USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=22 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 66 GLN : amide:sc= 0.172 K(o=1.1,f=-8.9!) USER MOD Set 1.2: B 59 ASN : amide:sc= 0.918 K(o=1.1,f=-9.1) USER MOD Set 2.1: A 47 THR OG1 : rot -75:sc= 1.27 USER MOD Set 2.2: A 48 SER OG : rot -160:sc=-0.00639 USER MOD Set 3.1: A 21 ASN : amide:sc= -2.66! C(o=-2.6!,f=-2.9!) USER MOD Set 3.2: A 25 LYS NZ :NH3+ -116:sc= 0.0451 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.336 X(o=-0.34,f=-0.34) USER MOD Single : A 14 GLN : amide:sc= -0.0222 X(o=-0.022,f=0) USER MOD Single : A 26 HIS : no HD1:sc= -0.116 X(o=-0.12,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 71:sc= 1.15 USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 39 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 40 MET CE :methyl 180:sc= -0.0525 (180deg=-0.0525) USER MOD Single : A 42 THR OG1 : rot 86:sc= 0.43 USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 ASN : amide:sc= -0.406 K(o=-0.41,f=-8.6!) USER MOD Single : A 53 GLN : amide:sc= -0.394 K(o=-0.39,f=-3) USER MOD Single : A 55 GLN : amide:sc= -2.06! C(o=-2.1!,f=-8.2!) USER MOD Single : A 59 ASN : amide:sc= 1.18 K(o=1.2,f=0) USER MOD Single : A 60 SER OG : rot 72:sc= 1.29 USER MOD Single : A 67 SER OG : rot -31:sc= 0.0378 USER MOD Single : A 68 SER OG : rot 79:sc= 1.2 USER MOD Single : B 8 SER OG : rot -15:sc= 0.681 USER MOD Single : B 11 GLN :FLIP amide:sc= -0.0184 F(o=-0.99,f=-0.018) USER MOD Single : B 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 21 ASN : amide:sc= -0.36 K(o=-0.36,f=-2.7!) USER MOD Single : B 25 LYS NZ :NH3+ -175:sc= 1.3 (180deg=1.24) USER MOD Single : B 26 HIS : no HD1:sc= 0.989 K(o=0.99,f=-5.4!) USER MOD Single : B 27 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0708) USER MOD Single : B 30 THR OG1 : rot 180:sc=0.000233 USER MOD Single : B 33 SER OG : rot 74:sc= 0.25 USER MOD Single : B 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 39 ASN : amide:sc= -0.0211 K(o=-0.021,f=-1.7!) USER MOD Single : B 40 MET CE :methyl -155:sc= 0 (180deg=-0.618) USER MOD Single : B 42 THR OG1 : rot 78:sc= 0.13 USER MOD Single : B 43 ASN : amide:sc=-0.00842 X(o=-0.0084,f=0) USER MOD Single : B 46 ASN : amide:sc= -0.445 K(o=-0.44,f=-6.7!) USER MOD Single : B 47 THR OG1 : rot -97:sc= 1.25 USER MOD Single : B 48 SER OG : rot -80:sc= 1.26 USER MOD Single : B 53 GLN : amide:sc= -0.0252 K(o=-0.025,f=-1) USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : B 60 SER OG : rot 20:sc= 0.0683 USER MOD Single : B 66 GLN : amide:sc= -0.436 K(o=-0.44,f=-4.4!) USER MOD Single : B 67 SER OG : rot -81:sc= 1.14 USER MOD Single : B 68 SER OG : rot 109:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 137 N ASP A 9 -12.496 7.843 13.992 1.00 0.00 N ATOM 138 CA ASP A 9 -13.021 7.517 12.659 1.00 0.00 C ATOM 139 C ASP A 9 -12.983 8.725 11.733 1.00 0.00 C ATOM 140 O ASP A 9 -12.549 8.632 10.585 1.00 0.00 O ATOM 141 CB ASP A 9 -14.464 7.022 12.755 1.00 0.00 C ATOM 142 CG ASP A 9 -14.620 5.806 13.640 1.00 0.00 C ATOM 143 OD1 ASP A 9 -14.773 5.985 14.863 1.00 0.00 O ATOM 144 OD2 ASP A 9 -14.621 4.674 13.116 1.00 0.00 O ATOM 0 HA ASP A 9 -12.384 6.733 12.249 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -15.092 7.826 13.139 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -14.827 6.784 11.755 1.00 0.00 H new ATOM 149 N GLU A 10 -13.439 9.860 12.249 1.00 0.00 N ATOM 150 CA GLU A 10 -13.503 11.092 11.475 1.00 0.00 C ATOM 151 C GLU A 10 -12.125 11.507 10.974 1.00 0.00 C ATOM 152 O GLU A 10 -11.966 11.894 9.820 1.00 0.00 O ATOM 153 CB GLU A 10 -14.103 12.207 12.327 1.00 0.00 C ATOM 154 CG GLU A 10 -15.531 11.929 12.765 1.00 0.00 C ATOM 155 CD GLU A 10 -16.036 12.943 13.766 1.00 0.00 C ATOM 156 OE1 GLU A 10 -16.541 14.003 13.347 1.00 0.00 O ATOM 157 OE2 GLU A 10 -15.926 12.682 14.983 1.00 0.00 O ATOM 0 H GLU A 10 -13.772 9.952 13.209 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.137 10.913 10.606 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.482 12.354 13.211 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.079 13.139 11.762 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -16.183 11.930 11.891 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -15.586 10.932 13.203 1.00 0.00 H new ATOM 164 N GLN A 11 -11.129 11.420 11.845 1.00 0.00 N ATOM 165 CA GLN A 11 -9.765 11.792 11.487 1.00 0.00 C ATOM 166 C GLN A 11 -9.218 10.858 10.416 1.00 0.00 C ATOM 167 O GLN A 11 -8.590 11.301 9.454 1.00 0.00 O ATOM 168 CB GLN A 11 -8.858 11.767 12.722 1.00 0.00 C ATOM 169 CG GLN A 11 -8.905 13.035 13.569 1.00 0.00 C ATOM 170 CD GLN A 11 -10.312 13.465 13.940 1.00 0.00 C ATOM 171 OE1 GLN A 11 -10.868 13.019 14.942 1.00 0.00 O ATOM 172 NE2 GLN A 11 -10.883 14.359 13.156 1.00 0.00 N ATOM 0 H GLN A 11 -11.239 11.095 12.806 1.00 0.00 H new ATOM 0 HA GLN A 11 -9.783 12.806 11.088 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -9.139 10.918 13.346 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -7.831 11.599 12.399 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -8.331 12.874 14.481 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -8.418 13.844 13.024 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -10.389 14.705 12.333 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -11.818 14.704 13.373 1.00 0.00 H new ATOM 181 N VAL A 12 -9.481 9.567 10.580 1.00 0.00 N ATOM 182 CA VAL A 12 -9.030 8.565 9.623 1.00 0.00 C ATOM 183 C VAL A 12 -9.676 8.787 8.258 1.00 0.00 C ATOM 184 O VAL A 12 -8.995 8.786 7.232 1.00 0.00 O ATOM 185 CB VAL A 12 -9.345 7.133 10.112 1.00 0.00 C ATOM 186 CG1 VAL A 12 -8.875 6.096 9.102 1.00 0.00 C ATOM 187 CG2 VAL A 12 -8.711 6.879 11.471 1.00 0.00 C ATOM 0 H VAL A 12 -10.006 9.189 11.369 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.949 8.673 9.532 1.00 0.00 H new ATOM 0 HB VAL A 12 -10.427 7.042 10.213 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -9.109 5.097 9.471 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -9.381 6.259 8.151 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -7.798 6.188 8.961 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -8.944 5.866 11.798 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -7.630 6.996 11.396 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.104 7.593 12.195 1.00 0.00 H new ATOM 197 N GLU A 13 -10.989 8.997 8.253 1.00 0.00 N ATOM 198 CA GLU A 13 -11.719 9.196 7.008 1.00 0.00 C ATOM 199 C GLU A 13 -11.293 10.490 6.321 1.00 0.00 C ATOM 200 O GLU A 13 -11.172 10.531 5.100 1.00 0.00 O ATOM 201 CB GLU A 13 -13.231 9.193 7.247 1.00 0.00 C ATOM 202 CG GLU A 13 -14.039 9.420 5.977 1.00 0.00 C ATOM 203 CD GLU A 13 -15.529 9.269 6.185 1.00 0.00 C ATOM 204 OE1 GLU A 13 -16.092 9.979 7.045 1.00 0.00 O ATOM 205 OE2 GLU A 13 -16.153 8.456 5.467 1.00 0.00 O ATOM 0 H GLU A 13 -11.566 9.033 9.093 1.00 0.00 H new ATOM 0 HA GLU A 13 -11.475 8.362 6.350 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -13.521 8.240 7.689 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.479 9.969 7.972 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -13.831 10.420 5.596 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.712 8.713 5.214 1.00 0.00 H new ATOM 212 N GLN A 14 -11.055 11.539 7.103 1.00 0.00 N ATOM 213 CA GLN A 14 -10.616 12.815 6.540 1.00 0.00 C ATOM 214 C GLN A 14 -9.241 12.680 5.893 1.00 0.00 C ATOM 215 O GLN A 14 -8.993 13.231 4.821 1.00 0.00 O ATOM 216 CB GLN A 14 -10.593 13.910 7.609 1.00 0.00 C ATOM 217 CG GLN A 14 -11.974 14.393 8.020 1.00 0.00 C ATOM 218 CD GLN A 14 -11.922 15.490 9.063 1.00 0.00 C ATOM 219 OE1 GLN A 14 -11.866 16.675 8.737 1.00 0.00 O ATOM 220 NE2 GLN A 14 -11.936 15.104 10.328 1.00 0.00 N ATOM 0 H GLN A 14 -11.157 11.533 8.118 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.334 13.101 5.771 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -10.072 13.534 8.490 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -10.018 14.757 7.236 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -12.504 14.758 7.140 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -12.547 13.552 8.411 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -11.983 14.111 10.558 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -11.900 15.799 11.074 1.00 0.00 H new ATOM 229 N LEU A 15 -8.355 11.934 6.542 1.00 0.00 N ATOM 230 CA LEU A 15 -7.023 11.698 6.002 1.00 0.00 C ATOM 231 C LEU A 15 -7.113 10.830 4.747 1.00 0.00 C ATOM 232 O LEU A 15 -6.395 11.050 3.770 1.00 0.00 O ATOM 233 CB LEU A 15 -6.130 11.025 7.051 1.00 0.00 C ATOM 234 CG LEU A 15 -4.658 10.881 6.654 1.00 0.00 C ATOM 235 CD1 LEU A 15 -4.016 12.248 6.467 1.00 0.00 C ATOM 236 CD2 LEU A 15 -3.902 10.075 7.698 1.00 0.00 C ATOM 0 H LEU A 15 -8.534 11.484 7.440 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.579 12.657 5.736 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.186 11.599 7.976 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.531 10.034 7.266 1.00 0.00 H new ATOM 0 HG LEU A 15 -4.609 10.348 5.705 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.970 12.123 6.185 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.541 12.792 5.682 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.076 12.809 7.400 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.858 9.982 7.400 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.961 10.581 8.661 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.345 9.082 7.782 1.00 0.00 H new ATOM 248 N LEU A 16 -8.010 9.851 4.783 1.00 0.00 N ATOM 249 CA LEU A 16 -8.254 8.983 3.637 1.00 0.00 C ATOM 250 C LEU A 16 -8.819 9.790 2.473 1.00 0.00 C ATOM 251 O LEU A 16 -8.360 9.668 1.337 1.00 0.00 O ATOM 252 CB LEU A 16 -9.226 7.859 4.017 1.00 0.00 C ATOM 253 CG LEU A 16 -9.524 6.847 2.909 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.261 6.095 2.519 1.00 0.00 C ATOM 255 CD2 LEU A 16 -10.612 5.878 3.352 1.00 0.00 C ATOM 0 H LEU A 16 -8.584 9.638 5.599 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.306 8.540 3.331 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.819 7.324 4.875 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.166 8.308 4.338 1.00 0.00 H new ATOM 0 HG LEU A 16 -9.883 7.389 2.034 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.492 5.380 1.730 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.513 6.802 2.160 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.871 5.564 3.387 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.812 5.165 2.552 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.282 5.342 4.242 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.522 6.432 3.580 1.00 0.00 H new ATOM 267 N ALA A 17 -9.807 10.626 2.775 1.00 0.00 N ATOM 268 CA ALA A 17 -10.443 11.476 1.775 1.00 0.00 C ATOM 269 C ALA A 17 -9.429 12.410 1.133 1.00 0.00 C ATOM 270 O ALA A 17 -9.531 12.736 -0.050 1.00 0.00 O ATOM 271 CB ALA A 17 -11.571 12.281 2.400 1.00 0.00 C ATOM 0 H ALA A 17 -10.188 10.733 3.715 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.858 10.832 1.000 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.034 12.910 1.639 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.317 11.602 2.813 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.172 12.909 3.196 1.00 0.00 H new ATOM 277 N GLU A 18 -8.453 12.838 1.919 1.00 0.00 N ATOM 278 CA GLU A 18 -7.382 13.676 1.416 1.00 0.00 C ATOM 279 C GLU A 18 -6.580 12.923 0.358 1.00 0.00 C ATOM 280 O GLU A 18 -6.407 13.399 -0.760 1.00 0.00 O ATOM 281 CB GLU A 18 -6.473 14.113 2.564 1.00 0.00 C ATOM 282 CG GLU A 18 -5.329 15.013 2.133 1.00 0.00 C ATOM 283 CD GLU A 18 -5.779 16.399 1.726 1.00 0.00 C ATOM 284 OE1 GLU A 18 -6.448 16.541 0.684 1.00 0.00 O ATOM 285 OE2 GLU A 18 -5.445 17.365 2.446 1.00 0.00 O ATOM 0 H GLU A 18 -8.383 12.616 2.912 1.00 0.00 H new ATOM 0 HA GLU A 18 -7.814 14.565 0.957 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -7.072 14.635 3.310 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.063 13.226 3.048 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.613 15.096 2.951 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -4.805 14.549 1.297 1.00 0.00 H new ATOM 292 N LEU A 19 -6.118 11.729 0.710 1.00 0.00 N ATOM 293 CA LEU A 19 -5.359 10.899 -0.218 1.00 0.00 C ATOM 294 C LEU A 19 -6.184 10.605 -1.469 1.00 0.00 C ATOM 295 O LEU A 19 -5.675 10.643 -2.591 1.00 0.00 O ATOM 296 CB LEU A 19 -4.949 9.586 0.453 1.00 0.00 C ATOM 297 CG LEU A 19 -4.109 9.740 1.721 1.00 0.00 C ATOM 298 CD1 LEU A 19 -3.835 8.381 2.341 1.00 0.00 C ATOM 299 CD2 LEU A 19 -2.803 10.461 1.417 1.00 0.00 C ATOM 0 H LEU A 19 -6.256 11.314 1.631 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.461 11.444 -0.508 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.850 9.025 0.699 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.388 8.989 -0.266 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.672 10.341 2.436 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.236 8.507 3.243 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.779 7.901 2.597 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.293 7.759 1.629 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.220 10.560 2.333 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.233 9.889 0.685 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.019 11.451 1.015 1.00 0.00 H new ATOM 311 N LEU A 20 -7.466 10.335 -1.266 1.00 0.00 N ATOM 312 CA LEU A 20 -8.360 10.006 -2.366 1.00 0.00 C ATOM 313 C LEU A 20 -8.593 11.207 -3.279 1.00 0.00 C ATOM 314 O LEU A 20 -8.512 11.078 -4.499 1.00 0.00 O ATOM 315 CB LEU A 20 -9.699 9.480 -1.839 1.00 0.00 C ATOM 316 CG LEU A 20 -9.619 8.169 -1.051 1.00 0.00 C ATOM 317 CD1 LEU A 20 -11.003 7.737 -0.595 1.00 0.00 C ATOM 318 CD2 LEU A 20 -8.970 7.078 -1.889 1.00 0.00 C ATOM 0 H LEU A 20 -7.910 10.338 -0.348 1.00 0.00 H new ATOM 0 HA LEU A 20 -7.878 9.224 -2.952 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -10.145 10.243 -1.201 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.373 9.337 -2.684 1.00 0.00 H new ATOM 0 HG LEU A 20 -9.001 8.337 -0.169 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -10.927 6.804 -0.037 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -11.433 8.508 0.044 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -11.643 7.589 -1.465 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -8.923 6.155 -1.311 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -9.560 6.912 -2.790 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -7.961 7.384 -2.167 1.00 0.00 H new ATOM 330 N ASN A 21 -8.869 12.376 -2.700 1.00 0.00 N ATOM 331 CA ASN A 21 -9.197 13.548 -3.508 1.00 0.00 C ATOM 332 C ASN A 21 -7.976 14.026 -4.285 1.00 0.00 C ATOM 333 O ASN A 21 -8.100 14.449 -5.426 1.00 0.00 O ATOM 334 CB ASN A 21 -9.796 14.696 -2.667 1.00 0.00 C ATOM 335 CG ASN A 21 -8.762 15.623 -2.050 1.00 0.00 C ATOM 336 OD1 ASN A 21 -8.293 16.569 -2.687 1.00 0.00 O ATOM 337 ND2 ASN A 21 -8.431 15.383 -0.798 1.00 0.00 N ATOM 0 H ASN A 21 -8.872 12.535 -1.692 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.966 13.241 -4.217 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -10.463 15.283 -3.298 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -10.405 14.268 -1.871 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -7.764 15.990 -0.321 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -8.841 14.590 -0.305 1.00 0.00 H new ATOM 344 N VAL A 22 -6.794 13.932 -3.680 1.00 0.00 N ATOM 345 CA VAL A 22 -5.566 14.309 -4.371 1.00 0.00 C ATOM 346 C VAL A 22 -5.378 13.449 -5.616 1.00 0.00 C ATOM 347 O VAL A 22 -5.056 13.957 -6.689 1.00 0.00 O ATOM 348 CB VAL A 22 -4.323 14.181 -3.459 1.00 0.00 C ATOM 349 CG1 VAL A 22 -3.043 14.442 -4.240 1.00 0.00 C ATOM 350 CG2 VAL A 22 -4.425 15.140 -2.282 1.00 0.00 C ATOM 0 H VAL A 22 -6.662 13.602 -2.724 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.664 15.356 -4.657 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.289 13.160 -3.079 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.185 14.346 -3.575 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.957 13.718 -5.050 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.069 15.450 -4.655 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.542 15.037 -1.651 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.489 16.164 -2.651 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.317 14.908 -1.700 1.00 0.00 H new ATOM 360 N LEU A 23 -5.607 12.154 -5.470 1.00 0.00 N ATOM 361 CA LEU A 23 -5.477 11.225 -6.582 1.00 0.00 C ATOM 362 C LEU A 23 -6.592 11.455 -7.608 1.00 0.00 C ATOM 363 O LEU A 23 -6.327 11.646 -8.798 1.00 0.00 O ATOM 364 CB LEU A 23 -5.508 9.783 -6.048 1.00 0.00 C ATOM 365 CG LEU A 23 -5.003 8.690 -7.000 1.00 0.00 C ATOM 366 CD1 LEU A 23 -4.695 7.422 -6.220 1.00 0.00 C ATOM 367 CD2 LEU A 23 -6.026 8.390 -8.087 1.00 0.00 C ATOM 0 H LEU A 23 -5.885 11.721 -4.589 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.525 11.394 -7.085 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.912 9.744 -5.136 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.534 9.545 -5.768 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.093 9.054 -7.478 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.337 6.652 -6.904 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.927 7.631 -5.475 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.599 7.073 -5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.640 7.612 -8.746 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.955 8.049 -7.629 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.217 9.293 -8.666 1.00 0.00 H new ATOM 379 N GLU A 24 -7.833 11.467 -7.136 1.00 0.00 N ATOM 380 CA GLU A 24 -8.998 11.537 -8.015 1.00 0.00 C ATOM 381 C GLU A 24 -9.104 12.890 -8.723 1.00 0.00 C ATOM 382 O GLU A 24 -9.484 12.954 -9.890 1.00 0.00 O ATOM 383 CB GLU A 24 -10.275 11.263 -7.214 1.00 0.00 C ATOM 384 CG GLU A 24 -11.534 11.215 -8.065 1.00 0.00 C ATOM 385 CD GLU A 24 -12.782 10.957 -7.247 1.00 0.00 C ATOM 386 OE1 GLU A 24 -13.179 11.843 -6.465 1.00 0.00 O ATOM 387 OE2 GLU A 24 -13.374 9.869 -7.383 1.00 0.00 O ATOM 0 H GLU A 24 -8.061 11.429 -6.143 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.876 10.774 -8.784 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.167 10.314 -6.688 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.390 12.037 -6.455 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.643 12.159 -8.599 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.430 10.433 -8.818 1.00 0.00 H new ATOM 394 N LYS A 25 -8.768 13.967 -8.024 1.00 0.00 N ATOM 395 CA LYS A 25 -8.878 15.310 -8.590 1.00 0.00 C ATOM 396 C LYS A 25 -7.760 15.580 -9.596 1.00 0.00 C ATOM 397 O LYS A 25 -7.946 16.321 -10.558 1.00 0.00 O ATOM 398 CB LYS A 25 -8.864 16.353 -7.468 1.00 0.00 C ATOM 399 CG LYS A 25 -8.908 17.797 -7.938 1.00 0.00 C ATOM 400 CD LYS A 25 -9.142 18.743 -6.770 1.00 0.00 C ATOM 401 CE LYS A 25 -8.103 18.556 -5.674 1.00 0.00 C ATOM 402 NZ LYS A 25 -8.463 19.300 -4.438 1.00 0.00 N ATOM 0 H LYS A 25 -8.418 13.939 -7.066 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.825 15.381 -9.125 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.717 16.173 -6.813 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.965 16.208 -6.868 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.971 18.051 -8.434 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.702 17.919 -8.675 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -9.114 19.773 -7.125 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.138 18.574 -6.360 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -8.005 17.495 -5.444 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.131 18.896 -6.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.750 20.035 -4.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.395 19.744 -4.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.496 18.642 -3.634 1.00 0.00 H new ATOM 416 N HIS A 26 -6.602 14.969 -9.379 1.00 0.00 N ATOM 417 CA HIS A 26 -5.485 15.129 -10.306 1.00 0.00 C ATOM 418 C HIS A 26 -5.635 14.168 -11.482 1.00 0.00 C ATOM 419 O HIS A 26 -5.034 14.371 -12.538 1.00 0.00 O ATOM 420 CB HIS A 26 -4.142 14.911 -9.596 1.00 0.00 C ATOM 421 CG HIS A 26 -3.781 16.005 -8.631 1.00 0.00 C ATOM 422 ND1 HIS A 26 -2.483 16.310 -8.279 1.00 0.00 N ATOM 423 CD2 HIS A 26 -4.563 16.864 -7.934 1.00 0.00 C ATOM 424 CE1 HIS A 26 -2.485 17.304 -7.409 1.00 0.00 C ATOM 425 NE2 HIS A 26 -3.735 17.659 -7.184 1.00 0.00 N ATOM 0 H HIS A 26 -6.411 14.365 -8.580 1.00 0.00 H new ATOM 0 HA HIS A 26 -5.499 16.151 -10.685 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -4.175 13.963 -9.060 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -3.355 14.826 -10.345 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -5.641 16.914 -7.964 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.611 17.750 -6.958 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -4.037 18.403 -6.555 1.00 0.00 H new ATOM 434 N LYS A 27 -6.452 13.132 -11.279 1.00 0.00 N ATOM 435 CA LYS A 27 -6.777 12.148 -12.314 1.00 0.00 C ATOM 436 C LYS A 27 -5.568 11.303 -12.694 1.00 0.00 C ATOM 437 O LYS A 27 -4.745 11.694 -13.527 1.00 0.00 O ATOM 438 CB LYS A 27 -7.373 12.818 -13.559 1.00 0.00 C ATOM 439 CG LYS A 27 -8.759 13.406 -13.335 1.00 0.00 C ATOM 440 CD LYS A 27 -9.763 12.326 -12.960 1.00 0.00 C ATOM 441 CE LYS A 27 -11.147 12.908 -12.717 1.00 0.00 C ATOM 442 NZ LYS A 27 -12.108 11.875 -12.242 1.00 0.00 N ATOM 0 H LYS A 27 -6.910 12.951 -10.386 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.529 11.484 -11.889 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.702 13.610 -13.891 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -7.425 12.086 -14.365 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.715 14.155 -12.545 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.091 13.916 -14.239 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.815 11.584 -13.757 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.423 11.808 -12.063 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.080 13.708 -11.980 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.520 13.354 -13.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -13.039 12.312 -12.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -12.192 11.124 -12.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.765 11.467 -11.349 1.00 0.00 H new ATOM 456 N ALA A 28 -5.466 10.140 -12.073 1.00 0.00 N ATOM 457 CA ALA A 28 -4.406 9.195 -12.375 1.00 0.00 C ATOM 458 C ALA A 28 -4.982 7.789 -12.479 1.00 0.00 C ATOM 459 O ALA A 28 -5.798 7.391 -11.650 1.00 0.00 O ATOM 460 CB ALA A 28 -3.322 9.251 -11.307 1.00 0.00 C ATOM 0 H ALA A 28 -6.112 9.826 -11.349 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.955 9.463 -13.331 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.535 8.536 -11.549 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.900 10.255 -11.269 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -3.753 9.001 -10.338 1.00 0.00 H new ATOM 466 N PRO A 29 -4.589 7.025 -13.513 1.00 0.00 N ATOM 467 CA PRO A 29 -5.052 5.646 -13.690 1.00 0.00 C ATOM 468 C PRO A 29 -4.571 4.740 -12.561 1.00 0.00 C ATOM 469 O PRO A 29 -3.565 5.036 -11.907 1.00 0.00 O ATOM 470 CB PRO A 29 -4.430 5.220 -15.026 1.00 0.00 C ATOM 471 CG PRO A 29 -3.285 6.148 -15.237 1.00 0.00 C ATOM 472 CD PRO A 29 -3.674 7.445 -14.587 1.00 0.00 C ATOM 0 HA PRO A 29 -6.140 5.573 -13.680 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -4.095 4.183 -14.992 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -5.153 5.295 -15.839 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -2.373 5.748 -14.794 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -3.088 6.288 -16.300 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.806 7.973 -14.192 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -4.163 8.117 -15.292 1.00 0.00 H new ATOM 480 N THR A 30 -5.287 3.646 -12.335 1.00 0.00 N ATOM 481 CA THR A 30 -4.936 2.697 -11.284 1.00 0.00 C ATOM 482 C THR A 30 -3.502 2.195 -11.461 1.00 0.00 C ATOM 483 O THR A 30 -2.767 2.040 -10.486 1.00 0.00 O ATOM 484 CB THR A 30 -5.913 1.501 -11.274 1.00 0.00 C ATOM 485 OG1 THR A 30 -7.266 1.980 -11.230 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.660 0.596 -10.076 1.00 0.00 C ATOM 0 H THR A 30 -6.119 3.392 -12.868 1.00 0.00 H new ATOM 0 HA THR A 30 -5.010 3.217 -10.329 1.00 0.00 H new ATOM 0 HB THR A 30 -5.752 0.924 -12.185 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.883 1.218 -11.226 1.00 0.00 H new ATOM 0 HG21 THR A 30 -6.362 -0.237 -10.095 1.00 0.00 H new ATOM 0 HG22 THR A 30 -4.641 0.212 -10.119 1.00 0.00 H new ATOM 0 HG23 THR A 30 -5.796 1.164 -9.156 1.00 0.00 H new ATOM 494 N ASP A 31 -3.110 1.974 -12.713 1.00 0.00 N ATOM 495 CA ASP A 31 -1.748 1.557 -13.050 1.00 0.00 C ATOM 496 C ASP A 31 -0.714 2.500 -12.438 1.00 0.00 C ATOM 497 O ASP A 31 0.208 2.067 -11.743 1.00 0.00 O ATOM 498 CB ASP A 31 -1.576 1.524 -14.571 1.00 0.00 C ATOM 499 CG ASP A 31 -0.174 1.132 -14.993 1.00 0.00 C ATOM 500 OD1 ASP A 31 0.093 -0.084 -15.119 1.00 0.00 O ATOM 501 OD2 ASP A 31 0.662 2.029 -15.212 1.00 0.00 O ATOM 0 H ASP A 31 -3.724 2.078 -13.521 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.588 0.560 -12.640 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -2.290 0.820 -14.998 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -1.813 2.506 -14.981 1.00 0.00 H new ATOM 506 N LEU A 32 -0.889 3.794 -12.685 1.00 0.00 N ATOM 507 CA LEU A 32 0.029 4.804 -12.177 1.00 0.00 C ATOM 508 C LEU A 32 -0.137 4.968 -10.670 1.00 0.00 C ATOM 509 O LEU A 32 0.834 5.182 -9.950 1.00 0.00 O ATOM 510 CB LEU A 32 -0.202 6.142 -12.886 1.00 0.00 C ATOM 511 CG LEU A 32 0.734 7.278 -12.466 1.00 0.00 C ATOM 512 CD1 LEU A 32 2.182 6.922 -12.768 1.00 0.00 C ATOM 513 CD2 LEU A 32 0.345 8.573 -13.164 1.00 0.00 C ATOM 0 H LEU A 32 -1.662 4.168 -13.236 1.00 0.00 H new ATOM 0 HA LEU A 32 1.048 4.475 -12.379 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.099 5.987 -13.960 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.230 6.456 -12.707 1.00 0.00 H new ATOM 0 HG LEU A 32 0.636 7.423 -11.390 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.830 7.743 -12.462 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.456 6.020 -12.221 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.298 6.748 -13.838 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.020 9.370 -12.854 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.413 8.439 -14.244 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.677 8.839 -12.895 1.00 0.00 H new ATOM 525 N SER A 33 -1.375 4.853 -10.203 1.00 0.00 N ATOM 526 CA SER A 33 -1.671 4.968 -8.782 1.00 0.00 C ATOM 527 C SER A 33 -0.911 3.911 -7.987 1.00 0.00 C ATOM 528 O SER A 33 -0.260 4.225 -6.991 1.00 0.00 O ATOM 529 CB SER A 33 -3.176 4.833 -8.544 1.00 0.00 C ATOM 530 OG SER A 33 -3.895 5.815 -9.269 1.00 0.00 O ATOM 0 H SER A 33 -2.191 4.680 -10.790 1.00 0.00 H new ATOM 0 HA SER A 33 -1.348 5.951 -8.440 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.507 3.839 -8.844 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.390 4.932 -7.480 1.00 0.00 H new ATOM 0 HG SER A 33 -3.861 5.605 -10.226 1.00 0.00 H new ATOM 536 N LEU A 34 -0.979 2.664 -8.447 1.00 0.00 N ATOM 537 CA LEU A 34 -0.274 1.564 -7.796 1.00 0.00 C ATOM 538 C LEU A 34 1.231 1.792 -7.846 1.00 0.00 C ATOM 539 O LEU A 34 1.948 1.484 -6.895 1.00 0.00 O ATOM 540 CB LEU A 34 -0.621 0.229 -8.465 1.00 0.00 C ATOM 541 CG LEU A 34 -2.099 -0.167 -8.406 1.00 0.00 C ATOM 542 CD1 LEU A 34 -2.327 -1.479 -9.143 1.00 0.00 C ATOM 543 CD2 LEU A 34 -2.566 -0.276 -6.962 1.00 0.00 C ATOM 0 H LEU A 34 -1.516 2.390 -9.270 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.592 1.527 -6.754 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.315 0.275 -9.510 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.032 -0.558 -7.995 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.685 0.610 -8.897 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.382 -1.746 -9.092 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.031 -1.366 -10.186 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.731 -2.265 -8.680 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.619 -0.558 -6.940 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.977 -1.033 -6.445 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.438 0.685 -6.465 1.00 0.00 H new ATOM 555 N MET A 35 1.696 2.346 -8.958 1.00 0.00 N ATOM 556 CA MET A 35 3.109 2.654 -9.136 1.00 0.00 C ATOM 557 C MET A 35 3.575 3.674 -8.100 1.00 0.00 C ATOM 558 O MET A 35 4.613 3.497 -7.459 1.00 0.00 O ATOM 559 CB MET A 35 3.347 3.189 -10.551 1.00 0.00 C ATOM 560 CG MET A 35 4.786 3.594 -10.829 1.00 0.00 C ATOM 561 SD MET A 35 5.004 4.278 -12.483 1.00 0.00 S ATOM 562 CE MET A 35 6.742 4.705 -12.446 1.00 0.00 C ATOM 0 H MET A 35 1.110 2.593 -9.756 1.00 0.00 H new ATOM 0 HA MET A 35 3.686 1.740 -8.996 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.050 2.426 -11.271 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.700 4.051 -10.715 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.102 4.331 -10.090 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.434 2.725 -10.710 1.00 0.00 H new ATOM 0 HE1 MET A 35 7.030 5.142 -13.402 1.00 0.00 H new ATOM 0 HE2 MET A 35 6.923 5.426 -11.649 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.333 3.808 -12.264 1.00 0.00 H new ATOM 572 N VAL A 36 2.797 4.737 -7.934 1.00 0.00 N ATOM 573 CA VAL A 36 3.133 5.786 -6.980 1.00 0.00 C ATOM 574 C VAL A 36 3.027 5.277 -5.545 1.00 0.00 C ATOM 575 O VAL A 36 3.957 5.441 -4.757 1.00 0.00 O ATOM 576 CB VAL A 36 2.227 7.024 -7.161 1.00 0.00 C ATOM 577 CG1 VAL A 36 2.563 8.098 -6.135 1.00 0.00 C ATOM 578 CG2 VAL A 36 2.358 7.578 -8.572 1.00 0.00 C ATOM 0 H VAL A 36 1.930 4.895 -8.447 1.00 0.00 H new ATOM 0 HA VAL A 36 4.164 6.079 -7.176 1.00 0.00 H new ATOM 0 HB VAL A 36 1.194 6.714 -7.003 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.912 8.959 -6.283 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.416 7.700 -5.131 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.602 8.404 -6.256 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.713 8.450 -8.682 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.393 7.867 -8.755 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.062 6.815 -9.292 1.00 0.00 H new ATOM 588 N LEU A 37 1.905 4.642 -5.221 1.00 0.00 N ATOM 589 CA LEU A 37 1.674 4.128 -3.870 1.00 0.00 C ATOM 590 C LEU A 37 2.732 3.098 -3.491 1.00 0.00 C ATOM 591 O LEU A 37 3.237 3.102 -2.367 1.00 0.00 O ATOM 592 CB LEU A 37 0.281 3.505 -3.763 1.00 0.00 C ATOM 593 CG LEU A 37 -0.885 4.470 -3.983 1.00 0.00 C ATOM 594 CD1 LEU A 37 -2.206 3.723 -3.942 1.00 0.00 C ATOM 595 CD2 LEU A 37 -0.866 5.579 -2.941 1.00 0.00 C ATOM 0 H LEU A 37 1.140 4.470 -5.873 1.00 0.00 H new ATOM 0 HA LEU A 37 1.741 4.967 -3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.205 2.698 -4.491 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.177 3.055 -2.776 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.775 4.924 -4.968 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.025 4.424 -4.100 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.220 2.965 -4.726 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.322 3.242 -2.971 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.703 6.255 -3.114 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.951 5.144 -1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.070 6.133 -3.016 1.00 0.00 H new ATOM 607 N GLY A 38 3.069 2.226 -4.436 1.00 0.00 N ATOM 608 CA GLY A 38 4.083 1.219 -4.190 1.00 0.00 C ATOM 609 C GLY A 38 5.413 1.836 -3.816 1.00 0.00 C ATOM 610 O GLY A 38 6.036 1.441 -2.828 1.00 0.00 O ATOM 0 H GLY A 38 2.657 2.199 -5.369 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.751 0.558 -3.389 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.206 0.603 -5.081 1.00 0.00 H new ATOM 614 N ASN A 39 5.842 2.821 -4.596 1.00 0.00 N ATOM 615 CA ASN A 39 7.094 3.516 -4.329 1.00 0.00 C ATOM 616 C ASN A 39 6.985 4.327 -3.044 1.00 0.00 C ATOM 617 O ASN A 39 7.935 4.415 -2.271 1.00 0.00 O ATOM 618 CB ASN A 39 7.462 4.435 -5.497 1.00 0.00 C ATOM 619 CG ASN A 39 8.825 5.080 -5.317 1.00 0.00 C ATOM 620 OD1 ASN A 39 9.732 4.497 -4.724 1.00 0.00 O ATOM 621 ND2 ASN A 39 8.981 6.290 -5.829 1.00 0.00 N ATOM 0 H ASN A 39 5.341 3.156 -5.419 1.00 0.00 H new ATOM 0 HA ASN A 39 7.880 2.770 -4.212 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.454 3.862 -6.424 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.705 5.213 -5.597 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.876 6.771 -5.739 1.00 0.00 H new ATOM 0 HD22 ASN A 39 8.206 6.742 -6.314 1.00 0.00 H new ATOM 628 N MET A 40 5.811 4.906 -2.818 1.00 0.00 N ATOM 629 CA MET A 40 5.556 5.709 -1.626 1.00 0.00 C ATOM 630 C MET A 40 5.794 4.895 -0.358 1.00 0.00 C ATOM 631 O MET A 40 6.569 5.300 0.507 1.00 0.00 O ATOM 632 CB MET A 40 4.121 6.239 -1.638 1.00 0.00 C ATOM 633 CG MET A 40 3.775 7.090 -0.428 1.00 0.00 C ATOM 634 SD MET A 40 2.053 7.621 -0.425 1.00 0.00 S ATOM 635 CE MET A 40 1.998 8.566 1.092 1.00 0.00 C ATOM 0 H MET A 40 5.014 4.833 -3.450 1.00 0.00 H new ATOM 0 HA MET A 40 6.249 6.550 -1.634 1.00 0.00 H new ATOM 0 HB2 MET A 40 3.968 6.829 -2.542 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.432 5.396 -1.687 1.00 0.00 H new ATOM 0 HG2 MET A 40 3.978 6.523 0.481 1.00 0.00 H new ATOM 0 HG3 MET A 40 4.422 7.967 -0.408 1.00 0.00 H new ATOM 0 HE1 MET A 40 0.993 8.963 1.237 1.00 0.00 H new ATOM 0 HE2 MET A 40 2.258 7.922 1.932 1.00 0.00 H new ATOM 0 HE3 MET A 40 2.709 9.390 1.033 1.00 0.00 H new ATOM 645 N VAL A 41 5.130 3.748 -0.260 1.00 0.00 N ATOM 646 CA VAL A 41 5.263 2.884 0.908 1.00 0.00 C ATOM 647 C VAL A 41 6.698 2.382 1.045 1.00 0.00 C ATOM 648 O VAL A 41 7.266 2.396 2.136 1.00 0.00 O ATOM 649 CB VAL A 41 4.294 1.682 0.844 1.00 0.00 C ATOM 650 CG1 VAL A 41 4.433 0.805 2.082 1.00 0.00 C ATOM 651 CG2 VAL A 41 2.858 2.159 0.692 1.00 0.00 C ATOM 0 H VAL A 41 4.494 3.395 -0.975 1.00 0.00 H new ATOM 0 HA VAL A 41 5.005 3.482 1.782 1.00 0.00 H new ATOM 0 HB VAL A 41 4.556 1.085 -0.029 1.00 0.00 H new ATOM 0 HG11 VAL A 41 3.741 -0.034 2.013 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.454 0.429 2.149 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.204 1.392 2.971 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.191 1.298 0.649 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.590 2.783 1.544 1.00 0.00 H new ATOM 0 HG23 VAL A 41 2.762 2.738 -0.226 1.00 0.00 H new ATOM 661 N THR A 42 7.286 1.969 -0.074 1.00 0.00 N ATOM 662 CA THR A 42 8.661 1.485 -0.079 1.00 0.00 C ATOM 663 C THR A 42 9.621 2.563 0.421 1.00 0.00 C ATOM 664 O THR A 42 10.422 2.328 1.325 1.00 0.00 O ATOM 665 CB THR A 42 9.095 1.035 -1.489 1.00 0.00 C ATOM 666 OG1 THR A 42 8.172 0.070 -2.005 1.00 0.00 O ATOM 667 CG2 THR A 42 10.491 0.432 -1.461 1.00 0.00 C ATOM 0 H THR A 42 6.832 1.960 -0.987 1.00 0.00 H new ATOM 0 HA THR A 42 8.699 0.627 0.592 1.00 0.00 H new ATOM 0 HB THR A 42 9.104 1.913 -2.134 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.423 0.532 -2.436 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.774 0.123 -2.467 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.201 1.175 -1.097 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.500 -0.434 -0.799 1.00 0.00 H new ATOM 675 N ASN A 43 9.517 3.754 -0.160 1.00 0.00 N ATOM 676 CA ASN A 43 10.396 4.860 0.198 1.00 0.00 C ATOM 677 C ASN A 43 10.181 5.271 1.647 1.00 0.00 C ATOM 678 O ASN A 43 11.131 5.628 2.344 1.00 0.00 O ATOM 679 CB ASN A 43 10.170 6.056 -0.730 1.00 0.00 C ATOM 680 CG ASN A 43 11.154 7.182 -0.471 1.00 0.00 C ATOM 681 OD1 ASN A 43 12.268 7.173 -0.991 1.00 0.00 O ATOM 682 ND2 ASN A 43 10.744 8.166 0.315 1.00 0.00 N ATOM 0 H ASN A 43 8.832 3.977 -0.882 1.00 0.00 H new ATOM 0 HA ASN A 43 11.426 4.522 0.082 1.00 0.00 H new ATOM 0 HB2 ASN A 43 10.259 5.730 -1.766 1.00 0.00 H new ATOM 0 HB3 ASN A 43 9.154 6.428 -0.599 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.361 8.955 0.508 1.00 0.00 H new ATOM 0 HD22 ASN A 43 9.811 8.135 0.727 1.00 0.00 H new ATOM 689 N LEU A 44 8.933 5.208 2.098 1.00 0.00 N ATOM 690 CA LEU A 44 8.599 5.513 3.484 1.00 0.00 C ATOM 691 C LEU A 44 9.385 4.607 4.425 1.00 0.00 C ATOM 692 O LEU A 44 9.988 5.070 5.390 1.00 0.00 O ATOM 693 CB LEU A 44 7.094 5.334 3.714 1.00 0.00 C ATOM 694 CG LEU A 44 6.591 5.708 5.109 1.00 0.00 C ATOM 695 CD1 LEU A 44 6.784 7.193 5.368 1.00 0.00 C ATOM 696 CD2 LEU A 44 5.129 5.322 5.268 1.00 0.00 C ATOM 0 H LEU A 44 8.133 4.947 1.521 1.00 0.00 H new ATOM 0 HA LEU A 44 8.866 6.549 3.691 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.558 5.936 2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.836 4.293 3.521 1.00 0.00 H new ATOM 0 HG LEU A 44 7.175 5.155 5.845 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.420 7.439 6.366 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.843 7.440 5.297 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.227 7.767 4.627 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.787 5.595 6.266 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.531 5.847 4.523 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.019 4.247 5.129 1.00 0.00 H new ATOM 708 N ILE A 45 9.399 3.318 4.112 1.00 0.00 N ATOM 709 CA ILE A 45 10.105 2.339 4.926 1.00 0.00 C ATOM 710 C ILE A 45 11.620 2.521 4.813 1.00 0.00 C ATOM 711 O ILE A 45 12.355 2.323 5.779 1.00 0.00 O ATOM 712 CB ILE A 45 9.724 0.897 4.514 1.00 0.00 C ATOM 713 CG1 ILE A 45 8.213 0.691 4.650 1.00 0.00 C ATOM 714 CG2 ILE A 45 10.478 -0.120 5.362 1.00 0.00 C ATOM 715 CD1 ILE A 45 7.734 -0.664 4.175 1.00 0.00 C ATOM 0 H ILE A 45 8.927 2.926 3.297 1.00 0.00 H new ATOM 0 HA ILE A 45 9.807 2.501 5.962 1.00 0.00 H new ATOM 0 HB ILE A 45 10.005 0.748 3.471 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.931 0.819 5.695 1.00 0.00 H new ATOM 0 HG13 ILE A 45 7.698 1.467 4.083 1.00 0.00 H new ATOM 0 HG21 ILE A 45 10.197 -1.128 5.057 1.00 0.00 H new ATOM 0 HG22 ILE A 45 11.551 0.015 5.224 1.00 0.00 H new ATOM 0 HG23 ILE A 45 10.227 0.025 6.413 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.654 -0.734 4.303 1.00 0.00 H new ATOM 0 HD12 ILE A 45 7.983 -0.789 3.121 1.00 0.00 H new ATOM 0 HD13 ILE A 45 8.220 -1.447 4.758 1.00 0.00 H new ATOM 727 N ASN A 46 12.080 2.919 3.634 1.00 0.00 N ATOM 728 CA ASN A 46 13.513 3.071 3.385 1.00 0.00 C ATOM 729 C ASN A 46 14.089 4.315 4.060 1.00 0.00 C ATOM 730 O ASN A 46 15.290 4.381 4.320 1.00 0.00 O ATOM 731 CB ASN A 46 13.810 3.139 1.881 1.00 0.00 C ATOM 732 CG ASN A 46 13.557 1.830 1.158 1.00 0.00 C ATOM 733 OD1 ASN A 46 13.610 0.752 1.752 1.00 0.00 O ATOM 734 ND2 ASN A 46 13.307 1.913 -0.138 1.00 0.00 N ATOM 0 H ASN A 46 11.486 3.143 2.835 1.00 0.00 H new ATOM 0 HA ASN A 46 13.991 2.190 3.815 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.195 3.919 1.432 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.850 3.430 1.736 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.150 1.065 -0.682 1.00 0.00 H new ATOM 0 HD22 ASN A 46 13.271 2.825 -0.593 1.00 0.00 H new ATOM 741 N THR A 47 13.247 5.305 4.326 1.00 0.00 N ATOM 742 CA THR A 47 13.732 6.580 4.847 1.00 0.00 C ATOM 743 C THR A 47 13.247 6.867 6.268 1.00 0.00 C ATOM 744 O THR A 47 14.010 7.346 7.105 1.00 0.00 O ATOM 745 CB THR A 47 13.314 7.746 3.930 1.00 0.00 C ATOM 746 OG1 THR A 47 11.894 7.726 3.733 1.00 0.00 O ATOM 747 CG2 THR A 47 14.017 7.662 2.583 1.00 0.00 C ATOM 0 H THR A 47 12.237 5.254 4.192 1.00 0.00 H new ATOM 0 HA THR A 47 14.818 6.496 4.873 1.00 0.00 H new ATOM 0 HB THR A 47 13.605 8.679 4.413 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.661 7.008 3.108 1.00 0.00 H new ATOM 0 HG21 THR A 47 13.703 8.497 1.956 1.00 0.00 H new ATOM 0 HG22 THR A 47 15.096 7.705 2.732 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.756 6.723 2.094 1.00 0.00 H new ATOM 755 N SER A 48 11.983 6.582 6.543 1.00 0.00 N ATOM 756 CA SER A 48 11.380 6.971 7.810 1.00 0.00 C ATOM 757 C SER A 48 11.439 5.841 8.835 1.00 0.00 C ATOM 758 O SER A 48 11.104 6.033 10.005 1.00 0.00 O ATOM 759 CB SER A 48 9.934 7.399 7.575 1.00 0.00 C ATOM 760 OG SER A 48 9.861 8.367 6.540 1.00 0.00 O ATOM 0 H SER A 48 11.357 6.085 5.909 1.00 0.00 H new ATOM 0 HA SER A 48 11.949 7.807 8.216 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.330 6.531 7.311 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.517 7.810 8.494 1.00 0.00 H new ATOM 0 HG SER A 48 9.015 8.857 6.609 1.00 0.00 H new ATOM 766 N ILE A 49 11.873 4.669 8.394 1.00 0.00 N ATOM 767 CA ILE A 49 11.951 3.511 9.267 1.00 0.00 C ATOM 768 C ILE A 49 13.404 3.086 9.454 1.00 0.00 C ATOM 769 O ILE A 49 14.185 3.074 8.502 1.00 0.00 O ATOM 770 CB ILE A 49 11.110 2.337 8.711 1.00 0.00 C ATOM 771 CG1 ILE A 49 9.628 2.733 8.675 1.00 0.00 C ATOM 772 CG2 ILE A 49 11.311 1.079 9.547 1.00 0.00 C ATOM 773 CD1 ILE A 49 8.716 1.653 8.135 1.00 0.00 C ATOM 0 H ILE A 49 12.176 4.497 7.436 1.00 0.00 H new ATOM 0 HA ILE A 49 11.539 3.789 10.237 1.00 0.00 H new ATOM 0 HB ILE A 49 11.443 2.118 7.697 1.00 0.00 H new ATOM 0 HG12 ILE A 49 9.308 2.994 9.684 1.00 0.00 H new ATOM 0 HG13 ILE A 49 9.516 3.628 8.063 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.709 0.269 9.136 1.00 0.00 H new ATOM 0 HG22 ILE A 49 12.363 0.795 9.529 1.00 0.00 H new ATOM 0 HG23 ILE A 49 11.005 1.273 10.575 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.686 2.010 8.142 1.00 0.00 H new ATOM 0 HD12 ILE A 49 9.008 1.407 7.114 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.796 0.763 8.760 1.00 0.00 H new ATOM 785 N ALA A 50 13.759 2.764 10.692 1.00 0.00 N ATOM 786 CA ALA A 50 15.124 2.390 11.033 1.00 0.00 C ATOM 787 C ALA A 50 15.545 1.104 10.325 1.00 0.00 C ATOM 788 O ALA A 50 14.756 0.160 10.208 1.00 0.00 O ATOM 789 CB ALA A 50 15.266 2.227 12.539 1.00 0.00 C ATOM 0 H ALA A 50 13.114 2.755 11.482 1.00 0.00 H new ATOM 0 HA ALA A 50 15.782 3.191 10.695 1.00 0.00 H new ATOM 0 HB1 ALA A 50 16.292 1.947 12.780 1.00 0.00 H new ATOM 0 HB2 ALA A 50 15.022 3.168 13.031 1.00 0.00 H new ATOM 0 HB3 ALA A 50 14.587 1.449 12.886 1.00 0.00 H new ATOM 795 N PRO A 51 16.803 1.052 9.853 1.00 0.00 N ATOM 796 CA PRO A 51 17.356 -0.114 9.150 1.00 0.00 C ATOM 797 C PRO A 51 17.602 -1.308 10.077 1.00 0.00 C ATOM 798 O PRO A 51 18.688 -1.884 10.099 1.00 0.00 O ATOM 799 CB PRO A 51 18.679 0.410 8.586 1.00 0.00 C ATOM 800 CG PRO A 51 19.070 1.513 9.505 1.00 0.00 C ATOM 801 CD PRO A 51 17.787 2.148 9.958 1.00 0.00 C ATOM 0 HA PRO A 51 16.669 -0.491 8.392 1.00 0.00 H new ATOM 0 HB2 PRO A 51 19.437 -0.373 8.562 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.559 0.770 7.564 1.00 0.00 H new ATOM 0 HG2 PRO A 51 19.637 1.131 10.354 1.00 0.00 H new ATOM 0 HG3 PRO A 51 19.706 2.238 8.997 1.00 0.00 H new ATOM 0 HD2 PRO A 51 17.863 2.522 10.979 1.00 0.00 H new ATOM 0 HD3 PRO A 51 17.514 2.994 9.328 1.00 0.00 H new ATOM 809 N ALA A 52 16.581 -1.673 10.835 1.00 0.00 N ATOM 810 CA ALA A 52 16.646 -2.827 11.717 1.00 0.00 C ATOM 811 C ALA A 52 15.446 -3.734 11.481 1.00 0.00 C ATOM 812 O ALA A 52 15.589 -4.898 11.113 1.00 0.00 O ATOM 813 CB ALA A 52 16.703 -2.381 13.172 1.00 0.00 C ATOM 0 H ALA A 52 15.688 -1.181 10.857 1.00 0.00 H new ATOM 0 HA ALA A 52 17.554 -3.388 11.496 1.00 0.00 H new ATOM 0 HB1 ALA A 52 16.751 -3.257 13.819 1.00 0.00 H new ATOM 0 HB2 ALA A 52 17.588 -1.764 13.329 1.00 0.00 H new ATOM 0 HB3 ALA A 52 15.811 -1.802 13.410 1.00 0.00 H new ATOM 819 N GLN A 53 14.258 -3.177 11.665 1.00 0.00 N ATOM 820 CA GLN A 53 13.024 -3.933 11.498 1.00 0.00 C ATOM 821 C GLN A 53 12.286 -3.505 10.232 1.00 0.00 C ATOM 822 O GLN A 53 11.098 -3.781 10.067 1.00 0.00 O ATOM 823 CB GLN A 53 12.126 -3.779 12.737 1.00 0.00 C ATOM 824 CG GLN A 53 12.265 -2.445 13.472 1.00 0.00 C ATOM 825 CD GLN A 53 11.840 -1.244 12.647 1.00 0.00 C ATOM 826 OE1 GLN A 53 10.989 -1.347 11.773 1.00 0.00 O ATOM 827 NE2 GLN A 53 12.420 -0.092 12.936 1.00 0.00 N ATOM 0 H GLN A 53 14.122 -2.202 11.931 1.00 0.00 H new ATOM 0 HA GLN A 53 13.282 -4.987 11.391 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.087 -3.902 12.432 1.00 0.00 H new ATOM 0 HB3 GLN A 53 12.352 -4.586 13.434 1.00 0.00 H new ATOM 0 HG2 GLN A 53 11.667 -2.479 14.383 1.00 0.00 H new ATOM 0 HG3 GLN A 53 13.303 -2.315 13.777 1.00 0.00 H new ATOM 0 HE21 GLN A 53 13.125 -0.046 13.672 1.00 0.00 H new ATOM 0 HE22 GLN A 53 12.162 0.751 12.423 1.00 0.00 H new ATOM 836 N ARG A 54 13.020 -2.861 9.327 1.00 0.00 N ATOM 837 CA ARG A 54 12.446 -2.323 8.091 1.00 0.00 C ATOM 838 C ARG A 54 11.730 -3.409 7.278 1.00 0.00 C ATOM 839 O ARG A 54 10.635 -3.189 6.759 1.00 0.00 O ATOM 840 CB ARG A 54 13.544 -1.655 7.244 1.00 0.00 C ATOM 841 CG ARG A 54 14.609 -2.620 6.738 1.00 0.00 C ATOM 842 CD ARG A 54 15.781 -1.893 6.097 1.00 0.00 C ATOM 843 NE ARG A 54 15.376 -1.045 4.980 1.00 0.00 N ATOM 844 CZ ARG A 54 16.151 -0.088 4.463 1.00 0.00 C ATOM 845 NH1 ARG A 54 17.370 0.124 4.951 1.00 0.00 N ATOM 846 NH2 ARG A 54 15.717 0.644 3.451 1.00 0.00 N ATOM 0 H ARG A 54 14.022 -2.697 9.426 1.00 0.00 H new ATOM 0 HA ARG A 54 11.702 -1.576 8.367 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.080 -1.162 6.390 1.00 0.00 H new ATOM 0 HB3 ARG A 54 14.025 -0.878 7.838 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.970 -3.228 7.567 1.00 0.00 H new ATOM 0 HG3 ARG A 54 14.165 -3.302 6.012 1.00 0.00 H new ATOM 0 HD2 ARG A 54 16.279 -1.282 6.849 1.00 0.00 H new ATOM 0 HD3 ARG A 54 16.509 -2.625 5.747 1.00 0.00 H new ATOM 0 HE ARG A 54 14.452 -1.191 4.573 1.00 0.00 H new ATOM 0 HH11 ARG A 54 17.716 -0.445 5.723 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.958 0.856 4.553 1.00 0.00 H new ATOM 0 HH21 ARG A 54 14.788 0.478 3.063 1.00 0.00 H new ATOM 0 HH22 ARG A 54 16.311 1.374 3.058 1.00 0.00 H new ATOM 860 N GLN A 55 12.333 -4.590 7.199 1.00 0.00 N ATOM 861 CA GLN A 55 11.776 -5.674 6.399 1.00 0.00 C ATOM 862 C GLN A 55 10.600 -6.322 7.125 1.00 0.00 C ATOM 863 O GLN A 55 9.733 -6.943 6.506 1.00 0.00 O ATOM 864 CB GLN A 55 12.857 -6.715 6.092 1.00 0.00 C ATOM 865 CG GLN A 55 12.443 -7.754 5.058 1.00 0.00 C ATOM 866 CD GLN A 55 12.199 -7.157 3.680 1.00 0.00 C ATOM 867 OE1 GLN A 55 11.795 -6.006 3.547 1.00 0.00 O ATOM 868 NE2 GLN A 55 12.444 -7.941 2.643 1.00 0.00 N ATOM 0 H GLN A 55 13.204 -4.820 7.677 1.00 0.00 H new ATOM 0 HA GLN A 55 11.413 -5.262 5.457 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.751 -6.201 5.738 1.00 0.00 H new ATOM 0 HB3 GLN A 55 13.128 -7.225 7.016 1.00 0.00 H new ATOM 0 HG2 GLN A 55 13.219 -8.516 4.986 1.00 0.00 H new ATOM 0 HG3 GLN A 55 11.536 -8.254 5.397 1.00 0.00 H new ATOM 0 HE21 GLN A 55 12.779 -8.893 2.791 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.298 -7.594 1.695 1.00 0.00 H new ATOM 877 N ALA A 56 10.568 -6.159 8.442 1.00 0.00 N ATOM 878 CA ALA A 56 9.494 -6.710 9.251 1.00 0.00 C ATOM 879 C ALA A 56 8.208 -5.934 9.013 1.00 0.00 C ATOM 880 O ALA A 56 7.144 -6.522 8.817 1.00 0.00 O ATOM 881 CB ALA A 56 9.868 -6.692 10.725 1.00 0.00 C ATOM 0 H ALA A 56 11.275 -5.649 8.971 1.00 0.00 H new ATOM 0 HA ALA A 56 9.334 -7.747 8.956 1.00 0.00 H new ATOM 0 HB1 ALA A 56 9.050 -7.109 11.313 1.00 0.00 H new ATOM 0 HB2 ALA A 56 10.767 -7.289 10.880 1.00 0.00 H new ATOM 0 HB3 ALA A 56 10.055 -5.666 11.040 1.00 0.00 H new ATOM 887 N ILE A 57 8.314 -4.610 9.012 1.00 0.00 N ATOM 888 CA ILE A 57 7.165 -3.753 8.752 1.00 0.00 C ATOM 889 C ILE A 57 6.690 -3.916 7.310 1.00 0.00 C ATOM 890 O ILE A 57 5.488 -3.958 7.048 1.00 0.00 O ATOM 891 CB ILE A 57 7.478 -2.267 9.037 1.00 0.00 C ATOM 892 CG1 ILE A 57 7.828 -2.077 10.517 1.00 0.00 C ATOM 893 CG2 ILE A 57 6.297 -1.382 8.650 1.00 0.00 C ATOM 894 CD1 ILE A 57 8.057 -0.633 10.915 1.00 0.00 C ATOM 0 H ILE A 57 9.184 -4.108 9.188 1.00 0.00 H new ATOM 0 HA ILE A 57 6.371 -4.064 9.431 1.00 0.00 H new ATOM 0 HB ILE A 57 8.336 -1.972 8.432 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.023 -2.488 11.126 1.00 0.00 H new ATOM 0 HG13 ILE A 57 8.725 -2.653 10.745 1.00 0.00 H new ATOM 0 HG21 ILE A 57 6.539 -0.340 8.859 1.00 0.00 H new ATOM 0 HG22 ILE A 57 6.087 -1.499 7.587 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.419 -1.673 9.227 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.300 -0.582 11.976 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.883 -0.222 10.334 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.154 -0.055 10.721 1.00 0.00 H new ATOM 906 N ALA A 58 7.639 -4.028 6.385 1.00 0.00 N ATOM 907 CA ALA A 58 7.317 -4.254 4.978 1.00 0.00 C ATOM 908 C ALA A 58 6.447 -5.500 4.817 1.00 0.00 C ATOM 909 O ALA A 58 5.405 -5.469 4.156 1.00 0.00 O ATOM 910 CB ALA A 58 8.590 -4.388 4.157 1.00 0.00 C ATOM 0 H ALA A 58 8.638 -3.966 6.584 1.00 0.00 H new ATOM 0 HA ALA A 58 6.756 -3.394 4.613 1.00 0.00 H new ATOM 0 HB1 ALA A 58 8.333 -4.556 3.111 1.00 0.00 H new ATOM 0 HB2 ALA A 58 9.177 -3.474 4.244 1.00 0.00 H new ATOM 0 HB3 ALA A 58 9.174 -5.231 4.527 1.00 0.00 H new ATOM 916 N ASN A 59 6.874 -6.593 5.443 1.00 0.00 N ATOM 917 CA ASN A 59 6.109 -7.831 5.420 1.00 0.00 C ATOM 918 C ASN A 59 4.769 -7.650 6.118 1.00 0.00 C ATOM 919 O ASN A 59 3.740 -8.068 5.598 1.00 0.00 O ATOM 920 CB ASN A 59 6.892 -8.978 6.070 1.00 0.00 C ATOM 921 CG ASN A 59 7.826 -9.673 5.097 1.00 0.00 C ATOM 922 OD1 ASN A 59 7.440 -10.628 4.427 1.00 0.00 O ATOM 923 ND2 ASN A 59 9.061 -9.203 5.014 1.00 0.00 N ATOM 0 H ASN A 59 7.745 -6.644 5.971 1.00 0.00 H new ATOM 0 HA ASN A 59 5.928 -8.088 4.376 1.00 0.00 H new ATOM 0 HB2 ASN A 59 7.470 -8.589 6.908 1.00 0.00 H new ATOM 0 HB3 ASN A 59 6.191 -9.706 6.478 1.00 0.00 H new ATOM 0 HD21 ASN A 59 9.730 -9.636 4.377 1.00 0.00 H new ATOM 0 HD22 ASN A 59 9.344 -8.408 5.587 1.00 0.00 H new ATOM 930 N SER A 60 4.788 -7.003 7.280 1.00 0.00 N ATOM 931 CA SER A 60 3.572 -6.766 8.056 1.00 0.00 C ATOM 932 C SER A 60 2.536 -5.990 7.240 1.00 0.00 C ATOM 933 O SER A 60 1.339 -6.262 7.328 1.00 0.00 O ATOM 934 CB SER A 60 3.901 -6.009 9.344 1.00 0.00 C ATOM 935 OG SER A 60 4.834 -6.730 10.135 1.00 0.00 O ATOM 0 H SER A 60 5.636 -6.631 7.708 1.00 0.00 H new ATOM 0 HA SER A 60 3.145 -7.736 8.312 1.00 0.00 H new ATOM 0 HB2 SER A 60 4.308 -5.028 9.099 1.00 0.00 H new ATOM 0 HB3 SER A 60 2.988 -5.842 9.915 1.00 0.00 H new ATOM 0 HG SER A 60 5.716 -6.700 9.709 1.00 0.00 H new ATOM 941 N PHE A 61 3.003 -5.035 6.441 1.00 0.00 N ATOM 942 CA PHE A 61 2.119 -4.258 5.581 1.00 0.00 C ATOM 943 C PHE A 61 1.402 -5.175 4.594 1.00 0.00 C ATOM 944 O PHE A 61 0.179 -5.123 4.454 1.00 0.00 O ATOM 945 CB PHE A 61 2.917 -3.184 4.829 1.00 0.00 C ATOM 946 CG PHE A 61 2.068 -2.260 3.997 1.00 0.00 C ATOM 947 CD1 PHE A 61 1.385 -1.209 4.587 1.00 0.00 C ATOM 948 CD2 PHE A 61 1.953 -2.445 2.627 1.00 0.00 C ATOM 949 CE1 PHE A 61 0.606 -0.358 3.826 1.00 0.00 C ATOM 950 CE2 PHE A 61 1.175 -1.597 1.861 1.00 0.00 C ATOM 951 CZ PHE A 61 0.499 -0.554 2.462 1.00 0.00 C ATOM 0 H PHE A 61 3.989 -4.781 6.372 1.00 0.00 H new ATOM 0 HA PHE A 61 1.372 -3.764 6.203 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.480 -2.592 5.551 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.645 -3.673 4.182 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.462 -1.053 5.653 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.478 -3.261 2.153 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.081 0.460 4.297 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.096 -1.750 0.795 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.113 0.108 1.867 1.00 0.00 H new ATOM 961 N ALA A 62 2.172 -6.031 3.928 1.00 0.00 N ATOM 962 CA ALA A 62 1.614 -6.984 2.973 1.00 0.00 C ATOM 963 C ALA A 62 0.707 -7.994 3.671 1.00 0.00 C ATOM 964 O ALA A 62 -0.311 -8.417 3.124 1.00 0.00 O ATOM 965 CB ALA A 62 2.731 -7.701 2.228 1.00 0.00 C ATOM 0 H ALA A 62 3.185 -6.084 4.032 1.00 0.00 H new ATOM 0 HA ALA A 62 1.011 -6.429 2.254 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.300 -8.408 1.519 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.336 -6.971 1.690 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.358 -8.237 2.940 1.00 0.00 H new ATOM 971 N ARG A 63 1.074 -8.366 4.893 1.00 0.00 N ATOM 972 CA ARG A 63 0.301 -9.326 5.670 1.00 0.00 C ATOM 973 C ARG A 63 -1.037 -8.732 6.100 1.00 0.00 C ATOM 974 O ARG A 63 -2.006 -9.456 6.314 1.00 0.00 O ATOM 975 CB ARG A 63 1.089 -9.790 6.898 1.00 0.00 C ATOM 976 CG ARG A 63 2.381 -10.510 6.555 1.00 0.00 C ATOM 977 CD ARG A 63 2.127 -11.704 5.654 1.00 0.00 C ATOM 978 NE ARG A 63 3.367 -12.327 5.195 1.00 0.00 N ATOM 979 CZ ARG A 63 3.509 -13.639 5.015 1.00 0.00 C ATOM 980 NH1 ARG A 63 2.518 -14.466 5.333 1.00 0.00 N ATOM 981 NH2 ARG A 63 4.646 -14.128 4.535 1.00 0.00 N ATOM 0 H ARG A 63 1.906 -8.015 5.368 1.00 0.00 H new ATOM 0 HA ARG A 63 0.106 -10.189 5.033 1.00 0.00 H new ATOM 0 HB2 ARG A 63 1.319 -8.925 7.520 1.00 0.00 H new ATOM 0 HB3 ARG A 63 0.461 -10.452 7.493 1.00 0.00 H new ATOM 0 HG2 ARG A 63 3.064 -9.819 6.062 1.00 0.00 H new ATOM 0 HG3 ARG A 63 2.869 -10.841 7.472 1.00 0.00 H new ATOM 0 HD2 ARG A 63 1.530 -12.441 6.191 1.00 0.00 H new ATOM 0 HD3 ARG A 63 1.541 -11.387 4.791 1.00 0.00 H new ATOM 0 HE ARG A 63 4.167 -11.724 5.002 1.00 0.00 H new ATOM 0 HH11 ARG A 63 1.648 -14.096 5.715 1.00 0.00 H new ATOM 0 HH12 ARG A 63 2.628 -15.471 5.195 1.00 0.00 H new ATOM 0 HH21 ARG A 63 5.414 -13.498 4.303 1.00 0.00 H new ATOM 0 HH22 ARG A 63 4.751 -15.133 4.398 1.00 0.00 H new ATOM 995 N ALA A 64 -1.083 -7.413 6.228 1.00 0.00 N ATOM 996 CA ALA A 64 -2.319 -6.726 6.572 1.00 0.00 C ATOM 997 C ALA A 64 -3.166 -6.496 5.327 1.00 0.00 C ATOM 998 O ALA A 64 -4.393 -6.611 5.367 1.00 0.00 O ATOM 999 CB ALA A 64 -2.019 -5.407 7.265 1.00 0.00 C ATOM 0 H ALA A 64 -0.279 -6.798 6.099 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.884 -7.355 7.260 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.954 -4.906 7.515 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.453 -5.596 8.177 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.434 -4.772 6.600 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.498 -6.187 4.222 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.163 -5.938 2.949 1.00 0.00 C ATOM 1007 C LEU A 65 -3.984 -7.151 2.513 1.00 0.00 C ATOM 1008 O LEU A 65 -5.209 -7.077 2.398 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.120 -5.595 1.878 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.673 -5.318 0.476 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.544 -4.074 0.477 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.537 -5.166 -0.524 1.00 0.00 C ATOM 0 H LEU A 65 -1.482 -6.102 4.183 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.844 -5.096 3.074 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.562 -4.719 2.208 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.410 -6.419 1.812 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.288 -6.168 0.179 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.926 -3.896 -0.528 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.379 -4.215 1.163 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.953 -3.216 0.797 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.948 -4.970 -1.514 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.898 -4.335 -0.225 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.950 -6.084 -0.550 1.00 0.00 H new ATOM 1024 N GLN A 66 -3.305 -8.275 2.308 1.00 0.00 N ATOM 1025 CA GLN A 66 -3.953 -9.498 1.839 1.00 0.00 C ATOM 1026 C GLN A 66 -4.968 -10.028 2.847 1.00 0.00 C ATOM 1027 O GLN A 66 -5.846 -10.811 2.497 1.00 0.00 O ATOM 1028 CB GLN A 66 -2.916 -10.585 1.530 1.00 0.00 C ATOM 1029 CG GLN A 66 -2.459 -10.619 0.075 1.00 0.00 C ATOM 1030 CD GLN A 66 -1.496 -9.505 -0.294 1.00 0.00 C ATOM 1031 OE1 GLN A 66 -1.519 -8.420 0.275 1.00 0.00 O ATOM 1032 NE2 GLN A 66 -0.642 -9.771 -1.264 1.00 0.00 N ATOM 0 H GLN A 66 -2.300 -8.366 2.460 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.486 -9.241 0.924 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -2.046 -10.433 2.169 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -3.336 -11.557 1.790 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -1.982 -11.579 -0.123 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -3.334 -10.558 -0.572 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -0.652 -10.686 -1.715 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.028 -9.062 -1.563 1.00 0.00 H new ATOM 1041 N SER A 67 -4.850 -9.597 4.092 1.00 0.00 N ATOM 1042 CA SER A 67 -5.749 -10.056 5.139 1.00 0.00 C ATOM 1043 C SER A 67 -7.015 -9.200 5.186 1.00 0.00 C ATOM 1044 O SER A 67 -8.023 -9.602 5.763 1.00 0.00 O ATOM 1045 CB SER A 67 -5.037 -10.024 6.494 1.00 0.00 C ATOM 1046 OG SER A 67 -5.817 -10.630 7.514 1.00 0.00 O ATOM 0 H SER A 67 -4.142 -8.931 4.402 1.00 0.00 H new ATOM 0 HA SER A 67 -6.041 -11.082 4.915 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.080 -10.539 6.414 1.00 0.00 H new ATOM 0 HB3 SER A 67 -4.821 -8.991 6.767 1.00 0.00 H new ATOM 0 HG SER A 67 -6.769 -10.498 7.320 1.00 0.00 H new ATOM 1052 N SER A 68 -6.964 -8.024 4.576 1.00 0.00 N ATOM 1053 CA SER A 68 -8.099 -7.111 4.596 1.00 0.00 C ATOM 1054 C SER A 68 -8.824 -7.104 3.252 1.00 0.00 C ATOM 1055 O SER A 68 -10.021 -6.824 3.185 1.00 0.00 O ATOM 1056 CB SER A 68 -7.626 -5.702 4.957 1.00 0.00 C ATOM 1057 OG SER A 68 -6.883 -5.718 6.167 1.00 0.00 O ATOM 0 H SER A 68 -6.152 -7.680 4.063 1.00 0.00 H new ATOM 0 HA SER A 68 -8.805 -7.455 5.352 1.00 0.00 H new ATOM 0 HB2 SER A 68 -7.010 -5.302 4.151 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.485 -5.040 5.061 1.00 0.00 H new ATOM 0 HG SER A 68 -5.971 -6.027 5.987 1.00 0.00 H new ATOM 1063 N ILE A 69 -8.098 -7.428 2.189 1.00 0.00 N ATOM 1064 CA ILE A 69 -8.672 -7.447 0.846 1.00 0.00 C ATOM 1065 C ILE A 69 -9.311 -8.806 0.551 1.00 0.00 C ATOM 1066 O ILE A 69 -9.899 -9.027 -0.508 1.00 0.00 O ATOM 1067 CB ILE A 69 -7.591 -7.130 -0.217 1.00 0.00 C ATOM 1068 CG1 ILE A 69 -8.229 -6.848 -1.582 1.00 0.00 C ATOM 1069 CG2 ILE A 69 -6.588 -8.274 -0.321 1.00 0.00 C ATOM 1070 CD1 ILE A 69 -7.231 -6.465 -2.651 1.00 0.00 C ATOM 0 H ILE A 69 -7.111 -7.681 2.229 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.444 -6.679 0.800 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.060 -6.233 0.100 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -8.775 -7.733 -1.908 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -8.958 -6.045 -1.474 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.837 -8.032 -1.073 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.102 -8.420 0.644 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -7.107 -9.188 -0.608 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.755 -6.281 -3.589 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -6.701 -5.562 -2.348 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -6.516 -7.276 -2.788 1.00 0.00 H new ATOM 1442 N SER B 8 5.705 10.584 -16.783 1.00 0.00 N ATOM 1443 CA SER B 8 6.150 11.953 -16.616 1.00 0.00 C ATOM 1444 C SER B 8 6.770 12.141 -15.235 1.00 0.00 C ATOM 1445 O SER B 8 6.064 12.224 -14.229 1.00 0.00 O ATOM 1446 CB SER B 8 4.970 12.900 -16.833 1.00 0.00 C ATOM 1447 OG SER B 8 3.736 12.239 -16.586 1.00 0.00 O ATOM 0 HA SER B 8 6.917 12.183 -17.355 1.00 0.00 H new ATOM 0 HB2 SER B 8 5.064 13.762 -16.172 1.00 0.00 H new ATOM 0 HB3 SER B 8 4.986 13.279 -17.855 1.00 0.00 H new ATOM 0 HG SER B 8 3.881 11.270 -16.573 1.00 0.00 H new ATOM 1453 N ASP B 9 8.098 12.187 -15.209 1.00 0.00 N ATOM 1454 CA ASP B 9 8.872 12.246 -13.969 1.00 0.00 C ATOM 1455 C ASP B 9 8.381 13.360 -13.052 1.00 0.00 C ATOM 1456 O ASP B 9 8.083 13.120 -11.884 1.00 0.00 O ATOM 1457 CB ASP B 9 10.360 12.454 -14.278 1.00 0.00 C ATOM 1458 CG ASP B 9 10.921 11.400 -15.212 1.00 0.00 C ATOM 1459 OD1 ASP B 9 10.751 11.542 -16.444 1.00 0.00 O ATOM 1460 OD2 ASP B 9 11.542 10.429 -14.728 1.00 0.00 O ATOM 0 H ASP B 9 8.673 12.184 -16.051 1.00 0.00 H new ATOM 0 HA ASP B 9 8.735 11.295 -13.454 1.00 0.00 H new ATOM 0 HB2 ASP B 9 10.499 13.439 -14.724 1.00 0.00 H new ATOM 0 HB3 ASP B 9 10.925 12.444 -13.346 1.00 0.00 H new ATOM 1465 N GLU B 10 8.289 14.574 -13.589 1.00 0.00 N ATOM 1466 CA GLU B 10 7.851 15.731 -12.808 1.00 0.00 C ATOM 1467 C GLU B 10 6.454 15.509 -12.227 1.00 0.00 C ATOM 1468 O GLU B 10 6.171 15.911 -11.100 1.00 0.00 O ATOM 1469 CB GLU B 10 7.847 17.010 -13.655 1.00 0.00 C ATOM 1470 CG GLU B 10 9.158 17.298 -14.370 1.00 0.00 C ATOM 1471 CD GLU B 10 9.266 16.583 -15.699 1.00 0.00 C ATOM 1472 OE1 GLU B 10 9.742 15.432 -15.726 1.00 0.00 O ATOM 1473 OE2 GLU B 10 8.860 17.169 -16.725 1.00 0.00 O ATOM 0 H GLU B 10 8.512 14.784 -14.562 1.00 0.00 H new ATOM 0 HA GLU B 10 8.564 15.849 -11.992 1.00 0.00 H new ATOM 0 HB2 GLU B 10 7.052 16.937 -14.397 1.00 0.00 H new ATOM 0 HB3 GLU B 10 7.605 17.856 -13.011 1.00 0.00 H new ATOM 0 HG2 GLU B 10 9.251 18.372 -14.531 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.989 16.998 -13.732 1.00 0.00 H new ATOM 1480 N GLN B 11 5.592 14.863 -13.002 1.00 0.00 N ATOM 1481 CA GLN B 11 4.218 14.611 -12.585 1.00 0.00 C ATOM 1482 C GLN B 11 4.177 13.572 -11.466 1.00 0.00 C ATOM 1483 O GLN B 11 3.508 13.766 -10.449 1.00 0.00 O ATOM 1484 CB GLN B 11 3.387 14.139 -13.783 1.00 0.00 C ATOM 1485 CG GLN B 11 1.922 13.880 -13.469 1.00 0.00 C ATOM 1486 CD GLN B 11 1.169 15.125 -13.039 1.00 0.00 C ATOM 1487 OE1 GLN B 11 1.581 16.279 -13.541 1.00 0.00 O flip ATOM 1488 NE2 GLN B 11 0.218 15.049 -12.263 1.00 0.00 N flip ATOM 0 H GLN B 11 5.822 14.502 -13.928 1.00 0.00 H new ATOM 0 HA GLN B 11 3.793 15.539 -12.203 1.00 0.00 H new ATOM 0 HB2 GLN B 11 3.450 14.889 -14.571 1.00 0.00 H new ATOM 0 HB3 GLN B 11 3.829 13.224 -14.178 1.00 0.00 H new ATOM 0 HG2 GLN B 11 1.438 13.458 -14.350 1.00 0.00 H new ATOM 0 HG3 GLN B 11 1.854 13.132 -12.679 1.00 0.00 H new ATOM 0 HE21 GLN B 11 -0.070 14.142 -11.897 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -0.282 15.893 -11.985 1.00 0.00 H new ATOM 1497 N VAL B 12 4.906 12.478 -11.655 1.00 0.00 N ATOM 1498 CA VAL B 12 4.981 11.422 -10.652 1.00 0.00 C ATOM 1499 C VAL B 12 5.628 11.946 -9.373 1.00 0.00 C ATOM 1500 O VAL B 12 5.147 11.687 -8.269 1.00 0.00 O ATOM 1501 CB VAL B 12 5.778 10.203 -11.170 1.00 0.00 C ATOM 1502 CG1 VAL B 12 5.854 9.110 -10.111 1.00 0.00 C ATOM 1503 CG2 VAL B 12 5.157 9.658 -12.448 1.00 0.00 C ATOM 0 H VAL B 12 5.455 12.299 -12.496 1.00 0.00 H new ATOM 0 HA VAL B 12 3.961 11.102 -10.440 1.00 0.00 H new ATOM 0 HB VAL B 12 6.792 10.536 -11.391 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.420 8.264 -10.501 1.00 0.00 H new ATOM 0 HG12 VAL B 12 6.350 9.499 -9.222 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.847 8.784 -9.852 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.733 8.801 -12.796 1.00 0.00 H new ATOM 0 HG22 VAL B 12 4.130 9.349 -12.251 1.00 0.00 H new ATOM 0 HG23 VAL B 12 5.162 10.433 -13.214 1.00 0.00 H new ATOM 1513 N GLU B 13 6.712 12.698 -9.537 1.00 0.00 N ATOM 1514 CA GLU B 13 7.423 13.294 -8.414 1.00 0.00 C ATOM 1515 C GLU B 13 6.492 14.232 -7.651 1.00 0.00 C ATOM 1516 O GLU B 13 6.436 14.200 -6.421 1.00 0.00 O ATOM 1517 CB GLU B 13 8.661 14.044 -8.929 1.00 0.00 C ATOM 1518 CG GLU B 13 9.678 14.423 -7.860 1.00 0.00 C ATOM 1519 CD GLU B 13 9.235 15.578 -6.987 1.00 0.00 C ATOM 1520 OE1 GLU B 13 8.906 16.650 -7.535 1.00 0.00 O ATOM 1521 OE2 GLU B 13 9.213 15.420 -5.751 1.00 0.00 O ATOM 0 H GLU B 13 7.120 12.910 -10.448 1.00 0.00 H new ATOM 0 HA GLU B 13 7.753 12.512 -7.730 1.00 0.00 H new ATOM 0 HB2 GLU B 13 9.157 13.425 -9.677 1.00 0.00 H new ATOM 0 HB3 GLU B 13 8.332 14.952 -9.434 1.00 0.00 H new ATOM 0 HG2 GLU B 13 9.871 13.555 -7.230 1.00 0.00 H new ATOM 0 HG3 GLU B 13 10.620 14.683 -8.342 1.00 0.00 H new ATOM 1528 N GLN B 14 5.747 15.047 -8.388 1.00 0.00 N ATOM 1529 CA GLN B 14 4.809 15.985 -7.785 1.00 0.00 C ATOM 1530 C GLN B 14 3.776 15.251 -6.942 1.00 0.00 C ATOM 1531 O GLN B 14 3.559 15.595 -5.782 1.00 0.00 O ATOM 1532 CB GLN B 14 4.105 16.811 -8.861 1.00 0.00 C ATOM 1533 CG GLN B 14 3.148 17.846 -8.298 1.00 0.00 C ATOM 1534 CD GLN B 14 2.536 18.714 -9.374 1.00 0.00 C ATOM 1535 OE1 GLN B 14 3.087 19.756 -9.732 1.00 0.00 O ATOM 1536 NE2 GLN B 14 1.400 18.294 -9.900 1.00 0.00 N ATOM 0 H GLN B 14 5.775 15.077 -9.407 1.00 0.00 H new ATOM 0 HA GLN B 14 5.376 16.655 -7.139 1.00 0.00 H new ATOM 0 HB2 GLN B 14 4.855 17.315 -9.471 1.00 0.00 H new ATOM 0 HB3 GLN B 14 3.555 16.140 -9.522 1.00 0.00 H new ATOM 0 HG2 GLN B 14 2.354 17.341 -7.748 1.00 0.00 H new ATOM 0 HG3 GLN B 14 3.679 18.477 -7.585 1.00 0.00 H new ATOM 0 HE21 GLN B 14 0.978 17.425 -9.574 1.00 0.00 H new ATOM 0 HE22 GLN B 14 0.945 18.839 -10.632 1.00 0.00 H new ATOM 1545 N LEU B 15 3.156 14.232 -7.528 1.00 0.00 N ATOM 1546 CA LEU B 15 2.129 13.462 -6.838 1.00 0.00 C ATOM 1547 C LEU B 15 2.711 12.763 -5.611 1.00 0.00 C ATOM 1548 O LEU B 15 2.120 12.791 -4.531 1.00 0.00 O ATOM 1549 CB LEU B 15 1.506 12.436 -7.791 1.00 0.00 C ATOM 1550 CG LEU B 15 0.330 11.641 -7.218 1.00 0.00 C ATOM 1551 CD1 LEU B 15 -0.819 12.568 -6.853 1.00 0.00 C ATOM 1552 CD2 LEU B 15 -0.130 10.586 -8.212 1.00 0.00 C ATOM 0 H LEU B 15 3.348 13.920 -8.480 1.00 0.00 H new ATOM 0 HA LEU B 15 1.351 14.148 -6.504 1.00 0.00 H new ATOM 0 HB2 LEU B 15 1.169 12.955 -8.688 1.00 0.00 H new ATOM 0 HB3 LEU B 15 2.281 11.735 -8.101 1.00 0.00 H new ATOM 0 HG LEU B 15 0.664 11.139 -6.310 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -1.644 11.982 -6.448 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -0.483 13.287 -6.106 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -1.154 13.100 -7.743 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -0.967 10.029 -7.790 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -0.445 11.070 -9.136 1.00 0.00 H new ATOM 0 HD23 LEU B 15 0.692 9.902 -8.423 1.00 0.00 H new ATOM 1564 N LEU B 16 3.881 12.155 -5.782 1.00 0.00 N ATOM 1565 CA LEU B 16 4.557 11.460 -4.691 1.00 0.00 C ATOM 1566 C LEU B 16 4.874 12.423 -3.551 1.00 0.00 C ATOM 1567 O LEU B 16 4.580 12.145 -2.386 1.00 0.00 O ATOM 1568 CB LEU B 16 5.848 10.808 -5.196 1.00 0.00 C ATOM 1569 CG LEU B 16 6.641 10.020 -4.150 1.00 0.00 C ATOM 1570 CD1 LEU B 16 5.849 8.809 -3.680 1.00 0.00 C ATOM 1571 CD2 LEU B 16 7.988 9.594 -4.714 1.00 0.00 C ATOM 0 H LEU B 16 4.383 12.130 -6.670 1.00 0.00 H new ATOM 0 HA LEU B 16 3.889 10.685 -4.316 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.598 10.137 -6.018 1.00 0.00 H new ATOM 0 HB3 LEU B 16 6.492 11.587 -5.604 1.00 0.00 H new ATOM 0 HG LEU B 16 6.817 10.667 -3.291 1.00 0.00 H new ATOM 0 HD11 LEU B 16 6.429 8.261 -2.937 1.00 0.00 H new ATOM 0 HD12 LEU B 16 4.909 9.139 -3.237 1.00 0.00 H new ATOM 0 HD13 LEU B 16 5.641 8.158 -4.529 1.00 0.00 H new ATOM 0 HD21 LEU B 16 8.539 9.035 -3.958 1.00 0.00 H new ATOM 0 HD22 LEU B 16 7.833 8.964 -5.590 1.00 0.00 H new ATOM 0 HD23 LEU B 16 8.559 10.478 -4.999 1.00 0.00 H new ATOM 1583 N ALA B 17 5.466 13.559 -3.895 1.00 0.00 N ATOM 1584 CA ALA B 17 5.825 14.559 -2.903 1.00 0.00 C ATOM 1585 C ALA B 17 4.583 15.141 -2.248 1.00 0.00 C ATOM 1586 O ALA B 17 4.586 15.417 -1.054 1.00 0.00 O ATOM 1587 CB ALA B 17 6.659 15.663 -3.527 1.00 0.00 C ATOM 0 H ALA B 17 5.707 13.809 -4.854 1.00 0.00 H new ATOM 0 HA ALA B 17 6.422 14.069 -2.134 1.00 0.00 H new ATOM 0 HB1 ALA B 17 6.916 16.400 -2.766 1.00 0.00 H new ATOM 0 HB2 ALA B 17 7.572 15.238 -3.943 1.00 0.00 H new ATOM 0 HB3 ALA B 17 6.089 16.145 -4.321 1.00 0.00 H new ATOM 1593 N GLU B 18 3.526 15.324 -3.034 1.00 0.00 N ATOM 1594 CA GLU B 18 2.265 15.843 -2.518 1.00 0.00 C ATOM 1595 C GLU B 18 1.709 14.919 -1.441 1.00 0.00 C ATOM 1596 O GLU B 18 1.285 15.376 -0.390 1.00 0.00 O ATOM 1597 CB GLU B 18 1.243 16.007 -3.647 1.00 0.00 C ATOM 1598 CG GLU B 18 -0.091 16.584 -3.193 1.00 0.00 C ATOM 1599 CD GLU B 18 0.008 18.028 -2.738 1.00 0.00 C ATOM 1600 OE1 GLU B 18 0.367 18.272 -1.566 1.00 0.00 O ATOM 1601 OE2 GLU B 18 -0.281 18.930 -3.551 1.00 0.00 O ATOM 0 H GLU B 18 3.519 15.120 -4.033 1.00 0.00 H new ATOM 0 HA GLU B 18 2.456 16.822 -2.078 1.00 0.00 H new ATOM 0 HB2 GLU B 18 1.665 16.655 -4.415 1.00 0.00 H new ATOM 0 HB3 GLU B 18 1.069 15.036 -4.110 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -0.807 16.516 -4.012 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -0.483 15.978 -2.376 1.00 0.00 H new ATOM 1608 N LEU B 19 1.731 13.618 -1.704 1.00 0.00 N ATOM 1609 CA LEU B 19 1.218 12.636 -0.753 1.00 0.00 C ATOM 1610 C LEU B 19 2.012 12.671 0.556 1.00 0.00 C ATOM 1611 O LEU B 19 1.436 12.645 1.648 1.00 0.00 O ATOM 1612 CB LEU B 19 1.260 11.232 -1.362 1.00 0.00 C ATOM 1613 CG LEU B 19 0.404 11.044 -2.620 1.00 0.00 C ATOM 1614 CD1 LEU B 19 0.534 9.622 -3.147 1.00 0.00 C ATOM 1615 CD2 LEU B 19 -1.051 11.373 -2.330 1.00 0.00 C ATOM 0 H LEU B 19 2.098 13.217 -2.567 1.00 0.00 H new ATOM 0 HA LEU B 19 0.182 12.892 -0.529 1.00 0.00 H new ATOM 0 HB2 LEU B 19 2.294 10.989 -1.605 1.00 0.00 H new ATOM 0 HB3 LEU B 19 0.933 10.516 -0.608 1.00 0.00 H new ATOM 0 HG LEU B 19 0.765 11.730 -3.386 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -0.080 9.507 -4.040 1.00 0.00 H new ATOM 0 HD12 LEU B 19 1.576 9.420 -3.395 1.00 0.00 H new ATOM 0 HD13 LEU B 19 0.200 8.919 -2.384 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -1.643 11.234 -3.235 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -1.424 10.713 -1.547 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -1.131 12.409 -2.000 1.00 0.00 H new ATOM 1627 N LEU B 20 3.333 12.748 0.442 1.00 0.00 N ATOM 1628 CA LEU B 20 4.190 12.844 1.616 1.00 0.00 C ATOM 1629 C LEU B 20 3.966 14.183 2.313 1.00 0.00 C ATOM 1630 O LEU B 20 3.960 14.271 3.546 1.00 0.00 O ATOM 1631 CB LEU B 20 5.663 12.696 1.224 1.00 0.00 C ATOM 1632 CG LEU B 20 6.656 12.719 2.391 1.00 0.00 C ATOM 1633 CD1 LEU B 20 6.371 11.579 3.358 1.00 0.00 C ATOM 1634 CD2 LEU B 20 8.082 12.632 1.873 1.00 0.00 C ATOM 0 H LEU B 20 3.832 12.746 -0.448 1.00 0.00 H new ATOM 0 HA LEU B 20 3.934 12.035 2.301 1.00 0.00 H new ATOM 0 HB2 LEU B 20 5.785 11.758 0.683 1.00 0.00 H new ATOM 0 HB3 LEU B 20 5.921 13.499 0.533 1.00 0.00 H new ATOM 0 HG LEU B 20 6.538 13.661 2.927 1.00 0.00 H new ATOM 0 HD11 LEU B 20 7.086 11.612 4.180 1.00 0.00 H new ATOM 0 HD12 LEU B 20 5.360 11.681 3.752 1.00 0.00 H new ATOM 0 HD13 LEU B 20 6.462 10.627 2.835 1.00 0.00 H new ATOM 0 HD21 LEU B 20 8.776 12.649 2.713 1.00 0.00 H new ATOM 0 HD22 LEU B 20 8.211 11.704 1.315 1.00 0.00 H new ATOM 0 HD23 LEU B 20 8.284 13.480 1.218 1.00 0.00 H new ATOM 1646 N ASN B 21 3.766 15.219 1.509 1.00 0.00 N ATOM 1647 CA ASN B 21 3.481 16.549 2.022 1.00 0.00 C ATOM 1648 C ASN B 21 2.136 16.557 2.736 1.00 0.00 C ATOM 1649 O ASN B 21 1.946 17.292 3.689 1.00 0.00 O ATOM 1650 CB ASN B 21 3.485 17.573 0.884 1.00 0.00 C ATOM 1651 CG ASN B 21 3.405 19.006 1.374 1.00 0.00 C ATOM 1652 OD1 ASN B 21 2.325 19.573 1.503 1.00 0.00 O ATOM 1653 ND2 ASN B 21 4.555 19.604 1.629 1.00 0.00 N ATOM 0 H ASN B 21 3.797 15.161 0.491 1.00 0.00 H new ATOM 0 HA ASN B 21 4.259 16.823 2.735 1.00 0.00 H new ATOM 0 HB2 ASN B 21 4.392 17.447 0.293 1.00 0.00 H new ATOM 0 HB3 ASN B 21 2.643 17.374 0.221 1.00 0.00 H new ATOM 0 HD21 ASN B 21 4.566 20.573 1.946 1.00 0.00 H new ATOM 0 HD22 ASN B 21 5.431 19.096 1.509 1.00 0.00 H new ATOM 1660 N VAL B 22 1.211 15.725 2.263 1.00 0.00 N ATOM 1661 CA VAL B 22 -0.091 15.550 2.904 1.00 0.00 C ATOM 1662 C VAL B 22 0.071 15.033 4.330 1.00 0.00 C ATOM 1663 O VAL B 22 -0.612 15.493 5.251 1.00 0.00 O ATOM 1664 CB VAL B 22 -0.990 14.578 2.101 1.00 0.00 C ATOM 1665 CG1 VAL B 22 -2.169 14.098 2.936 1.00 0.00 C ATOM 1666 CG2 VAL B 22 -1.487 15.244 0.828 1.00 0.00 C ATOM 0 H VAL B 22 1.342 15.155 1.427 1.00 0.00 H new ATOM 0 HA VAL B 22 -0.572 16.528 2.930 1.00 0.00 H new ATOM 0 HB VAL B 22 -0.387 13.710 1.835 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -2.781 13.417 2.344 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -1.801 13.579 3.821 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -2.771 14.954 3.242 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -2.117 14.547 0.275 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -2.065 16.132 1.084 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -0.635 15.531 0.211 1.00 0.00 H new ATOM 1676 N LEU B 23 0.981 14.079 4.506 1.00 0.00 N ATOM 1677 CA LEU B 23 1.277 13.542 5.828 1.00 0.00 C ATOM 1678 C LEU B 23 1.720 14.677 6.753 1.00 0.00 C ATOM 1679 O LEU B 23 1.231 14.810 7.873 1.00 0.00 O ATOM 1680 CB LEU B 23 2.366 12.459 5.725 1.00 0.00 C ATOM 1681 CG LEU B 23 2.492 11.500 6.918 1.00 0.00 C ATOM 1682 CD1 LEU B 23 3.330 10.293 6.531 1.00 0.00 C ATOM 1683 CD2 LEU B 23 3.116 12.190 8.123 1.00 0.00 C ATOM 0 H LEU B 23 1.525 13.663 3.750 1.00 0.00 H new ATOM 0 HA LEU B 23 0.381 13.083 6.245 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.175 11.867 4.830 1.00 0.00 H new ATOM 0 HB3 LEU B 23 3.327 12.953 5.581 1.00 0.00 H new ATOM 0 HG LEU B 23 1.488 11.176 7.192 1.00 0.00 H new ATOM 0 HD11 LEU B 23 3.413 9.619 7.384 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.854 9.771 5.701 1.00 0.00 H new ATOM 0 HD13 LEU B 23 4.325 10.622 6.230 1.00 0.00 H new ATOM 0 HD21 LEU B 23 3.190 11.483 8.949 1.00 0.00 H new ATOM 0 HD22 LEU B 23 4.112 12.549 7.862 1.00 0.00 H new ATOM 0 HD23 LEU B 23 2.493 13.033 8.422 1.00 0.00 H new ATOM 1695 N GLU B 24 2.617 15.518 6.251 1.00 0.00 N ATOM 1696 CA GLU B 24 3.119 16.656 7.015 1.00 0.00 C ATOM 1697 C GLU B 24 2.100 17.801 7.044 1.00 0.00 C ATOM 1698 O GLU B 24 2.226 18.740 7.831 1.00 0.00 O ATOM 1699 CB GLU B 24 4.434 17.150 6.408 1.00 0.00 C ATOM 1700 CG GLU B 24 5.552 16.121 6.450 1.00 0.00 C ATOM 1701 CD GLU B 24 6.002 15.802 7.862 1.00 0.00 C ATOM 1702 OE1 GLU B 24 6.879 16.519 8.386 1.00 0.00 O ATOM 1703 OE2 GLU B 24 5.486 14.831 8.456 1.00 0.00 O ATOM 0 H GLU B 24 3.013 15.433 5.315 1.00 0.00 H new ATOM 0 HA GLU B 24 3.289 16.326 8.040 1.00 0.00 H new ATOM 0 HB2 GLU B 24 4.259 17.441 5.372 1.00 0.00 H new ATOM 0 HB3 GLU B 24 4.756 18.045 6.940 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.215 15.205 5.965 1.00 0.00 H new ATOM 0 HG3 GLU B 24 6.402 16.491 5.877 1.00 0.00 H new ATOM 1710 N LYS B 25 1.093 17.708 6.189 1.00 0.00 N ATOM 1711 CA LYS B 25 0.091 18.759 6.048 1.00 0.00 C ATOM 1712 C LYS B 25 -0.981 18.620 7.123 1.00 0.00 C ATOM 1713 O LYS B 25 -1.455 19.610 7.675 1.00 0.00 O ATOM 1714 CB LYS B 25 -0.540 18.682 4.653 1.00 0.00 C ATOM 1715 CG LYS B 25 -1.279 19.935 4.213 1.00 0.00 C ATOM 1716 CD LYS B 25 -1.817 19.789 2.792 1.00 0.00 C ATOM 1717 CE LYS B 25 -0.713 19.438 1.798 1.00 0.00 C ATOM 1718 NZ LYS B 25 -1.226 19.321 0.404 1.00 0.00 N ATOM 0 H LYS B 25 0.946 16.907 5.575 1.00 0.00 H new ATOM 0 HA LYS B 25 0.573 19.729 6.170 1.00 0.00 H new ATOM 0 HB2 LYS B 25 0.244 18.467 3.927 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -1.234 17.842 4.630 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.103 20.133 4.898 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -0.608 20.793 4.264 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -2.583 19.014 2.772 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -2.297 20.719 2.488 1.00 0.00 H new ATOM 0 HE2 LYS B 25 0.063 20.203 1.835 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -0.248 18.497 2.092 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -0.460 18.999 -0.222 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -2.006 18.634 0.378 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -1.570 20.248 0.082 1.00 0.00 H new ATOM 1732 N HIS B 26 -1.361 17.381 7.414 1.00 0.00 N ATOM 1733 CA HIS B 26 -2.366 17.115 8.441 1.00 0.00 C ATOM 1734 C HIS B 26 -1.699 16.714 9.753 1.00 0.00 C ATOM 1735 O HIS B 26 -2.268 16.903 10.826 1.00 0.00 O ATOM 1736 CB HIS B 26 -3.336 16.015 7.987 1.00 0.00 C ATOM 1737 CG HIS B 26 -4.257 16.429 6.875 1.00 0.00 C ATOM 1738 ND1 HIS B 26 -5.631 16.355 6.968 1.00 0.00 N ATOM 1739 CD2 HIS B 26 -3.995 16.910 5.635 1.00 0.00 C ATOM 1740 CE1 HIS B 26 -6.170 16.772 5.837 1.00 0.00 C ATOM 1741 NE2 HIS B 26 -5.202 17.115 5.014 1.00 0.00 N ATOM 0 H HIS B 26 -0.992 16.547 6.957 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.933 18.032 8.600 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.760 15.148 7.663 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.935 15.698 8.841 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.018 17.097 5.214 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.227 16.823 5.623 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.328 17.475 4.068 1.00 0.00 H new ATOM 1750 N LYS B 27 -0.488 16.169 9.642 1.00 0.00 N ATOM 1751 CA LYS B 27 0.292 15.706 10.791 1.00 0.00 C ATOM 1752 C LYS B 27 -0.422 14.602 11.560 1.00 0.00 C ATOM 1753 O LYS B 27 -1.232 14.854 12.455 1.00 0.00 O ATOM 1754 CB LYS B 27 0.674 16.863 11.721 1.00 0.00 C ATOM 1755 CG LYS B 27 1.763 17.760 11.150 1.00 0.00 C ATOM 1756 CD LYS B 27 2.952 16.940 10.665 1.00 0.00 C ATOM 1757 CE LYS B 27 4.127 17.816 10.258 1.00 0.00 C ATOM 1758 NZ LYS B 27 4.773 18.459 11.429 1.00 0.00 N ATOM 0 H LYS B 27 -0.017 16.035 8.747 1.00 0.00 H new ATOM 0 HA LYS B 27 1.213 15.282 10.391 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -0.212 17.464 11.925 1.00 0.00 H new ATOM 0 HB3 LYS B 27 1.010 16.457 12.675 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.360 18.345 10.324 1.00 0.00 H new ATOM 0 HG3 LYS B 27 2.092 18.468 11.911 1.00 0.00 H new ATOM 0 HD2 LYS B 27 3.266 16.257 11.454 1.00 0.00 H new ATOM 0 HD3 LYS B 27 2.647 16.327 9.817 1.00 0.00 H new ATOM 0 HE2 LYS B 27 4.862 17.212 9.725 1.00 0.00 H new ATOM 0 HE3 LYS B 27 3.783 18.585 9.566 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 5.663 18.907 11.132 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 4.137 19.181 11.823 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 4.972 17.740 12.154 1.00 0.00 H new ATOM 1772 N ALA B 28 -0.113 13.370 11.188 1.00 0.00 N ATOM 1773 CA ALA B 28 -0.671 12.202 11.843 1.00 0.00 C ATOM 1774 C ALA B 28 0.448 11.241 12.222 1.00 0.00 C ATOM 1775 O ALA B 28 1.494 11.218 11.569 1.00 0.00 O ATOM 1776 CB ALA B 28 -1.681 11.520 10.930 1.00 0.00 C ATOM 0 H ALA B 28 0.530 13.154 10.426 1.00 0.00 H new ATOM 0 HA ALA B 28 -1.188 12.512 12.751 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -2.093 10.645 11.433 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -2.486 12.216 10.694 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -1.188 11.211 10.009 1.00 0.00 H new ATOM 1782 N PRO B 29 0.261 10.458 13.297 1.00 0.00 N ATOM 1783 CA PRO B 29 1.243 9.459 13.721 1.00 0.00 C ATOM 1784 C PRO B 29 1.494 8.418 12.636 1.00 0.00 C ATOM 1785 O PRO B 29 0.559 7.962 11.978 1.00 0.00 O ATOM 1786 CB PRO B 29 0.604 8.808 14.956 1.00 0.00 C ATOM 1787 CG PRO B 29 -0.843 9.167 14.891 1.00 0.00 C ATOM 1788 CD PRO B 29 -0.912 10.491 14.187 1.00 0.00 C ATOM 0 HA PRO B 29 2.215 9.906 13.929 1.00 0.00 H new ATOM 0 HB2 PRO B 29 0.741 7.727 14.945 1.00 0.00 H new ATOM 0 HB3 PRO B 29 1.059 9.178 15.875 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -1.409 8.408 14.351 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -1.273 9.234 15.890 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -1.840 10.602 13.626 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -0.862 11.324 14.889 1.00 0.00 H new ATOM 1796 N THR B 30 2.756 8.043 12.459 1.00 0.00 N ATOM 1797 CA THR B 30 3.144 7.096 11.419 1.00 0.00 C ATOM 1798 C THR B 30 2.392 5.770 11.567 1.00 0.00 C ATOM 1799 O THR B 30 2.067 5.115 10.573 1.00 0.00 O ATOM 1800 CB THR B 30 4.664 6.848 11.449 1.00 0.00 C ATOM 1801 OG1 THR B 30 5.351 8.103 11.533 1.00 0.00 O ATOM 1802 CG2 THR B 30 5.121 6.102 10.203 1.00 0.00 C ATOM 0 H THR B 30 3.533 8.383 13.026 1.00 0.00 H new ATOM 0 HA THR B 30 2.877 7.534 10.457 1.00 0.00 H new ATOM 0 HB THR B 30 4.896 6.236 12.321 1.00 0.00 H new ATOM 0 HG1 THR B 30 6.318 7.946 11.554 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.198 5.940 10.250 1.00 0.00 H new ATOM 0 HG22 THR B 30 4.612 5.140 10.148 1.00 0.00 H new ATOM 0 HG23 THR B 30 4.881 6.691 9.318 1.00 0.00 H new ATOM 1810 N ASP B 31 2.098 5.394 12.812 1.00 0.00 N ATOM 1811 CA ASP B 31 1.306 4.197 13.097 1.00 0.00 C ATOM 1812 C ASP B 31 -0.041 4.275 12.387 1.00 0.00 C ATOM 1813 O ASP B 31 -0.481 3.320 11.744 1.00 0.00 O ATOM 1814 CB ASP B 31 1.072 4.050 14.606 1.00 0.00 C ATOM 1815 CG ASP B 31 2.358 3.968 15.401 1.00 0.00 C ATOM 1816 OD1 ASP B 31 2.915 5.035 15.743 1.00 0.00 O ATOM 1817 OD2 ASP B 31 2.810 2.842 15.705 1.00 0.00 O ATOM 0 H ASP B 31 2.398 5.904 13.643 1.00 0.00 H new ATOM 0 HA ASP B 31 1.860 3.331 12.735 1.00 0.00 H new ATOM 0 HB2 ASP B 31 0.486 4.898 14.961 1.00 0.00 H new ATOM 0 HB3 ASP B 31 0.480 3.153 14.790 1.00 0.00 H new ATOM 1822 N LEU B 32 -0.677 5.436 12.496 1.00 0.00 N ATOM 1823 CA LEU B 32 -1.970 5.662 11.874 1.00 0.00 C ATOM 1824 C LEU B 32 -1.817 5.768 10.363 1.00 0.00 C ATOM 1825 O LEU B 32 -2.620 5.219 9.617 1.00 0.00 O ATOM 1826 CB LEU B 32 -2.617 6.935 12.434 1.00 0.00 C ATOM 1827 CG LEU B 32 -4.005 7.261 11.880 1.00 0.00 C ATOM 1828 CD1 LEU B 32 -4.994 6.157 12.222 1.00 0.00 C ATOM 1829 CD2 LEU B 32 -4.494 8.593 12.423 1.00 0.00 C ATOM 0 H LEU B 32 -0.313 6.237 13.013 1.00 0.00 H new ATOM 0 HA LEU B 32 -2.618 4.815 12.101 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -2.690 6.840 13.517 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -1.956 7.778 12.232 1.00 0.00 H new ATOM 0 HG LEU B 32 -3.931 7.332 10.795 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -5.975 6.409 11.819 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -4.654 5.217 11.788 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -5.063 6.053 13.305 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -5.483 8.810 12.019 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -4.549 8.544 13.511 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -3.801 9.382 12.130 1.00 0.00 H new ATOM 1841 N SER B 33 -0.770 6.460 9.923 1.00 0.00 N ATOM 1842 CA SER B 33 -0.499 6.628 8.501 1.00 0.00 C ATOM 1843 C SER B 33 -0.390 5.273 7.799 1.00 0.00 C ATOM 1844 O SER B 33 -0.975 5.069 6.735 1.00 0.00 O ATOM 1845 CB SER B 33 0.790 7.427 8.304 1.00 0.00 C ATOM 1846 OG SER B 33 0.730 8.661 8.997 1.00 0.00 O ATOM 0 H SER B 33 -0.093 6.915 10.535 1.00 0.00 H new ATOM 0 HA SER B 33 -1.331 7.175 8.057 1.00 0.00 H new ATOM 0 HB2 SER B 33 1.641 6.846 8.660 1.00 0.00 H new ATOM 0 HB3 SER B 33 0.951 7.609 7.241 1.00 0.00 H new ATOM 0 HG SER B 33 0.833 8.502 9.958 1.00 0.00 H new ATOM 1852 N LEU B 34 0.349 4.350 8.409 1.00 0.00 N ATOM 1853 CA LEU B 34 0.507 3.007 7.861 1.00 0.00 C ATOM 1854 C LEU B 34 -0.836 2.285 7.807 1.00 0.00 C ATOM 1855 O LEU B 34 -1.151 1.612 6.827 1.00 0.00 O ATOM 1856 CB LEU B 34 1.497 2.200 8.704 1.00 0.00 C ATOM 1857 CG LEU B 34 2.933 2.730 8.711 1.00 0.00 C ATOM 1858 CD1 LEU B 34 3.794 1.923 9.670 1.00 0.00 C ATOM 1859 CD2 LEU B 34 3.525 2.693 7.311 1.00 0.00 C ATOM 0 H LEU B 34 0.848 4.508 9.284 1.00 0.00 H new ATOM 0 HA LEU B 34 0.896 3.098 6.847 1.00 0.00 H new ATOM 0 HB2 LEU B 34 1.134 2.169 9.731 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.508 1.173 8.338 1.00 0.00 H new ATOM 0 HG LEU B 34 2.913 3.766 9.050 1.00 0.00 H new ATOM 0 HD11 LEU B 34 4.812 2.314 9.662 1.00 0.00 H new ATOM 0 HD12 LEU B 34 3.384 1.998 10.677 1.00 0.00 H new ATOM 0 HD13 LEU B 34 3.804 0.878 9.359 1.00 0.00 H new ATOM 0 HD21 LEU B 34 4.546 3.074 7.338 1.00 0.00 H new ATOM 0 HD22 LEU B 34 3.530 1.666 6.945 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.924 3.312 6.645 1.00 0.00 H new ATOM 1871 N MET B 35 -1.627 2.443 8.863 1.00 0.00 N ATOM 1872 CA MET B 35 -2.940 1.815 8.941 1.00 0.00 C ATOM 1873 C MET B 35 -3.872 2.375 7.865 1.00 0.00 C ATOM 1874 O MET B 35 -4.600 1.628 7.208 1.00 0.00 O ATOM 1875 CB MET B 35 -3.539 2.025 10.336 1.00 0.00 C ATOM 1876 CG MET B 35 -4.880 1.338 10.543 1.00 0.00 C ATOM 1877 SD MET B 35 -5.494 1.498 12.235 1.00 0.00 S ATOM 1878 CE MET B 35 -7.061 0.639 12.106 1.00 0.00 C ATOM 0 H MET B 35 -1.380 3.003 9.679 1.00 0.00 H new ATOM 0 HA MET B 35 -2.826 0.745 8.765 1.00 0.00 H new ATOM 0 HB2 MET B 35 -2.835 1.657 11.082 1.00 0.00 H new ATOM 0 HB3 MET B 35 -3.659 3.094 10.512 1.00 0.00 H new ATOM 0 HG2 MET B 35 -5.611 1.762 9.854 1.00 0.00 H new ATOM 0 HG3 MET B 35 -4.784 0.281 10.294 1.00 0.00 H new ATOM 0 HE1 MET B 35 -7.563 0.651 13.073 1.00 0.00 H new ATOM 0 HE2 MET B 35 -7.688 1.135 11.365 1.00 0.00 H new ATOM 0 HE3 MET B 35 -6.886 -0.393 11.801 1.00 0.00 H new ATOM 1888 N VAL B 36 -3.830 3.691 7.680 1.00 0.00 N ATOM 1889 CA VAL B 36 -4.641 4.349 6.662 1.00 0.00 C ATOM 1890 C VAL B 36 -4.217 3.907 5.266 1.00 0.00 C ATOM 1891 O VAL B 36 -5.059 3.535 4.454 1.00 0.00 O ATOM 1892 CB VAL B 36 -4.560 5.891 6.769 1.00 0.00 C ATOM 1893 CG1 VAL B 36 -5.335 6.558 5.642 1.00 0.00 C ATOM 1894 CG2 VAL B 36 -5.087 6.359 8.115 1.00 0.00 C ATOM 0 H VAL B 36 -3.242 4.323 8.223 1.00 0.00 H new ATOM 0 HA VAL B 36 -5.675 4.051 6.835 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.512 6.179 6.681 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -5.262 7.641 5.741 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -4.917 6.252 4.683 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -6.382 6.259 5.694 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -5.023 7.446 8.173 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -6.127 6.051 8.226 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -4.490 5.917 8.913 1.00 0.00 H new ATOM 1904 N LEU B 37 -2.913 3.929 5.001 1.00 0.00 N ATOM 1905 CA LEU B 37 -2.384 3.506 3.702 1.00 0.00 C ATOM 1906 C LEU B 37 -2.748 2.054 3.413 1.00 0.00 C ATOM 1907 O LEU B 37 -3.079 1.704 2.281 1.00 0.00 O ATOM 1908 CB LEU B 37 -0.862 3.677 3.650 1.00 0.00 C ATOM 1909 CG LEU B 37 -0.359 5.122 3.707 1.00 0.00 C ATOM 1910 CD1 LEU B 37 1.162 5.153 3.729 1.00 0.00 C ATOM 1911 CD2 LEU B 37 -0.890 5.922 2.525 1.00 0.00 C ATOM 0 H LEU B 37 -2.202 4.234 5.666 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.836 4.141 2.940 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.423 3.125 4.481 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.493 3.218 2.733 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.729 5.579 4.625 1.00 0.00 H new ATOM 0 HD11 LEU B 37 1.504 6.187 3.770 1.00 0.00 H new ATOM 0 HD12 LEU B 37 1.524 4.616 4.606 1.00 0.00 H new ATOM 0 HD13 LEU B 37 1.549 4.678 2.827 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -0.521 6.946 2.584 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -0.550 5.467 1.595 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -1.980 5.927 2.549 1.00 0.00 H new ATOM 1923 N GLY B 38 -2.692 1.220 4.446 1.00 0.00 N ATOM 1924 CA GLY B 38 -3.055 -0.175 4.302 1.00 0.00 C ATOM 1925 C GLY B 38 -4.481 -0.346 3.820 1.00 0.00 C ATOM 1926 O GLY B 38 -4.725 -0.973 2.789 1.00 0.00 O ATOM 0 H GLY B 38 -2.400 1.489 5.385 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.375 -0.655 3.598 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.933 -0.682 5.259 1.00 0.00 H new ATOM 1930 N ASN B 39 -5.422 0.228 4.560 1.00 0.00 N ATOM 1931 CA ASN B 39 -6.836 0.161 4.198 1.00 0.00 C ATOM 1932 C ASN B 39 -7.094 0.881 2.879 1.00 0.00 C ATOM 1933 O ASN B 39 -7.968 0.487 2.107 1.00 0.00 O ATOM 1934 CB ASN B 39 -7.712 0.771 5.300 1.00 0.00 C ATOM 1935 CG ASN B 39 -7.759 -0.078 6.560 1.00 0.00 C ATOM 1936 OD1 ASN B 39 -6.814 -0.794 6.884 1.00 0.00 O ATOM 1937 ND2 ASN B 39 -8.867 -0.001 7.284 1.00 0.00 N ATOM 0 H ASN B 39 -5.232 0.747 5.417 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.097 -0.891 4.082 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -7.334 1.762 5.550 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -8.725 0.903 4.920 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -8.955 -0.547 8.141 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -9.631 0.604 6.984 1.00 0.00 H new ATOM 1944 N MET B 40 -6.321 1.933 2.630 1.00 0.00 N ATOM 1945 CA MET B 40 -6.426 2.711 1.397 1.00 0.00 C ATOM 1946 C MET B 40 -6.149 1.827 0.187 1.00 0.00 C ATOM 1947 O MET B 40 -7.001 1.680 -0.693 1.00 0.00 O ATOM 1948 CB MET B 40 -5.444 3.892 1.447 1.00 0.00 C ATOM 1949 CG MET B 40 -5.558 4.881 0.293 1.00 0.00 C ATOM 1950 SD MET B 40 -4.810 4.292 -1.236 1.00 0.00 S ATOM 1951 CE MET B 40 -4.932 5.763 -2.247 1.00 0.00 C ATOM 0 H MET B 40 -5.606 2.271 3.274 1.00 0.00 H new ATOM 0 HA MET B 40 -7.439 3.101 1.304 1.00 0.00 H new ATOM 0 HB2 MET B 40 -5.596 4.431 2.382 1.00 0.00 H new ATOM 0 HB3 MET B 40 -4.428 3.498 1.468 1.00 0.00 H new ATOM 0 HG2 MET B 40 -6.611 5.097 0.113 1.00 0.00 H new ATOM 0 HG3 MET B 40 -5.085 5.820 0.581 1.00 0.00 H new ATOM 0 HE1 MET B 40 -4.942 5.481 -3.300 1.00 0.00 H new ATOM 0 HE2 MET B 40 -5.852 6.295 -2.005 1.00 0.00 H new ATOM 0 HE3 MET B 40 -4.077 6.410 -2.053 1.00 0.00 H new ATOM 1961 N VAL B 41 -4.966 1.221 0.161 1.00 0.00 N ATOM 1962 CA VAL B 41 -4.579 0.341 -0.937 1.00 0.00 C ATOM 1963 C VAL B 41 -5.512 -0.866 -1.007 1.00 0.00 C ATOM 1964 O VAL B 41 -5.900 -1.301 -2.094 1.00 0.00 O ATOM 1965 CB VAL B 41 -3.115 -0.138 -0.796 1.00 0.00 C ATOM 1966 CG1 VAL B 41 -2.726 -1.047 -1.952 1.00 0.00 C ATOM 1967 CG2 VAL B 41 -2.167 1.051 -0.715 1.00 0.00 C ATOM 0 H VAL B 41 -4.258 1.323 0.888 1.00 0.00 H new ATOM 0 HA VAL B 41 -4.660 0.916 -1.860 1.00 0.00 H new ATOM 0 HB VAL B 41 -3.036 -0.709 0.129 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -1.692 -1.370 -1.829 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -3.380 -1.919 -1.965 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -2.827 -0.504 -2.892 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -1.142 0.693 -0.616 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -2.256 1.650 -1.621 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -2.423 1.662 0.150 1.00 0.00 H new ATOM 1977 N THR B 42 -5.879 -1.386 0.161 1.00 0.00 N ATOM 1978 CA THR B 42 -6.819 -2.496 0.251 1.00 0.00 C ATOM 1979 C THR B 42 -8.118 -2.170 -0.477 1.00 0.00 C ATOM 1980 O THR B 42 -8.518 -2.879 -1.401 1.00 0.00 O ATOM 1981 CB THR B 42 -7.136 -2.842 1.722 1.00 0.00 C ATOM 1982 OG1 THR B 42 -5.947 -3.270 2.390 1.00 0.00 O ATOM 1983 CG2 THR B 42 -8.192 -3.930 1.815 1.00 0.00 C ATOM 0 H THR B 42 -5.537 -1.053 1.062 1.00 0.00 H new ATOM 0 HA THR B 42 -6.347 -3.357 -0.222 1.00 0.00 H new ATOM 0 HB THR B 42 -7.524 -1.944 2.203 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.398 -2.489 2.612 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.394 -4.152 2.863 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.108 -3.590 1.333 1.00 0.00 H new ATOM 0 HG23 THR B 42 -7.832 -4.830 1.316 1.00 0.00 H new ATOM 1991 N ASN B 43 -8.752 -1.075 -0.075 1.00 0.00 N ATOM 1992 CA ASN B 43 -10.034 -0.677 -0.641 1.00 0.00 C ATOM 1993 C ASN B 43 -9.897 -0.360 -2.125 1.00 0.00 C ATOM 1994 O ASN B 43 -10.759 -0.723 -2.924 1.00 0.00 O ATOM 1995 CB ASN B 43 -10.594 0.538 0.108 1.00 0.00 C ATOM 1996 CG ASN B 43 -11.982 0.928 -0.365 1.00 0.00 C ATOM 1997 OD1 ASN B 43 -12.982 0.404 0.120 1.00 0.00 O ATOM 1998 ND2 ASN B 43 -12.054 1.864 -1.303 1.00 0.00 N ATOM 0 H ASN B 43 -8.397 -0.445 0.644 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.727 -1.511 -0.530 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -10.626 0.319 1.175 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -9.919 1.384 -0.023 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.963 2.173 -1.647 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -11.200 2.275 -1.680 1.00 0.00 H new ATOM 2005 N LEU B 44 -8.802 0.301 -2.486 1.00 0.00 N ATOM 2006 CA LEU B 44 -8.548 0.679 -3.873 1.00 0.00 C ATOM 2007 C LEU B 44 -8.563 -0.544 -4.786 1.00 0.00 C ATOM 2008 O LEU B 44 -9.319 -0.595 -5.759 1.00 0.00 O ATOM 2009 CB LEU B 44 -7.200 1.399 -3.986 1.00 0.00 C ATOM 2010 CG LEU B 44 -6.830 1.875 -5.394 1.00 0.00 C ATOM 2011 CD1 LEU B 44 -7.835 2.901 -5.895 1.00 0.00 C ATOM 2012 CD2 LEU B 44 -5.425 2.451 -5.408 1.00 0.00 C ATOM 0 H LEU B 44 -8.072 0.588 -1.834 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.343 1.354 -4.191 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.210 2.261 -3.319 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.418 0.729 -3.629 1.00 0.00 H new ATOM 0 HG LEU B 44 -6.857 1.016 -6.065 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.554 3.226 -6.897 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.828 2.453 -5.924 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.844 3.760 -5.224 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.178 2.784 -6.416 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -5.372 3.297 -4.723 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -4.715 1.686 -5.095 1.00 0.00 H new ATOM 2024 N ILE B 45 -7.752 -1.537 -4.454 1.00 0.00 N ATOM 2025 CA ILE B 45 -7.651 -2.742 -5.269 1.00 0.00 C ATOM 2026 C ILE B 45 -8.934 -3.567 -5.175 1.00 0.00 C ATOM 2027 O ILE B 45 -9.370 -4.171 -6.152 1.00 0.00 O ATOM 2028 CB ILE B 45 -6.445 -3.609 -4.841 1.00 0.00 C ATOM 2029 CG1 ILE B 45 -5.152 -2.797 -4.925 1.00 0.00 C ATOM 2030 CG2 ILE B 45 -6.341 -4.859 -5.706 1.00 0.00 C ATOM 2031 CD1 ILE B 45 -3.921 -3.559 -4.476 1.00 0.00 C ATOM 0 H ILE B 45 -7.154 -1.534 -3.627 1.00 0.00 H new ATOM 0 HA ILE B 45 -7.503 -2.426 -6.302 1.00 0.00 H new ATOM 0 HB ILE B 45 -6.598 -3.921 -3.808 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.008 -2.466 -5.953 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.256 -1.901 -4.313 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -5.485 -5.453 -5.386 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -7.251 -5.450 -5.603 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -6.212 -4.570 -6.749 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -3.044 -2.918 -4.564 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -4.042 -3.867 -3.438 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -3.790 -4.441 -5.103 1.00 0.00 H new ATOM 2043 N ASN B 46 -9.552 -3.556 -4.004 1.00 0.00 N ATOM 2044 CA ASN B 46 -10.750 -4.355 -3.751 1.00 0.00 C ATOM 2045 C ASN B 46 -11.973 -3.795 -4.490 1.00 0.00 C ATOM 2046 O ASN B 46 -12.993 -4.476 -4.626 1.00 0.00 O ATOM 2047 CB ASN B 46 -11.020 -4.413 -2.244 1.00 0.00 C ATOM 2048 CG ASN B 46 -12.095 -5.411 -1.861 1.00 0.00 C ATOM 2049 OD1 ASN B 46 -12.295 -6.421 -2.535 1.00 0.00 O ATOM 2050 ND2 ASN B 46 -12.791 -5.135 -0.769 1.00 0.00 N ATOM 0 H ASN B 46 -9.244 -3.000 -3.206 1.00 0.00 H new ATOM 0 HA ASN B 46 -10.573 -5.361 -4.130 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -10.096 -4.670 -1.727 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -11.314 -3.423 -1.897 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -13.525 -5.771 -0.458 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -12.593 -4.286 -0.239 1.00 0.00 H new ATOM 2057 N THR B 47 -11.878 -2.557 -4.960 1.00 0.00 N ATOM 2058 CA THR B 47 -12.989 -1.931 -5.671 1.00 0.00 C ATOM 2059 C THR B 47 -12.716 -1.786 -7.171 1.00 0.00 C ATOM 2060 O THR B 47 -13.515 -2.233 -7.998 1.00 0.00 O ATOM 2061 CB THR B 47 -13.323 -0.548 -5.081 1.00 0.00 C ATOM 2062 OG1 THR B 47 -12.129 0.232 -4.950 1.00 0.00 O ATOM 2063 CG2 THR B 47 -13.997 -0.682 -3.725 1.00 0.00 C ATOM 0 H THR B 47 -11.050 -1.969 -4.863 1.00 0.00 H new ATOM 0 HA THR B 47 -13.842 -2.597 -5.542 1.00 0.00 H new ATOM 0 HB THR B 47 -14.011 -0.047 -5.762 1.00 0.00 H new ATOM 0 HG1 THR B 47 -11.792 0.162 -4.033 1.00 0.00 H new ATOM 0 HG21 THR B 47 -14.222 0.309 -3.331 1.00 0.00 H new ATOM 0 HG22 THR B 47 -14.922 -1.248 -3.833 1.00 0.00 H new ATOM 0 HG23 THR B 47 -13.331 -1.203 -3.037 1.00 0.00 H new ATOM 2071 N SER B 48 -11.593 -1.163 -7.520 1.00 0.00 N ATOM 2072 CA SER B 48 -11.308 -0.835 -8.915 1.00 0.00 C ATOM 2073 C SER B 48 -10.790 -2.043 -9.697 1.00 0.00 C ATOM 2074 O SER B 48 -11.029 -2.161 -10.903 1.00 0.00 O ATOM 2075 CB SER B 48 -10.305 0.324 -8.997 1.00 0.00 C ATOM 2076 OG SER B 48 -9.087 0.008 -8.340 1.00 0.00 O ATOM 0 H SER B 48 -10.869 -0.876 -6.861 1.00 0.00 H new ATOM 0 HA SER B 48 -12.248 -0.529 -9.375 1.00 0.00 H new ATOM 0 HB2 SER B 48 -10.105 0.560 -10.042 1.00 0.00 H new ATOM 0 HB3 SER B 48 -10.741 1.216 -8.547 1.00 0.00 H new ATOM 0 HG SER B 48 -9.195 0.130 -7.374 1.00 0.00 H new ATOM 2082 N ILE B 49 -10.092 -2.938 -9.017 1.00 0.00 N ATOM 2083 CA ILE B 49 -9.544 -4.122 -9.659 1.00 0.00 C ATOM 2084 C ILE B 49 -10.614 -5.201 -9.779 1.00 0.00 C ATOM 2085 O ILE B 49 -11.450 -5.357 -8.886 1.00 0.00 O ATOM 2086 CB ILE B 49 -8.320 -4.663 -8.880 1.00 0.00 C ATOM 2087 CG1 ILE B 49 -7.189 -3.627 -8.878 1.00 0.00 C ATOM 2088 CG2 ILE B 49 -7.835 -5.984 -9.458 1.00 0.00 C ATOM 2089 CD1 ILE B 49 -6.689 -3.257 -10.258 1.00 0.00 C ATOM 0 H ILE B 49 -9.891 -2.867 -8.019 1.00 0.00 H new ATOM 0 HA ILE B 49 -9.211 -3.842 -10.658 1.00 0.00 H new ATOM 0 HB ILE B 49 -8.630 -4.846 -7.851 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -7.538 -2.725 -8.375 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -6.355 -4.016 -8.293 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.975 -6.336 -8.889 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -8.635 -6.722 -9.401 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.547 -5.841 -10.499 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -5.891 -2.520 -10.170 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -6.308 -4.147 -10.758 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -7.508 -2.837 -10.841 1.00 0.00 H new ATOM 2101 N ALA B 50 -10.600 -5.918 -10.896 1.00 0.00 N ATOM 2102 CA ALA B 50 -11.566 -6.976 -11.153 1.00 0.00 C ATOM 2103 C ALA B 50 -11.575 -7.994 -10.016 1.00 0.00 C ATOM 2104 O ALA B 50 -10.518 -8.447 -9.570 1.00 0.00 O ATOM 2105 CB ALA B 50 -11.260 -7.654 -12.478 1.00 0.00 C ATOM 0 H ALA B 50 -9.921 -5.783 -11.645 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.559 -6.530 -11.210 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.989 -8.444 -12.660 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.312 -6.920 -13.283 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.259 -8.085 -12.444 1.00 0.00 H new ATOM 2111 N PRO B 51 -12.781 -8.365 -9.543 1.00 0.00 N ATOM 2112 CA PRO B 51 -12.967 -9.249 -8.382 1.00 0.00 C ATOM 2113 C PRO B 51 -12.106 -10.510 -8.419 1.00 0.00 C ATOM 2114 O PRO B 51 -11.623 -10.967 -7.380 1.00 0.00 O ATOM 2115 CB PRO B 51 -14.446 -9.620 -8.462 1.00 0.00 C ATOM 2116 CG PRO B 51 -15.085 -8.455 -9.127 1.00 0.00 C ATOM 2117 CD PRO B 51 -14.074 -7.931 -10.108 1.00 0.00 C ATOM 0 HA PRO B 51 -12.670 -8.751 -7.459 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -14.595 -10.535 -9.035 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -14.867 -9.792 -7.471 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -16.003 -8.751 -9.634 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -15.355 -7.690 -8.399 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -14.233 -8.342 -11.105 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -14.128 -6.846 -10.198 1.00 0.00 H new ATOM 2125 N ALA B 52 -11.909 -11.053 -9.611 1.00 0.00 N ATOM 2126 CA ALA B 52 -11.173 -12.300 -9.778 1.00 0.00 C ATOM 2127 C ALA B 52 -9.697 -12.143 -9.430 1.00 0.00 C ATOM 2128 O ALA B 52 -9.082 -13.048 -8.869 1.00 0.00 O ATOM 2129 CB ALA B 52 -11.315 -12.795 -11.208 1.00 0.00 C ATOM 0 H ALA B 52 -12.250 -10.648 -10.483 1.00 0.00 H new ATOM 0 HA ALA B 52 -11.599 -13.029 -9.089 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -10.763 -13.727 -11.327 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -12.368 -12.966 -11.431 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -10.916 -12.047 -11.893 1.00 0.00 H new ATOM 2135 N GLN B 53 -9.135 -10.983 -9.738 1.00 0.00 N ATOM 2136 CA GLN B 53 -7.696 -10.793 -9.624 1.00 0.00 C ATOM 2137 C GLN B 53 -7.338 -9.704 -8.616 1.00 0.00 C ATOM 2138 O GLN B 53 -6.225 -9.185 -8.632 1.00 0.00 O ATOM 2139 CB GLN B 53 -7.116 -10.463 -11.001 1.00 0.00 C ATOM 2140 CG GLN B 53 -7.823 -9.315 -11.701 1.00 0.00 C ATOM 2141 CD GLN B 53 -7.389 -9.156 -13.144 1.00 0.00 C ATOM 2142 OE1 GLN B 53 -7.020 -10.126 -13.808 1.00 0.00 O ATOM 2143 NE2 GLN B 53 -7.442 -7.935 -13.646 1.00 0.00 N ATOM 0 H GLN B 53 -9.648 -10.165 -10.066 1.00 0.00 H new ATOM 0 HA GLN B 53 -7.260 -11.721 -9.255 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -6.060 -10.215 -10.891 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.171 -11.351 -11.631 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -8.900 -9.481 -11.666 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -7.625 -8.389 -11.162 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -7.753 -7.157 -13.064 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -7.172 -7.770 -14.616 1.00 0.00 H new ATOM 2152 N ARG B 54 -8.272 -9.380 -7.729 1.00 0.00 N ATOM 2153 CA ARG B 54 -8.024 -8.388 -6.679 1.00 0.00 C ATOM 2154 C ARG B 54 -6.823 -8.783 -5.828 1.00 0.00 C ATOM 2155 O ARG B 54 -5.817 -8.074 -5.782 1.00 0.00 O ATOM 2156 CB ARG B 54 -9.250 -8.233 -5.778 1.00 0.00 C ATOM 2157 CG ARG B 54 -10.403 -7.484 -6.420 1.00 0.00 C ATOM 2158 CD ARG B 54 -11.644 -7.547 -5.550 1.00 0.00 C ATOM 2159 NE ARG B 54 -12.098 -8.924 -5.369 1.00 0.00 N ATOM 2160 CZ ARG B 54 -13.177 -9.274 -4.672 1.00 0.00 C ATOM 2161 NH1 ARG B 54 -13.871 -8.359 -4.011 1.00 0.00 N ATOM 2162 NH2 ARG B 54 -13.539 -10.552 -4.618 1.00 0.00 N ATOM 0 H ARG B 54 -9.207 -9.787 -7.712 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.816 -7.437 -7.170 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -9.596 -9.223 -5.480 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.954 -7.711 -4.868 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -10.120 -6.444 -6.582 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -10.619 -7.912 -7.399 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -11.432 -7.101 -4.578 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -12.440 -6.957 -6.005 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.552 -9.667 -5.806 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -13.579 -7.382 -4.035 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -14.697 -8.632 -3.478 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -12.991 -11.258 -5.109 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.365 -10.826 -4.086 1.00 0.00 H new ATOM 2176 N GLN B 55 -6.923 -9.931 -5.178 1.00 0.00 N ATOM 2177 CA GLN B 55 -5.869 -10.394 -4.292 1.00 0.00 C ATOM 2178 C GLN B 55 -4.669 -10.866 -5.106 1.00 0.00 C ATOM 2179 O GLN B 55 -3.529 -10.807 -4.647 1.00 0.00 O ATOM 2180 CB GLN B 55 -6.393 -11.510 -3.384 1.00 0.00 C ATOM 2181 CG GLN B 55 -5.395 -11.964 -2.329 1.00 0.00 C ATOM 2182 CD GLN B 55 -5.998 -12.924 -1.324 1.00 0.00 C ATOM 2183 OE1 GLN B 55 -6.921 -13.675 -1.634 1.00 0.00 O ATOM 2184 NE2 GLN B 55 -5.481 -12.904 -0.107 1.00 0.00 N ATOM 0 H GLN B 55 -7.724 -10.559 -5.248 1.00 0.00 H new ATOM 0 HA GLN B 55 -5.546 -9.567 -3.659 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -7.300 -11.166 -2.888 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -6.671 -12.366 -3.999 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -4.548 -12.444 -2.819 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -5.007 -11.092 -1.803 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -4.715 -12.266 0.111 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -5.848 -13.526 0.613 1.00 0.00 H new ATOM 2193 N ALA B 56 -4.932 -11.320 -6.326 1.00 0.00 N ATOM 2194 CA ALA B 56 -3.871 -11.717 -7.240 1.00 0.00 C ATOM 2195 C ALA B 56 -2.949 -10.536 -7.543 1.00 0.00 C ATOM 2196 O ALA B 56 -1.724 -10.652 -7.453 1.00 0.00 O ATOM 2197 CB ALA B 56 -4.459 -12.279 -8.525 1.00 0.00 C ATOM 0 H ALA B 56 -5.874 -11.422 -6.704 1.00 0.00 H new ATOM 0 HA ALA B 56 -3.280 -12.497 -6.761 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -3.652 -12.571 -9.197 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -5.072 -13.150 -8.294 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -5.075 -11.519 -9.006 1.00 0.00 H new ATOM 2203 N ILE B 57 -3.543 -9.399 -7.887 1.00 0.00 N ATOM 2204 CA ILE B 57 -2.776 -8.190 -8.158 1.00 0.00 C ATOM 2205 C ILE B 57 -2.191 -7.627 -6.863 1.00 0.00 C ATOM 2206 O ILE B 57 -1.117 -7.020 -6.864 1.00 0.00 O ATOM 2207 CB ILE B 57 -3.634 -7.122 -8.884 1.00 0.00 C ATOM 2208 CG1 ILE B 57 -4.016 -7.627 -10.281 1.00 0.00 C ATOM 2209 CG2 ILE B 57 -2.893 -5.793 -8.980 1.00 0.00 C ATOM 2210 CD1 ILE B 57 -4.806 -6.632 -11.106 1.00 0.00 C ATOM 0 H ILE B 57 -4.552 -9.290 -7.985 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.955 -8.458 -8.823 1.00 0.00 H new ATOM 0 HB ILE B 57 -4.541 -6.954 -8.304 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -3.107 -7.889 -10.822 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -4.600 -8.541 -10.177 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -3.519 -5.064 -9.494 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -2.663 -5.432 -7.978 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -1.967 -5.932 -9.537 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -5.036 -7.067 -12.079 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -5.734 -6.387 -10.590 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -4.217 -5.725 -11.244 1.00 0.00 H new ATOM 2222 N ALA B 58 -2.880 -7.856 -5.752 1.00 0.00 N ATOM 2223 CA ALA B 58 -2.353 -7.481 -4.445 1.00 0.00 C ATOM 2224 C ALA B 58 -1.058 -8.241 -4.163 1.00 0.00 C ATOM 2225 O ALA B 58 -0.137 -7.717 -3.536 1.00 0.00 O ATOM 2226 CB ALA B 58 -3.379 -7.747 -3.354 1.00 0.00 C ATOM 0 H ALA B 58 -3.800 -8.297 -5.729 1.00 0.00 H new ATOM 0 HA ALA B 58 -2.137 -6.413 -4.451 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.965 -7.460 -2.387 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -4.279 -7.164 -3.551 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.630 -8.808 -3.341 1.00 0.00 H new ATOM 2232 N ASN B 59 -0.988 -9.474 -4.653 1.00 0.00 N ATOM 2233 CA ASN B 59 0.214 -10.288 -4.519 1.00 0.00 C ATOM 2234 C ASN B 59 1.350 -9.716 -5.358 1.00 0.00 C ATOM 2235 O ASN B 59 2.494 -9.659 -4.909 1.00 0.00 O ATOM 2236 CB ASN B 59 -0.057 -11.742 -4.922 1.00 0.00 C ATOM 2237 CG ASN B 59 -0.936 -12.474 -3.925 1.00 0.00 C ATOM 2238 OD1 ASN B 59 -0.923 -12.178 -2.731 1.00 0.00 O ATOM 2239 ND2 ASN B 59 -1.701 -13.444 -4.408 1.00 0.00 N ATOM 0 H ASN B 59 -1.753 -9.933 -5.148 1.00 0.00 H new ATOM 0 HA ASN B 59 0.510 -10.271 -3.470 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -0.534 -11.760 -5.902 1.00 0.00 H new ATOM 0 HB3 ASN B 59 0.892 -12.270 -5.020 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -2.307 -13.975 -3.783 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -1.683 -13.659 -5.405 1.00 0.00 H new ATOM 2246 N SER B 60 1.038 -9.279 -6.573 1.00 0.00 N ATOM 2247 CA SER B 60 2.045 -8.667 -7.430 1.00 0.00 C ATOM 2248 C SER B 60 2.463 -7.301 -6.880 1.00 0.00 C ATOM 2249 O SER B 60 3.585 -6.845 -7.109 1.00 0.00 O ATOM 2250 CB SER B 60 1.539 -8.558 -8.872 1.00 0.00 C ATOM 2251 OG SER B 60 0.213 -8.064 -8.927 1.00 0.00 O ATOM 0 H SER B 60 0.106 -9.336 -6.983 1.00 0.00 H new ATOM 0 HA SER B 60 2.927 -9.308 -7.437 1.00 0.00 H new ATOM 0 HB2 SER B 60 2.196 -7.899 -9.439 1.00 0.00 H new ATOM 0 HB3 SER B 60 1.582 -9.538 -9.348 1.00 0.00 H new ATOM 0 HG SER B 60 -0.001 -7.607 -8.087 1.00 0.00 H new ATOM 2257 N PHE B 61 1.562 -6.664 -6.136 1.00 0.00 N ATOM 2258 CA PHE B 61 1.878 -5.416 -5.455 1.00 0.00 C ATOM 2259 C PHE B 61 2.898 -5.686 -4.352 1.00 0.00 C ATOM 2260 O PHE B 61 3.850 -4.928 -4.170 1.00 0.00 O ATOM 2261 CB PHE B 61 0.606 -4.792 -4.869 1.00 0.00 C ATOM 2262 CG PHE B 61 0.802 -3.412 -4.301 1.00 0.00 C ATOM 2263 CD1 PHE B 61 0.681 -2.292 -5.112 1.00 0.00 C ATOM 2264 CD2 PHE B 61 1.100 -3.232 -2.958 1.00 0.00 C ATOM 2265 CE1 PHE B 61 0.852 -1.021 -4.594 1.00 0.00 C ATOM 2266 CE2 PHE B 61 1.274 -1.964 -2.435 1.00 0.00 C ATOM 2267 CZ PHE B 61 1.150 -0.858 -3.254 1.00 0.00 C ATOM 0 H PHE B 61 0.608 -6.993 -5.991 1.00 0.00 H new ATOM 0 HA PHE B 61 2.303 -4.712 -6.171 1.00 0.00 H new ATOM 0 HB2 PHE B 61 -0.156 -4.748 -5.648 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.222 -5.445 -4.085 1.00 0.00 H new ATOM 0 HD1 PHE B 61 0.451 -2.414 -6.160 1.00 0.00 H new ATOM 0 HD2 PHE B 61 1.197 -4.093 -2.313 1.00 0.00 H new ATOM 0 HE1 PHE B 61 0.753 -0.158 -5.235 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.506 -1.838 -1.388 1.00 0.00 H new ATOM 0 HZ PHE B 61 1.286 0.133 -2.847 1.00 0.00 H new ATOM 2277 N ALA B 62 2.698 -6.788 -3.635 1.00 0.00 N ATOM 2278 CA ALA B 62 3.640 -7.221 -2.612 1.00 0.00 C ATOM 2279 C ALA B 62 4.991 -7.548 -3.238 1.00 0.00 C ATOM 2280 O ALA B 62 6.038 -7.212 -2.688 1.00 0.00 O ATOM 2281 CB ALA B 62 3.092 -8.422 -1.854 1.00 0.00 C ATOM 0 H ALA B 62 1.888 -7.398 -3.746 1.00 0.00 H new ATOM 0 HA ALA B 62 3.779 -6.406 -1.902 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.810 -8.731 -1.094 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.151 -8.152 -1.376 1.00 0.00 H new ATOM 0 HB3 ALA B 62 2.923 -9.245 -2.549 1.00 0.00 H new ATOM 2287 N ARG B 63 4.957 -8.193 -4.400 1.00 0.00 N ATOM 2288 CA ARG B 63 6.170 -8.487 -5.155 1.00 0.00 C ATOM 2289 C ARG B 63 6.914 -7.206 -5.515 1.00 0.00 C ATOM 2290 O ARG B 63 8.132 -7.125 -5.360 1.00 0.00 O ATOM 2291 CB ARG B 63 5.842 -9.270 -6.428 1.00 0.00 C ATOM 2292 CG ARG B 63 5.818 -10.776 -6.231 1.00 0.00 C ATOM 2293 CD ARG B 63 7.162 -11.277 -5.727 1.00 0.00 C ATOM 2294 NE ARG B 63 7.278 -12.731 -5.794 1.00 0.00 N ATOM 2295 CZ ARG B 63 8.123 -13.438 -5.050 1.00 0.00 C ATOM 2296 NH1 ARG B 63 8.834 -12.843 -4.102 1.00 0.00 N ATOM 2297 NH2 ARG B 63 8.245 -14.747 -5.232 1.00 0.00 N ATOM 0 H ARG B 63 4.098 -8.523 -4.841 1.00 0.00 H new ATOM 0 HA ARG B 63 6.813 -9.098 -4.521 1.00 0.00 H new ATOM 0 HB2 ARG B 63 4.871 -8.946 -6.803 1.00 0.00 H new ATOM 0 HB3 ARG B 63 6.577 -9.025 -7.194 1.00 0.00 H new ATOM 0 HG2 ARG B 63 5.036 -11.042 -5.520 1.00 0.00 H new ATOM 0 HG3 ARG B 63 5.572 -11.266 -7.173 1.00 0.00 H new ATOM 0 HD2 ARG B 63 7.959 -10.825 -6.317 1.00 0.00 H new ATOM 0 HD3 ARG B 63 7.304 -10.952 -4.696 1.00 0.00 H new ATOM 0 HE ARG B 63 6.677 -13.232 -6.448 1.00 0.00 H new ATOM 0 HH11 ARG B 63 8.733 -11.841 -3.942 1.00 0.00 H new ATOM 0 HH12 ARG B 63 9.482 -13.388 -3.533 1.00 0.00 H new ATOM 0 HH21 ARG B 63 7.689 -15.217 -5.946 1.00 0.00 H new ATOM 0 HH22 ARG B 63 8.895 -15.283 -4.658 1.00 0.00 H new ATOM 2311 N ALA B 64 6.173 -6.208 -5.989 1.00 0.00 N ATOM 2312 CA ALA B 64 6.753 -4.915 -6.327 1.00 0.00 C ATOM 2313 C ALA B 64 7.420 -4.287 -5.107 1.00 0.00 C ATOM 2314 O ALA B 64 8.472 -3.661 -5.214 1.00 0.00 O ATOM 2315 CB ALA B 64 5.689 -3.985 -6.890 1.00 0.00 C ATOM 0 H ALA B 64 5.167 -6.272 -6.147 1.00 0.00 H new ATOM 0 HA ALA B 64 7.515 -5.071 -7.090 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.140 -3.024 -7.137 1.00 0.00 H new ATOM 0 HB2 ALA B 64 5.259 -4.426 -7.789 1.00 0.00 H new ATOM 0 HB3 ALA B 64 4.905 -3.838 -6.148 1.00 0.00 H new ATOM 2321 N LEU B 65 6.799 -4.471 -3.950 1.00 0.00 N ATOM 2322 CA LEU B 65 7.346 -3.982 -2.690 1.00 0.00 C ATOM 2323 C LEU B 65 8.650 -4.707 -2.357 1.00 0.00 C ATOM 2324 O LEU B 65 9.685 -4.077 -2.135 1.00 0.00 O ATOM 2325 CB LEU B 65 6.326 -4.193 -1.564 1.00 0.00 C ATOM 2326 CG LEU B 65 6.733 -3.661 -0.189 1.00 0.00 C ATOM 2327 CD1 LEU B 65 6.771 -2.141 -0.195 1.00 0.00 C ATOM 2328 CD2 LEU B 65 5.781 -4.171 0.882 1.00 0.00 C ATOM 0 H LEU B 65 5.908 -4.960 -3.857 1.00 0.00 H new ATOM 0 HA LEU B 65 7.556 -2.917 -2.789 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.389 -3.717 -1.854 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.127 -5.261 -1.475 1.00 0.00 H new ATOM 0 HG LEU B 65 7.734 -4.026 0.041 1.00 0.00 H new ATOM 0 HD11 LEU B 65 7.062 -1.780 0.791 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.494 -1.798 -0.935 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.784 -1.753 -0.446 1.00 0.00 H new ATOM 0 HD21 LEU B 65 6.085 -3.783 1.854 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.768 -3.836 0.658 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.806 -5.261 0.902 1.00 0.00 H new ATOM 2340 N GLN B 66 8.593 -6.034 -2.367 1.00 0.00 N ATOM 2341 CA GLN B 66 9.729 -6.875 -1.985 1.00 0.00 C ATOM 2342 C GLN B 66 10.949 -6.637 -2.873 1.00 0.00 C ATOM 2343 O GLN B 66 12.085 -6.778 -2.424 1.00 0.00 O ATOM 2344 CB GLN B 66 9.337 -8.352 -2.053 1.00 0.00 C ATOM 2345 CG GLN B 66 8.200 -8.734 -1.120 1.00 0.00 C ATOM 2346 CD GLN B 66 7.706 -10.149 -1.359 1.00 0.00 C ATOM 2347 OE1 GLN B 66 7.779 -10.663 -2.475 1.00 0.00 O ATOM 2348 NE2 GLN B 66 7.194 -10.783 -0.314 1.00 0.00 N ATOM 0 H GLN B 66 7.762 -6.559 -2.639 1.00 0.00 H new ATOM 0 HA GLN B 66 9.998 -6.604 -0.964 1.00 0.00 H new ATOM 0 HB2 GLN B 66 9.050 -8.594 -3.076 1.00 0.00 H new ATOM 0 HB3 GLN B 66 10.209 -8.960 -1.814 1.00 0.00 H new ATOM 0 HG2 GLN B 66 8.534 -8.638 -0.087 1.00 0.00 H new ATOM 0 HG3 GLN B 66 7.374 -8.036 -1.254 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.153 -10.320 0.594 1.00 0.00 H new ATOM 0 HE22 GLN B 66 6.841 -11.734 -0.417 1.00 0.00 H new ATOM 2357 N SER B 67 10.716 -6.279 -4.126 1.00 0.00 N ATOM 2358 CA SER B 67 11.801 -6.104 -5.078 1.00 0.00 C ATOM 2359 C SER B 67 12.334 -4.671 -5.074 1.00 0.00 C ATOM 2360 O SER B 67 13.302 -4.359 -5.771 1.00 0.00 O ATOM 2361 CB SER B 67 11.324 -6.494 -6.478 1.00 0.00 C ATOM 2362 OG SER B 67 10.088 -5.869 -6.787 1.00 0.00 O ATOM 0 H SER B 67 9.786 -6.104 -4.507 1.00 0.00 H new ATOM 0 HA SER B 67 12.623 -6.755 -4.779 1.00 0.00 H new ATOM 0 HB2 SER B 67 12.075 -6.207 -7.215 1.00 0.00 H new ATOM 0 HB3 SER B 67 11.214 -7.577 -6.540 1.00 0.00 H new ATOM 0 HG SER B 67 9.355 -6.373 -6.375 1.00 0.00 H new ATOM 2368 N SER B 68 11.714 -3.805 -4.285 1.00 0.00 N ATOM 2369 CA SER B 68 12.116 -2.407 -4.246 1.00 0.00 C ATOM 2370 C SER B 68 12.769 -2.047 -2.914 1.00 0.00 C ATOM 2371 O SER B 68 13.494 -1.056 -2.817 1.00 0.00 O ATOM 2372 CB SER B 68 10.907 -1.511 -4.508 1.00 0.00 C ATOM 2373 OG SER B 68 10.293 -1.840 -5.745 1.00 0.00 O ATOM 0 H SER B 68 10.937 -4.043 -3.668 1.00 0.00 H new ATOM 0 HA SER B 68 12.858 -2.247 -5.028 1.00 0.00 H new ATOM 0 HB2 SER B 68 10.185 -1.621 -3.698 1.00 0.00 H new ATOM 0 HB3 SER B 68 11.218 -0.466 -4.518 1.00 0.00 H new ATOM 0 HG SER B 68 9.429 -2.272 -5.577 1.00 0.00 H new ATOM 2379 N ILE B 69 12.520 -2.849 -1.888 1.00 0.00 N ATOM 2380 CA ILE B 69 13.097 -2.592 -0.576 1.00 0.00 C ATOM 2381 C ILE B 69 14.341 -3.450 -0.349 1.00 0.00 C ATOM 2382 O ILE B 69 14.326 -4.656 -0.602 1.00 0.00 O ATOM 2383 CB ILE B 69 12.072 -2.826 0.564 1.00 0.00 C ATOM 2384 CG1 ILE B 69 12.714 -2.542 1.929 1.00 0.00 C ATOM 2385 CG2 ILE B 69 11.512 -4.242 0.517 1.00 0.00 C ATOM 2386 CD1 ILE B 69 11.749 -2.642 3.092 1.00 0.00 C ATOM 0 H ILE B 69 11.927 -3.677 -1.938 1.00 0.00 H new ATOM 0 HA ILE B 69 13.385 -1.541 -0.555 1.00 0.00 H new ATOM 0 HB ILE B 69 11.242 -2.134 0.420 1.00 0.00 H new ATOM 0 HG12 ILE B 69 13.533 -3.243 2.088 1.00 0.00 H new ATOM 0 HG13 ILE B 69 13.148 -1.542 1.915 1.00 0.00 H new ATOM 0 HG21 ILE B 69 10.796 -4.377 1.328 1.00 0.00 H new ATOM 0 HG22 ILE B 69 11.013 -4.404 -0.438 1.00 0.00 H new ATOM 0 HG23 ILE B 69 12.326 -4.959 0.628 1.00 0.00 H new ATOM 0 HD11 ILE B 69 12.276 -2.428 4.022 1.00 0.00 H new ATOM 0 HD12 ILE B 69 10.942 -1.921 2.958 1.00 0.00 H new ATOM 0 HD13 ILE B 69 11.333 -3.649 3.134 1.00 0.00 H new