00 H new ATOM 0 HG SER A 67 -3.006 -10.714 6.208 1.00 0.00 H new ATOM 1052 N SER A 68 -6.269 -9.393 4.213 1.00 0.00 N ATOM 1053 CA SER A 68 -7.397 -8.480 4.206 1.00 0.00 C ATOM 1054 C SER A 68 -8.084 -8.520 2.843 1.00 0.00 C ATOM 1055 O SER A 68 -9.309 -8.429 2.743 1.00 0.00 O ATOM 1056 CB SER A 68 -6.938 -7.054 4.538 1.00 0.00 C ATOM 1057 OG SER A 68 -8.043 -6.186 4.731 1.00 0.00 O ATOM 0 H SER A 68 -5.418 -9.013 3.799 1.00 0.00 H new ATOM 0 HA SER A 68 -8.110 -8.792 4.970 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.323 -7.068 5.438 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.312 -6.674 3.730 1.00 0.00 H new ATOM 0 HG SER A 68 -7.719 -5.286 4.942 1.00 0.00 H new ATOM 1063 N ILE A 69 -7.287 -8.674 1.791 1.00 0.00 N ATOM 1064 CA ILE A 69 -7.826 -8.798 0.445 1.00 0.00 C ATOM 1065 C ILE A 69 -8.339 -10.220 0.221 1.00 0.00 C ATOM 1066 O ILE A 69 -7.711 -11.019 -0.470 1.00 0.00 O ATOM 1067 CB ILE A 69 -6.775 -8.453 -0.639 1.00 0.00 C ATOM 1068 CG1 ILE A 69 -6.084 -7.119 -0.327 1.00 0.00 C ATOM 1069 CG2 ILE A 69 -7.423 -8.396 -2.017 1.00 0.00 C ATOM 1070 CD1 ILE A 69 -7.020 -5.932 -0.320 1.00 0.00 C ATOM 0 H ILE A 69 -6.269 -8.716 1.846 1.00 0.00 H new ATOM 0 HA ILE A 69 -8.644 -8.084 0.355 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.022 -9.241 -0.638 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -5.598 -7.192 0.646 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.299 -6.946 -1.064 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.668 -8.152 -2.764 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -7.866 -9.364 -2.251 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.199 -7.631 -2.023 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -6.458 -5.027 -0.092 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.488 -5.832 -1.299 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.791 -6.081 0.436 1.00 0.00 H new ATOM 1442 N SER B 8 4.935 10.731 -17.473 1.00 0.00 N ATOM 1443 CA SER B 8 5.946 11.751 -17.234 1.00 0.00 C ATOM 1444 C SER B 8 6.375 11.786 -15.769 1.00 0.00 C ATOM 1445 O SER B 8 5.541 11.758 -14.859 1.00 0.00 O ATOM 1446 CB SER B 8 5.416 13.113 -17.669 1.00 0.00 C ATOM 1447 OG SER B 8 5.006 13.085 -19.029 1.00 0.00 O ATOM 0 HA SER B 8 6.827 11.501 -17.825 1.00 0.00 H new ATOM 0 HB2 SER B 8 4.575 13.400 -17.037 1.00 0.00 H new ATOM 0 HB3 SER B 8 6.189 13.869 -17.533 1.00 0.00 H new ATOM 0 HG SER B 8 4.555 12.236 -19.217 1.00 0.00 H new ATOM 1453 N ASP B 9 7.687 11.850 -15.565 1.00 0.00 N ATOM 1454 CA ASP B 9 8.279 11.870 -14.232 1.00 0.00 C ATOM 1455 C ASP B 9 7.751 13.041 -13.410 1.00 0.00 C ATOM 1456 O ASP B 9 7.520 12.909 -12.208 1.00 0.00 O ATOM 1457 CB ASP B 9 9.805 11.949 -14.343 1.00 0.00 C ATOM 1458 CG ASP B 9 10.492 12.095 -13.000 1.00 0.00 C ATOM 1459 OD1 ASP B 9 10.746 11.067 -12.338 1.00 0.00 O ATOM 1460 OD2 ASP B 9 10.809 13.240 -12.612 1.00 0.00 O ATOM 0 H ASP B 9 8.371 11.890 -16.321 1.00 0.00 H new ATOM 0 HA ASP B 9 8.000 10.949 -13.721 1.00 0.00 H new ATOM 0 HB2 ASP B 9 10.174 11.051 -14.838 1.00 0.00 H new ATOM 0 HB3 ASP B 9 10.074 12.795 -14.976 1.00 0.00 H new ATOM 1465 N GLU B 10 7.550 14.181 -14.069 1.00 0.00 N ATOM 1466 CA GLU B 10 7.004 15.359 -13.404 1.00 0.00 C ATOM 1467 C GLU B 10 5.642 15.055 -12.792 1.00 0.00 C ATOM 1468 O GLU B 10 5.391 15.393 -11.638 1.00 0.00 O ATOM 1469 CB GLU B 10 6.877 16.531 -14.379 1.00 0.00 C ATOM 1470 CG GLU B 10 8.210 17.060 -14.882 1.00 0.00 C ATOM 1471 CD GLU B 10 9.125 17.502 -13.761 1.00 0.00 C ATOM 1472 OE1 GLU B 10 8.770 18.450 -13.032 1.00 0.00 O ATOM 1473 OE2 GLU B 10 10.207 16.899 -13.598 1.00 0.00 O ATOM 0 H GLU B 10 7.757 14.312 -15.059 1.00 0.00 H new ATOM 0 HA GLU B 10 7.697 15.636 -12.609 1.00 0.00 H new ATOM 0 HB2 GLU B 10 6.276 16.217 -15.233 1.00 0.00 H new ATOM 0 HB3 GLU B 10 6.337 17.341 -13.889 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.706 16.285 -15.466 1.00 0.00 H new ATOM 0 HG3 GLU B 10 8.033 17.900 -15.553 1.00 0.00 H new ATOM 1480 N GLN B 11 4.779 14.403 -13.567 1.00 0.00 N ATOM 1481 CA GLN B 11 3.437 14.054 -13.111 1.00 0.00 C ATOM 1482 C GLN B 11 3.508 13.165 -11.871 1.00 0.00 C ATOM 1483 O GLN B 11 2.834 13.423 -10.874 1.00 0.00 O ATOM 1484 CB GLN B 11 2.668 13.343 -14.234 1.00 0.00 C ATOM 1485 CG GLN B 11 1.227 12.993 -13.882 1.00 0.00 C ATOM 1486 CD GLN B 11 0.372 14.215 -13.599 1.00 0.00 C ATOM 1487 OE1 GLN B 11 0.276 14.669 -12.462 1.00 0.00 O ATOM 1488 NE2 GLN B 11 -0.265 14.753 -14.627 1.00 0.00 N ATOM 0 H GLN B 11 4.988 14.104 -14.520 1.00 0.00 H new ATOM 0 HA GLN B 11 2.908 14.970 -12.847 1.00 0.00 H new ATOM 0 HB2 GLN B 11 2.669 13.979 -15.119 1.00 0.00 H new ATOM 0 HB3 GLN B 11 3.198 12.428 -14.499 1.00 0.00 H new ATOM 0 HG2 GLN B 11 0.785 12.429 -14.703 1.00 0.00 H new ATOM 0 HG3 GLN B 11 1.220 12.341 -13.008 1.00 0.00 H new ATOM 0 HE21 GLN B 11 -0.162 14.350 -15.558 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -0.858 15.571 -14.488 1.00 0.00 H new ATOM 1497 N VAL B 12 4.350 12.139 -11.932 1.00 0.00 N ATOM 1498 CA VAL B 12 4.531 11.222 -10.809 1.00 0.00 C ATOM 1499 C VAL B 12 4.991 11.979 -9.561 1.00 0.00 C ATOM 1500 O VAL B 12 4.483 11.757 -8.459 1.00 0.00 O ATOM 1501 CB VAL B 12 5.562 10.119 -11.144 1.00 0.00 C ATOM 1502 CG1 VAL B 12 5.687 9.124 -9.999 1.00 0.00 C ATOM 1503 CG2 VAL B 12 5.186 9.405 -12.435 1.00 0.00 C ATOM 0 H VAL B 12 4.920 11.920 -12.749 1.00 0.00 H new ATOM 0 HA VAL B 12 3.566 10.754 -10.615 1.00 0.00 H new ATOM 0 HB VAL B 12 6.532 10.597 -11.285 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.418 8.359 -10.260 1.00 0.00 H new ATOM 0 HG12 VAL B 12 6.012 9.645 -9.098 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.720 8.655 -9.817 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.924 8.633 -12.652 1.00 0.00 H new ATOM 0 HG22 VAL B 12 4.203 8.946 -12.324 1.00 0.00 H new ATOM 0 HG23 VAL B 12 5.161 10.124 -13.254 1.00 0.00 H new ATOM 1513 N GLU B 13 5.940 12.888 -9.755 1.00 0.00 N ATOM 1514 CA GLU B 13 6.483 13.691 -8.666 1.00 0.00 C ATOM 1515 C GLU B 13 5.405 14.590 -8.059 1.00 0.00 C ATOM 1516 O GLU B 13 5.396 14.833 -6.855 1.00 0.00 O ATOM 1517 CB GLU B 13 7.648 14.539 -9.184 1.00 0.00 C ATOM 1518 CG GLU B 13 8.370 15.335 -8.106 1.00 0.00 C ATOM 1519 CD GLU B 13 9.124 14.462 -7.122 1.00 0.00 C ATOM 1520 OE1 GLU B 13 9.909 13.594 -7.565 1.00 0.00 O ATOM 1521 OE2 GLU B 13 8.971 14.668 -5.900 1.00 0.00 O ATOM 0 H GLU B 13 6.353 13.088 -10.666 1.00 0.00 H new ATOM 0 HA GLU B 13 6.842 13.021 -7.885 1.00 0.00 H new ATOM 0 HB2 GLU B 13 8.366 13.885 -9.679 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.272 15.230 -9.939 1.00 0.00 H new ATOM 0 HG2 GLU B 13 9.069 16.025 -8.580 1.00 0.00 H new ATOM 0 HG3 GLU B 13 7.644 15.940 -7.563 1.00 0.00 H new ATOM 1528 N GLN B 14 4.492 15.071 -8.898 1.00 0.00 N ATOM 1529 CA GLN B 14 3.430 15.967 -8.446 1.00 0.00 C ATOM 1530 C GLN B 14 2.493 15.261 -7.471 1.00 0.00 C ATOM 1531 O GLN B 14 2.143 15.817 -6.431 1.00 0.00 O ATOM 1532 CB GLN B 14 2.647 16.521 -9.637 1.00 0.00 C ATOM 1533 CG GLN B 14 3.491 17.390 -10.554 1.00 0.00 C ATOM 1534 CD GLN B 14 2.747 17.848 -11.792 1.00 0.00 C ATOM 1535 OE1 GLN B 14 1.841 17.173 -12.275 1.00 0.00 O ATOM 1536 NE2 GLN B 14 3.129 19.001 -12.316 1.00 0.00 N ATOM 0 H GLN B 14 4.466 14.856 -9.895 1.00 0.00 H new ATOM 0 HA GLN B 14 3.897 16.801 -7.921 1.00 0.00 H new ATOM 0 HB2 GLN B 14 2.235 15.691 -10.211 1.00 0.00 H new ATOM 0 HB3 GLN B 14 1.803 17.104 -9.269 1.00 0.00 H new ATOM 0 HG2 GLN B 14 3.835 18.264 -10.001 1.00 0.00 H new ATOM 0 HG3 GLN B 14 4.378 16.834 -10.856 1.00 0.00 H new ATOM 0 HE21 GLN B 14 3.886 19.531 -11.884 1.00 0.00 H new ATOM 0 HE22 GLN B 14 2.667 19.360 -13.152 1.00 0.00 H new ATOM 1545 N LEU B 15 2.099 14.033 -7.799 1.00 0.00 N ATOM 1546 CA LEU B 15 1.262 13.246 -6.898 1.00 0.00 C ATOM 1547 C LEU B 15 2.013 12.939 -5.610 1.00 0.00 C ATOM 1548 O LEU B 15 1.476 13.089 -4.514 1.00 0.00 O ATOM 1549 CB LEU B 15 0.806 11.933 -7.548 1.00 0.00 C ATOM 1550 CG LEU B 15 -0.379 12.039 -8.512 1.00 0.00 C ATOM 1551 CD1 LEU B 15 0.034 12.690 -9.818 1.00 0.00 C ATOM 1552 CD2 LEU B 15 -0.975 10.664 -8.765 1.00 0.00 C ATOM 0 H LEU B 15 2.343 13.565 -8.672 1.00 0.00 H new ATOM 0 HA LEU B 15 0.377 13.842 -6.674 1.00 0.00 H new ATOM 0 HB2 LEU B 15 1.651 11.505 -8.087 1.00 0.00 H new ATOM 0 HB3 LEU B 15 0.544 11.231 -6.757 1.00 0.00 H new ATOM 0 HG LEU B 15 -1.138 12.671 -8.050 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -0.828 12.752 -10.482 1.00 0.00 H new ATOM 0 HD12 LEU B 15 0.413 13.693 -9.621 1.00 0.00 H new ATOM 0 HD13 LEU B 15 0.815 12.094 -10.291 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -1.817 10.753 -9.452 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -0.217 10.014 -9.202 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -1.319 10.238 -7.823 1.00 0.00 H new ATOM 1564 N LEU B 16 3.265 12.522 -5.759 1.00 0.00 N ATOM 1565 CA LEU B 16 4.109 12.178 -4.623 1.00 0.00 C ATOM 1566 C LEU B 16 4.275 13.379 -3.689 1.00 0.00 C ATOM 1567 O LEU B 16 4.175 13.246 -2.468 1.00 0.00 O ATOM 1568 CB LEU B 16 5.468 11.672 -5.132 1.00 0.00 C ATOM 1569 CG LEU B 16 6.452 11.178 -4.067 1.00 0.00 C ATOM 1570 CD1 LEU B 16 7.311 10.055 -4.627 1.00 0.00 C ATOM 1571 CD2 LEU B 16 7.342 12.314 -3.588 1.00 0.00 C ATOM 0 H LEU B 16 3.721 12.414 -6.665 1.00 0.00 H new ATOM 0 HA LEU B 16 3.634 11.383 -4.048 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.288 10.859 -5.835 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.945 12.477 -5.691 1.00 0.00 H new ATOM 0 HG LEU B 16 5.877 10.803 -3.220 1.00 0.00 H new ATOM 0 HD11 LEU B 16 8.006 9.712 -3.861 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.672 9.227 -4.934 1.00 0.00 H new ATOM 0 HD13 LEU B 16 7.871 10.420 -5.488 1.00 0.00 H new ATOM 0 HD21 LEU B 16 8.033 11.941 -2.832 1.00 0.00 H new ATOM 0 HD22 LEU B 16 7.907 12.714 -4.430 1.00 0.00 H new ATOM 0 HD23 LEU B 16 6.725 13.103 -3.158 1.00 0.00 H new ATOM 1583 N ALA B 17 4.502 14.550 -4.274 1.00 0.00 N ATOM 1584 CA ALA B 17 4.663 15.777 -3.503 1.00 0.00 C ATOM 1585 C ALA B 17 3.394 16.107 -2.724 1.00 0.00 C ATOM 1586 O ALA B 17 3.457 16.452 -1.546 1.00 0.00 O ATOM 1587 CB ALA B 17 5.039 16.936 -4.416 1.00 0.00 C ATOM 0 H ALA B 17 4.579 14.675 -5.283 1.00 0.00 H new ATOM 0 HA ALA B 17 5.469 15.619 -2.787 1.00 0.00 H new ATOM 0 HB1 ALA B 17 5.155 17.843 -3.823 1.00 0.00 H new ATOM 0 HB2 ALA B 17 5.978 16.711 -4.922 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.254 17.085 -5.157 1.00 0.00 H new ATOM 1593 N GLU B 18 2.246 15.986 -3.381 1.00 0.00 N ATOM 1594 CA GLU B 18 0.968 16.266 -2.736 1.00 0.00 C ATOM 1595 C GLU B 18 0.684 15.266 -1.619 1.00 0.00 C ATOM 1596 O GLU B 18 0.115 15.626 -0.588 1.00 0.00 O ATOM 1597 CB GLU B 18 -0.172 16.254 -3.754 1.00 0.00 C ATOM 1598 CG GLU B 18 -0.165 17.451 -4.689 1.00 0.00 C ATOM 1599 CD GLU B 18 -1.363 17.475 -5.616 1.00 0.00 C ATOM 1600 OE1 GLU B 18 -2.410 16.889 -5.264 1.00 0.00 O ATOM 1601 OE2 GLU B 18 -1.274 18.098 -6.694 1.00 0.00 O ATOM 0 H GLU B 18 2.174 15.697 -4.357 1.00 0.00 H new ATOM 0 HA GLU B 18 1.033 17.262 -2.298 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.110 15.341 -4.346 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -1.123 16.225 -3.222 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -0.149 18.368 -4.099 1.00 0.00 H new ATOM 0 HG3 GLU B 18 0.749 17.438 -5.283 1.00 0.00 H new ATOM 1608 N LEU B 19 1.087 14.017 -1.819 1.00 0.00 N ATOM 1609 CA LEU B 19 0.925 12.993 -0.793 1.00 0.00 C ATOM 1610 C LEU B 19 1.772 13.326 0.430 1.00 0.00 C ATOM 1611 O LEU B 19 1.299 13.255 1.564 1.00 0.00 O ATOM 1612 CB LEU B 19 1.299 11.613 -1.338 1.00 0.00 C ATOM 1613 CG LEU B 19 0.386 11.081 -2.444 1.00 0.00 C ATOM 1614 CD1 LEU B 19 0.893 9.744 -2.958 1.00 0.00 C ATOM 1615 CD2 LEU B 19 -1.044 10.948 -1.943 1.00 0.00 C ATOM 0 H LEU B 19 1.527 13.689 -2.679 1.00 0.00 H new ATOM 0 HA LEU B 19 -0.124 12.972 -0.497 1.00 0.00 H new ATOM 0 HB2 LEU B 19 2.319 11.655 -1.720 1.00 0.00 H new ATOM 0 HB3 LEU B 19 1.296 10.901 -0.513 1.00 0.00 H new ATOM 0 HG LEU B 19 0.397 11.795 -3.267 1.00 0.00 H new ATOM 0 HD11 LEU B 19 0.231 9.382 -3.744 1.00 0.00 H new ATOM 0 HD12 LEU B 19 1.899 9.866 -3.359 1.00 0.00 H new ATOM 0 HD13 LEU B 19 0.913 9.024 -2.140 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -1.677 10.568 -2.745 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -1.072 10.257 -1.101 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -1.410 11.924 -1.624 1.00 0.00 H new ATOM 1627 N LEU B 20 3.023 13.705 0.194 1.00 0.00 N ATOM 1628 CA LEU B 20 3.910 14.124 1.274 1.00 0.00 C ATOM 1629 C LEU B 20 3.381 15.390 1.935 1.00 0.00 C ATOM 1630 O LEU B 20 3.529 15.580 3.142 1.00 0.00 O ATOM 1631 CB LEU B 20 5.326 14.358 0.748 1.00 0.00 C ATOM 1632 CG LEU B 20 6.074 13.092 0.324 1.00 0.00 C ATOM 1633 CD1 LEU B 20 7.410 13.446 -0.303 1.00 0.00 C ATOM 1634 CD2 LEU B 20 6.277 12.170 1.518 1.00 0.00 C ATOM 0 H LEU B 20 3.446 13.731 -0.734 1.00 0.00 H new ATOM 0 HA LEU B 20 3.943 13.327 2.017 1.00 0.00 H new ATOM 0 HB2 LEU B 20 5.274 15.034 -0.105 1.00 0.00 H new ATOM 0 HB3 LEU B 20 5.906 14.863 1.520 1.00 0.00 H new ATOM 0 HG LEU B 20 5.472 12.570 -0.420 1.00 0.00 H new ATOM 0 HD11 LEU B 20 7.927 12.533 -0.598 1.00 0.00 H new ATOM 0 HD12 LEU B 20 7.246 14.070 -1.182 1.00 0.00 H new ATOM 0 HD13 LEU B 20 8.018 13.990 0.420 1.00 0.00 H new ATOM 0 HD21 LEU B 20 6.810 11.274 1.200 1.00 0.00 H new ATOM 0 HD22 LEU B 20 6.859 12.686 2.282 1.00 0.00 H new ATOM 0 HD23 LEU B 20 5.308 11.888 1.929 1.00 0.00 H new ATOM 1646 N ASN B 21 2.762 16.251 1.136 1.00 0.00 N ATOM 1647 CA ASN B 21 2.129 17.463 1.645 1.00 0.00 C ATOM 1648 C ASN B 21 1.048 17.107 2.661 1.00 0.00 C ATOM 1649 O ASN B 21 0.888 17.785 3.667 1.00 0.00 O ATOM 1650 CB ASN B 21 1.531 18.274 0.490 1.00 0.00 C ATOM 1651 CG ASN B 21 0.876 19.567 0.943 1.00 0.00 C ATOM 1652 OD1 ASN B 21 1.288 20.184 1.926 1.00 0.00 O ATOM 1653 ND2 ASN B 21 -0.149 19.989 0.220 1.00 0.00 N ATOM 0 H ASN B 21 2.685 16.131 0.126 1.00 0.00 H new ATOM 0 HA ASN B 21 2.885 18.071 2.141 1.00 0.00 H new ATOM 0 HB2 ASN B 21 2.317 18.505 -0.229 1.00 0.00 H new ATOM 0 HB3 ASN B 21 0.793 17.663 -0.030 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -0.628 20.854 0.470 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -0.460 19.449 -0.588 1.00 0.00 H new ATOM 1660 N VAL B 22 0.321 16.025 2.398 1.00 0.00 N ATOM 1661 CA VAL B 22 -0.685 15.534 3.332 1.00 0.00 C ATOM 1662 C VAL B 22 -0.039 15.163 4.667 1.00 0.00 C ATOM 1663 O VAL B 22 -0.506 15.575 5.733 1.00 0.00 O ATOM 1664 CB VAL B 22 -1.436 14.305 2.769 1.00 0.00 C ATOM 1665 CG1 VAL B 22 -2.405 13.740 3.798 1.00 0.00 C ATOM 1666 CG2 VAL B 22 -2.172 14.666 1.487 1.00 0.00 C ATOM 0 H VAL B 22 0.410 15.472 1.546 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.405 16.338 3.483 1.00 0.00 H new ATOM 0 HB VAL B 22 -0.698 13.537 2.539 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -2.920 12.877 3.377 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -1.854 13.435 4.688 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.136 14.503 4.067 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -2.694 13.788 1.107 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -2.894 15.456 1.692 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.456 15.013 0.742 1.00 0.00 H new ATOM 1676 N LEU B 23 1.049 14.404 4.598 1.00 0.00 N ATOM 1677 CA LEU B 23 1.768 13.978 5.796 1.00 0.00 C ATOM 1678 C LEU B 23 2.323 15.173 6.565 1.00 0.00 C ATOM 1679 O LEU B 23 2.274 15.202 7.793 1.00 0.00 O ATOM 1680 CB LEU B 23 2.907 13.013 5.440 1.00 0.00 C ATOM 1681 CG LEU B 23 2.508 11.540 5.264 1.00 0.00 C ATOM 1682 CD1 LEU B 23 1.821 11.017 6.516 1.00 0.00 C ATOM 1683 CD2 LEU B 23 1.615 11.349 4.047 1.00 0.00 C ATOM 0 H LEU B 23 1.454 14.070 3.724 1.00 0.00 H new ATOM 0 HA LEU B 23 1.053 13.458 6.434 1.00 0.00 H new ATOM 0 HB2 LEU B 23 3.372 13.356 4.516 1.00 0.00 H new ATOM 0 HB3 LEU B 23 3.665 13.073 6.220 1.00 0.00 H new ATOM 0 HG LEU B 23 3.421 10.966 5.102 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.546 9.972 6.371 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.500 11.099 7.365 1.00 0.00 H new ATOM 0 HD13 LEU B 23 0.924 11.604 6.711 1.00 0.00 H new ATOM 0 HD21 LEU B 23 1.351 10.296 3.951 1.00 0.00 H new ATOM 0 HD22 LEU B 23 0.708 11.941 4.165 1.00 0.00 H new ATOM 0 HD23 LEU B 23 2.146 11.673 3.152 1.00 0.00 H new ATOM 1695 N GLU B 24 2.838 16.157 5.841 1.00 0.00 N ATOM 1696 CA GLU B 24 3.408 17.346 6.464 1.00 0.00 C ATOM 1697 C GLU B 24 2.324 18.262 7.021 1.00 0.00 C ATOM 1698 O GLU B 24 2.434 18.755 8.142 1.00 0.00 O ATOM 1699 CB GLU B 24 4.273 18.108 5.460 1.00 0.00 C ATOM 1700 CG GLU B 24 5.537 17.364 5.065 1.00 0.00 C ATOM 1701 CD GLU B 24 6.485 17.177 6.231 1.00 0.00 C ATOM 1702 OE1 GLU B 24 6.281 16.240 7.032 1.00 0.00 O ATOM 1703 OE2 GLU B 24 7.440 17.971 6.354 1.00 0.00 O ATOM 0 H GLU B 24 2.873 16.157 4.822 1.00 0.00 H new ATOM 0 HA GLU B 24 4.029 17.017 7.297 1.00 0.00 H new ATOM 0 HB2 GLU B 24 3.685 18.310 4.565 1.00 0.00 H new ATOM 0 HB3 GLU B 24 4.547 19.073 5.886 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.269 16.389 4.658 1.00 0.00 H new ATOM 0 HG3 GLU B 24 6.045 17.912 4.271 1.00 0.00 H new ATOM 1710 N LYS B 25 1.275 18.479 6.243 1.00 0.00 N ATOM 1711 CA LYS B 25 0.183 19.358 6.649 1.00 0.00 C ATOM 1712 C LYS B 25 -0.536 18.809 7.874 1.00 0.00 C ATOM 1713 O LYS B 25 -0.832 19.541 8.820 1.00 0.00 O ATOM 1714 CB LYS B 25 -0.804 19.533 5.490 1.00 0.00 C ATOM 1715 CG LYS B 25 -1.956 20.484 5.783 1.00 0.00 C ATOM 1716 CD LYS B 25 -2.851 20.671 4.566 1.00 0.00 C ATOM 1717 CE LYS B 25 -3.586 19.390 4.196 1.00 0.00 C ATOM 1718 NZ LYS B 25 -4.676 19.077 5.157 1.00 0.00 N ATOM 0 H LYS B 25 1.154 18.057 5.322 1.00 0.00 H new ATOM 0 HA LYS B 25 0.604 20.328 6.912 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -0.261 19.898 4.618 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -1.212 18.557 5.226 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.546 20.097 6.613 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -1.560 21.450 6.096 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -3.576 21.460 4.767 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -2.248 21.000 3.720 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -4.003 19.488 3.194 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -2.879 18.561 4.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -5.277 18.323 4.767 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -4.264 18.760 6.058 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -5.251 19.928 5.320 1.00 0.00 H new ATOM 1732 N HIS B 26 -0.802 17.512 7.863 1.00 0.00 N ATOM 1733 CA HIS B 26 -1.574 16.889 8.928 1.00 0.00 C ATOM 1734 C HIS B 26 -0.672 16.458 10.082 1.00 0.00 C ATOM 1735 O HIS B 26 -1.130 16.344 11.220 1.00 0.00 O ATOM 1736 CB HIS B 26 -2.330 15.674 8.387 1.00 0.00 C ATOM 1737 CG HIS B 26 -3.518 15.289 9.210 1.00 0.00 C ATOM 1738 ND1 HIS B 26 -3.454 14.433 10.291 1.00 0.00 N ATOM 1739 CD2 HIS B 26 -4.815 15.647 9.094 1.00 0.00 C ATOM 1740 CE1 HIS B 26 -4.662 14.286 10.800 1.00 0.00 C ATOM 1741 NE2 HIS B 26 -5.501 15.010 10.092 1.00 0.00 N ATOM 0 H HIS B 26 -0.496 16.871 7.131 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.286 17.625 9.302 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.657 15.885 7.369 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -1.647 14.827 8.333 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -5.233 16.312 8.352 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -4.918 13.675 11.653 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -6.504 15.085 10.260 1.00 0.00 H new ATOM 1750 N LYS B 27 0.606 16.236 9.776 1.00 0.00 N ATOM 1751 CA LYS B 27 1.564 15.683 10.736 1.00 0.00 C ATOM 1752 C LYS B 27 1.025 14.380 11.317 1.00 0.00 C ATOM 1753 O LYS B 27 0.620 14.319 12.477 1.00 0.00 O ATOM 1754 CB LYS B 27 1.885 16.681 11.859 1.00 0.00 C ATOM 1755 CG LYS B 27 2.564 17.966 11.393 1.00 0.00 C ATOM 1756 CD LYS B 27 4.066 17.800 11.153 1.00 0.00 C ATOM 1757 CE LYS B 27 4.376 16.985 9.903 1.00 0.00 C ATOM 1758 NZ LYS B 27 5.782 17.162 9.456 1.00 0.00 N ATOM 0 H LYS B 27 1.007 16.433 8.859 1.00 0.00 H new ATOM 0 HA LYS B 27 2.494 15.482 10.204 1.00 0.00 H new ATOM 0 HB2 LYS B 27 0.959 16.941 12.372 1.00 0.00 H new ATOM 0 HB3 LYS B 27 2.528 16.191 12.590 1.00 0.00 H new ATOM 0 HG2 LYS B 27 2.091 18.306 10.472 1.00 0.00 H new ATOM 0 HG3 LYS B 27 2.406 18.745 12.139 1.00 0.00 H new ATOM 0 HD2 LYS B 27 4.526 18.784 11.063 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.517 17.315 12.019 1.00 0.00 H new ATOM 0 HE2 LYS B 27 4.190 15.930 10.103 1.00 0.00 H new ATOM 0 HE3 LYS B 27 3.701 17.281 9.100 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 6.000 16.468 8.712 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 5.908 18.124 9.080 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 6.423 17.018 10.262 1.00 0.00 H new ATOM 1772 N ALA B 28 0.993 13.352 10.486 1.00 0.00 N ATOM 1773 CA ALA B 28 0.416 12.076 10.881 1.00 0.00 C ATOM 1774 C ALA B 28 1.489 11.119 11.379 1.00 0.00 C ATOM 1775 O ALA B 28 2.535 10.962 10.748 1.00 0.00 O ATOM 1776 CB ALA B 28 -0.349 11.461 9.720 1.00 0.00 C ATOM 0 H ALA B 28 1.359 13.375 9.534 1.00 0.00 H new ATOM 0 HA ALA B 28 -0.278 12.257 11.702 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.775 10.507 10.030 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -1.150 12.134 9.415 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.329 11.300 8.882 1.00 0.00 H new ATOM 1782 N PRO B 29 1.246 10.481 12.535 1.00 0.00 N ATOM 1783 CA PRO B 29 2.154 9.473 13.085 1.00 0.00 C ATOM 1784 C PRO B 29 2.178 8.212 12.228 1.00 0.00 C ATOM 1785 O PRO B 29 1.246 7.965 11.456 1.00 0.00 O ATOM 1786 CB PRO B 29 1.565 9.172 14.467 1.00 0.00 C ATOM 1787 CG PRO B 29 0.128 9.547 14.359 1.00 0.00 C ATOM 1788 CD PRO B 29 0.073 10.701 13.398 1.00 0.00 C ATOM 0 HA PRO B 29 3.186 9.822 13.122 1.00 0.00 H new ATOM 0 HB2 PRO B 29 1.681 8.119 14.725 1.00 0.00 H new ATOM 0 HB3 PRO B 29 2.067 9.748 15.245 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -0.468 8.709 13.997 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -0.276 9.829 15.331 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -0.854 10.702 12.824 1.00 0.00 H new ATOM 0 HD3 PRO B 29 0.129 11.658 13.916 1.00 0.00 H new ATOM 1796 N THR B 30 3.230 7.416 12.372 1.00 0.00 N ATOM 1797 CA THR B 30 3.395 6.204 11.575 1.00 0.00 C ATOM 1798 C THR B 30 2.195 5.271 11.745 1.00 0.00 C ATOM 1799 O THR B 30 1.770 4.613 10.794 1.00 0.00 O ATOM 1800 CB THR B 30 4.681 5.458 11.971 1.00 0.00 C ATOM 1801 OG1 THR B 30 5.745 6.400 12.168 1.00 0.00 O ATOM 1802 CG2 THR B 30 5.087 4.463 10.893 1.00 0.00 C ATOM 0 H THR B 30 3.985 7.588 13.036 1.00 0.00 H new ATOM 0 HA THR B 30 3.466 6.506 10.530 1.00 0.00 H new ATOM 0 HB THR B 30 4.488 4.914 12.895 1.00 0.00 H new ATOM 0 HG1 THR B 30 6.562 5.922 12.422 1.00 0.00 H new ATOM 0 HG21 THR B 30 5.999 3.949 11.197 1.00 0.00 H new ATOM 0 HG22 THR B 30 4.289 3.734 10.752 1.00 0.00 H new ATOM 0 HG23 THR B 30 5.264 4.993 9.957 1.00 0.00 H new ATOM 1810 N ASP B 31 1.654 5.244 12.961 1.00 0.00 N ATOM 1811 CA ASP B 31 0.466 4.453 13.282 1.00 0.00 C ATOM 1812 C ASP B 31 -0.662 4.751 12.304 1.00 0.00 C ATOM 1813 O ASP B 31 -1.111 3.878 11.561 1.00 0.00 O ATOM 1814 CB ASP B 31 -0.024 4.780 14.697 1.00 0.00 C ATOM 1815 CG ASP B 31 1.046 4.629 15.755 1.00 0.00 C ATOM 1816 OD1 ASP B 31 2.010 5.421 15.744 1.00 0.00 O ATOM 1817 OD2 ASP B 31 0.918 3.731 16.614 1.00 0.00 O ATOM 0 H ASP B 31 2.026 5.769 13.752 1.00 0.00 H new ATOM 0 HA ASP B 31 0.741 3.401 13.214 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -0.400 5.803 14.715 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -0.862 4.127 14.943 1.00 0.00 H new ATOM 1822 N LEU B 32 -1.098 6.003 12.303 1.00 0.00 N ATOM 1823 CA LEU B 32 -2.221 6.425 11.482 1.00 0.00 C ATOM 1824 C LEU B 32 -1.836 6.441 10.006 1.00 0.00 C ATOM 1825 O LEU B 32 -2.673 6.195 9.141 1.00 0.00 O ATOM 1826 CB LEU B 32 -2.703 7.809 11.926 1.00 0.00 C ATOM 1827 CG LEU B 32 -3.989 8.304 11.259 1.00 0.00 C ATOM 1828 CD1 LEU B 32 -5.151 7.368 11.568 1.00 0.00 C ATOM 1829 CD2 LEU B 32 -4.309 9.719 11.716 1.00 0.00 C ATOM 0 H LEU B 32 -0.687 6.748 12.866 1.00 0.00 H new ATOM 0 HA LEU B 32 -3.034 5.711 11.611 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -2.857 7.792 13.005 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -1.911 8.531 11.729 1.00 0.00 H new ATOM 0 HG LEU B 32 -3.836 8.312 10.180 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -6.055 7.738 11.084 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -4.923 6.369 11.195 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -5.307 7.326 12.646 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -5.226 10.058 11.234 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -4.442 9.731 12.798 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -3.489 10.383 11.444 1.00 0.00 H new ATOM 1841 N SER B 33 -0.566 6.717 9.727 1.00 0.00 N ATOM 1842 CA SER B 33 -0.070 6.737 8.360 1.00 0.00 C ATOM 1843 C SER B 33 -0.268 5.372 7.703 1.00 0.00 C ATOM 1844 O SER B 33 -0.943 5.265 6.679 1.00 0.00 O ATOM 1845 CB SER B 33 1.409 7.134 8.334 1.00 0.00 C ATOM 1846 OG SER B 33 1.894 7.239 7.007 1.00 0.00 O ATOM 0 H SER B 33 0.138 6.930 10.433 1.00 0.00 H new ATOM 0 HA SER B 33 -0.636 7.478 7.796 1.00 0.00 H new ATOM 0 HB2 SER B 33 1.540 8.087 8.847 1.00 0.00 H new ATOM 0 HB3 SER B 33 1.995 6.395 8.880 1.00 0.00 H new ATOM 0 HG SER B 33 2.840 7.495 7.024 1.00 0.00 H new ATOM 1852 N LEU B 34 0.294 4.331 8.314 1.00 0.00 N ATOM 1853 CA LEU B 34 0.166 2.975 7.792 1.00 0.00 C ATOM 1854 C LEU B 34 -1.294 2.536 7.794 1.00 0.00 C ATOM 1855 O LEU B 34 -1.737 1.821 6.897 1.00 0.00 O ATOM 1856 CB LEU B 34 1.008 1.999 8.619 1.00 0.00 C ATOM 1857 CG LEU B 34 2.521 2.221 8.544 1.00 0.00 C ATOM 1858 CD1 LEU B 34 3.250 1.250 9.461 1.00 0.00 C ATOM 1859 CD2 LEU B 34 3.012 2.070 7.112 1.00 0.00 C ATOM 0 H LEU B 34 0.842 4.402 9.171 1.00 0.00 H new ATOM 0 HA LEU B 34 0.532 2.970 6.765 1.00 0.00 H new ATOM 0 HB2 LEU B 34 0.698 2.069 9.662 1.00 0.00 H new ATOM 0 HB3 LEU B 34 0.789 0.984 8.288 1.00 0.00 H new ATOM 0 HG LEU B 34 2.735 3.236 8.877 1.00 0.00 H new ATOM 0 HD11 LEU B 34 4.324 1.423 9.394 1.00 0.00 H new ATOM 0 HD12 LEU B 34 2.921 1.404 10.489 1.00 0.00 H new ATOM 0 HD13 LEU B 34 3.028 0.227 9.158 1.00 0.00 H new ATOM 0 HD21 LEU B 34 4.089 2.231 7.078 1.00 0.00 H new ATOM 0 HD22 LEU B 34 2.784 1.066 6.753 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.515 2.804 6.478 1.00 0.00 H new ATOM 1871 N MET B 35 -2.033 2.979 8.806 1.00 0.00 N ATOM 1872 CA MET B 35 -3.457 2.684 8.913 1.00 0.00 C ATOM 1873 C MET B 35 -4.214 3.199 7.688 1.00 0.00 C ATOM 1874 O MET B 35 -4.903 2.437 7.007 1.00 0.00 O ATOM 1875 CB MET B 35 -4.028 3.313 10.187 1.00 0.00 C ATOM 1876 CG MET B 35 -5.531 3.139 10.353 1.00 0.00 C ATOM 1877 SD MET B 35 -6.033 1.410 10.446 1.00 0.00 S ATOM 1878 CE MET B 35 -7.793 1.585 10.734 1.00 0.00 C ATOM 0 H MET B 35 -1.666 3.548 9.569 1.00 0.00 H new ATOM 0 HA MET B 35 -3.581 1.602 8.961 1.00 0.00 H new ATOM 0 HB2 MET B 35 -3.526 2.876 11.050 1.00 0.00 H new ATOM 0 HB3 MET B 35 -3.795 4.378 10.188 1.00 0.00 H new ATOM 0 HG2 MET B 35 -5.853 3.654 11.258 1.00 0.00 H new ATOM 0 HG3 MET B 35 -6.041 3.615 9.516 1.00 0.00 H new ATOM 0 HE1 MET B 35 -8.248 0.598 10.815 1.00 0.00 H new ATOM 0 HE2 MET B 35 -7.957 2.137 11.659 1.00 0.00 H new ATOM 0 HE3 MET B 35 -8.246 2.126 9.903 1.00 0.00 H new ATOM 1888 N VAL B 36 -4.072 4.486 7.401 1.00 0.00 N ATOM 1889 CA VAL B 36 -4.778 5.096 6.283 1.00 0.00 C ATOM 1890 C VAL B 36 -4.250 4.572 4.949 1.00 0.00 C ATOM 1891 O VAL B 36 -5.030 4.269 4.048 1.00 0.00 O ATOM 1892 CB VAL B 36 -4.681 6.637 6.315 1.00 0.00 C ATOM 1893 CG1 VAL B 36 -5.387 7.251 5.116 1.00 0.00 C ATOM 1894 CG2 VAL B 36 -5.269 7.178 7.608 1.00 0.00 C ATOM 0 H VAL B 36 -3.476 5.126 7.926 1.00 0.00 H new ATOM 0 HA VAL B 36 -5.827 4.819 6.383 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.627 6.912 6.267 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -5.304 8.337 5.162 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -4.924 6.890 4.197 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -6.439 6.966 5.128 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -5.193 8.265 7.615 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -6.317 6.887 7.681 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -4.719 6.770 8.456 1.00 0.00 H new ATOM 1904 N LEU B 37 -2.931 4.445 4.833 1.00 0.00 N ATOM 1905 CA LEU B 37 -2.319 3.936 3.607 1.00 0.00 C ATOM 1906 C LEU B 37 -2.821 2.530 3.297 1.00 0.00 C ATOM 1907 O LEU B 37 -3.226 2.244 2.170 1.00 0.00 O ATOM 1908 CB LEU B 37 -0.791 3.932 3.717 1.00 0.00 C ATOM 1909 CG LEU B 37 -0.131 5.313 3.740 1.00 0.00 C ATOM 1910 CD1 LEU B 37 1.372 5.177 3.913 1.00 0.00 C ATOM 1911 CD2 LEU B 37 -0.453 6.080 2.467 1.00 0.00 C ATOM 0 H LEU B 37 -2.267 4.686 5.569 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.607 4.600 2.792 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.510 3.399 4.625 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.385 3.368 2.878 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.529 5.872 4.587 1.00 0.00 H new ATOM 0 HD11 LEU B 37 1.828 6.167 3.928 1.00 0.00 H new ATOM 0 HD12 LEU B 37 1.585 4.666 4.852 1.00 0.00 H new ATOM 0 HD13 LEU B 37 1.783 4.601 3.084 1.00 0.00 H new ATOM 0 HD21 LEU B 37 0.025 7.059 2.501 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -0.083 5.526 1.605 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -1.532 6.206 2.381 1.00 0.00 H new ATOM 1923 N GLY B 38 -2.810 1.666 4.307 1.00 0.00 N ATOM 1924 CA GLY B 38 -3.283 0.305 4.131 1.00 0.00 C ATOM 1925 C GLY B 38 -4.733 0.255 3.694 1.00 0.00 C ATOM 1926 O GLY B 38 -5.090 -0.493 2.781 1.00 0.00 O ATOM 0 H GLY B 38 -2.481 1.885 5.247 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.664 -0.200 3.389 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -3.168 -0.242 5.067 1.00 0.00 H new ATOM 1930 N ASN B 39 -5.568 1.069 4.330 1.00 0.00 N ATOM 1931 CA ASN B 39 -6.985 1.135 3.989 1.00 0.00 C ATOM 1932 C ASN B 39 -7.180 1.696 2.587 1.00 0.00 C ATOM 1933 O ASN B 39 -8.031 1.221 1.840 1.00 0.00 O ATOM 1934 CB ASN B 39 -7.759 1.979 5.007 1.00 0.00 C ATOM 1935 CG ASN B 39 -8.147 1.190 6.243 1.00 0.00 C ATOM 1936 OD1 ASN B 39 -9.222 0.596 6.299 1.00 0.00 O ATOM 1937 ND2 ASN B 39 -7.281 1.175 7.243 1.00 0.00 N ATOM 0 H ASN B 39 -5.288 1.694 5.086 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.378 0.119 4.015 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -7.151 2.834 5.302 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -8.659 2.375 4.536 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -7.496 0.659 8.096 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -6.398 1.680 7.161 1.00 0.00 H new ATOM 1944 N MET B 40 -6.379 2.695 2.228 1.00 0.00 N ATOM 1945 CA MET B 40 -6.446 3.295 0.899 1.00 0.00 C ATOM 1946 C MET B 40 -6.122 2.278 -0.187 1.00 0.00 C ATOM 1947 O MET B 40 -6.857 2.157 -1.166 1.00 0.00 O ATOM 1948 CB MET B 40 -5.500 4.491 0.795 1.00 0.00 C ATOM 1949 CG MET B 40 -6.140 5.806 1.204 1.00 0.00 C ATOM 1950 SD MET B 40 -7.392 6.359 0.029 1.00 0.00 S ATOM 1951 CE MET B 40 -6.395 6.589 -1.442 1.00 0.00 C ATOM 0 H MET B 40 -5.675 3.107 2.840 1.00 0.00 H new ATOM 0 HA MET B 40 -7.469 3.640 0.748 1.00 0.00 H new ATOM 0 HB2 MET B 40 -4.627 4.310 1.423 1.00 0.00 H new ATOM 0 HB3 MET B 40 -5.143 4.574 -0.231 1.00 0.00 H new ATOM 0 HG2 MET B 40 -6.594 5.695 2.189 1.00 0.00 H new ATOM 0 HG3 MET B 40 -5.368 6.570 1.294 1.00 0.00 H new ATOM 0 HE1 MET B 40 -6.621 7.558 -1.887 1.00 0.00 H new ATOM 0 HE2 MET B 40 -5.339 6.549 -1.176 1.00 0.00 H new ATOM 0 HE3 MET B 40 -6.618 5.800 -2.160 1.00 0.00 H new ATOM 1961 N VAL B 41 -5.030 1.541 -0.010 1.00 0.00 N ATOM 1962 CA VAL B 41 -4.637 0.525 -0.981 1.00 0.00 C ATOM 1963 C VAL B 41 -5.700 -0.570 -1.060 1.00 0.00 C ATOM 1964 O VAL B 41 -6.083 -0.998 -2.150 1.00 0.00 O ATOM 1965 CB VAL B 41 -3.265 -0.101 -0.640 1.00 0.00 C ATOM 1966 CG1 VAL B 41 -2.864 -1.133 -1.686 1.00 0.00 C ATOM 1967 CG2 VAL B 41 -2.199 0.979 -0.530 1.00 0.00 C ATOM 0 H VAL B 41 -4.405 1.627 0.791 1.00 0.00 H new ATOM 0 HA VAL B 41 -4.547 1.018 -1.949 1.00 0.00 H new ATOM 0 HB VAL B 41 -3.353 -0.605 0.322 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -1.896 -1.559 -1.424 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -3.612 -1.925 -1.721 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -2.797 -0.654 -2.663 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -1.240 0.520 -0.290 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -2.120 1.510 -1.479 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -2.473 1.682 0.257 1.00 0.00 H new ATOM 1977 N THR B 42 -6.194 -0.994 0.099 1.00 0.00 N ATOM 1978 CA THR B 42 -7.252 -1.995 0.160 1.00 0.00 C ATOM 1979 C THR B 42 -8.506 -1.504 -0.565 1.00 0.00 C ATOM 1980 O THR B 42 -9.112 -2.239 -1.343 1.00 0.00 O ATOM 1981 CB THR B 42 -7.601 -2.347 1.623 1.00 0.00 C ATOM 1982 OG1 THR B 42 -6.427 -2.802 2.308 1.00 0.00 O ATOM 1983 CG2 THR B 42 -8.675 -3.424 1.695 1.00 0.00 C ATOM 0 H THR B 42 -5.878 -0.659 1.009 1.00 0.00 H new ATOM 0 HA THR B 42 -6.884 -2.893 -0.336 1.00 0.00 H new ATOM 0 HB THR B 42 -7.985 -1.446 2.100 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.932 -2.031 2.656 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.897 -3.648 2.739 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.579 -3.070 1.200 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.319 -4.327 1.198 1.00 0.00 H new ATOM 1991 N ASN B 43 -8.870 -0.249 -0.318 1.00 0.00 N ATOM 1992 CA ASN B 43 -10.040 0.360 -0.946 1.00 0.00 C ATOM 1993 C ASN B 43 -9.845 0.473 -2.456 1.00 0.00 C ATOM 1994 O ASN B 43 -10.765 0.210 -3.228 1.00 0.00 O ATOM 1995 CB ASN B 43 -10.298 1.748 -0.350 1.00 0.00 C ATOM 1996 CG ASN B 43 -11.549 2.410 -0.904 1.00 0.00 C ATOM 1997 OD1 ASN B 43 -12.526 1.741 -1.244 1.00 0.00 O ATOM 1998 ND2 ASN B 43 -11.526 3.731 -0.994 1.00 0.00 N ATOM 0 H ASN B 43 -8.368 0.371 0.318 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.902 -0.278 -0.753 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -10.389 1.661 0.733 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -9.438 2.388 -0.547 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.338 4.232 -1.356 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -10.697 4.248 -0.702 1.00 0.00 H new ATOM 2005 N LEU B 44 -8.639 0.854 -2.866 1.00 0.00 N ATOM 2006 CA LEU B 44 -8.307 0.988 -4.281 1.00 0.00 C ATOM 2007 C LEU B 44 -8.507 -0.340 -5.009 1.00 0.00 C ATOM 2008 O LEU B 44 -9.179 -0.400 -6.043 1.00 0.00 O ATOM 2009 CB LEU B 44 -6.857 1.457 -4.438 1.00 0.00 C ATOM 2010 CG LEU B 44 -6.406 1.729 -5.876 1.00 0.00 C ATOM 2011 CD1 LEU B 44 -7.144 2.929 -6.453 1.00 0.00 C ATOM 2012 CD2 LEU B 44 -4.903 1.950 -5.929 1.00 0.00 C ATOM 0 H LEU B 44 -7.870 1.077 -2.234 1.00 0.00 H new ATOM 0 HA LEU B 44 -8.973 1.729 -4.723 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -6.723 2.368 -3.855 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.200 0.702 -4.006 1.00 0.00 H new ATOM 0 HG LEU B 44 -6.648 0.856 -6.482 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -6.809 3.105 -7.475 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.216 2.732 -6.451 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.936 3.810 -5.846 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -4.600 2.142 -6.958 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -4.639 2.805 -5.307 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -4.391 1.061 -5.560 1.00 0.00 H new ATOM 2024 N ILE B 45 -7.939 -1.400 -4.447 1.00 0.00 N ATOM 2025 CA ILE B 45 -8.045 -2.734 -5.028 1.00 0.00 C ATOM 2026 C ILE B 45 -9.488 -3.239 -4.963 1.00 0.00 C ATOM 2027 O ILE B 45 -9.940 -3.993 -5.825 1.00 0.00 O ATOM 2028 CB ILE B 45 -7.112 -3.731 -4.300 1.00 0.00 C ATOM 2029 CG1 ILE B 45 -5.666 -3.226 -4.326 1.00 0.00 C ATOM 2030 CG2 ILE B 45 -7.199 -5.111 -4.934 1.00 0.00 C ATOM 2031 CD1 ILE B 45 -4.694 -4.126 -3.590 1.00 0.00 C ATOM 0 H ILE B 45 -7.397 -1.361 -3.584 1.00 0.00 H new ATOM 0 HA ILE B 45 -7.739 -2.665 -6.072 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.438 -3.808 -3.263 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.343 -3.128 -5.362 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.630 -2.230 -3.885 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -6.535 -5.796 -4.407 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -8.224 -5.477 -4.870 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -6.901 -5.050 -5.981 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -3.691 -3.705 -3.651 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -4.991 -4.205 -2.544 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -4.700 -5.117 -4.044 1.00 0.00 H new ATOM 2043 N ASN B 46 -10.206 -2.797 -3.940 1.00 0.00 N ATOM 2044 CA ASN B 46 -11.587 -3.214 -3.718 1.00 0.00 C ATOM 2045 C ASN B 46 -12.538 -2.586 -4.737 1.00 0.00 C ATOM 2046 O ASN B 46 -13.493 -3.226 -5.178 1.00 0.00 O ATOM 2047 CB ASN B 46 -12.020 -2.830 -2.296 1.00 0.00 C ATOM 2048 CG ASN B 46 -13.462 -3.198 -1.991 1.00 0.00 C ATOM 2049 OD1 ASN B 46 -14.380 -2.419 -2.241 1.00 0.00 O ATOM 2050 ND2 ASN B 46 -13.670 -4.378 -1.426 1.00 0.00 N ATOM 0 H ASN B 46 -9.852 -2.142 -3.243 1.00 0.00 H new ATOM 0 HA ASN B 46 -11.635 -4.296 -3.841 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.366 -3.324 -1.578 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -11.889 -1.756 -2.160 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -14.617 -4.667 -1.183 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -12.883 -4.997 -1.234 1.00 0.00 H new ATOM 2057 N THR B 47 -12.273 -1.344 -5.116 1.00 0.00 N ATOM 2058 CA THR B 47 -13.192 -0.600 -5.968 1.00 0.00 C ATOM 2059 C THR B 47 -12.748 -0.566 -7.431 1.00 0.00 C ATOM 2060 O THR B 47 -13.425 -1.114 -8.303 1.00 0.00 O ATOM 2061 CB THR B 47 -13.370 0.841 -5.453 1.00 0.00 C ATOM 2062 OG1 THR B 47 -12.088 1.424 -5.179 1.00 0.00 O ATOM 2063 CG2 THR B 47 -14.225 0.867 -4.195 1.00 0.00 C ATOM 0 H THR B 47 -11.433 -0.831 -4.849 1.00 0.00 H new ATOM 0 HA THR B 47 -14.144 -1.129 -5.923 1.00 0.00 H new ATOM 0 HB THR B 47 -13.875 1.420 -6.226 1.00 0.00 H new ATOM 0 HG1 THR B 47 -11.825 1.217 -4.258 1.00 0.00 H new ATOM 0 HG21 THR B 47 -14.336 1.896 -3.851 1.00 0.00 H new ATOM 0 HG22 THR B 47 -15.208 0.450 -4.414 1.00 0.00 H new ATOM 0 HG23 THR B 47 -13.745 0.274 -3.416 1.00 0.00 H new ATOM 2071 N SER B 48 -11.616 0.073 -7.699 1.00 0.00 N ATOM 2072 CA SER B 48 -11.187 0.319 -9.072 1.00 0.00 C ATOM 2073 C SER B 48 -10.689 -0.952 -9.756 1.00 0.00 C ATOM 2074 O SER B 48 -10.792 -1.089 -10.979 1.00 0.00 O ATOM 2075 CB SER B 48 -10.098 1.396 -9.102 1.00 0.00 C ATOM 2076 OG SER B 48 -8.959 1.001 -8.357 1.00 0.00 O ATOM 0 H SER B 48 -10.979 0.430 -6.987 1.00 0.00 H new ATOM 0 HA SER B 48 -12.058 0.668 -9.627 1.00 0.00 H new ATOM 0 HB2 SER B 48 -9.809 1.594 -10.134 1.00 0.00 H new ATOM 0 HB3 SER B 48 -10.494 2.327 -8.697 1.00 0.00 H new ATOM 0 HG SER B 48 -9.230 0.378 -7.651 1.00 0.00 H new ATOM 2082 N ILE B 49 -10.164 -1.883 -8.974 1.00 0.00 N ATOM 2083 CA ILE B 49 -9.609 -3.109 -9.523 1.00 0.00 C ATOM 2084 C ILE B 49 -10.669 -4.209 -9.559 1.00 0.00 C ATOM 2085 O ILE B 49 -11.563 -4.247 -8.710 1.00 0.00 O ATOM 2086 CB ILE B 49 -8.372 -3.570 -8.714 1.00 0.00 C ATOM 2087 CG1 ILE B 49 -7.303 -2.472 -8.736 1.00 0.00 C ATOM 2088 CG2 ILE B 49 -7.807 -4.873 -9.265 1.00 0.00 C ATOM 2089 CD1 ILE B 49 -6.038 -2.822 -7.977 1.00 0.00 C ATOM 0 H ILE B 49 -10.111 -1.812 -7.958 1.00 0.00 H new ATOM 0 HA ILE B 49 -9.287 -2.906 -10.544 1.00 0.00 H new ATOM 0 HB ILE B 49 -8.681 -3.752 -7.685 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -7.043 -2.254 -9.772 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -7.726 -1.560 -8.314 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.939 -5.171 -8.676 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -8.568 -5.652 -9.210 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.509 -4.730 -10.304 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -5.334 -1.993 -8.042 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -6.281 -3.010 -6.931 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -5.588 -3.715 -8.411 1.00 0.00 H new ATOM 2101 N ALA B 50 -10.580 -5.070 -10.571 1.00 0.00 N ATOM 2102 CA ALA B 50 -11.522 -6.170 -10.751 1.00 0.00 C ATOM 2103 C ALA B 50 -11.641 -7.024 -9.488 1.00 0.00 C ATOM 2104 O ALA B 50 -10.638 -7.369 -8.860 1.00 0.00 O ATOM 2105 CB ALA B 50 -11.098 -7.025 -11.933 1.00 0.00 C ATOM 0 H ALA B 50 -9.855 -5.024 -11.287 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.505 -5.743 -10.950 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.805 -7.844 -12.062 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.081 -6.415 -12.836 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.103 -7.430 -11.750 1.00 0.00 H new ATOM 2111 N PRO B 51 -12.880 -7.394 -9.123 1.00 0.00 N ATOM 2112 CA PRO B 51 -13.181 -8.088 -7.862 1.00 0.00 C ATOM 2113 C PRO B 51 -12.664 -9.528 -7.803 1.00 0.00 C ATOM 2114 O PRO B 51 -12.802 -10.194 -6.774 1.00 0.00 O ATOM 2115 CB PRO B 51 -14.717 -8.082 -7.794 1.00 0.00 C ATOM 2116 CG PRO B 51 -15.165 -7.130 -8.851 1.00 0.00 C ATOM 2117 CD PRO B 51 -14.099 -7.149 -9.905 1.00 0.00 C ATOM 0 HA PRO B 51 -12.689 -7.588 -7.028 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -15.120 -9.079 -7.969 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -15.064 -7.766 -6.810 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -16.128 -7.431 -9.264 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -15.293 -6.127 -8.444 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -14.272 -7.933 -10.642 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -14.049 -6.205 -10.448 1.00 0.00 H new ATOM 2125 N ALA B 52 -12.073 -10.010 -8.888 1.00 0.00 N ATOM 2126 CA ALA B 52 -11.566 -11.375 -8.922 1.00 0.00 C ATOM 2127 C ALA B 52 -10.051 -11.407 -8.735 1.00 0.00 C ATOM 2128 O ALA B 52 -9.559 -11.905 -7.723 1.00 0.00 O ATOM 2129 CB ALA B 52 -11.967 -12.065 -10.218 1.00 0.00 C ATOM 0 H ALA B 52 -11.934 -9.482 -9.749 1.00 0.00 H new ATOM 0 HA ALA B 52 -12.014 -11.920 -8.091 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -11.578 -13.083 -10.223 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -13.054 -12.091 -10.295 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -11.556 -11.515 -11.065 1.00 0.00 H new ATOM 2135 N GLN B 53 -9.312 -10.842 -9.689 1.00 0.00 N ATOM 2136 CA GLN B 53 -7.845 -10.869 -9.646 1.00 0.00 C ATOM 2137 C GLN B 53 -7.283 -9.861 -8.643 1.00 0.00 C ATOM 2138 O GLN B 53 -6.075 -9.625 -8.598 1.00 0.00 O ATOM 2139 CB GLN B 53 -7.251 -10.604 -11.032 1.00 0.00 C ATOM 2140 CG GLN B 53 -7.575 -9.229 -11.596 1.00 0.00 C ATOM 2141 CD GLN B 53 -6.831 -8.944 -12.886 1.00 0.00 C ATOM 2142 OE1 GLN B 53 -5.713 -9.414 -13.090 1.00 0.00 O ATOM 2143 NE2 GLN B 53 -7.450 -8.178 -13.769 1.00 0.00 N ATOM 0 H GLN B 53 -9.701 -10.361 -10.500 1.00 0.00 H new ATOM 0 HA GLN B 53 -7.558 -11.868 -9.319 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -6.168 -10.717 -10.979 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.617 -11.363 -11.723 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -8.648 -9.156 -11.775 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -7.322 -8.468 -10.858 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -8.377 -7.808 -13.561 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -7.000 -7.958 -14.657 1.00 0.00 H new ATOM 2152 N ARG B 54 -8.160 -9.284 -7.833 1.00 0.00 N ATOM 2153 CA ARG B 54 -7.761 -8.323 -6.810 1.00 0.00 C ATOM 2154 C ARG B 54 -6.733 -8.923 -5.849 1.00 0.00 C ATOM 2155 O ARG B 54 -5.823 -8.236 -5.390 1.00 0.00 O ATOM 2156 CB ARG B 54 -8.989 -7.843 -6.030 1.00 0.00 C ATOM 2157 CG ARG B 54 -9.841 -8.975 -5.484 1.00 0.00 C ATOM 2158 CD ARG B 54 -10.971 -8.459 -4.611 1.00 0.00 C ATOM 2159 NE ARG B 54 -11.895 -9.529 -4.241 1.00 0.00 N ATOM 2160 CZ ARG B 54 -12.170 -9.878 -2.985 1.00 0.00 C ATOM 2161 NH1 ARG B 54 -11.579 -9.252 -1.974 1.00 0.00 N ATOM 2162 NH2 ARG B 54 -13.031 -10.861 -2.740 1.00 0.00 N ATOM 0 H ARG B 54 -9.163 -9.466 -7.865 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.297 -7.474 -7.312 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.661 -7.214 -5.202 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -9.602 -7.219 -6.681 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -10.255 -9.550 -6.312 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -9.215 -9.654 -4.905 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.558 -8.006 -3.710 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -11.513 -7.676 -5.141 1.00 0.00 H new ATOM 0 HE ARG B 54 -12.359 -10.041 -4.992 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -10.913 -8.502 -2.158 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -11.791 -9.521 -1.013 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.482 -11.349 -3.514 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -13.241 -11.127 -1.778 1.00 0.00 H new ATOM 2176 N GLN B 55 -6.869 -10.212 -5.562 1.00 0.00 N ATOM 2177 CA GLN B 55 -5.980 -10.879 -4.623 1.00 0.00 C ATOM 2178 C GLN B 55 -4.620 -11.131 -5.265 1.00 0.00 C ATOM 2179 O GLN B 55 -3.583 -11.041 -4.606 1.00 0.00 O ATOM 2180 CB GLN B 55 -6.597 -12.192 -4.142 1.00 0.00 C ATOM 2181 CG GLN B 55 -7.966 -12.016 -3.500 1.00 0.00 C ATOM 2182 CD GLN B 55 -8.564 -13.318 -3.002 1.00 0.00 C ATOM 2183 OE1 GLN B 55 -7.713 -14.242 -2.581 1.00 0.00 O flip ATOM 2184 NE2 GLN B 55 -9.784 -13.487 -2.986 1.00 0.00 N flip ATOM 0 H GLN B 55 -7.586 -10.814 -5.966 1.00 0.00 H new ATOM 0 HA GLN B 55 -5.839 -10.229 -3.760 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -6.685 -12.875 -4.987 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -5.924 -12.660 -3.423 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -7.882 -11.320 -2.666 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -8.645 -11.565 -4.224 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -10.405 -12.750 -3.319 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -10.173 -14.364 -2.639 1.00 0.00 H new ATOM 2193 N ALA B 56 -4.633 -11.437 -6.557 1.00 0.00 N ATOM 2194 CA ALA B 56 -3.403 -11.605 -7.319 1.00 0.00 C ATOM 2195 C ALA B 56 -2.637 -10.288 -7.382 1.00 0.00 C ATOM 2196 O ALA B 56 -1.407 -10.266 -7.310 1.00 0.00 O ATOM 2197 CB ALA B 56 -3.709 -12.114 -8.720 1.00 0.00 C ATOM 0 H ALA B 56 -5.486 -11.574 -7.100 1.00 0.00 H new ATOM 0 HA ALA B 56 -2.780 -12.344 -6.816 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -2.779 -12.234 -9.275 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -4.219 -13.075 -8.655 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.349 -11.398 -9.235 1.00 0.00 H new ATOM 2203 N ILE B 57 -3.378 -9.189 -7.504 1.00 0.00 N ATOM 2204 CA ILE B 57 -2.784 -7.857 -7.496 1.00 0.00 C ATOM 2205 C ILE B 57 -2.081 -7.600 -6.166 1.00 0.00 C ATOM 2206 O ILE B 57 -0.940 -7.144 -6.134 1.00 0.00 O ATOM 2207 CB ILE B 57 -3.844 -6.755 -7.740 1.00 0.00 C ATOM 2208 CG1 ILE B 57 -4.521 -6.951 -9.101 1.00 0.00 C ATOM 2209 CG2 ILE B 57 -3.210 -5.370 -7.651 1.00 0.00 C ATOM 2210 CD1 ILE B 57 -3.565 -6.915 -10.276 1.00 0.00 C ATOM 0 H ILE B 57 -4.392 -9.196 -7.610 1.00 0.00 H new ATOM 0 HA ILE B 57 -2.059 -7.819 -8.309 1.00 0.00 H new ATOM 0 HB ILE B 57 -4.605 -6.834 -6.963 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -5.044 -7.907 -9.101 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -5.275 -6.175 -9.235 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -3.971 -4.610 -7.825 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -2.778 -5.231 -6.660 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -2.427 -5.279 -8.404 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -4.121 -7.061 -11.202 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.060 -5.950 -10.305 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -2.825 -7.708 -10.168 1.00 0.00 H new ATOM 2222 N ALA B 58 -2.763 -7.921 -5.071 1.00 0.00 N ATOM 2223 CA ALA B 58 -2.196 -7.757 -3.737 1.00 0.00 C ATOM 2224 C ALA B 58 -0.934 -8.600 -3.571 1.00 0.00 C ATOM 2225 O ALA B 58 0.064 -8.140 -3.014 1.00 0.00 O ATOM 2226 CB ALA B 58 -3.222 -8.124 -2.675 1.00 0.00 C ATOM 0 H ALA B 58 -3.711 -8.297 -5.082 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.923 -6.709 -3.612 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.783 -7.996 -1.685 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -4.093 -7.476 -2.772 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.526 -9.163 -2.806 1.00 0.00 H new ATOM 2232 N ASN B 59 -0.985 -9.829 -4.073 1.00 0.00 N ATOM 2233 CA ASN B 59 0.150 -10.743 -3.997 1.00 0.00 C ATOM 2234 C ASN B 59 1.346 -10.207 -4.773 1.00 0.00 C ATOM 2235 O ASN B 59 2.462 -10.168 -4.258 1.00 0.00 O ATOM 2236 CB ASN B 59 -0.234 -12.127 -4.529 1.00 0.00 C ATOM 2237 CG ASN B 59 -0.804 -13.030 -3.453 1.00 0.00 C ATOM 2238 OD1 ASN B 59 -0.076 -13.800 -2.826 1.00 0.00 O ATOM 2239 ND2 ASN B 59 -2.106 -12.948 -3.232 1.00 0.00 N ATOM 0 H ASN B 59 -1.805 -10.217 -4.539 1.00 0.00 H new ATOM 0 HA ASN B 59 0.431 -10.829 -2.947 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -0.966 -12.014 -5.328 1.00 0.00 H new ATOM 0 HB3 ASN B 59 0.645 -12.600 -4.967 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -2.541 -13.536 -2.521 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -2.675 -12.297 -3.773 1.00 0.00 H new ATOM 2246 N SER B 60 1.109 -9.782 -6.008 1.00 0.00 N ATOM 2247 CA SER B 60 2.183 -9.280 -6.853 1.00 0.00 C ATOM 2248 C SER B 60 2.715 -7.945 -6.331 1.00 0.00 C ATOM 2249 O SER B 60 3.908 -7.664 -6.438 1.00 0.00 O ATOM 2250 CB SER B 60 1.711 -9.156 -8.305 1.00 0.00 C ATOM 2251 OG SER B 60 0.441 -8.529 -8.385 1.00 0.00 O ATOM 0 H SER B 60 0.187 -9.775 -6.444 1.00 0.00 H new ATOM 0 HA SER B 60 3.004 -9.997 -6.822 1.00 0.00 H new ATOM 0 HB2 SER B 60 2.439 -8.581 -8.878 1.00 0.00 H new ATOM 0 HB3 SER B 60 1.659 -10.146 -8.758 1.00 0.00 H new ATOM 0 HG SER B 60 -0.258 -9.173 -8.146 1.00 0.00 H new ATOM 2257 N PHE B 61 1.830 -7.136 -5.753 1.00 0.00 N ATOM 2258 CA PHE B 61 2.230 -5.872 -5.143 1.00 0.00 C ATOM 2259 C PHE B 61 3.184 -6.129 -3.980 1.00 0.00 C ATOM 2260 O PHE B 61 4.219 -5.472 -3.855 1.00 0.00 O ATOM 2261 CB PHE B 61 0.998 -5.100 -4.655 1.00 0.00 C ATOM 2262 CG PHE B 61 1.317 -3.765 -4.036 1.00 0.00 C ATOM 2263 CD1 PHE B 61 1.576 -2.662 -4.835 1.00 0.00 C ATOM 2264 CD2 PHE B 61 1.356 -3.614 -2.659 1.00 0.00 C ATOM 2265 CE1 PHE B 61 1.867 -1.435 -4.271 1.00 0.00 C ATOM 2266 CE2 PHE B 61 1.647 -2.388 -2.090 1.00 0.00 C ATOM 2267 CZ PHE B 61 1.903 -1.298 -2.897 1.00 0.00 C ATOM 0 H PHE B 61 0.831 -7.334 -5.695 1.00 0.00 H new ATOM 0 HA PHE B 61 2.742 -5.270 -5.894 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.322 -4.947 -5.496 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.466 -5.710 -3.925 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.550 -2.763 -5.910 1.00 0.00 H new ATOM 0 HD2 PHE B 61 1.157 -4.464 -2.023 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.066 -0.583 -4.904 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.674 -2.283 -1.015 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.131 -0.339 -2.455 1.00 0.00 H new ATOM 2277 N ALA B 62 2.834 -7.098 -3.139 1.00 0.00 N ATOM 2278 CA ALA B 62 3.671 -7.475 -2.007 1.00 0.00 C ATOM 2279 C ALA B 62 5.019 -8.007 -2.488 1.00 0.00 C ATOM 2280 O ALA B 62 6.063 -7.700 -1.914 1.00 0.00 O ATOM 2281 CB ALA B 62 2.966 -8.515 -1.149 1.00 0.00 C ATOM 0 H ALA B 62 1.972 -7.638 -3.222 1.00 0.00 H new ATOM 0 HA ALA B 62 3.849 -6.587 -1.401 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.604 -8.786 -0.308 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.028 -8.103 -0.775 1.00 0.00 H new ATOM 0 HB3 ALA B 62 2.760 -9.402 -1.748 1.00 0.00 H new ATOM 2287 N ARG B 63 4.983 -8.791 -3.559 1.00 0.00 N ATOM 2288 CA ARG B 63 6.199 -9.346 -4.146 1.00 0.00 C ATOM 2289 C ARG B 63 7.072 -8.246 -4.739 1.00 0.00 C ATOM 2290 O ARG B 63 8.301 -8.347 -4.728 1.00 0.00 O ATOM 2291 CB ARG B 63 5.850 -10.382 -5.215 1.00 0.00 C ATOM 2292 CG ARG B 63 5.248 -11.654 -4.644 1.00 0.00 C ATOM 2293 CD ARG B 63 4.918 -12.657 -5.733 1.00 0.00 C ATOM 2294 NE ARG B 63 4.569 -13.963 -5.177 1.00 0.00 N ATOM 2295 CZ ARG B 63 5.132 -15.105 -5.560 1.00 0.00 C ATOM 2296 NH1 ARG B 63 5.979 -15.120 -6.585 1.00 0.00 N ATOM 2297 NH2 ARG B 63 4.823 -16.238 -4.942 1.00 0.00 N ATOM 0 H ARG B 63 4.124 -9.058 -4.040 1.00 0.00 H new ATOM 0 HA ARG B 63 6.764 -9.836 -3.353 1.00 0.00 H new ATOM 0 HB2 ARG B 63 5.148 -9.941 -5.923 1.00 0.00 H new ATOM 0 HB3 ARG B 63 6.751 -10.634 -5.775 1.00 0.00 H new ATOM 0 HG2 ARG B 63 5.946 -12.101 -3.937 1.00 0.00 H new ATOM 0 HG3 ARG B 63 4.343 -11.410 -4.087 1.00 0.00 H new ATOM 0 HD2 ARG B 63 4.088 -12.283 -6.333 1.00 0.00 H new ATOM 0 HD3 ARG B 63 5.772 -12.763 -6.402 1.00 0.00 H new ATOM 0 HE ARG B 63 3.852 -14.000 -4.453 1.00 0.00 H new ATOM 0 HH11 ARG B 63 6.198 -14.255 -7.079 1.00 0.00 H new ATOM 0 HH12 ARG B 63 6.410 -15.997 -6.878 1.00 0.00 H new ATOM 0 HH21 ARG B 63 4.153 -16.233 -4.173 1.00 0.00 H new ATOM 0 HH22 ARG B 63 5.255 -17.114 -5.236 1.00 0.00 H new ATOM 2311 N ALA B 64 6.439 -7.198 -5.251 1.00 0.00 N ATOM 2312 CA ALA B 64 7.164 -6.051 -5.779 1.00 0.00 C ATOM 2313 C ALA B 64 7.790 -5.252 -4.642 1.00 0.00 C ATOM 2314 O ALA B 64 8.908 -4.761 -4.755 1.00 0.00 O ATOM 2315 CB ALA B 64 6.244 -5.170 -6.610 1.00 0.00 C ATOM 0 H ALA B 64 5.424 -7.119 -5.312 1.00 0.00 H new ATOM 0 HA ALA B 64 7.962 -6.415 -6.427 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.805 -4.319 -6.995 1.00 0.00 H new ATOM 0 HB2 ALA B 64 5.843 -5.747 -7.443 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.424 -4.812 -5.988 1.00 0.00 H new ATOM 2321 N LEU B 65 7.056 -5.147 -3.539 1.00 0.00 N ATOM 2322 CA LEU B 65 7.544 -4.457 -2.348 1.00 0.00 C ATOM 2323 C LEU B 65 8.783 -5.157 -1.795 1.00 0.00 C ATOM 2324 O LEU B 65 9.705 -4.517 -1.287 1.00 0.00 O ATOM 2325 CB LEU B 65 6.442 -4.421 -1.286 1.00 0.00 C ATOM 2326 CG LEU B 65 6.755 -3.597 -0.034 1.00 0.00 C ATOM 2327 CD1 LEU B 65 6.855 -2.118 -0.374 1.00 0.00 C ATOM 2328 CD2 LEU B 65 5.697 -3.829 1.036 1.00 0.00 C ATOM 0 H LEU B 65 6.116 -5.533 -3.444 1.00 0.00 H new ATOM 0 HA LEU B 65 7.817 -3.437 -2.618 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.535 -4.024 -1.743 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.224 -5.444 -0.980 1.00 0.00 H new ATOM 0 HG LEU B 65 7.719 -3.923 0.357 1.00 0.00 H new ATOM 0 HD11 LEU B 65 7.078 -1.551 0.530 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.650 -1.965 -1.103 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.908 -1.776 -0.792 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.936 -3.235 1.918 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.721 -3.533 0.653 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.676 -4.885 1.304 1.00 0.00 H new ATOM 2340 N GLN B 66 8.806 -6.476 -1.907 1.00 0.00 N ATOM 2341 CA GLN B 66 9.936 -7.281 -1.454 1.00 0.00 C ATOM 2342 C GLN B 66 11.091 -7.217 -2.448 1.00 0.00 C ATOM 2343 O GLN B 66 12.176 -7.736 -2.189 1.00 0.00 O ATOM 2344 CB GLN B 66 9.506 -8.730 -1.226 1.00 0.00 C ATOM 2345 CG GLN B 66 8.587 -8.909 -0.028 1.00 0.00 C ATOM 2346 CD GLN B 66 9.256 -8.516 1.277 1.00 0.00 C ATOM 2347 OE1 GLN B 66 9.876 -9.347 1.942 1.00 0.00 O ATOM 2348 NE2 GLN B 66 9.145 -7.251 1.647 1.00 0.00 N ATOM 0 H GLN B 66 8.045 -7.020 -2.313 1.00 0.00 H new ATOM 0 HA GLN B 66 10.283 -6.868 -0.507 1.00 0.00 H new ATOM 0 HB2 GLN B 66 9.000 -9.095 -2.120 1.00 0.00 H new ATOM 0 HB3 GLN B 66 10.394 -9.347 -1.088 1.00 0.00 H new ATOM 0 HG2 GLN B 66 7.689 -8.307 -0.169 1.00 0.00 H new ATOM 0 HG3 GLN B 66 8.267 -9.950 0.029 1.00 0.00 H new ATOM 0 HE21 GLN B 66 8.622 -6.594 1.067 1.00 0.00 H new ATOM 0 HE22 GLN B 66 9.582 -6.932 2.512 1.00 0.00 H new ATOM 2357 N SER B 67 10.842 -6.607 -3.597 1.00 0.00 N ATOM 2358 CA SER B 67 11.872 -6.436 -4.609 1.00 0.00 C ATOM 2359 C SER B 67 12.523 -5.059 -4.478 1.00 0.00 C ATOM 2360 O SER B 67 13.727 -4.904 -4.700 1.00 0.00 O ATOM 2361 CB SER B 67 11.265 -6.610 -6.003 1.00 0.00 C ATOM 2362 OG SER B 67 12.219 -6.368 -7.020 1.00 0.00 O ATOM 0 H SER B 67 9.933 -6.221 -3.852 1.00 0.00 H new ATOM 0 HA SER B 67 12.641 -7.194 -4.463 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.871 -7.621 -6.106 1.00 0.00 H new ATOM 0 HB3 SER B 67 10.424 -5.927 -6.122 1.00 0.00 H new ATOM 0 HG SER B 67 11.800 -6.489 -7.897 1.00 0.00 H new ATOM 2368 N SER B 68 11.723 -4.068 -4.107 1.00 0.00 N ATOM 2369 CA SER B 68 12.207 -2.707 -3.957 1.00 0.00 C ATOM 2370 C SER B 68 12.941 -2.523 -2.629 1.00 0.00 C ATOM 2371 O SER B 68 13.987 -1.875 -2.570 1.00 0.00 O ATOM 2372 CB SER B 68 11.034 -1.730 -4.071 1.00 0.00 C ATOM 2373 OG SER B 68 9.936 -2.159 -3.281 1.00 0.00 O ATOM 0 H SER B 68 10.730 -4.185 -3.904 1.00 0.00 H new ATOM 0 HA SER B 68 12.921 -2.501 -4.754 1.00 0.00 H new ATOM 0 HB2 SER B 68 11.351 -0.737 -3.751 1.00 0.00 H new ATOM 0 HB3 SER B 68 10.726 -1.646 -5.113 1.00 0.00 H new ATOM 0 HG SER B 68 9.200 -1.518 -3.369 1.00 0.00 H new ATOM 2379 N ILE B 69 12.391 -3.095 -1.564 1.00 0.00 N ATOM 2380 CA ILE B 69 13.004 -2.986 -0.248 1.00 0.00 C ATOM 2381 C ILE B 69 14.140 -3.991 -0.098 1.00 0.00 C ATOM 2382 O ILE B 69 13.924 -5.145 0.270 1.00 0.00 O ATOM 2383 CB ILE B 69 11.977 -3.199 0.888 1.00 0.00 C ATOM 2384 CG1 ILE B 69 10.811 -2.219 0.736 1.00 0.00 C ATOM 2385 CG2 ILE B 69 12.646 -3.027 2.249 1.00 0.00 C ATOM 2386 CD1 ILE B 69 9.753 -2.359 1.808 1.00 0.00 C ATOM 0 H ILE B 69 11.526 -3.636 -1.587 1.00 0.00 H new ATOM 0 HA ILE B 69 13.399 -1.973 -0.166 1.00 0.00 H new ATOM 0 HB ILE B 69 11.588 -4.215 0.822 1.00 0.00 H new ATOM 0 HG12 ILE B 69 11.200 -1.201 0.753 1.00 0.00 H new ATOM 0 HG13 ILE B 69 10.348 -2.368 -0.240 1.00 0.00 H new ATOM 0 HG21 ILE B 69 11.910 -3.180 3.038 1.00 0.00 H new ATOM 0 HG22 ILE B 69 13.449 -3.757 2.355 1.00 0.00 H new ATOM 0 HG23 ILE B 69 13.058 -2.021 2.327 1.00 0.00 H new ATOM 0 HD11 ILE B 69 8.960 -1.632 1.634 1.00 0.00 H new ATOM 0 HD12 ILE B 69 9.336 -3.365 1.778 1.00 0.00 H new ATOM 0 HD13 ILE B 69 10.200 -2.181 2.786 1.00 0.00 H new